----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 20:53:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.450049595006198 -5.404764344999998 0.000000000000000 b 3.450049595006198 5.404764344999998 0.000000000000000 c -3.277924791351193 0.000000000000000 3.809480036290911 Atomic positions (fractional): *1 O 0.27535003745780 0.21465308656111 0.21935805965058 15.999 2 O 0.78534691343889 0.72464996254220 0.28064194034942 15.999 3 O 0.72464996254220 0.78534691343889 0.78064194034942 15.999 4 O 0.21465308656111 0.27535003745780 0.71935805965058 15.999 *5 O 0.05261909918724 0.62836037763402 0.84024594945506 15.999 6 O 0.37163962236598 0.94738090081276 0.65975405054493 15.999 7 O 0.94738090081276 0.37163962236598 0.15975405054493 15.999 8 O 0.62836037763402 0.05261909918724 0.34024594945506 15.999 *9 Er 0.63188654365009 0.36811345634991 0.75000000000000 167.259 10 Er 0.36811345634991 0.63188654365009 0.25000000000000 167.259 *11 Ta 0.10136640471903 0.89863359528097 0.75000000000000 180.948 12 Ta 0.89863359528097 0.10136640471903 0.25000000000000 180.948 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.900099190012397 0.000000000000000 0.000000000000000 b 0.000000000000000 10.809528689999997 0.000000000000000 c -3.277924791351193 0.000000000000000 3.809480036290911 Atomic positions (fractional): *1 O 0.24500156200945 0.96965152455166 0.21935805965058 15.999 > 1 2 O 0.75499843799055 0.96965152455166 0.28064194034942 15.999 > 2 3 O 0.25499843799055 0.53034847544834 0.78064194034942 15.999 > 3 4 O 0.74500156200945 0.53034847544834 0.71935805965058 15.999 > 4 *5 O 0.84048973841063 0.78787063922339 0.84024594945507 15.999 > 5 6 O 0.15951026158937 0.78787063922339 0.65975405054493 15.999 > 6 7 O 0.65951026158937 0.71212936077661 0.15975405054493 15.999 > 7 8 O 0.34048973841063 0.71212936077661 0.34024594945506 15.999 > 8 9 O 0.74500156200945 0.46965152455165 0.21935805965058 15.999 > 1 10 O 0.25499843799055 0.46965152455165 0.28064194034942 15.999 > 2 11 O 0.75499843799055 0.03034847544834 0.78064194034942 15.999 > 3 12 O 0.24500156200945 0.03034847544834 0.71935805965058 15.999 > 4 13 O 0.34048973841063 0.28787063922339 0.84024594945507 15.999 > 5 14 O 0.65951026158937 0.28787063922339 0.65975405054493 15.999 > 6 15 O 0.15951026158937 0.21212936077661 0.15975405054493 15.999 > 7 16 O 0.84048973841063 0.21212936077661 0.34024594945506 15.999 > 8 *17 Er 0.50000000000000 0.86811345634991 0.75000000000000 167.259 > 9 18 Er 0.00000000000000 0.63188654365009 0.25000000000000 167.259 > 10 19 Er 0.00000000000000 0.36811345634991 0.75000000000000 167.259 > 9 20 Er 0.50000000000000 0.13188654365009 0.25000000000000 167.259 > 10 *21 Ta 0.00000000000000 0.89863359528097 0.75000000000000 180.948 > 11 22 Ta 0.50000000000000 0.60136640471903 0.25000000000000 180.948 > 12 23 Ta 0.50000000000000 0.39863359528097 0.75000000000000 180.948 > 11 24 Ta 0.00000000000000 0.10136640471903 0.25000000000000 180.948 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.800198380024794 0.000000000000000 0.000000000000000 b 0.000000000000000 10.809528689999997 0.000000000000000 c -9.833774374053579 0.000000000000000 11.428440108872733 Atomic positions (fractional): *1 O 0.12250078100473 0.96965152455166 0.07311935321686 15.999 > 1 2 O 0.62250078100473 0.96965152455166 0.07311935321686 15.999 > 1 3 O 0.12250078100473 0.96965152455166 0.40645268655019 15.999 > 1 4 O 0.62250078100473 0.96965152455166 0.40645268655019 15.999 > 1 5 O 0.12250078100473 0.96965152455166 0.73978601988353 15.999 > 1 6 O 0.62250078100473 0.96965152455166 0.73978601988353 15.999 > 1 7 O 0.37749921899527 0.96965152455166 0.09354731344981 15.999 > 2 8 O 0.87749921899527 0.96965152455166 0.09354731344981 15.999 > 2 9 O 0.37749921899527 0.96965152455166 0.42688064678314 15.999 > 2 10 O 0.87749921899527 0.96965152455166 0.42688064678314 15.999 > 2 11 O 0.37749921899527 0.96965152455166 0.76021398011647 15.999 > 2 12 O 0.87749921899527 0.96965152455166 0.76021398011647 15.999 > 2 13 O 0.12749921899527 0.53034847544834 0.26021398011647 15.999 > 3 14 O 0.62749921899527 0.53034847544834 0.26021398011647 15.999 > 3 15 O 0.12749921899527 0.53034847544834 0.59354731344981 15.999 > 3 16 O 0.62749921899527 0.53034847544834 0.59354731344981 15.999 > 3 17 O 0.12749921899527 0.53034847544834 0.92688064678314 15.999 > 3 18 O 0.62749921899527 0.53034847544834 0.92688064678314 15.999 > 3 19 O 0.37250078100473 0.53034847544834 0.23978601988353 15.999 > 4 20 O 0.87250078100473 0.53034847544834 0.23978601988353 15.999 > 4 21 O 0.37250078100473 0.53034847544834 0.57311935321686 15.999 > 4 22 O 0.87250078100473 0.53034847544834 0.57311935321686 15.999 > 4 23 O 0.37250078100473 0.53034847544834 0.90645268655019 15.999 > 4 24 O 0.87250078100473 0.53034847544834 0.90645268655019 15.999 > 4 *25 O 0.42024486920531 0.78787063922339 0.28008198315169 15.999 > 5 26 O 0.92024486920531 0.78787063922339 0.28008198315169 15.999 > 5 27 O 0.42024486920531 0.78787063922339 0.61341531648502 15.999 > 5 28 O 0.92024486920531 0.78787063922339 0.61341531648502 15.999 > 5 29 O 0.42024486920531 0.78787063922339 0.94674864981836 15.999 > 5 30 O 0.92024486920531 0.78787063922339 0.94674864981836 15.999 > 5 31 O 0.07975513079469 0.78787063922339 0.21991801684831 15.999 > 6 32 O 0.57975513079469 0.78787063922339 0.21991801684831 15.999 > 6 33 O 0.07975513079469 0.78787063922339 0.55325135018164 15.999 > 6 34 O 0.57975513079469 0.78787063922339 0.55325135018164 15.999 > 6 35 O 0.07975513079469 0.78787063922339 0.88658468351498 15.999 > 6 36 O 0.57975513079469 0.78787063922339 0.88658468351498 15.999 > 6 37 O 0.32975513079469 0.71212936077661 0.05325135018164 15.999 > 7 38 O 0.82975513079469 0.71212936077661 0.05325135018164 15.999 > 7 39 O 0.32975513079469 0.71212936077661 0.38658468351498 15.999 > 7 40 O 0.82975513079469 0.71212936077661 0.38658468351498 15.999 > 7 41 O 0.32975513079469 0.71212936077661 0.71991801684831 15.999 > 7 42 O 0.82975513079469 0.71212936077661 0.71991801684831 15.999 > 7 43 O 0.17024486920531 0.71212936077661 0.11341531648502 15.999 > 8 44 O 0.67024486920531 0.71212936077661 0.11341531648502 15.999 > 8 45 O 0.17024486920531 0.71212936077661 0.44674864981835 15.999 > 8 46 O 0.67024486920531 0.71212936077661 0.44674864981835 15.999 > 8 47 O 0.17024486920531 0.71212936077661 0.78008198315169 15.999 > 8 48 O 0.67024486920531 0.71212936077661 0.78008198315169 15.999 > 8 49 O 0.37250078100473 0.46965152455165 0.07311935321686 15.999 > 1 50 O 0.87250078100473 0.46965152455165 0.07311935321686 15.999 > 1 51 O 0.37250078100473 0.46965152455165 0.40645268655019 15.999 > 1 52 O 0.87250078100473 0.46965152455165 0.40645268655019 15.999 > 1 53 O 0.37250078100473 0.46965152455165 0.73978601988353 15.999 > 1 54 O 0.87250078100473 0.46965152455165 0.73978601988353 15.999 > 1 55 O 0.12749921899527 0.46965152455165 0.09354731344981 15.999 > 2 56 O 0.62749921899527 0.46965152455165 0.09354731344981 15.999 > 2 57 O 0.12749921899527 0.46965152455165 0.42688064678314 15.999 > 2 58 O 0.62749921899527 0.46965152455165 0.42688064678314 15.999 > 2 59 O 0.12749921899527 0.46965152455165 0.76021398011647 15.999 > 2 60 O 0.62749921899527 0.46965152455165 0.76021398011647 15.999 > 2 61 O 0.37749921899527 0.03034847544834 0.26021398011647 15.999 > 3 62 O 0.87749921899527 0.03034847544834 0.26021398011647 15.999 > 3 63 O 0.37749921899527 0.03034847544834 0.59354731344981 15.999 > 3 64 O 0.87749921899527 0.03034847544834 0.59354731344981 15.999 > 3 65 O 0.37749921899527 0.03034847544834 0.92688064678314 15.999 > 3 66 O 0.87749921899527 0.03034847544834 0.92688064678314 15.999 > 3 67 O 0.12250078100473 0.03034847544834 0.23978601988353 15.999 > 4 68 O 0.62250078100473 0.03034847544834 0.23978601988353 15.999 > 4 69 O 0.12250078100473 0.03034847544834 0.57311935321686 15.999 > 4 70 O 0.62250078100473 0.03034847544834 0.57311935321686 15.999 > 4 71 O 0.12250078100473 0.03034847544834 0.90645268655019 15.999 > 4 72 O 0.62250078100473 0.03034847544834 0.90645268655019 15.999 > 4 73 O 0.17024486920531 0.28787063922339 0.28008198315169 15.999 > 5 74 O 0.67024486920531 0.28787063922339 0.28008198315169 15.999 > 5 75 O 0.17024486920531 0.28787063922339 0.61341531648502 15.999 > 5 76 O 0.67024486920531 0.28787063922339 0.61341531648502 15.999 > 5 77 O 0.17024486920531 0.28787063922339 0.94674864981836 15.999 > 5 78 O 0.67024486920531 0.28787063922339 0.94674864981836 15.999 > 5 79 O 0.32975513079469 0.28787063922339 0.21991801684831 15.999 > 6 80 O 0.82975513079469 0.28787063922339 0.21991801684831 15.999 > 6 81 O 0.32975513079469 0.28787063922339 0.55325135018164 15.999 > 6 82 O 0.82975513079469 0.28787063922339 0.55325135018164 15.999 > 6 83 O 0.32975513079469 0.28787063922339 0.88658468351498 15.999 > 6 84 O 0.82975513079469 0.28787063922339 0.88658468351498 15.999 > 6 85 O 0.07975513079469 0.21212936077661 0.05325135018164 15.999 > 7 86 O 0.57975513079469 0.21212936077661 0.05325135018164 15.999 > 7 87 O 0.07975513079469 0.21212936077661 0.38658468351498 15.999 > 7 88 O 0.57975513079469 0.21212936077661 0.38658468351498 15.999 > 7 89 O 0.07975513079469 0.21212936077661 0.71991801684831 15.999 > 7 90 O 0.57975513079469 0.21212936077661 0.71991801684831 15.999 > 7 91 O 0.42024486920531 0.21212936077661 0.11341531648502 15.999 > 8 92 O 0.92024486920531 0.21212936077661 0.11341531648502 15.999 > 8 93 O 0.42024486920531 0.21212936077661 0.44674864981835 15.999 > 8 94 O 0.92024486920531 0.21212936077661 0.44674864981835 15.999 > 8 95 O 0.42024486920531 0.21212936077661 0.78008198315169 15.999 > 8 96 O 0.92024486920531 0.21212936077661 0.78008198315169 15.999 > 8 *97 Er 0.25000000000000 0.86811345634991 0.25000000000000 167.259 > 9 98 Er 0.75000000000000 0.86811345634991 0.25000000000000 167.259 > 9 99 Er 0.25000000000000 0.86811345634991 0.58333333333333 167.259 > 9 100 Er 0.75000000000000 0.86811345634991 0.58333333333333 167.259 > 9 101 Er 0.25000000000000 0.86811345634991 0.91666666666667 167.259 > 9 102 Er 0.75000000000000 0.86811345634991 0.91666666666667 167.259 > 9 103 Er 0.00000000000000 0.63188654365009 0.08333333333333 167.259 > 10 104 Er 0.50000000000000 0.63188654365009 0.08333333333333 167.259 > 10 105 Er 0.00000000000000 0.63188654365009 0.41666666666667 167.259 > 10 106 Er 0.50000000000000 0.63188654365009 0.41666666666667 167.259 > 10 107 Er 0.00000000000000 0.63188654365009 0.75000000000000 167.259 > 10 108 Er 0.50000000000000 0.63188654365009 0.75000000000000 167.259 > 10 109 Er 0.00000000000000 0.36811345634991 0.25000000000000 167.259 > 9 110 Er 0.50000000000000 0.36811345634991 0.25000000000000 167.259 > 9 111 Er 0.00000000000000 0.36811345634991 0.58333333333333 167.259 > 9 112 Er 0.50000000000000 0.36811345634991 0.58333333333333 167.259 > 9 113 Er 0.00000000000000 0.36811345634991 0.91666666666667 167.259 > 9 114 Er 0.50000000000000 0.36811345634991 0.91666666666667 167.259 > 9 115 Er 0.25000000000000 0.13188654365009 0.08333333333333 167.259 > 10 116 Er 0.75000000000000 0.13188654365009 0.08333333333333 167.259 > 10 117 Er 0.25000000000000 0.13188654365009 0.41666666666667 167.259 > 10 118 Er 0.75000000000000 0.13188654365009 0.41666666666667 167.259 > 10 119 Er 0.25000000000000 0.13188654365009 0.75000000000000 167.259 > 10 120 Er 0.75000000000000 0.13188654365009 0.75000000000000 167.259 > 10 *121 Ta 0.00000000000000 0.89863359528097 0.25000000000000 180.948 > 11 122 Ta 0.50000000000000 0.89863359528097 0.25000000000000 180.948 > 11 123 Ta 0.00000000000000 0.89863359528097 0.58333333333333 180.948 > 11 124 Ta 0.50000000000000 0.89863359528097 0.58333333333333 180.948 > 11 125 Ta 0.00000000000000 0.89863359528097 0.91666666666667 180.948 > 11 126 Ta 0.50000000000000 0.89863359528097 0.91666666666667 180.948 > 11 127 Ta 0.25000000000000 0.60136640471903 0.08333333333333 180.948 > 12 128 Ta 0.75000000000000 0.60136640471903 0.08333333333333 180.948 > 12 129 Ta 0.25000000000000 0.60136640471903 0.41666666666667 180.948 > 12 130 Ta 0.75000000000000 0.60136640471903 0.41666666666667 180.948 > 12 131 Ta 0.25000000000000 0.60136640471903 0.75000000000000 180.948 > 12 132 Ta 0.75000000000000 0.60136640471903 0.75000000000000 180.948 > 12 133 Ta 0.25000000000000 0.39863359528097 0.25000000000000 180.948 > 11 134 Ta 0.75000000000000 0.39863359528097 0.25000000000000 180.948 > 11 135 Ta 0.25000000000000 0.39863359528097 0.58333333333333 180.948 > 11 136 Ta 0.75000000000000 0.39863359528097 0.58333333333333 180.948 > 11 137 Ta 0.25000000000000 0.39863359528097 0.91666666666667 180.948 > 11 138 Ta 0.75000000000000 0.39863359528097 0.91666666666667 180.948 > 11 139 Ta 0.00000000000000 0.10136640471903 0.08333333333333 180.948 > 12 140 Ta 0.50000000000000 0.10136640471903 0.08333333333333 180.948 > 12 141 Ta 0.00000000000000 0.10136640471903 0.41666666666667 180.948 > 12 142 Ta 0.50000000000000 0.10136640471903 0.41666666666667 180.948 > 12 143 Ta 0.00000000000000 0.10136640471903 0.75000000000000 180.948 > 12 144 Ta 0.50000000000000 0.10136640471903 0.75000000000000 180.948 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.9155372 0.0000000 -0.3150373 0.0000000 4.6238646 0.0000000 -0.3150393 0.0000000 4.7237214 -------------------------- Born effective charges -------------------------- 1 O -1.9449007 0.2660904 0.1294338 0.2026940 -2.1158190 -0.4720769 0.1016917 -0.5685035 -3.2576129 2 O -1.9449007 -0.2660904 0.1294338 -0.2026940 -2.1158190 0.4720769 0.1016917 0.5685035 -3.2576129 3 O -1.9449007 0.2660904 0.1294338 0.2026940 -2.1158190 -0.4720769 0.1016917 -0.5685035 -3.2576129 4 O -1.9449007 -0.2660904 0.1294338 -0.2026940 -2.1158190 0.4720769 0.1016917 0.5685035 -3.2576129 5 O -3.2012551 -0.9078003 0.3307092 -0.9251139 -2.5709500 0.5651352 0.3824848 0.4722037 -1.5677630 6 O -3.2012551 0.9078003 0.3307092 0.9251139 -2.5709500 -0.5651352 0.3824848 -0.4722037 -1.5677630 7 O -3.2012551 -0.9078003 0.3307092 -0.9251139 -2.5709500 0.5651352 0.3824848 0.4722037 -1.5677630 8 O -3.2012551 0.9078003 0.3307092 0.9251139 -2.5709500 -0.5651352 0.3824848 -0.4722037 -1.5677630 9 Er 4.4623798 0.0000000 0.0169556 0.0000000 3.8645460 0.0000000 0.4007637 0.0000000 4.2693900 10 Er 4.4623798 0.0000000 0.0169556 0.0000000 3.8645460 0.0000000 0.4007637 0.0000000 4.2693900 11 Ta 5.8299318 0.0000000 -0.9372416 0.0000000 5.5089920 0.0000000 -1.3691167 0.0000000 5.3813618 12 Ta 5.8299318 0.0000000 -0.9372416 0.0000000 5.5089920 0.0000000 -1.3691167 0.0000000 5.3813618 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 400 - Time: 0.908 Solver_block: 200 / 400 - Time: 0.910 Solver_block: 300 / 400 - Time: 0.929 Solver_block: 400 / 400 - Time: 0.914 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.738 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 20:53:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:53:30]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.450049595006198 -5.404764344999998 0.000000000000000 b 3.450049595006198 5.404764344999998 0.000000000000000 c -3.277924791351193 0.000000000000000 3.809480036290911 Atomic positions (fractional): 1 O 0.27535003745780 0.21465308656111 0.21935805965058 15.999 2 O 0.78534691343889 0.72464996254220 0.28064194034942 15.999 3 O 0.72464996254220 0.78534691343889 0.78064194034942 15.999 4 O 0.21465308656111 0.27535003745780 0.71935805965058 15.999 5 O 0.05261909918724 0.62836037763402 0.84024594945506 15.999 6 O 0.37163962236598 0.94738090081276 0.65975405054493 15.999 7 O 0.94738090081276 0.37163962236598 0.15975405054493 15.999 8 O 0.62836037763402 0.05261909918724 0.34024594945506 15.999 9 Er 0.63188654365009 0.36811345634991 0.75000000000000 167.259 10 Er 0.36811345634991 0.63188654365009 0.25000000000000 167.259 11 Ta 0.10136640471903 0.89863359528097 0.75000000000000 180.948 12 Ta 0.89863359528097 0.10136640471903 0.25000000000000 180.948 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.800198380024794 0.000000000000000 0.000000000000000 b 0.000000000000000 10.809528689999997 0.000000000000000 c -9.833774374053579 0.000000000000000 11.428440108872733 Atomic positions (fractional): 1 O 0.12250078100473 0.96965152455166 0.07311935321686 15.999 > 1 2 O 0.62250078100473 0.96965152455166 0.07311935321686 15.999 > 1 3 O 0.12250078100473 0.96965152455166 0.40645268655019 15.999 > 1 4 O 0.62250078100473 0.96965152455166 0.40645268655019 15.999 > 1 5 O 0.12250078100473 0.96965152455166 0.73978601988353 15.999 > 1 6 O 0.62250078100473 0.96965152455166 0.73978601988353 15.999 > 1 7 O 0.37749921899527 0.96965152455166 0.09354731344981 15.999 > 7 8 O 0.87749921899527 0.96965152455166 0.09354731344981 15.999 > 7 9 O 0.37749921899527 0.96965152455166 0.42688064678314 15.999 > 7 10 O 0.87749921899527 0.96965152455166 0.42688064678314 15.999 > 7 11 O 0.37749921899527 0.96965152455166 0.76021398011647 15.999 > 7 12 O 0.87749921899527 0.96965152455166 0.76021398011647 15.999 > 7 13 O 0.12749921899527 0.53034847544834 0.26021398011647 15.999 > 13 14 O 0.62749921899527 0.53034847544834 0.26021398011647 15.999 > 13 15 O 0.12749921899527 0.53034847544834 0.59354731344981 15.999 > 13 16 O 0.62749921899527 0.53034847544834 0.59354731344981 15.999 > 13 17 O 0.12749921899527 0.53034847544834 0.92688064678314 15.999 > 13 18 O 0.62749921899527 0.53034847544834 0.92688064678314 15.999 > 13 19 O 0.37250078100473 0.53034847544834 0.23978601988353 15.999 > 19 20 O 0.87250078100473 0.53034847544834 0.23978601988353 15.999 > 19 21 O 0.37250078100473 0.53034847544834 0.57311935321686 15.999 > 19 22 O 0.87250078100473 0.53034847544834 0.57311935321686 15.999 > 19 23 O 0.37250078100473 0.53034847544834 0.90645268655019 15.999 > 19 24 O 0.87250078100473 0.53034847544834 0.90645268655019 15.999 > 19 25 O 0.42024486920531 0.78787063922339 0.28008198315169 15.999 > 25 26 O 0.92024486920531 0.78787063922339 0.28008198315169 15.999 > 25 27 O 0.42024486920531 0.78787063922339 0.61341531648502 15.999 > 25 28 O 0.92024486920531 0.78787063922339 0.61341531648502 15.999 > 25 29 O 0.42024486920531 0.78787063922339 0.94674864981836 15.999 > 25 30 O 0.92024486920531 0.78787063922339 0.94674864981836 15.999 > 25 31 O 0.07975513079469 0.78787063922339 0.21991801684831 15.999 > 31 32 O 0.57975513079469 0.78787063922339 0.21991801684831 15.999 > 31 33 O 0.07975513079469 0.78787063922339 0.55325135018164 15.999 > 31 34 O 0.57975513079469 0.78787063922339 0.55325135018164 15.999 > 31 35 O 0.07975513079469 0.78787063922339 0.88658468351498 15.999 > 31 36 O 0.57975513079469 0.78787063922339 0.88658468351498 15.999 > 31 37 O 0.32975513079469 0.71212936077661 0.05325135018164 15.999 > 37 38 O 0.82975513079469 0.71212936077661 0.05325135018164 15.999 > 37 39 O 0.32975513079469 0.71212936077661 0.38658468351498 15.999 > 37 40 O 0.82975513079469 0.71212936077661 0.38658468351498 15.999 > 37 41 O 0.32975513079469 0.71212936077661 0.71991801684831 15.999 > 37 42 O 0.82975513079469 0.71212936077661 0.71991801684831 15.999 > 37 43 O 0.17024486920531 0.71212936077661 0.11341531648502 15.999 > 43 44 O 0.67024486920531 0.71212936077661 0.11341531648502 15.999 > 43 45 O 0.17024486920531 0.71212936077661 0.44674864981835 15.999 > 43 46 O 0.67024486920531 0.71212936077661 0.44674864981835 15.999 > 43 47 O 0.17024486920531 0.71212936077661 0.78008198315169 15.999 > 43 48 O 0.67024486920531 0.71212936077661 0.78008198315169 15.999 > 43 49 O 0.37250078100473 0.46965152455165 0.07311935321686 15.999 > 1 50 O 0.87250078100473 0.46965152455165 0.07311935321686 15.999 > 1 51 O 0.37250078100473 0.46965152455165 0.40645268655019 15.999 > 1 52 O 0.87250078100473 0.46965152455165 0.40645268655019 15.999 > 1 53 O 0.37250078100473 0.46965152455165 0.73978601988353 15.999 > 1 54 O 0.87250078100473 0.46965152455165 0.73978601988353 15.999 > 1 55 O 0.12749921899527 0.46965152455165 0.09354731344981 15.999 > 7 56 O 0.62749921899527 0.46965152455165 0.09354731344981 15.999 > 7 57 O 0.12749921899527 0.46965152455165 0.42688064678314 15.999 > 7 58 O 0.62749921899527 0.46965152455165 0.42688064678314 15.999 > 7 59 O 0.12749921899527 0.46965152455165 0.76021398011647 15.999 > 7 60 O 0.62749921899527 0.46965152455165 0.76021398011647 15.999 > 7 61 O 0.37749921899527 0.03034847544834 0.26021398011647 15.999 > 13 62 O 0.87749921899527 0.03034847544834 0.26021398011647 15.999 > 13 63 O 0.37749921899527 0.03034847544834 0.59354731344981 15.999 > 13 64 O 0.87749921899527 0.03034847544834 0.59354731344981 15.999 > 13 65 O 0.37749921899527 0.03034847544834 0.92688064678314 15.999 > 13 66 O 0.87749921899527 0.03034847544834 0.92688064678314 15.999 > 13 67 O 0.12250078100473 0.03034847544834 0.23978601988353 15.999 > 19 68 O 0.62250078100473 0.03034847544834 0.23978601988353 15.999 > 19 69 O 0.12250078100473 0.03034847544834 0.57311935321686 15.999 > 19 70 O 0.62250078100473 0.03034847544834 0.57311935321686 15.999 > 19 71 O 0.12250078100473 0.03034847544834 0.90645268655019 15.999 > 19 72 O 0.62250078100473 0.03034847544834 0.90645268655019 15.999 > 19 73 O 0.17024486920531 0.28787063922339 0.28008198315169 15.999 > 25 74 O 0.67024486920531 0.28787063922339 0.28008198315169 15.999 > 25 75 O 0.17024486920531 0.28787063922339 0.61341531648502 15.999 > 25 76 O 0.67024486920531 0.28787063922339 0.61341531648502 15.999 > 25 77 O 0.17024486920531 0.28787063922339 0.94674864981836 15.999 > 25 78 O 0.67024486920531 0.28787063922339 0.94674864981836 15.999 > 25 79 O 0.32975513079469 0.28787063922339 0.21991801684831 15.999 > 31 80 O 0.82975513079469 0.28787063922339 0.21991801684831 15.999 > 31 81 O 0.32975513079469 0.28787063922339 0.55325135018164 15.999 > 31 82 O 0.82975513079469 0.28787063922339 0.55325135018164 15.999 > 31 83 O 0.32975513079469 0.28787063922339 0.88658468351498 15.999 > 31 84 O 0.82975513079469 0.28787063922339 0.88658468351498 15.999 > 31 85 O 0.07975513079469 0.21212936077661 0.05325135018164 15.999 > 37 86 O 0.57975513079469 0.21212936077661 0.05325135018164 15.999 > 37 87 O 0.07975513079469 0.21212936077661 0.38658468351498 15.999 > 37 88 O 0.57975513079469 0.21212936077661 0.38658468351498 15.999 > 37 89 O 0.07975513079469 0.21212936077661 0.71991801684831 15.999 > 37 90 O 0.57975513079469 0.21212936077661 0.71991801684831 15.999 > 37 91 O 0.42024486920531 0.21212936077661 0.11341531648502 15.999 > 43 92 O 0.92024486920531 0.21212936077661 0.11341531648502 15.999 > 43 93 O 0.42024486920531 0.21212936077661 0.44674864981835 15.999 > 43 94 O 0.92024486920531 0.21212936077661 0.44674864981835 15.999 > 43 95 O 0.42024486920531 0.21212936077661 0.78008198315169 15.999 > 43 96 O 0.92024486920531 0.21212936077661 0.78008198315169 15.999 > 43 97 Er 0.25000000000000 0.86811345634991 0.25000000000000 167.259 > 97 98 Er 0.75000000000000 0.86811345634991 0.25000000000000 167.259 > 97 99 Er 0.25000000000000 0.86811345634991 0.58333333333333 167.259 > 97 100 Er 0.75000000000000 0.86811345634991 0.58333333333333 167.259 > 97 101 Er 0.25000000000000 0.86811345634991 0.91666666666667 167.259 > 97 102 Er 0.75000000000000 0.86811345634991 0.91666666666667 167.259 > 97 103 Er 0.00000000000000 0.63188654365009 0.08333333333333 167.259 > 103 104 Er 0.50000000000000 0.63188654365009 0.08333333333333 167.259 > 103 105 Er 0.00000000000000 0.63188654365009 0.41666666666667 167.259 > 103 106 Er 0.50000000000000 0.63188654365009 0.41666666666667 167.259 > 103 107 Er 0.00000000000000 0.63188654365009 0.75000000000000 167.259 > 103 108 Er 0.50000000000000 0.63188654365009 0.75000000000000 167.259 > 103 109 Er 0.00000000000000 0.36811345634991 0.25000000000000 167.259 > 97 110 Er 0.50000000000000 0.36811345634991 0.25000000000000 167.259 > 97 111 Er 0.00000000000000 0.36811345634991 0.58333333333333 167.259 > 97 112 Er 0.50000000000000 0.36811345634991 0.58333333333333 167.259 > 97 113 Er 0.00000000000000 0.36811345634991 0.91666666666667 167.259 > 97 114 Er 0.50000000000000 0.36811345634991 0.91666666666667 167.259 > 97 115 Er 0.25000000000000 0.13188654365009 0.08333333333333 167.259 > 103 116 Er 0.75000000000000 0.13188654365009 0.08333333333333 167.259 > 103 117 Er 0.25000000000000 0.13188654365009 0.41666666666667 167.259 > 103 118 Er 0.75000000000000 0.13188654365009 0.41666666666667 167.259 > 103 119 Er 0.25000000000000 0.13188654365009 0.75000000000000 167.259 > 103 120 Er 0.75000000000000 0.13188654365009 0.75000000000000 167.259 > 103 121 Ta 0.00000000000000 0.89863359528097 0.25000000000000 180.948 > 121 122 Ta 0.50000000000000 0.89863359528097 0.25000000000000 180.948 > 121 123 Ta 0.00000000000000 0.89863359528097 0.58333333333333 180.948 > 121 124 Ta 0.50000000000000 0.89863359528097 0.58333333333333 180.948 > 121 125 Ta 0.00000000000000 0.89863359528097 0.91666666666667 180.948 > 121 126 Ta 0.50000000000000 0.89863359528097 0.91666666666667 180.948 > 121 127 Ta 0.25000000000000 0.60136640471903 0.08333333333333 180.948 > 127 128 Ta 0.75000000000000 0.60136640471903 0.08333333333333 180.948 > 127 129 Ta 0.25000000000000 0.60136640471903 0.41666666666667 180.948 > 127 130 Ta 0.75000000000000 0.60136640471903 0.41666666666667 180.948 > 127 131 Ta 0.25000000000000 0.60136640471903 0.75000000000000 180.948 > 127 132 Ta 0.75000000000000 0.60136640471903 0.75000000000000 180.948 > 127 133 Ta 0.25000000000000 0.39863359528097 0.25000000000000 180.948 > 121 134 Ta 0.75000000000000 0.39863359528097 0.25000000000000 180.948 > 121 135 Ta 0.25000000000000 0.39863359528097 0.58333333333333 180.948 > 121 136 Ta 0.75000000000000 0.39863359528097 0.58333333333333 180.948 > 121 137 Ta 0.25000000000000 0.39863359528097 0.91666666666667 180.948 > 121 138 Ta 0.75000000000000 0.39863359528097 0.91666666666667 180.948 > 121 139 Ta 0.00000000000000 0.10136640471903 0.08333333333333 180.948 > 127 140 Ta 0.50000000000000 0.10136640471903 0.08333333333333 180.948 > 127 141 Ta 0.00000000000000 0.10136640471903 0.41666666666667 180.948 > 127 142 Ta 0.50000000000000 0.10136640471903 0.41666666666667 180.948 > 127 143 Ta 0.00000000000000 0.10136640471903 0.75000000000000 180.948 > 127 144 Ta 0.50000000000000 0.10136640471903 0.75000000000000 180.948 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.9155372 0.0000000 -0.3150373 0.0000000 4.6238646 0.0000000 -0.3150393 0.0000000 4.7237214 -------------------------- Born effective charges -------------------------- 1 O -1.9449007 0.2660904 0.1294338 0.2026940 -2.1158190 -0.4720769 0.1016917 -0.5685035 -3.2576129 2 O -1.9449007 -0.2660904 0.1294338 -0.2026940 -2.1158190 0.4720769 0.1016917 0.5685035 -3.2576129 3 O -1.9449007 0.2660904 0.1294338 0.2026940 -2.1158190 -0.4720769 0.1016917 -0.5685035 -3.2576129 4 O -1.9449007 -0.2660904 0.1294338 -0.2026940 -2.1158190 0.4720769 0.1016917 0.5685035 -3.2576129 5 O -3.2012551 -0.9078003 0.3307092 -0.9251139 -2.5709500 0.5651352 0.3824848 0.4722037 -1.5677630 6 O -3.2012551 0.9078003 0.3307092 0.9251139 -2.5709500 -0.5651352 0.3824848 -0.4722037 -1.5677630 7 O -3.2012551 -0.9078003 0.3307092 -0.9251139 -2.5709500 0.5651352 0.3824848 0.4722037 -1.5677630 8 O -3.2012551 0.9078003 0.3307092 0.9251139 -2.5709500 -0.5651352 0.3824848 -0.4722037 -1.5677630 9 Er 4.4623798 0.0000000 0.0169556 0.0000000 3.8645460 0.0000000 0.4007637 0.0000000 4.2693900 10 Er 4.4623798 0.0000000 0.0169556 0.0000000 3.8645460 0.0000000 0.4007637 0.0000000 4.2693900 11 Ta 5.8299318 0.0000000 -0.9372416 0.0000000 5.5089920 0.0000000 -1.3691167 0.0000000 5.3813618 12 Ta 5.8299318 0.0000000 -0.9372416 0.0000000 5.5089920 0.0000000 -1.3691167 0.0000000 5.3813618 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 121, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:53:54]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:53:54]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.450049595006198 -5.404764344999998 0.000000000000000 b 3.450049595006198 5.404764344999998 0.000000000000000 c -3.277924791351193 0.000000000000000 3.809480036290911 Atomic positions (fractional): 1 O 0.27535003745780 0.21465308656111 0.21935805965058 15.999 2 O 0.78534691343889 0.72464996254220 0.28064194034942 15.999 3 O 0.72464996254220 0.78534691343889 0.78064194034942 15.999 4 O 0.21465308656111 0.27535003745780 0.71935805965058 15.999 5 O 0.05261909918724 0.62836037763402 0.84024594945506 15.999 6 O 0.37163962236598 0.94738090081276 0.65975405054493 15.999 7 O 0.94738090081276 0.37163962236598 0.15975405054493 15.999 8 O 0.62836037763402 0.05261909918724 0.34024594945506 15.999 9 Er 0.63188654365009 0.36811345634991 0.75000000000000 167.259 10 Er 0.36811345634991 0.63188654365009 0.25000000000000 167.259 11 Ta 0.10136640471903 0.89863359528097 0.75000000000000 180.948 12 Ta 0.89863359528097 0.10136640471903 0.25000000000000 180.948 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.800198380024794 0.000000000000000 0.000000000000000 b 0.000000000000000 10.809528689999997 0.000000000000000 c -9.833774374053579 0.000000000000000 11.428440108872733 Atomic positions (fractional): 1 O 0.12250078100473 0.96965152455166 0.07311935321686 15.999 > 1 2 O 0.62250078100473 0.96965152455166 0.07311935321686 15.999 > 1 3 O 0.12250078100473 0.96965152455166 0.40645268655019 15.999 > 1 4 O 0.62250078100473 0.96965152455166 0.40645268655019 15.999 > 1 5 O 0.12250078100473 0.96965152455166 0.73978601988353 15.999 > 1 6 O 0.62250078100473 0.96965152455166 0.73978601988353 15.999 > 1 7 O 0.37749921899527 0.96965152455166 0.09354731344981 15.999 > 7 8 O 0.87749921899527 0.96965152455166 0.09354731344981 15.999 > 7 9 O 0.37749921899527 0.96965152455166 0.42688064678314 15.999 > 7 10 O 0.87749921899527 0.96965152455166 0.42688064678314 15.999 > 7 11 O 0.37749921899527 0.96965152455166 0.76021398011647 15.999 > 7 12 O 0.87749921899527 0.96965152455166 0.76021398011647 15.999 > 7 13 O 0.12749921899527 0.53034847544834 0.26021398011647 15.999 > 13 14 O 0.62749921899527 0.53034847544834 0.26021398011647 15.999 > 13 15 O 0.12749921899527 0.53034847544834 0.59354731344981 15.999 > 13 16 O 0.62749921899527 0.53034847544834 0.59354731344981 15.999 > 13 17 O 0.12749921899527 0.53034847544834 0.92688064678314 15.999 > 13 18 O 0.62749921899527 0.53034847544834 0.92688064678314 15.999 > 13 19 O 0.37250078100473 0.53034847544834 0.23978601988353 15.999 > 19 20 O 0.87250078100473 0.53034847544834 0.23978601988353 15.999 > 19 21 O 0.37250078100473 0.53034847544834 0.57311935321686 15.999 > 19 22 O 0.87250078100473 0.53034847544834 0.57311935321686 15.999 > 19 23 O 0.37250078100473 0.53034847544834 0.90645268655019 15.999 > 19 24 O 0.87250078100473 0.53034847544834 0.90645268655019 15.999 > 19 25 O 0.42024486920531 0.78787063922339 0.28008198315169 15.999 > 25 26 O 0.92024486920531 0.78787063922339 0.28008198315169 15.999 > 25 27 O 0.42024486920531 0.78787063922339 0.61341531648502 15.999 > 25 28 O 0.92024486920531 0.78787063922339 0.61341531648502 15.999 > 25 29 O 0.42024486920531 0.78787063922339 0.94674864981836 15.999 > 25 30 O 0.92024486920531 0.78787063922339 0.94674864981836 15.999 > 25 31 O 0.07975513079469 0.78787063922339 0.21991801684831 15.999 > 31 32 O 0.57975513079469 0.78787063922339 0.21991801684831 15.999 > 31 33 O 0.07975513079469 0.78787063922339 0.55325135018164 15.999 > 31 34 O 0.57975513079469 0.78787063922339 0.55325135018164 15.999 > 31 35 O 0.07975513079469 0.78787063922339 0.88658468351498 15.999 > 31 36 O 0.57975513079469 0.78787063922339 0.88658468351498 15.999 > 31 37 O 0.32975513079469 0.71212936077661 0.05325135018164 15.999 > 37 38 O 0.82975513079469 0.71212936077661 0.05325135018164 15.999 > 37 39 O 0.32975513079469 0.71212936077661 0.38658468351498 15.999 > 37 40 O 0.82975513079469 0.71212936077661 0.38658468351498 15.999 > 37 41 O 0.32975513079469 0.71212936077661 0.71991801684831 15.999 > 37 42 O 0.82975513079469 0.71212936077661 0.71991801684831 15.999 > 37 43 O 0.17024486920531 0.71212936077661 0.11341531648502 15.999 > 43 44 O 0.67024486920531 0.71212936077661 0.11341531648502 15.999 > 43 45 O 0.17024486920531 0.71212936077661 0.44674864981835 15.999 > 43 46 O 0.67024486920531 0.71212936077661 0.44674864981835 15.999 > 43 47 O 0.17024486920531 0.71212936077661 0.78008198315169 15.999 > 43 48 O 0.67024486920531 0.71212936077661 0.78008198315169 15.999 > 43 49 O 0.37250078100473 0.46965152455165 0.07311935321686 15.999 > 1 50 O 0.87250078100473 0.46965152455165 0.07311935321686 15.999 > 1 51 O 0.37250078100473 0.46965152455165 0.40645268655019 15.999 > 1 52 O 0.87250078100473 0.46965152455165 0.40645268655019 15.999 > 1 53 O 0.37250078100473 0.46965152455165 0.73978601988353 15.999 > 1 54 O 0.87250078100473 0.46965152455165 0.73978601988353 15.999 > 1 55 O 0.12749921899527 0.46965152455165 0.09354731344981 15.999 > 7 56 O 0.62749921899527 0.46965152455165 0.09354731344981 15.999 > 7 57 O 0.12749921899527 0.46965152455165 0.42688064678314 15.999 > 7 58 O 0.62749921899527 0.46965152455165 0.42688064678314 15.999 > 7 59 O 0.12749921899527 0.46965152455165 0.76021398011647 15.999 > 7 60 O 0.62749921899527 0.46965152455165 0.76021398011647 15.999 > 7 61 O 0.37749921899527 0.03034847544834 0.26021398011647 15.999 > 13 62 O 0.87749921899527 0.03034847544834 0.26021398011647 15.999 > 13 63 O 0.37749921899527 0.03034847544834 0.59354731344981 15.999 > 13 64 O 0.87749921899527 0.03034847544834 0.59354731344981 15.999 > 13 65 O 0.37749921899527 0.03034847544834 0.92688064678314 15.999 > 13 66 O 0.87749921899527 0.03034847544834 0.92688064678314 15.999 > 13 67 O 0.12250078100473 0.03034847544834 0.23978601988353 15.999 > 19 68 O 0.62250078100473 0.03034847544834 0.23978601988353 15.999 > 19 69 O 0.12250078100473 0.03034847544834 0.57311935321686 15.999 > 19 70 O 0.62250078100473 0.03034847544834 0.57311935321686 15.999 > 19 71 O 0.12250078100473 0.03034847544834 0.90645268655019 15.999 > 19 72 O 0.62250078100473 0.03034847544834 0.90645268655019 15.999 > 19 73 O 0.17024486920531 0.28787063922339 0.28008198315169 15.999 > 25 74 O 0.67024486920531 0.28787063922339 0.28008198315169 15.999 > 25 75 O 0.17024486920531 0.28787063922339 0.61341531648502 15.999 > 25 76 O 0.67024486920531 0.28787063922339 0.61341531648502 15.999 > 25 77 O 0.17024486920531 0.28787063922339 0.94674864981836 15.999 > 25 78 O 0.67024486920531 0.28787063922339 0.94674864981836 15.999 > 25 79 O 0.32975513079469 0.28787063922339 0.21991801684831 15.999 > 31 80 O 0.82975513079469 0.28787063922339 0.21991801684831 15.999 > 31 81 O 0.32975513079469 0.28787063922339 0.55325135018164 15.999 > 31 82 O 0.82975513079469 0.28787063922339 0.55325135018164 15.999 > 31 83 O 0.32975513079469 0.28787063922339 0.88658468351498 15.999 > 31 84 O 0.82975513079469 0.28787063922339 0.88658468351498 15.999 > 31 85 O 0.07975513079469 0.21212936077661 0.05325135018164 15.999 > 37 86 O 0.57975513079469 0.21212936077661 0.05325135018164 15.999 > 37 87 O 0.07975513079469 0.21212936077661 0.38658468351498 15.999 > 37 88 O 0.57975513079469 0.21212936077661 0.38658468351498 15.999 > 37 89 O 0.07975513079469 0.21212936077661 0.71991801684831 15.999 > 37 90 O 0.57975513079469 0.21212936077661 0.71991801684831 15.999 > 37 91 O 0.42024486920531 0.21212936077661 0.11341531648502 15.999 > 43 92 O 0.92024486920531 0.21212936077661 0.11341531648502 15.999 > 43 93 O 0.42024486920531 0.21212936077661 0.44674864981835 15.999 > 43 94 O 0.92024486920531 0.21212936077661 0.44674864981835 15.999 > 43 95 O 0.42024486920531 0.21212936077661 0.78008198315169 15.999 > 43 96 O 0.92024486920531 0.21212936077661 0.78008198315169 15.999 > 43 97 Er 0.25000000000000 0.86811345634991 0.25000000000000 167.259 > 97 98 Er 0.75000000000000 0.86811345634991 0.25000000000000 167.259 > 97 99 Er 0.25000000000000 0.86811345634991 0.58333333333333 167.259 > 97 100 Er 0.75000000000000 0.86811345634991 0.58333333333333 167.259 > 97 101 Er 0.25000000000000 0.86811345634991 0.91666666666667 167.259 > 97 102 Er 0.75000000000000 0.86811345634991 0.91666666666667 167.259 > 97 103 Er 0.00000000000000 0.63188654365009 0.08333333333333 167.259 > 103 104 Er 0.50000000000000 0.63188654365009 0.08333333333333 167.259 > 103 105 Er 0.00000000000000 0.63188654365009 0.41666666666667 167.259 > 103 106 Er 0.50000000000000 0.63188654365009 0.41666666666667 167.259 > 103 107 Er 0.00000000000000 0.63188654365009 0.75000000000000 167.259 > 103 108 Er 0.50000000000000 0.63188654365009 0.75000000000000 167.259 > 103 109 Er 0.00000000000000 0.36811345634991 0.25000000000000 167.259 > 97 110 Er 0.50000000000000 0.36811345634991 0.25000000000000 167.259 > 97 111 Er 0.00000000000000 0.36811345634991 0.58333333333333 167.259 > 97 112 Er 0.50000000000000 0.36811345634991 0.58333333333333 167.259 > 97 113 Er 0.00000000000000 0.36811345634991 0.91666666666667 167.259 > 97 114 Er 0.50000000000000 0.36811345634991 0.91666666666667 167.259 > 97 115 Er 0.25000000000000 0.13188654365009 0.08333333333333 167.259 > 103 116 Er 0.75000000000000 0.13188654365009 0.08333333333333 167.259 > 103 117 Er 0.25000000000000 0.13188654365009 0.41666666666667 167.259 > 103 118 Er 0.75000000000000 0.13188654365009 0.41666666666667 167.259 > 103 119 Er 0.25000000000000 0.13188654365009 0.75000000000000 167.259 > 103 120 Er 0.75000000000000 0.13188654365009 0.75000000000000 167.259 > 103 121 Ta 0.00000000000000 0.89863359528097 0.25000000000000 180.948 > 121 122 Ta 0.50000000000000 0.89863359528097 0.25000000000000 180.948 > 121 123 Ta 0.00000000000000 0.89863359528097 0.58333333333333 180.948 > 121 124 Ta 0.50000000000000 0.89863359528097 0.58333333333333 180.948 > 121 125 Ta 0.00000000000000 0.89863359528097 0.91666666666667 180.948 > 121 126 Ta 0.50000000000000 0.89863359528097 0.91666666666667 180.948 > 121 127 Ta 0.25000000000000 0.60136640471903 0.08333333333333 180.948 > 127 128 Ta 0.75000000000000 0.60136640471903 0.08333333333333 180.948 > 127 129 Ta 0.25000000000000 0.60136640471903 0.41666666666667 180.948 > 127 130 Ta 0.75000000000000 0.60136640471903 0.41666666666667 180.948 > 127 131 Ta 0.25000000000000 0.60136640471903 0.75000000000000 180.948 > 127 132 Ta 0.75000000000000 0.60136640471903 0.75000000000000 180.948 > 127 133 Ta 0.25000000000000 0.39863359528097 0.25000000000000 180.948 > 121 134 Ta 0.75000000000000 0.39863359528097 0.25000000000000 180.948 > 121 135 Ta 0.25000000000000 0.39863359528097 0.58333333333333 180.948 > 121 136 Ta 0.75000000000000 0.39863359528097 0.58333333333333 180.948 > 121 137 Ta 0.25000000000000 0.39863359528097 0.91666666666667 180.948 > 121 138 Ta 0.75000000000000 0.39863359528097 0.91666666666667 180.948 > 121 139 Ta 0.00000000000000 0.10136640471903 0.08333333333333 180.948 > 127 140 Ta 0.50000000000000 0.10136640471903 0.08333333333333 180.948 > 127 141 Ta 0.00000000000000 0.10136640471903 0.41666666666667 180.948 > 127 142 Ta 0.50000000000000 0.10136640471903 0.41666666666667 180.948 > 127 143 Ta 0.00000000000000 0.10136640471903 0.75000000000000 180.948 > 127 144 Ta 0.50000000000000 0.10136640471903 0.75000000000000 180.948 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.9155372 0.0000000 -0.3150373 0.0000000 4.6238646 0.0000000 -0.3150393 0.0000000 4.7237214 -------------------------- Born effective charges -------------------------- 1 O -1.9449007 0.2660904 0.1294338 0.2026940 -2.1158190 -0.4720769 0.1016917 -0.5685035 -3.2576129 2 O -1.9449007 -0.2660904 0.1294338 -0.2026940 -2.1158190 0.4720769 0.1016917 0.5685035 -3.2576129 3 O -1.9449007 0.2660904 0.1294338 0.2026940 -2.1158190 -0.4720769 0.1016917 -0.5685035 -3.2576129 4 O -1.9449007 -0.2660904 0.1294338 -0.2026940 -2.1158190 0.4720769 0.1016917 0.5685035 -3.2576129 5 O -3.2012551 -0.9078003 0.3307092 -0.9251139 -2.5709500 0.5651352 0.3824848 0.4722037 -1.5677630 6 O -3.2012551 0.9078003 0.3307092 0.9251139 -2.5709500 -0.5651352 0.3824848 -0.4722037 -1.5677630 7 O -3.2012551 -0.9078003 0.3307092 -0.9251139 -2.5709500 0.5651352 0.3824848 0.4722037 -1.5677630 8 O -3.2012551 0.9078003 0.3307092 0.9251139 -2.5709500 -0.5651352 0.3824848 -0.4722037 -1.5677630 9 Er 4.4623798 0.0000000 0.0169556 0.0000000 3.8645460 0.0000000 0.4007637 0.0000000 4.2693900 10 Er 4.4623798 0.0000000 0.0169556 0.0000000 3.8645460 0.0000000 0.4007637 0.0000000 4.2693900 11 Ta 5.8299318 0.0000000 -0.9372416 0.0000000 5.5089920 0.0000000 -1.3691167 0.0000000 5.3813618 12 Ta 5.8299318 0.0000000 -0.9372416 0.0000000 5.5089920 0.0000000 -1.3691167 0.0000000 5.3813618 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 11 13 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.80, Number of G-points: 301, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/432) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 3.228 ( 0.000 0.000 0.000) 0.000 3.266 ( 0.000 0.000 0.000) 0.000 3.807 ( 0.000 0.000 0.000) 0.000 3.999 ( 0.000 0.000 0.000) 0.000 4.566 ( 0.000 0.000 0.000) 0.000 5.008 ( 0.000 0.000 0.000) 0.000 5.083 ( 0.000 0.000 0.000) 0.000 5.292 ( 0.000 0.000 0.000) 0.000 5.499 ( 0.000 0.000 0.000) 0.000 5.620 ( 0.000 0.000 0.000) 0.000 5.893 ( 0.000 0.000 0.000) 0.000 7.157 ( 0.000 0.000 0.000) 0.000 7.497 ( 0.000 0.000 0.000) 0.000 8.965 ( 0.000 0.000 0.000) 0.000 9.487 ( 0.000 0.000 0.000) 0.000 9.819 ( 0.000 0.000 0.000) 0.000 10.193 ( 0.000 0.000 0.000) 0.000 10.243 ( 0.000 0.000 0.000) 0.000 11.352 ( 0.000 0.000 0.000) 0.000 11.892 ( 0.000 0.000 0.000) 0.000 12.578 ( 0.000 0.000 0.000) 0.000 12.844 ( 0.000 0.000 0.000) 0.000 13.482 ( 0.000 0.000 0.000) 0.000 14.474 ( 0.000 0.000 0.000) 0.000 16.172 ( 0.000 0.000 0.000) 0.000 16.329 ( 0.000 0.000 0.000) 0.000 19.199 ( 0.000 0.000 0.000) 0.000 19.832 ( 0.000 0.000 0.000) 0.000 19.845 ( 0.000 0.000 0.000) 0.000 19.915 ( 0.000 0.000 0.000) 0.000 21.225 ( 0.000 0.000 0.000) 0.000 23.620 ( 0.000 0.000 0.000) 0.000 24.301 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/432) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.513 ( 14.837 -13.746 17.911) 27.017 0.565 ( 15.266 -27.152 11.497) 33.204 1.059 ( 43.367 -11.478 32.890) 55.625 3.218 ( -1.807 0.083 0.552) 1.891 3.294 ( 6.434 1.634 -1.868) 6.896 3.764 ( -4.386 3.473 2.093) 5.973 4.034 ( 2.228 -0.300 0.430) 2.289 4.579 ( 2.917 2.995 -0.932) 4.283 4.973 ( -2.619 4.266 -2.937) 5.804 5.079 ( -18.437 0.333 4.588) 19.002 5.537 ( 3.038 0.528 -3.083) 4.360 5.587 ( -1.817 4.822 23.872) 24.422 5.878 ( -4.621 -3.432 0.679) 5.796 6.298 ( 68.360 59.567 -31.063) 95.845 7.211 ( 7.491 -0.546 -0.802) 7.554 7.827 ( -13.378 -46.335 -23.397) 53.603 9.112 ( -9.897 -25.429 -2.637) 27.414 9.501 ( 1.668 -1.698 -0.191) 2.388 9.823 ( 4.383 11.046 2.372) 12.118 10.135 ( -4.083 -5.947 -7.932) 10.722 11.083 ( 27.586 40.505 -21.545) 53.533 11.638 ( 38.962 -6.186 -23.615) 45.978 12.010 ( -7.243 4.830 20.866) 22.609 12.551 ( -1.177 -2.069 -4.082) 4.725 13.268 ( -6.025 -62.468 -35.176) 71.944 13.496 ( 1.364 -2.147 -0.536) 2.599 14.442 ( -2.751 1.029 -1.570) 3.331 16.235 ( -5.819 3.039 -6.739) 9.408 17.859 ( -81.043 55.734 139.354) 170.569 19.351 ( -21.153 -22.306 4.119) 31.016 19.829 ( -4.924 -2.180 -1.719) 5.653 19.874 ( -5.210 -3.319 -1.038) 6.264 21.253 ( 2.724 1.519 3.104) 4.401 22.309 ( 82.282 38.205 -65.629) 111.969 23.902 ( -6.774 -42.654 -23.002) 48.933 24.309 ( -0.534 -0.777 1.373) 1.665 ======================= Grid point 2 (3/432) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.027 ( 14.428 -14.454 17.648) 26.991 1.115 ( 14.972 -24.436 12.004) 31.070 2.061 ( 40.701 -9.736 29.442) 51.168 3.193 ( -3.052 1.054 1.354) 3.501 3.335 ( 7.337 4.205 -4.315) 9.494 3.728 ( -1.656 4.776 6.344) 8.111 4.044 ( 1.560 2.621 -2.476) 3.929 4.573 ( 5.638 4.203 -4.793) 8.510 4.779 ( -11.391 5.088 -1.377) 12.551 4.997 ( -2.383 -3.172 -2.095) 4.486 5.534 ( -2.161 0.837 1.882) 2.986 5.735 ( -1.600 5.544 11.252) 12.646 5.880 ( -1.922 -4.049 5.112) 6.798 6.374 ( 33.977 25.861 -11.061) 44.109 7.297 ( 8.521 0.544 -5.540) 10.178 7.773 ( -7.718 -25.373 -13.372) 29.701 9.167 ( -5.905 -8.862 3.709) 11.276 9.570 ( 1.709 -6.151 2.492) 6.854 9.758 ( 4.731 18.164 -2.218) 18.901 10.076 ( -2.136 -7.038 -3.072) 7.971 10.903 ( 8.841 20.696 -6.923) 23.546 11.912 ( 19.747 -7.170 -7.666) 22.363 12.132 ( -2.613 -3.966 11.754) 12.677 12.514 ( 0.667 -3.010 -4.488) 5.445 13.318 ( -1.583 -26.677 -14.069) 30.201 13.555 ( 3.117 -4.012 1.986) 5.454 14.352 ( -5.134 2.099 -2.856) 6.239 15.983 ( -10.347 4.566 -12.323) 16.727 17.923 ( -35.086 26.894 68.314) 81.371 19.296 ( -3.070 -3.825 -4.752) 6.829 19.695 ( -11.030 -0.557 -2.735) 11.377 19.819 ( -7.027 -6.910 -4.580) 10.867 21.343 ( 4.164 1.806 6.941) 8.294 22.331 ( 40.935 15.293 -34.087) 55.421 23.919 ( -1.675 -18.995 -9.802) 21.440 24.325 ( -1.586 -0.865 2.459) 3.051 ======================= Grid point 3 (4/432) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( 13.764 -14.958 15.314) 25.450 1.640 ( 13.502 -20.565 14.012) 28.312 2.923 ( 34.205 -4.433 19.092) 39.422 3.157 ( -2.812 1.763 4.345) 5.468 3.307 ( 2.356 6.024 -2.315) 6.870 3.770 ( 1.865 7.028 4.316) 8.455 3.984 ( 3.890 3.061 -5.751) 7.588 4.519 ( -3.877 4.660 -2.797) 6.676 4.651 ( 1.856 -1.335 -4.083) 4.680 4.985 ( -2.166 -3.784 -0.237) 4.366 5.489 ( -6.534 4.303 3.399) 8.530 5.729 ( -7.243 -2.423 3.590) 8.440 6.011 ( 5.535 3.620 10.766) 12.635 6.502 ( 22.632 12.987 -4.058) 26.407 7.251 ( 1.750 1.328 -13.173) 13.355 7.780 ( -0.909 -19.082 -8.078) 20.741 9.145 ( -8.739 3.589 3.760) 10.168 9.607 ( 1.888 4.070 -1.793) 4.831 9.749 ( 4.854 0.779 4.672) 6.782 10.115 ( 3.169 -0.295 3.229) 4.534 10.824 ( 3.214 2.773 -2.702) 5.032 12.039 ( 0.492 5.997 2.863) 6.663 12.283 ( 9.360 -11.256 -3.416) 15.033 12.536 ( 2.713 -4.431 -0.950) 5.281 13.348 ( -1.805 -15.532 -7.746) 17.450 13.707 ( 5.913 -6.330 6.791) 11.007 14.208 ( -7.226 3.718 -3.783) 8.963 15.629 ( -12.416 5.448 -15.017) 20.232 18.028 ( -17.190 16.141 42.632) 48.719 19.227 ( 4.134 4.954 -8.033) 10.304 19.528 ( -13.511 -4.013 -0.097) 14.095 19.686 ( -8.089 -4.949 -9.888) 13.700 21.471 ( 3.328 1.819 8.656) 9.451 22.356 ( 25.473 6.744 -22.455) 34.621 23.959 ( 1.549 -11.331 -5.326) 12.616 24.331 ( -3.064 -0.194 3.010) 4.299 ======================= Grid point 4 (5/432) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( 12.075 -13.618 10.320) 20.923 2.131 ( 10.546 -16.562 16.641) 25.738 3.043 ( -2.215 5.937 -1.411) 6.492 3.199 ( 0.740 6.029 -3.031) 6.789 3.602 ( 1.856 9.872 -0.401) 10.053 3.665 ( 15.750 0.506 8.418) 17.866 4.096 ( 14.616 -3.155 1.250) 15.004 4.379 ( -8.091 2.610 -0.992) 8.559 4.699 ( 6.263 -4.408 -3.795) 8.548 4.990 ( -3.996 -4.307 2.147) 6.255 5.365 ( -9.790 8.048 3.052) 13.036 5.699 ( -5.381 -3.790 1.707) 6.800 6.182 ( 7.531 4.794 9.726) 13.202 6.639 ( 13.685 6.205 -0.681) 15.041 7.058 ( -3.669 0.653 -15.023) 15.478 7.871 ( 3.711 -15.627 -5.707) 17.045 8.975 ( -10.577 10.460 1.871) 14.993 9.631 ( 6.286 4.045 1.251) 7.579 9.806 ( -2.336 -0.387 1.915) 3.046 10.241 ( 7.028 2.546 6.362) 9.816 10.906 ( 3.982 -13.307 2.167) 14.058 11.906 ( -8.294 12.774 -1.549) 15.309 12.450 ( 11.161 -4.986 -5.294) 13.322 12.631 ( 3.739 -7.798 0.778) 8.683 13.367 ( -2.392 -10.007 -2.321) 10.547 13.946 ( 5.769 -5.564 5.938) 9.975 14.029 ( -5.979 3.498 -0.608) 6.954 15.250 ( -11.627 5.574 -14.574) 19.459 18.155 ( -6.809 9.290 25.753) 28.211 19.151 ( 4.003 7.807 -4.057) 9.667 19.424 ( -9.864 -5.591 1.644) 11.457 19.481 ( -6.970 -3.062 -13.633) 15.615 21.575 ( 1.376 1.972 6.458) 6.891 22.381 ( 14.973 2.393 -13.345) 20.199 24.028 ( 3.890 -7.623 -3.190) 9.134 24.313 ( -4.294 0.964 2.869) 5.254 ======================= Grid point 5 (6/432) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( 6.433 -7.216 4.256) 10.563 2.522 ( 4.210 -8.480 11.101) 14.590 2.972 ( 0.198 1.239 2.416) 2.723 3.110 ( -0.846 4.062 -7.728) 8.771 3.341 ( -5.414 9.625 -4.853) 12.063 4.002 ( 13.864 -0.355 2.621) 14.114 4.231 ( -10.779 1.128 2.586) 11.142 4.362 ( 12.452 -2.592 0.367) 12.724 4.763 ( 2.111 -2.937 -1.761) 4.023 5.019 ( -0.539 -5.988 2.318) 6.444 5.181 ( -8.610 8.976 0.523) 12.449 5.692 ( -1.699 -1.793 0.798) 2.595 6.326 ( 4.746 2.548 5.086) 7.408 6.726 ( 4.745 2.398 0.507) 5.341 6.859 ( -3.721 -0.728 -8.340) 9.161 7.980 ( 3.068 -7.778 -2.494) 8.725 8.798 ( -5.379 6.445 0.906) 8.444 9.690 ( 3.605 2.682 1.237) 4.660 9.781 ( -2.277 -0.793 0.002) 2.411 10.338 ( 2.476 1.621 2.301) 3.749 11.189 ( 8.301 -17.838 6.896) 20.848 11.607 ( -9.904 15.868 -6.229) 19.715 12.528 ( 3.818 -0.541 -1.857) 4.280 12.745 ( 2.914 -4.470 -0.052) 5.337 13.406 ( -0.703 -4.809 0.798) 4.925 13.826 ( -4.487 4.098 -2.921) 6.742 14.225 ( 5.417 -4.748 7.121) 10.129 14.940 ( -6.622 3.711 -8.543) 11.428 18.252 ( -1.316 3.171 8.889) 9.529 19.144 ( 2.726 5.588 6.160) 8.752 19.271 ( -4.908 -3.738 -13.158) 14.532 19.387 ( -2.893 -1.957 0.577) 3.540 21.621 ( 0.230 0.956 2.205) 2.415 22.402 ( 5.035 0.477 -4.363) 6.679 24.102 ( 3.186 -3.638 -1.531) 5.073 24.274 ( -3.189 1.365 1.615) 3.827 ======================= Grid point 12 (7/432) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 21.579 -0.000 13.407) 25.405 0.900 ( 14.194 -0.000 22.583) 26.673 1.984 ( 43.431 -0.000 31.972) 53.930 3.202 ( -2.197 0.000 1.259) 2.532 3.372 ( 8.519 -0.000 -4.424) 9.600 3.767 ( -2.980 0.000 5.906) 6.615 4.067 ( 1.431 -0.000 -0.630) 1.564 4.610 ( 6.709 -0.000 -7.591) 10.131 4.845 ( -19.507 0.000 3.514) 19.821 4.950 ( 2.279 -0.000 -6.659) 7.038 5.538 ( -1.716 0.000 1.684) 2.404 5.783 ( -9.181 0.000 2.172) 9.434 5.844 ( 5.457 -0.000 14.177) 15.191 6.785 ( 30.326 -0.000 -28.637) 41.710 7.316 ( 8.639 -0.000 -0.829) 8.678 7.348 ( -4.826 0.000 -6.820) 8.355 9.049 ( -4.225 0.000 11.436) 12.192 9.539 ( 4.877 -0.000 -0.844) 4.950 9.920 ( -5.532 0.000 -10.166) 11.574 10.001 ( 8.040 -0.000 3.921) 8.946 11.183 ( -6.740 0.000 -6.038) 9.049 11.763 ( 41.604 -0.000 -29.617) 51.069 12.204 ( -5.138 0.000 17.371) 18.115 12.454 ( -0.625 0.000 -4.158) 4.204 12.990 ( 6.588 -0.000 -2.802) 7.159 13.532 ( 1.042 -0.000 4.804) 4.916 14.371 ( -4.867 0.000 -2.825) 5.627 16.022 ( -11.053 0.000 -12.193) 16.458 18.200 ( -61.233 0.000 75.653) 97.329 19.249 ( 8.124 -0.000 -4.949) 9.512 19.713 ( -10.647 0.000 -4.432) 11.533 19.730 ( -6.154 0.000 -3.158) 6.917 21.362 ( 2.162 -0.000 9.084) 9.338 22.514 ( 44.864 -0.000 -55.850) 71.638 23.694 ( 4.135 -0.000 0.996) 4.254 24.318 ( -1.553 0.000 2.900) 3.290 ======================= Grid point 13 (8/432) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( 20.143 -8.040 12.627) 25.096 1.368 ( 12.536 -8.265 22.795) 27.296 2.871 ( 39.236 -1.539 25.088) 46.597 3.187 ( -2.505 1.232 2.573) 3.797 3.391 ( 3.407 2.992 -4.265) 6.225 3.830 ( 2.743 0.959 5.309) 6.052 4.038 ( -0.483 2.401 -3.894) 4.601 4.584 ( 4.158 1.985 -10.448) 11.419 4.643 ( -11.051 0.774 1.200) 11.143 4.921 ( 1.335 -3.000 -5.231) 6.176 5.524 ( -4.929 0.651 3.433) 6.042 5.692 ( -9.914 -1.383 3.958) 10.764 6.066 ( 6.594 1.976 12.213) 14.019 6.776 ( 18.428 17.570 -10.159) 27.413 7.232 ( -1.857 -6.384 -14.211) 15.690 7.450 ( 2.269 -14.166 -1.854) 14.466 9.132 ( -7.811 -2.525 12.127) 14.644 9.536 ( -5.287 -2.547 -4.189) 7.210 9.855 ( 10.471 1.352 -0.801) 10.588 10.134 ( 7.250 3.700 3.829) 8.995 10.972 ( -4.874 8.318 -6.727) 11.756 12.030 ( 28.720 -5.672 -12.528) 31.843 12.275 ( -5.084 10.038 14.027) 17.982 12.459 ( 1.686 -5.621 -0.801) 5.923 13.059 ( 2.671 -13.831 -8.150) 16.274 13.645 ( 3.746 -1.560 8.673) 9.575 14.254 ( -6.483 1.472 -3.548) 7.536 15.691 ( -13.451 1.866 -15.189) 20.374 18.234 ( -30.271 6.886 43.967) 53.822 19.301 ( 10.271 2.787 -6.338) 12.387 19.492 ( -13.189 0.194 -4.643) 13.983 19.604 ( -8.570 -4.120 -6.064) 11.278 21.505 ( 1.464 1.524 12.336) 12.515 22.447 ( 28.642 3.370 -36.611) 46.605 23.796 ( 4.821 -6.259 -0.284) 7.906 24.328 ( -2.963 -0.116 3.936) 4.928 ======================= Grid point 14 (9/432) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( 15.871 -7.853 12.770) 21.832 1.870 ( 12.153 -12.918 20.167) 26.857 3.135 ( -1.323 4.443 -0.748) 4.695 3.306 ( -1.602 6.015 -3.187) 6.993 3.613 ( 28.749 -1.071 17.201) 33.519 3.823 ( -5.742 9.262 -2.576) 11.197 4.027 ( 10.900 -3.937 -3.775) 12.189 4.416 ( -10.182 1.632 -3.003) 10.740 4.636 ( 6.492 -2.895 -4.454) 8.388 4.910 ( -1.787 -4.608 -2.100) 5.370 5.458 ( -8.455 3.263 2.944) 9.529 5.650 ( -6.430 -1.939 5.372) 8.600 6.256 ( 6.171 3.439 10.006) 12.249 6.767 ( 7.885 9.612 -2.884) 12.763 7.057 ( -2.444 -1.829 -16.670) 16.947 7.583 ( 1.800 -16.430 -1.087) 16.564 9.098 ( -11.784 4.469 5.500) 13.751 9.453 ( -8.912 -11.323 -1.255) 14.464 10.030 ( 15.625 12.544 2.467) 20.189 10.254 ( 7.790 -0.279 5.896) 9.774 10.825 ( -0.569 1.194 -3.173) 3.438 12.161 ( 0.771 16.929 0.870) 16.969 12.355 ( 16.451 -4.878 -1.761) 17.249 12.534 ( 1.117 -4.042 2.568) 4.917 13.120 ( -0.901 -17.963 -5.520) 18.813 13.852 ( 7.111 -4.182 10.356) 13.240 14.098 ( -7.429 3.385 -3.671) 8.951 15.319 ( -12.966 2.648 -15.265) 20.202 18.285 ( -13.345 5.686 24.203) 28.217 19.268 ( -7.166 3.069 -2.692) 8.248 19.335 ( -0.595 -0.855 -4.827) 4.939 19.452 ( -2.964 -1.786 -8.362) 9.050 21.631 ( -0.235 3.935 11.497) 12.154 22.396 ( 18.636 -0.372 -25.030) 31.208 23.911 ( 5.727 -5.606 -0.429) 8.026 24.326 ( -4.364 0.563 4.423) 6.239 ======================= Grid point 15 (10/432) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( 12.607 -5.874 9.130) 16.638 2.335 ( 8.324 -12.040 17.669) 22.945 3.045 ( -3.502 5.945 -0.819) 6.948 3.173 ( -3.572 3.916 -5.802) 7.859 3.555 ( -9.041 13.657 -6.678) 17.687 3.998 ( 15.559 0.469 -0.477) 15.573 4.218 ( -6.900 -4.169 2.982) 8.596 4.288 ( 11.084 -4.398 -4.907) 12.895 4.726 ( 6.376 -1.415 1.182) 6.637 4.905 ( -3.158 -6.809 -0.369) 7.515 5.313 ( -9.568 6.082 -0.083) 11.338 5.676 ( -1.416 -0.198 6.193) 6.356 6.372 ( 1.274 2.717 4.014) 5.011 6.721 ( -3.503 -1.498 -5.036) 6.314 6.890 ( 1.386 3.172 -6.305) 7.193 7.762 ( 3.170 -15.750 2.775) 16.304 8.919 ( -11.179 7.035 0.640) 13.224 9.433 ( -10.817 -15.506 -0.726) 18.920 10.056 ( 6.561 15.346 0.090) 16.690 10.408 ( 8.284 5.947 0.912) 10.239 10.947 ( 10.258 -10.838 7.133) 16.540 11.940 ( -4.878 23.344 -2.851) 24.018 12.517 ( 4.300 -0.524 -0.797) 4.405 12.668 ( 10.301 -4.482 1.826) 11.382 13.222 ( -1.681 -16.203 0.957) 16.318 13.917 ( -5.355 5.430 -3.582) 8.425 14.127 ( 7.806 -6.051 8.859) 13.267 14.989 ( -9.679 2.032 -11.258) 14.985 18.302 ( -4.910 2.643 4.675) 7.277 19.148 ( -11.126 -6.523 -1.398) 12.972 19.225 ( -5.656 2.086 1.880) 6.314 19.436 ( 11.715 5.033 -6.213) 14.183 21.681 ( -1.338 5.779 6.408) 8.732 22.374 ( 9.080 -3.615 -14.380) 17.387 24.030 ( 6.158 -4.249 0.003) 7.482 24.304 ( -4.892 1.758 4.310) 6.753 ======================= Grid point 16 (11/432) ======================= q-point: (-0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( 4.822 3.218 1.367) 5.956 2.587 ( -1.138 -0.558 2.735) 3.015 3.000 ( -4.799 1.777 -4.559) 6.854 3.032 ( -0.350 -2.501 5.310) 5.880 3.304 ( -3.559 5.346 -2.886) 7.041 3.997 ( -11.081 -1.198 -5.440) 12.402 4.203 ( 8.548 -2.136 -2.303) 9.106 4.364 ( -5.190 -1.644 -4.333) 6.958 4.818 ( 2.168 3.205 3.603) 5.288 4.976 ( 2.975 -10.901 -0.373) 11.305 5.146 ( -1.081 4.839 -5.119) 7.126 5.734 ( 1.959 3.002 4.595) 5.828 6.294 ( -8.229 -0.982 -6.072) 10.274 6.646 ( -8.223 -6.180 -0.944) 10.329 6.903 ( 4.428 3.324 5.575) 7.858 7.967 ( 1.101 -8.963 7.785) 11.923 8.750 ( -5.339 1.272 -2.581) 6.065 9.406 ( -11.330 -16.306 -1.696) 19.928 9.988 ( 0.531 7.572 -2.128) 7.883 10.405 ( 5.856 10.932 -4.088) 13.058 11.327 ( 14.030 -9.829 10.095) 19.884 11.618 ( -3.779 24.768 -5.044) 25.557 12.531 ( -3.224 -0.143 2.884) 4.328 12.812 ( 5.697 3.329 1.512) 6.769 13.353 ( -0.219 -10.753 2.650) 11.077 13.818 ( 1.762 2.765 -0.281) 3.290 14.266 ( -0.024 0.002 -4.114) 4.114 14.873 ( 1.566 -3.914 4.200) 5.950 18.200 ( -2.841 -2.836 -13.442) 14.029 19.038 ( -7.495 -6.237 -2.231) 10.002 19.285 ( -0.443 -0.011 13.902) 13.909 19.492 ( 13.476 7.414 -4.095) 15.917 21.655 ( -1.509 4.947 0.721) 5.222 22.357 ( -1.026 -4.855 -4.815) 6.914 24.128 ( 3.448 -0.654 1.297) 3.741 24.277 ( -2.226 1.785 2.908) 4.075 ======================= Grid point 17 (12/432) ======================= q-point: (-0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.217 ( -7.057 15.116 -8.112) 18.550 2.384 ( -9.297 12.440 -12.369) 19.854 2.956 ( 0.624 -3.895 2.669) 4.763 3.113 ( -3.873 -4.274 2.674) 6.358 3.399 ( 5.457 -11.041 7.089) 14.210 3.716 ( -16.906 3.611 -10.814) 20.391 4.125 ( -14.337 1.027 -7.049) 16.009 4.332 ( 6.010 -2.890 1.313) 6.797 4.776 ( -6.251 4.480 1.468) 7.829 5.039 ( 3.257 0.131 -3.133) 4.521 5.197 ( 10.642 -10.296 -5.427) 15.770 5.771 ( 3.528 4.701 1.116) 5.983 6.113 ( -8.533 -3.056 -7.410) 11.707 6.534 ( -17.414 -6.722 0.996) 18.693 7.053 ( 4.512 0.242 11.258) 12.131 8.060 ( -4.823 5.485 9.876) 12.283 8.762 ( 5.428 -13.009 -3.468) 14.517 9.371 ( -11.842 -15.657 -1.250) 19.671 9.921 ( -1.136 -0.693 -3.100) 3.374 10.287 ( 1.938 12.384 -8.305) 15.036 11.273 ( -1.803 28.890 -1.079) 28.966 11.722 ( 13.330 -9.553 4.477) 17.000 12.508 ( -6.701 2.029 6.006) 9.225 12.785 ( -2.309 9.755 0.646) 10.045 13.436 ( 1.678 -2.310 1.897) 3.428 13.932 ( 9.309 -2.755 4.684) 10.778 14.083 ( -6.627 5.498 -10.363) 13.473 15.133 ( 9.923 -8.111 13.608) 18.694 17.992 ( -0.833 -9.480 -27.095) 28.718 19.035 ( -3.280 -5.673 5.393) 8.487 19.466 ( 7.526 1.144 7.736) 10.853 19.585 ( 11.458 7.099 3.665) 13.969 21.580 ( -2.359 2.802 -3.641) 5.165 22.313 ( -10.859 -5.663 3.010) 12.611 24.146 ( -1.537 5.800 4.740) 7.646 24.299 ( 3.249 -0.490 -0.414) 3.312 ======================= Grid point 18 (13/432) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( -10.339 18.812 -14.802) 26.074 1.975 ( -12.943 17.846 -9.701) 24.085 2.974 ( -15.692 -0.061 -3.818) 16.150 3.122 ( -2.284 -4.536 -0.233) 5.084 3.279 ( -7.138 7.118 -11.107) 14.999 3.606 ( 0.021 -11.467 -0.329) 11.472 3.932 ( -8.937 -3.500 2.860) 10.015 4.447 ( 4.454 -3.766 0.673) 5.872 4.674 ( -5.756 1.169 1.195) 5.994 5.037 ( 3.247 2.278 -2.723) 4.811 5.357 ( 7.785 -11.449 -5.166) 14.777 5.756 ( 0.024 0.714 -5.379) 5.426 5.984 ( -1.240 0.867 -4.157) 4.424 6.332 ( -25.511 -8.124 2.830) 26.922 7.225 ( 0.069 -1.310 10.999) 11.077 8.033 ( -2.418 10.937 9.140) 14.457 8.972 ( 8.649 -16.922 -1.561) 19.068 9.337 ( -11.862 -15.951 0.386) 19.882 9.897 ( -0.095 -2.044 -3.606) 4.146 10.094 ( -1.308 8.214 -7.536) 11.224 11.031 ( -0.375 25.886 1.589) 25.937 11.946 ( 8.506 -4.621 -2.277) 9.944 12.457 ( -7.520 6.722 7.659) 12.664 12.647 ( -4.351 9.810 -0.411) 10.739 13.503 ( 4.718 3.155 2.940) 6.392 13.842 ( -7.161 7.608 -3.706) 11.086 14.146 ( 9.384 -2.763 5.135) 11.048 15.510 ( 11.087 -8.644 14.532) 20.219 17.741 ( 3.420 -16.628 -39.174) 42.694 19.155 ( 2.047 -3.354 9.742) 10.505 19.604 ( 13.172 4.642 -1.514) 14.048 19.766 ( 8.254 4.535 11.529) 14.887 21.462 ( -4.625 1.034 -6.059) 7.692 22.233 ( -20.443 -7.740 9.164) 23.703 24.137 ( 0.269 9.267 7.524) 11.940 24.334 ( 3.165 0.093 -1.582) 3.540 ======================= Grid point 19 (14/432) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( -10.934 20.662 -15.557) 28.080 1.521 ( -14.745 21.190 -9.687) 27.573 2.328 ( -31.220 21.544 -19.860) 42.817 3.167 ( 2.491 -2.607 -0.068) 3.606 3.246 ( -2.714 -4.951 1.950) 5.973 3.608 ( -0.911 -9.221 -6.987) 11.605 3.982 ( -2.409 -4.707 6.382) 8.288 4.487 ( -3.167 -5.248 -0.946) 6.202 4.702 ( 4.266 -4.227 3.318) 6.861 5.036 ( 2.408 1.525 -0.689) 2.933 5.461 ( 3.643 -9.694 -6.174) 12.057 5.644 ( -3.832 -2.967 -9.661) 10.808 5.962 ( 4.915 4.739 -1.941) 7.098 6.077 ( -32.490 -10.535 6.295) 34.731 7.290 ( -5.895 -0.034 5.832) 8.292 8.062 ( 4.741 10.664 9.891) 15.298 9.174 ( 4.562 -8.456 1.190) 9.682 9.371 ( -7.733 -22.927 0.703) 24.206 9.797 ( 2.949 12.967 -6.291) 14.712 10.055 ( -2.764 -9.176 3.344) 10.150 10.854 ( -2.850 18.525 3.263) 19.025 11.950 ( -0.321 1.427 -9.100) 9.216 12.344 ( -5.242 14.732 2.845) 15.893 12.558 ( -2.297 2.971 3.038) 4.830 13.530 ( 4.277 3.382 -5.606) 7.820 13.767 ( -1.644 13.040 19.820) 23.782 14.324 ( 6.926 -0.026 5.103) 8.603 15.874 ( 9.027 -8.298 12.587) 17.572 17.467 ( 8.612 -24.808 -55.162) 61.094 19.348 ( 10.848 2.272 7.937) 13.632 19.726 ( 11.320 2.854 0.216) 11.676 19.936 ( 7.531 6.748 7.050) 12.327 21.319 ( -6.617 -0.615 -4.602) 8.084 22.104 ( -31.109 -11.492 13.268) 35.719 24.185 ( 4.690 11.958 11.585) 17.297 24.344 ( 1.796 1.204 -1.254) 2.500 ======================= Grid point 20 (15/432) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.851 ( -8.963 23.508 -12.506) 28.096 0.989 ( -19.900 19.833 -14.863) 31.785 1.501 ( -22.206 38.338 -14.501) 46.618 3.208 ( 0.777 -2.381 -0.098) 2.507 3.248 ( -3.959 -2.492 1.186) 4.827 3.650 ( 2.940 -9.751 -2.851) 10.576 4.026 ( -1.407 -1.448 1.785) 2.695 4.490 ( -2.642 -7.109 -0.412) 7.595 4.866 ( 5.967 -7.300 2.121) 9.664 5.069 ( 4.277 -0.808 -0.379) 4.369 5.430 ( -4.309 -11.067 -17.526) 21.171 5.534 ( -5.716 -0.549 0.716) 5.786 5.794 ( -34.259 -10.229 7.713) 36.576 5.966 ( 3.419 6.142 -0.094) 7.030 7.231 ( -6.276 1.837 1.335) 6.675 8.188 ( 8.564 8.036 9.323) 14.994 9.302 ( 2.435 -4.369 6.939) 8.554 9.499 ( -3.377 -23.005 -1.510) 23.300 9.722 ( 12.648 14.074 -0.831) 18.940 10.167 ( -6.353 -10.267 9.206) 15.183 10.700 ( -11.776 8.209 4.634) 15.085 11.729 ( -7.750 7.041 -12.414) 16.240 12.170 ( -2.165 15.825 -0.861) 15.996 12.569 ( -0.259 0.767 2.874) 2.986 13.489 ( 1.599 0.643 -3.604) 3.994 14.031 ( 9.230 17.764 42.289) 46.788 14.456 ( 5.974 6.023 9.816) 12.974 16.148 ( 4.043 -6.802 8.048) 11.286 17.077 ( 10.127 -32.572 -82.836) 89.584 19.587 ( 24.597 8.004 1.344) 25.901 19.847 ( 5.762 0.635 2.825) 6.449 19.990 ( 4.653 8.554 -0.594) 9.756 21.222 ( -5.233 -1.672 0.548) 5.521 21.888 ( -43.771 -14.610 15.168) 48.574 24.310 ( 4.107 4.591 3.850) 7.265 24.371 ( 6.739 9.819 14.124) 18.475 ======================= Grid point 21 (16/432) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.419 ( -0.000 24.798 -0.000) 24.798 0.485 ( -0.000 28.461 -0.000) 28.461 0.878 ( -0.000 51.289 -0.000) 51.289 3.232 ( -0.000 0.533 -0.000) 0.533 3.236 ( 0.000 -3.527 0.000) 3.527 3.739 ( 0.000 -7.862 0.000) 7.862 4.042 ( 0.000 -1.113 0.000) 1.113 4.520 ( 0.000 -5.259 0.000) 5.259 4.963 ( 0.000 -5.044 0.000) 5.044 5.080 ( 0.000 -0.482 0.000) 0.482 5.270 ( 0.000 -2.653 0.000) 2.653 5.482 ( 0.000 -1.511 0.000) 1.511 5.626 ( -0.000 0.554 -0.000) 0.554 5.942 ( -0.000 5.157 -0.000) 5.157 7.173 ( -0.000 1.845 -0.000) 1.845 8.299 ( -0.000 1.261 -0.000) 1.261 9.431 ( 0.000 -6.423 0.000) 6.423 9.643 ( 0.000 -18.845 0.000) 18.845 10.087 ( -0.000 0.467 -0.000) 0.467 10.089 ( 0.000 -16.833 0.000) 16.833 10.429 ( -0.000 21.098 -0.000) 21.098 11.462 ( -0.000 11.590 -0.000) 11.590 12.022 ( -0.000 13.682 -0.000) 13.682 12.581 ( -0.000 0.348 -0.000) 0.348 13.480 ( 0.000 -0.186 0.000) 0.186 14.407 ( 0.000 -7.527 0.000) 7.527 14.843 ( -0.000 1.667 -0.000) 1.667 16.183 ( -0.000 1.251 -0.000) 1.251 16.488 ( 0.000 -8.326 0.000) 8.326 19.841 ( -0.000 1.045 -0.000) 1.045 19.900 ( -0.000 6.360 -0.000) 6.360 19.921 ( -0.000 0.646 -0.000) 0.646 21.218 ( 0.000 -0.708 0.000) 0.708 21.622 ( 0.000 -3.413 0.000) 3.413 24.311 ( -0.000 1.129 -0.000) 1.129 24.602 ( 0.000 -0.432 0.000) 0.432 ======================= Grid point 24 (17/432) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 19.594 -0.000 13.393) 23.734 1.748 ( 10.985 -0.000 22.387) 24.937 3.176 ( -0.812 0.000 -0.613) 1.017 3.366 ( -2.930 0.000 -3.375) 4.469 3.603 ( 32.009 -0.000 18.228) 36.835 3.894 ( -2.320 0.000 0.432) 2.360 4.002 ( 4.908 -0.000 -5.618) 7.460 4.430 ( -11.696 0.000 -5.265) 12.826 4.610 ( 6.381 -0.000 -4.139) 7.606 4.864 ( 0.190 -0.000 -4.600) 4.604 5.484 ( -7.770 0.000 3.137) 8.379 5.634 ( -6.780 0.000 7.206) 9.894 6.286 ( 5.926 -0.000 9.559) 11.247 6.940 ( 10.631 -0.000 -9.443) 14.219 6.964 ( -8.545 0.000 -11.146) 14.045 7.422 ( 2.086 -0.000 0.632) 2.179 9.136 ( -11.436 0.000 10.376) 15.441 9.352 ( -9.172 0.000 -5.061) 10.475 10.122 ( 20.925 -0.000 7.332) 22.172 10.266 ( 4.177 -0.000 0.915) 4.276 10.849 ( -3.986 0.000 -6.264) 7.425 12.284 ( 26.451 -0.000 -4.796) 26.882 12.423 ( 4.665 -0.000 -3.586) 5.884 12.470 ( -6.401 0.000 18.417) 19.498 12.901 ( -0.500 0.000 -11.306) 11.317 13.817 ( 6.375 -0.000 10.764) 12.510 14.128 ( -7.191 0.000 -3.641) 8.060 15.341 ( -13.504 0.000 -15.549) 20.594 18.335 ( -15.884 0.000 23.697) 28.528 19.254 ( -12.915 0.000 -5.033) 13.861 19.398 ( -10.902 0.000 -3.789) 11.542 19.407 ( 13.713 -0.000 -7.335) 15.551 21.672 ( -1.524 0.000 15.069) 15.145 22.387 ( 20.544 -0.000 -31.453) 37.568 23.860 ( 6.672 -0.000 1.087) 6.760 24.331 ( -4.351 0.000 5.001) 6.628 ======================= Grid point 25 (18/432) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 14.801 -0.395 13.109) 19.776 2.165 ( 10.878 -7.184 18.801) 22.878 3.127 ( -2.428 2.839 -2.400) 4.440 3.234 ( -7.492 2.562 -5.001) 9.365 3.742 ( -11.679 6.866 -3.098) 13.898 4.033 ( 15.227 3.564 -3.337) 15.990 4.111 ( 8.581 -5.951 1.335) 10.528 4.229 ( -1.089 -3.146 -8.495) 9.124 4.712 ( 8.175 -0.327 4.346) 9.264 4.813 ( -3.463 -3.360 -3.059) 5.713 5.380 ( -9.574 1.966 0.067) 9.774 5.679 ( -1.260 0.268 9.536) 9.622 6.411 ( 0.133 1.530 4.608) 4.857 6.706 ( -8.996 -0.236 -11.362) 14.494 6.933 ( 2.692 1.417 -4.644) 5.552 7.536 ( 3.112 -8.477 6.526) 11.141 9.022 ( -13.555 4.700 2.833) 14.624 9.233 ( -8.589 -7.636 -1.450) 11.584 10.220 ( -4.244 4.331 -3.919) 7.220 10.512 ( 21.657 4.809 8.055) 23.601 10.818 ( 5.956 -4.395 -0.104) 7.403 12.355 ( 1.447 22.291 0.601) 22.346 12.523 ( 2.991 2.672 1.348) 4.231 12.608 ( 14.634 -2.044 4.468) 15.437 12.885 ( -1.947 -22.212 -2.736) 22.464 13.985 ( -6.002 2.392 -2.943) 7.100 14.049 ( 8.090 -2.730 9.483) 12.761 15.009 ( -11.009 0.526 -12.694) 16.811 18.336 ( -7.094 1.112 2.176) 7.503 19.061 ( -10.766 -2.921 -3.018) 11.557 19.252 ( -8.813 0.815 4.330) 9.853 19.504 ( 14.380 2.366 -6.844) 16.100 21.781 ( -4.241 4.500 13.196) 14.573 22.303 ( 13.494 -3.426 -24.658) 28.317 23.977 ( 7.291 -1.767 1.415) 7.635 24.326 ( -5.158 0.679 5.571) 7.623 ======================= Grid point 26 (19/432) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( 11.309 1.061 7.205) 13.451 2.524 ( 4.621 -5.773 12.232) 14.293 3.016 ( -6.468 2.678 -1.079) 7.083 3.053 ( -5.671 1.481 -5.453) 8.006 3.453 ( -11.462 9.766 -5.301) 15.964 3.959 ( -10.723 -3.179 -8.054) 13.782 4.162 ( 9.185 -2.303 -2.984) 9.928 4.337 ( 5.466 -1.083 -5.460) 7.801 4.783 ( -0.698 -9.139 -3.516) 9.817 4.872 ( 3.467 1.616 6.521) 7.560 5.217 ( -4.874 3.088 -6.064) 8.370 5.784 ( 2.100 2.570 8.753) 9.361 6.308 ( -10.597 3.085 -5.413) 12.293 6.530 ( -10.177 -7.491 -3.319) 13.065 6.950 ( 3.691 2.048 3.533) 5.504 7.768 ( 3.961 -11.425 10.151) 15.788 8.810 ( -12.077 4.514 -2.028) 13.051 9.188 ( -8.049 -9.518 -0.459) 12.473 10.034 ( -9.422 0.173 -7.412) 11.989 10.649 ( 10.605 15.417 -2.123) 18.832 11.143 ( 18.129 -11.095 9.670) 23.351 12.112 ( -0.416 31.388 -1.558) 31.429 12.526 ( -3.131 -0.221 3.705) 4.856 12.854 ( 13.113 1.647 2.360) 13.425 13.078 ( -0.749 -21.318 4.421) 21.785 13.876 ( -1.393 3.112 -1.147) 3.597 14.241 ( 5.034 -2.171 -0.765) 5.535 14.818 ( -3.191 -2.385 -0.606) 4.029 18.162 ( -6.211 -1.637 -16.750) 17.939 18.953 ( -6.877 -3.558 0.222) 7.747 19.289 ( -1.098 0.405 13.922) 13.971 19.593 ( 14.052 4.190 -5.573) 15.687 21.774 ( -4.212 8.380 5.311) 10.779 22.247 ( 3.885 -7.584 -14.157) 16.523 24.104 ( 6.701 -1.539 1.770) 7.100 24.313 ( -4.600 1.811 5.555) 7.436 ======================= Grid point 27 (20/432) ======================= q-point: (-0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 0.232 11.467 -6.406) 13.137 2.531 ( -7.678 5.241 -5.967) 11.047 2.918 ( -4.200 -0.950 3.070) 5.289 3.044 ( -5.048 -4.178 4.760) 8.099 3.278 ( 0.103 -2.400 0.503) 2.454 3.742 ( -11.452 -1.171 -7.495) 13.737 4.173 ( -8.619 5.373 -9.865) 14.159 4.285 ( 4.441 -2.153 1.676) 5.213 4.840 ( -5.654 2.374 -1.774) 6.384 4.892 ( 1.723 -14.280 -1.580) 14.470 5.136 ( 7.345 0.827 -8.487) 11.254 5.856 ( 1.282 5.304 3.602) 6.538 6.085 ( -8.288 -0.218 -5.675) 10.048 6.405 ( -19.085 -8.565 1.732) 20.990 7.064 ( 4.596 0.908 8.215) 9.457 8.026 ( 1.292 -8.229 11.984) 14.595 8.626 ( -5.551 -2.400 -5.404) 8.110 9.164 ( -7.636 -9.034 0.464) 11.838 9.837 ( -9.849 -5.927 -7.961) 13.983 10.555 ( 4.228 15.993 -7.460) 18.147 11.568 ( 17.388 -7.970 7.766) 20.644 11.829 ( 1.577 34.826 0.325) 34.863 12.527 ( -5.435 0.438 6.182) 8.243 12.937 ( 2.183 7.821 1.145) 8.200 13.284 ( 0.731 -15.335 4.402) 15.971 13.919 ( 8.861 0.825 3.247) 9.473 14.148 ( -4.159 2.201 -11.434) 12.365 14.991 ( 8.015 -8.124 12.315) 16.790 17.855 ( -6.512 -6.451 -27.271) 28.770 18.962 ( -1.213 -3.097 6.220) 7.053 19.485 ( 6.708 1.172 13.073) 14.741 19.683 ( 12.089 4.348 -1.917) 12.990 21.669 ( -3.732 7.552 -2.026) 8.664 22.193 ( -6.391 -8.426 -5.045) 11.717 24.205 ( 3.651 1.184 3.253) 5.031 24.310 ( -1.205 1.855 3.954) 4.531 ======================= Grid point 28 (21/432) ======================= q-point: (-0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( -7.353 18.012 -14.624) 24.338 2.221 ( -13.357 11.505 -7.855) 19.300 2.938 ( -6.743 -3.141 1.966) 7.694 3.030 ( -3.212 -5.061 1.677) 6.225 3.406 ( -0.966 -11.169 0.014) 11.210 3.489 ( -5.734 12.700 -7.803) 15.971 3.888 ( -11.876 0.395 -2.106) 12.068 4.389 ( 3.971 -3.202 0.980) 5.195 4.686 ( -7.544 0.193 -3.835) 8.465 5.024 ( 2.867 -8.248 -1.876) 8.932 5.155 ( 6.510 -7.528 -8.501) 13.089 5.771 ( -5.752 1.577 -5.089) 7.841 6.020 ( 2.609 2.509 -0.826) 3.712 6.205 ( -25.851 -7.341 4.013) 27.171 7.214 ( 2.256 -0.024 9.332) 9.601 8.149 ( -4.333 2.714 9.794) 11.048 8.652 ( 5.102 -17.651 -4.623) 18.946 9.144 ( -8.030 -7.882 1.572) 11.361 9.712 ( -8.686 -12.634 -6.081) 16.494 10.353 ( 1.139 15.979 -8.801) 18.278 11.578 ( 3.001 36.460 2.833) 36.692 11.878 ( 13.013 -3.561 1.764) 13.607 12.514 ( -6.297 1.322 6.737) 9.316 12.837 ( -3.899 11.224 -0.637) 11.899 13.463 ( 3.816 -8.279 4.306) 10.082 13.919 ( -5.249 2.302 -9.800) 11.353 14.136 ( 11.451 1.147 8.200) 14.131 15.346 ( 10.085 -10.398 13.431) 19.754 17.500 ( -5.224 -11.532 -34.576) 36.821 19.113 ( 5.701 -1.819 11.099) 12.609 19.679 ( 12.331 4.299 0.847) 13.086 19.829 ( 8.559 2.577 9.901) 13.339 21.512 ( -5.363 4.909 -5.669) 9.219 22.096 ( -15.283 -8.606 0.074) 17.539 24.261 ( 1.293 5.208 6.990) 8.812 24.338 ( 2.409 0.622 0.493) 2.537 ======================= Grid point 29 (22/432) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.691 ( -8.777 21.210 -13.955) 26.863 1.815 ( -16.171 14.538 -10.903) 24.326 2.699 ( -18.884 17.843 -5.505) 26.557 3.067 ( -3.641 -7.904 2.189) 8.974 3.265 ( 4.299 8.771 -3.982) 10.548 3.431 ( -2.562 -11.200 -7.929) 13.960 3.888 ( -3.526 -6.093 9.365) 11.716 4.413 ( -2.210 -3.389 -4.856) 6.321 4.629 ( -0.160 -4.564 1.775) 4.900 5.047 ( 1.485 -0.474 -2.608) 3.038 5.235 ( 2.542 -15.489 -8.331) 17.770 5.630 ( -5.186 0.303 -4.624) 6.955 5.923 ( -22.244 -6.396 -0.775) 23.158 6.062 ( -0.511 4.288 3.925) 5.836 7.301 ( -2.357 1.357 6.104) 6.682 8.176 ( 0.079 3.593 7.372) 8.201 8.865 ( 5.684 -23.047 -3.675) 24.021 9.133 ( -7.036 -7.698 3.459) 10.988 9.671 ( -9.437 -17.435 -3.755) 20.178 10.168 ( 3.053 14.310 -4.063) 15.186 11.351 ( 2.637 36.050 4.078) 36.376 11.986 ( 5.549 2.666 -5.562) 8.297 12.498 ( -4.365 2.548 5.444) 7.428 12.672 ( -4.094 11.091 -0.794) 11.849 13.567 ( 3.878 0.522 -5.350) 6.628 13.829 ( -2.506 -3.732 8.156) 9.313 14.370 ( 10.465 4.438 11.139) 15.915 15.707 ( 8.234 -11.312 11.910) 18.374 17.125 ( -3.394 -15.602 -42.364) 45.273 19.377 ( 13.576 1.246 11.643) 17.928 19.782 ( 10.283 3.610 -1.607) 11.016 20.039 ( 8.504 5.209 10.123) 14.210 21.329 ( -7.840 1.946 -4.990) 9.495 21.932 ( -22.722 -9.390 1.780) 24.650 24.333 ( 3.291 6.145 8.083) 10.673 24.363 ( 2.397 0.998 0.648) 2.676 ======================= Grid point 30 (23/432) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -8.174 22.868 -12.468) 27.298 1.307 ( -16.609 19.410 -11.371) 27.963 2.173 ( -11.866 38.229 -4.102) 40.238 3.107 ( -4.014 -8.338 1.476) 9.371 3.257 ( 3.252 3.158 -1.087) 4.661 3.450 ( 0.918 -13.514 -4.236) 14.193 3.988 ( -1.802 -3.092 5.457) 6.526 4.361 ( -2.736 -7.480 -3.461) 8.684 4.740 ( 3.526 -7.576 2.231) 8.649 5.049 ( 0.475 -1.632 -0.525) 1.779 5.241 ( -2.291 -11.763 -11.355) 16.509 5.526 ( -8.805 -0.476 1.351) 8.921 5.698 ( -14.621 -3.678 0.340) 15.081 6.067 ( 2.218 5.400 0.913) 5.909 7.275 ( -4.095 3.514 1.977) 5.747 8.261 ( 4.005 1.615 5.117) 6.695 9.075 ( 1.920 -24.642 -3.759) 25.001 9.185 ( -2.294 -8.195 5.146) 9.945 9.656 ( -8.561 -18.191 -3.141) 20.349 10.127 ( 4.233 7.903 3.583) 9.655 11.127 ( 1.059 34.441 3.955) 34.683 11.871 ( -1.130 9.106 -8.950) 12.818 12.427 ( -2.622 12.543 0.437) 12.822 12.585 ( -1.176 2.131 1.844) 3.053 13.507 ( 0.875 1.531 -4.666) 4.988 14.038 ( 2.600 -9.334 12.740) 16.005 14.612 ( 9.762 8.310 19.728) 23.527 16.006 ( 3.711 -10.410 10.332) 15.129 16.692 ( -2.910 -15.147 -50.244) 52.558 19.687 ( 20.402 4.534 6.174) 21.793 19.862 ( 4.656 1.270 1.917) 5.193 20.142 ( 4.419 9.324 1.855) 10.483 21.200 ( -6.039 -0.992 0.965) 6.195 21.700 ( -25.601 -9.282 0.804) 27.243 24.351 ( 1.026 2.088 -0.525) 2.385 24.478 ( 5.441 3.182 9.722) 11.587 ======================= Grid point 31 (24/432) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( -0.000 24.208 -0.000) 24.208 0.951 ( -0.000 26.866 -0.000) 26.866 1.707 ( -0.000 46.543 -0.000) 46.543 3.148 ( 0.000 -6.869 0.000) 6.869 3.250 ( -0.000 1.932 -0.000) 1.932 3.556 ( 0.000 -13.372 0.000) 13.372 4.020 ( 0.000 -1.441 0.000) 1.441 4.398 ( 0.000 -8.810 0.000) 8.810 4.850 ( 0.000 -8.028 0.000) 8.028 5.063 ( 0.000 -1.722 0.000) 1.722 5.200 ( 0.000 -5.820 0.000) 5.820 5.459 ( 0.000 -1.119 0.000) 1.119 5.630 ( 0.000 -0.277 0.000) 0.277 6.040 ( -0.000 5.876 -0.000) 5.876 7.220 ( -0.000 3.766 -0.000) 3.766 8.320 ( -0.000 0.844 -0.000) 0.844 9.264 ( 0.000 -24.405 0.000) 24.405 9.292 ( 0.000 -9.266 0.000) 9.266 9.747 ( 0.000 -21.929 0.000) 21.929 10.142 ( -0.000 5.026 -0.000) 5.026 10.878 ( -0.000 31.808 -0.000) 31.808 11.686 ( -0.000 13.718 -0.000) 13.718 12.285 ( -0.000 15.862 -0.000) 15.862 12.586 ( -0.000 0.228 -0.000) 0.228 13.481 ( -0.000 0.370 -0.000) 0.370 14.238 ( 0.000 -12.214 0.000) 12.214 14.868 ( -0.000 1.066 -0.000) 1.066 16.212 ( -0.000 2.073 -0.000) 2.073 16.292 ( 0.000 -14.437 0.000) 14.437 19.865 ( -0.000 1.730 -0.000) 1.730 19.936 ( -0.000 1.173 -0.000) 1.173 20.047 ( -0.000 10.797 -0.000) 10.797 21.202 ( 0.000 -1.261 0.000) 1.261 21.539 ( 0.000 -6.223 0.000) 6.223 24.337 ( -0.000 1.898 -0.000) 1.898 24.592 ( 0.000 -0.854 0.000) 0.854 ======================= Grid point 36 (25/432) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( 12.149 -0.000 9.012) 15.127 2.445 ( 7.586 -0.000 14.859) 16.683 3.055 ( -10.978 0.000 -5.160) 12.130 3.059 ( -3.775 0.000 -3.995) 5.496 3.553 ( -15.223 0.000 -3.969) 15.732 3.918 ( -11.407 0.000 -9.316) 14.728 4.143 ( 11.173 -0.000 -5.254) 12.347 4.328 ( 12.629 -0.000 -4.345) 13.355 4.695 ( -5.664 0.000 -4.010) 6.940 4.888 ( 4.526 -0.000 6.828) 8.192 5.243 ( -5.836 0.000 -6.550) 8.773 5.808 ( 2.159 -0.000 10.385) 10.607 6.383 ( -12.042 0.000 3.720) 12.603 6.418 ( -10.758 0.000 -13.455) 17.227 6.968 ( 3.507 -0.000 2.747) 4.455 7.662 ( 4.960 -0.000 11.181) 12.232 8.859 ( -14.949 0.000 -1.789) 15.056 9.100 ( -5.643 0.000 0.285) 5.651 10.032 ( -11.637 0.000 -9.191) 14.829 10.837 ( 4.512 -0.000 -3.625) 5.788 10.996 ( 25.239 -0.000 11.392) 27.691 12.495 ( 2.829 -0.000 -0.281) 2.843 12.624 ( -0.277 0.000 -6.258) 6.264 12.682 ( -4.874 0.000 14.303) 15.111 12.870 ( 15.579 -0.000 3.432) 15.953 13.904 ( -2.688 0.000 -1.009) 2.871 14.219 ( 6.750 -0.000 0.625) 6.779 14.797 ( -4.900 0.000 -2.693) 5.591 18.148 ( -7.491 0.000 -17.918) 19.421 18.923 ( -6.156 0.000 1.049) 6.245 19.293 ( -1.535 0.000 14.240) 14.322 19.628 ( 13.975 -0.000 -6.347) 15.349 21.872 ( -8.960 0.000 13.460) 16.170 22.157 ( 9.493 -0.000 -24.079) 25.883 24.090 ( 7.380 -0.000 2.193) 7.699 24.329 ( -4.956 0.000 6.266) 7.988 ======================= Grid point 37 (26/432) ======================= q-point: (-0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.561 ( 1.044 1.738 -3.001) 3.622 2.598 ( 0.134 3.288 -1.382) 3.569 2.907 ( -6.788 -0.552 3.618) 7.711 2.989 ( -4.510 -1.658 3.354) 5.860 3.294 ( -10.644 2.209 -5.420) 12.147 3.697 ( -8.969 -2.672 -7.075) 11.732 4.221 ( 6.380 -0.583 -4.318) 7.726 4.346 ( -0.504 9.032 -2.065) 9.279 4.637 ( -1.254 -12.951 -3.435) 13.458 4.878 ( -8.753 1.008 -3.031) 9.318 5.150 ( 6.101 0.477 -8.870) 10.776 5.935 ( 1.526 3.132 7.331) 8.117 6.110 ( -9.639 3.239 -8.849) 13.480 6.260 ( -19.837 -7.652 3.725) 21.586 7.077 ( 4.639 0.443 6.772) 8.221 7.891 ( 5.862 -5.141 11.579) 13.959 8.626 ( -12.513 0.715 -5.000) 13.494 9.063 ( -4.618 -3.004 1.885) 5.822 9.764 ( -12.294 -2.347 -10.474) 16.321 10.764 ( 0.173 7.375 -7.778) 10.720 11.455 ( 21.839 -4.373 9.157) 24.081 12.402 ( 4.831 30.329 -0.630) 30.718 12.533 ( -5.527 1.530 7.319) 9.298 12.941 ( -0.437 -24.438 7.391) 25.535 13.032 ( 5.503 3.015 1.074) 6.366 13.937 ( 7.157 0.784 3.625) 8.061 14.166 ( -1.818 0.337 -12.843) 12.975 14.887 ( 6.428 -3.567 11.167) 13.369 17.782 ( -9.237 -2.180 -26.943) 28.566 18.928 ( 0.071 -0.968 6.550) 6.622 19.502 ( 5.903 0.600 16.193) 17.246 19.730 ( 12.257 1.258 -5.089) 13.331 21.817 ( -8.138 8.870 3.276) 12.475 22.040 ( -0.093 -8.880 -14.115) 16.676 24.208 ( 6.165 -0.165 2.420) 6.625 24.340 ( -3.382 1.113 6.314) 7.248 ======================= Grid point 38 (27/432) ======================= q-point: (-0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.359 ( -11.697 6.283 -8.012) 15.508 2.403 ( -4.789 11.630 -13.295) 18.301 2.893 ( -8.945 -1.611 3.382) 9.697 2.969 ( -4.357 -2.015 2.305) 5.326 3.229 ( -0.716 -9.120 -2.362) 9.448 3.593 ( -2.649 -0.064 1.188) 2.904 4.032 ( -9.897 15.128 -6.655) 19.263 4.346 ( 3.256 -1.201 1.580) 3.813 4.677 ( -8.777 -2.063 -7.418) 11.675 4.766 ( 2.837 -16.795 -3.075) 17.308 5.125 ( 4.256 0.108 -8.513) 9.518 5.813 ( -8.832 3.316 -5.568) 10.955 6.043 ( -6.649 -1.328 -1.330) 6.909 6.095 ( -14.636 -3.928 7.854) 17.068 7.221 ( 3.930 0.617 8.525) 9.408 8.126 ( 2.263 -4.238 10.268) 11.337 8.452 ( -4.724 -6.081 -6.304) 9.952 9.056 ( -4.561 -2.881 2.516) 5.952 9.538 ( -10.801 -7.497 -9.020) 15.944 10.572 ( -2.592 9.397 -9.057) 13.306 11.822 ( 16.816 -2.471 4.364) 17.548 12.200 ( 4.549 35.297 3.197) 35.733 12.526 ( -6.499 0.757 6.562) 9.267 12.991 ( -3.217 6.234 -1.456) 7.165 13.225 ( 2.792 -19.267 6.761) 20.609 13.951 ( -3.632 1.604 -13.620) 14.187 14.155 ( 12.910 0.699 8.792) 15.635 15.185 ( 9.436 -7.825 12.103) 17.227 17.359 ( -9.422 -5.361 -30.777) 32.630 19.091 ( 7.441 -0.790 11.968) 14.115 19.749 ( 11.161 3.985 5.251) 12.963 19.846 ( 9.035 -0.546 6.374) 11.070 21.624 ( -6.600 8.223 -6.030) 12.147 21.943 ( -10.717 -9.517 -5.540) 15.366 24.304 ( 4.218 0.591 2.925) 5.167 24.365 ( -0.735 2.116 5.293) 5.748 ======================= Grid point 39 (28/432) ======================= q-point: (-0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -10.548 15.131 -9.191) 20.608 2.036 ( -10.778 13.655 -13.682) 22.132 2.819 ( -8.073 -1.771 2.549) 8.650 2.956 ( -5.508 -4.651 0.198) 7.211 3.237 ( -2.530 -10.381 -7.333) 12.959 3.552 ( 2.152 19.159 -3.378) 19.573 3.809 ( -6.109 -0.589 8.059) 10.129 4.369 ( -1.963 -2.032 -5.529) 6.209 4.553 ( -2.515 -4.195 -1.217) 5.041 4.913 ( 1.297 -17.134 -2.855) 17.419 5.071 ( 1.373 -1.829 -8.010) 8.331 5.642 ( -6.606 0.985 -3.548) 7.562 5.823 ( -21.984 -5.398 0.364) 22.640 6.122 ( 1.807 2.724 2.785) 4.294 7.335 ( 1.116 2.482 6.704) 7.235 8.200 ( -3.511 -0.037 5.615) 6.622 8.521 ( 5.197 -16.963 -3.342) 18.053 9.047 ( -4.147 -2.684 2.547) 5.558 9.408 ( -9.598 -12.883 -5.750) 17.064 10.373 ( -1.265 9.531 -5.998) 11.331 11.961 ( 5.162 26.238 1.814) 26.802 12.054 ( 8.595 13.733 1.355) 16.257 12.503 ( -5.548 -0.523 4.506) 7.167 12.851 ( -4.299 8.907 -1.880) 10.067 13.481 ( 4.563 -12.807 3.924) 14.150 13.761 ( -4.480 -1.571 -7.235) 8.654 14.434 ( 12.718 2.855 12.064) 17.761 15.510 ( 7.962 -11.309 9.940) 17.032 16.935 ( -8.357 -7.381 -32.598) 34.452 19.392 ( 14.548 0.640 14.216) 20.350 19.841 ( 8.641 3.220 -2.520) 9.559 20.105 ( 9.978 2.629 13.340) 16.865 21.388 ( -8.610 5.023 -7.221) 12.309 21.780 ( -17.040 -8.863 -4.567) 19.743 24.374 ( 2.514 0.494 0.821) 2.690 24.409 ( 1.843 3.074 6.624) 7.532 ======================= Grid point 40 (29/432) ======================= q-point: (-0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( -11.702 18.339 -12.910) 25.297 1.657 ( -6.879 20.745 -6.057) 22.680 2.688 ( -7.185 19.590 2.476) 21.012 2.949 ( -3.853 -9.822 0.198) 10.553 3.213 ( -1.250 -13.896 -6.829) 15.534 3.396 ( 3.976 15.500 -1.725) 16.095 3.924 ( -1.506 -4.317 10.191) 11.169 4.256 ( -3.819 -4.794 -7.922) 10.016 4.616 ( 1.629 -6.881 1.579) 7.246 5.001 ( -0.115 -8.241 -2.635) 8.653 5.033 ( -0.580 -8.903 -6.239) 10.887 5.517 ( -11.098 -0.500 1.435) 11.202 5.640 ( -7.653 -3.430 -1.980) 8.617 6.141 ( 1.586 3.431 1.082) 3.932 7.349 ( -1.518 5.238 2.740) 6.103 8.247 ( 0.367 -3.172 3.791) 4.956 8.700 ( 3.110 -19.147 -2.757) 19.592 9.072 ( -0.827 -4.760 2.874) 5.622 9.354 ( -9.226 -15.707 -3.328) 18.518 10.264 ( 1.482 7.147 -1.093) 7.381 11.754 ( 2.453 38.212 4.369) 38.539 12.022 ( 2.174 8.987 -5.228) 10.622 12.503 ( -2.039 -1.347 2.193) 3.283 12.707 ( -2.516 9.954 -0.891) 10.306 13.536 ( 0.889 1.488 -5.067) 5.355 13.819 ( 0.241 -15.738 5.479) 16.666 14.706 ( 9.495 3.375 14.201) 17.413 15.797 ( 4.239 -13.737 7.708) 16.312 16.528 ( -6.393 -5.374 -30.868) 31.977 19.746 ( 17.944 2.570 10.124) 20.762 19.889 ( 4.080 1.759 -0.118) 4.444 20.295 ( 6.220 8.477 6.222) 12.217 21.193 ( -7.273 0.430 -1.338) 7.408 21.553 ( -17.993 -8.398 -5.859) 20.702 24.385 ( 0.856 1.869 -0.112) 2.058 24.506 ( 3.135 0.616 5.758) 6.585 ======================= Grid point 41 (30/432) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.230 ( -0.000 22.979 -0.000) 22.979 1.382 ( -0.000 24.030 -0.000) 24.030 2.407 ( -0.000 34.959 -0.000) 34.959 3.008 ( 0.000 -9.691 0.000) 9.691 3.304 ( 0.000 -16.231 0.000) 16.231 3.321 ( -0.000 7.938 -0.000) 7.938 3.998 ( 0.000 -1.080 0.000) 1.080 4.241 ( 0.000 -9.353 0.000) 9.353 4.708 ( 0.000 -8.487 0.000) 8.487 5.020 ( 0.000 -3.281 0.000) 3.281 5.070 ( 0.000 -9.724 0.000) 9.724 5.443 ( 0.000 -0.930 0.000) 0.930 5.612 ( 0.000 -1.914 0.000) 1.914 6.127 ( -0.000 4.246 -0.000) 4.246 7.300 ( -0.000 5.783 -0.000) 5.783 8.309 ( 0.000 -2.762 0.000) 2.762 8.870 ( 0.000 -21.394 0.000) 21.394 9.148 ( 0.000 -7.048 0.000) 7.048 9.398 ( 0.000 -18.598 0.000) 18.598 10.232 ( -0.000 5.151 -0.000) 5.151 11.476 ( -0.000 38.352 -0.000) 38.352 11.901 ( -0.000 11.648 -0.000) 11.648 12.491 ( -0.000 5.185 -0.000) 5.185 12.615 ( -0.000 6.073 -0.000) 6.073 13.496 ( -0.000 1.452 -0.000) 1.452 14.001 ( 0.000 -16.011 0.000) 16.011 14.878 ( -0.000 0.225 -0.000) 0.225 16.023 ( 0.000 -16.936 0.000) 16.936 16.249 ( -0.000 2.212 -0.000) 2.212 19.896 ( -0.000 1.813 -0.000) 1.813 19.959 ( -0.000 1.443 -0.000) 1.443 20.248 ( -0.000 12.632 -0.000) 12.632 21.178 ( 0.000 -1.483 0.000) 1.483 21.418 ( 0.000 -8.048 0.000) 8.048 24.372 ( -0.000 2.161 -0.000) 2.161 24.574 ( 0.000 -1.199 0.000) 1.199 ======================= Grid point 48 (31/432) ======================= q-point: ( 0.36 -0.64 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( -11.360 0.000 -5.896) 12.798 2.509 ( -2.042 0.000 -15.061) 15.199 2.884 ( -10.040 0.000 5.534) 11.464 2.958 ( -6.892 0.000 2.583) 7.360 3.137 ( -0.999 0.000 -5.703) 5.789 3.580 ( -2.516 0.000 2.695) 3.687 4.208 ( -1.945 0.000 -4.445) 4.852 4.397 ( -3.192 0.000 0.850) 3.304 4.496 ( 0.373 -0.000 -2.129) 2.162 4.684 ( -6.149 0.000 -10.194) 11.905 5.127 ( 3.962 -0.000 -8.736) 9.593 5.856 ( -8.845 0.000 -9.313) 12.844 5.995 ( -25.143 0.000 7.294) 26.180 6.083 ( 3.394 -0.000 3.918) 5.184 7.227 ( 4.611 -0.000 8.356) 9.544 8.078 ( 6.853 -0.000 9.416) 11.646 8.408 ( -10.482 0.000 -5.822) 11.990 9.034 ( -3.050 0.000 3.069) 4.327 9.473 ( -11.548 0.000 -10.238) 15.432 10.654 ( -4.571 0.000 -9.314) 10.375 11.799 ( 18.589 -0.000 5.817) 19.478 12.502 ( -3.753 0.000 1.682) 4.113 12.723 ( 8.140 -0.000 2.147) 8.418 12.849 ( -5.679 0.000 12.223) 13.477 13.067 ( -0.884 0.000 -1.166) 1.463 13.966 ( -3.709 0.000 -14.527) 14.993 14.160 ( 14.043 -0.000 8.870) 16.610 15.114 ( 9.161 -0.000 11.524) 14.722 17.315 ( -10.628 0.000 -29.339) 31.205 19.085 ( 7.944 -0.000 12.269) 14.616 19.801 ( 10.108 -0.000 16.536) 19.380 19.824 ( 9.789 -0.000 -4.537) 10.789 21.769 ( -16.939 0.000 6.712) 18.221 21.788 ( 0.831 -0.000 -20.440) 20.457 24.307 ( 4.716 -0.000 2.172) 5.192 24.385 ( -1.353 0.000 6.291) 6.435 ======================= Grid point 50 (32/432) ======================= q-point: (-0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( -11.867 5.610 -4.368) 13.834 2.247 ( -4.733 7.223 -16.224) 18.380 2.776 ( -8.543 -0.553 1.374) 8.671 2.874 ( -7.827 -5.276 -1.195) 9.515 3.109 ( -0.074 -3.915 -6.072) 7.225 3.662 ( 1.694 -0.753 9.800) 9.974 4.021 ( -5.731 17.346 -2.635) 18.457 4.335 ( -3.258 -2.524 -5.235) 6.662 4.502 ( -1.416 -1.180 -3.167) 3.665 4.622 ( -0.098 -14.470 -1.115) 14.513 5.056 ( 1.276 -0.409 -9.440) 9.534 5.661 ( -6.596 1.142 -5.268) 8.518 5.749 ( -22.662 -2.917 3.290) 23.085 6.152 ( 2.295 0.868 2.216) 3.306 7.372 ( 3.546 1.425 7.543) 8.456 8.209 ( -3.761 2.082 1.526) 4.562 8.303 ( 2.910 -8.974 -0.086) 9.435 9.033 ( -2.407 0.372 2.735) 3.662 9.252 ( -9.314 -5.249 -7.555) 13.091 10.481 ( -4.164 3.273 -6.906) 8.704 12.046 ( 12.318 1.020 1.529) 12.455 12.452 ( -2.410 3.366 0.309) 4.152 12.639 ( 0.496 28.592 7.332) 29.521 12.948 ( -4.028 1.088 -1.507) 4.437 13.164 ( 2.433 -22.137 5.806) 23.015 13.762 ( -3.743 0.463 -11.667) 12.261 14.465 ( 13.933 0.895 11.448) 18.055 15.363 ( 7.813 -5.004 8.399) 12.515 16.860 ( -10.100 -2.015 -27.528) 29.391 19.399 ( 14.847 0.198 15.492) 21.459 19.883 ( 7.096 1.398 -3.204) 7.910 20.130 ( 11.411 0.568 15.767) 19.471 21.494 ( -9.165 7.409 -9.892) 15.386 21.633 ( -13.981 -8.512 -6.688) 17.682 24.379 ( 2.888 0.127 1.552) 3.281 24.443 ( 0.678 0.963 5.345) 5.473 ======================= Grid point 51 (33/432) ======================= q-point: (-0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( -8.212 14.936 -9.070) 19.307 1.958 ( -5.215 13.652 -6.036) 15.811 2.757 ( -3.437 -6.613 3.176) 8.101 2.841 ( -3.960 -5.265 1.669) 6.796 3.032 ( -2.776 -5.328 -9.653) 11.370 3.750 ( 3.874 20.994 -0.376) 21.352 3.863 ( -2.706 -0.522 11.660) 11.981 4.199 ( -4.663 -2.333 -10.465) 11.692 4.521 ( 0.928 -3.972 0.936) 4.185 4.750 ( -0.487 -16.404 -0.197) 16.412 4.975 ( -0.078 -2.269 -7.036) 7.393 5.511 ( -13.147 -0.182 1.645) 13.250 5.586 ( -4.474 -2.748 -2.594) 5.856 6.182 ( 1.278 1.516 0.871) 2.166 7.441 ( 0.992 5.127 3.793) 6.454 8.171 ( -2.367 -4.954 0.439) 5.508 8.449 ( 3.462 -10.353 0.263) 10.920 9.029 ( -0.496 -0.532 1.226) 1.426 9.147 ( -7.051 -8.778 -3.294) 11.731 10.357 ( -1.460 3.713 -2.928) 4.949 12.125 ( 4.332 6.571 -0.829) 7.914 12.396 ( 5.167 23.881 0.804) 24.447 12.479 ( -5.200 8.981 3.778) 11.044 12.844 ( -2.751 5.783 -1.616) 6.605 13.445 ( 3.462 -19.307 3.520) 19.928 13.614 ( -3.539 -2.051 -5.786) 7.086 14.743 ( 9.413 1.290 10.657) 14.277 15.584 ( 4.348 -10.172 4.889) 12.094 16.478 ( -7.251 -1.312 -20.874) 22.136 19.776 ( 16.257 1.115 12.696) 20.658 19.916 ( 3.918 1.303 -1.684) 4.460 20.412 ( 8.791 5.063 11.581) 15.396 21.222 ( -9.197 3.120 -5.733) 11.278 21.417 ( -14.227 -7.717 -9.090) 18.563 24.411 ( 1.103 1.188 0.528) 1.705 24.508 ( 1.628 -0.125 3.740) 4.081 ======================= Grid point 52 (34/432) ======================= q-point: (-0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( -0.000 20.359 -0.000) 20.359 1.748 ( -0.000 18.899 -0.000) 18.899 2.814 ( -0.000 13.072 -0.000) 13.072 2.831 ( 0.000 -10.806 0.000) 10.806 3.026 ( 0.000 -16.248 0.000) 16.248 3.574 ( -0.000 21.898 -0.000) 21.898 3.984 ( 0.000 -0.552 0.000) 0.552 4.100 ( 0.000 -7.024 0.000) 7.024 4.579 ( 0.000 -6.340 0.000) 6.340 4.871 ( 0.000 -13.829 0.000) 13.829 4.957 ( 0.000 -3.884 0.000) 3.884 5.428 ( 0.000 -0.714 0.000) 0.714 5.571 ( 0.000 -2.698 0.000) 2.698 6.181 ( -0.000 2.200 -0.000) 2.200 7.411 ( -0.000 7.077 -0.000) 7.077 8.221 ( 0.000 -7.190 0.000) 7.190 8.570 ( 0.000 -13.717 0.000) 13.717 9.069 ( 0.000 -2.508 0.000) 2.508 9.141 ( 0.000 -11.678 0.000) 11.678 10.306 ( -0.000 3.537 -0.000) 3.537 12.075 ( -0.000 9.096 -0.000) 9.096 12.135 ( -0.000 39.075 -0.000) 39.075 12.479 ( 0.000 -3.598 0.000) 3.598 12.759 ( -0.000 7.853 -0.000) 7.853 13.525 ( -0.000 1.836 -0.000) 1.836 13.694 ( 0.000 -20.757 0.000) 20.757 14.880 ( -0.000 0.065 -0.000) 0.065 15.750 ( 0.000 -14.477 0.000) 14.477 16.282 ( -0.000 1.658 -0.000) 1.658 19.923 ( -0.000 1.308 -0.000) 1.308 19.982 ( -0.000 1.259 -0.000) 1.259 20.457 ( -0.000 11.680 -0.000) 11.680 21.154 ( 0.000 -1.221 0.000) 1.221 21.277 ( 0.000 -8.376 0.000) 8.376 24.407 ( -0.000 1.911 -0.000) 1.911 24.553 ( 0.000 -1.295 0.000) 1.295 ======================= Grid point 61 (35/432) ======================= q-point: ( 0.45 -0.55 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( -6.969 0.000 -1.436) 7.115 2.051 ( -3.789 0.000 -11.797) 12.390 2.720 ( -5.263 0.000 -2.492) 5.823 2.725 ( -3.232 0.000 3.378) 4.675 3.005 ( -2.241 0.000 -6.909) 7.264 3.814 ( 2.213 -0.000 12.563) 12.756 4.043 ( -2.615 0.000 -0.195) 2.623 4.164 ( -2.582 0.000 -11.710) 11.991 4.502 ( 1.228 -0.000 -2.121) 2.451 4.547 ( -2.022 0.000 5.109) 5.494 4.954 ( 0.096 -0.000 -8.573) 8.574 5.511 ( -14.962 0.000 2.018) 15.097 5.560 ( -2.604 0.000 -2.830) 3.846 6.195 ( 1.191 -0.000 0.736) 1.400 7.492 ( 2.328 -0.000 4.623) 5.176 8.121 ( -3.303 0.000 -2.697) 4.264 8.361 ( 3.103 -0.000 2.823) 4.195 9.044 ( -1.029 0.000 1.912) 2.172 9.057 ( -5.543 0.000 -4.466) 7.118 10.388 ( -2.492 0.000 -3.447) 4.254 12.185 ( 6.238 -0.000 0.037) 6.238 12.413 ( -2.912 0.000 0.020) 2.912 12.874 ( -3.270 0.000 1.767) 3.717 12.961 ( 4.391 -0.000 1.884) 4.778 13.063 ( -0.436 0.000 2.978) 3.010 13.612 ( -2.526 0.000 -7.011) 7.452 14.754 ( 9.455 -0.000 9.598) 13.473 15.493 ( 4.338 -0.000 4.065) 5.945 16.468 ( -7.400 0.000 -18.083) 19.539 19.785 ( 15.665 -0.000 13.501) 20.680 19.928 ( 3.855 -0.000 -2.166) 4.422 20.456 ( 10.053 -0.000 14.297) 17.478 21.297 ( -5.091 0.000 -15.722) 16.525 21.302 ( -18.125 0.000 -2.536) 18.302 24.422 ( 1.349 -0.000 0.884) 1.613 24.506 ( 0.985 -0.000 3.017) 3.174 ======================= Grid point 63 (36/432) ======================= q-point: (-0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( -0.000 12.691 -0.000) 12.691 1.976 ( -0.000 6.236 -0.000) 6.236 2.685 ( 0.000 -4.577 0.000) 4.577 2.788 ( 0.000 -10.379 0.000) 10.379 2.923 ( -0.000 2.251 -0.000) 2.251 3.944 ( -0.000 16.535 -0.000) 16.535 3.980 ( -0.000 0.561 -0.000) 0.561 4.017 ( 0.000 -2.604 0.000) 2.604 4.505 ( 0.000 -2.301 0.000) 2.301 4.631 ( 0.000 -12.223 0.000) 12.223 4.905 ( 0.000 -1.869 0.000) 1.869 5.420 ( 0.000 -0.262 0.000) 0.262 5.534 ( 0.000 -1.304 0.000) 1.304 6.204 ( -0.000 0.632 -0.000) 0.632 7.516 ( -0.000 4.260 -0.000) 4.260 8.105 ( 0.000 -4.887 0.000) 4.887 8.416 ( 0.000 -4.569 0.000) 4.569 9.009 ( 0.000 -3.904 0.000) 3.904 9.050 ( 0.000 -0.277 0.000) 0.277 10.347 ( -0.000 1.242 -0.000) 1.242 12.201 ( -0.000 5.140 -0.000) 5.140 12.410 ( 0.000 -3.598 0.000) 3.598 12.760 ( -0.000 34.424 -0.000) 34.424 12.849 ( -0.000 2.740 -0.000) 2.740 13.292 ( 0.000 -27.233 0.000) 27.233 13.550 ( -0.000 0.834 -0.000) 0.834 14.882 ( -0.000 0.140 -0.000) 0.140 15.570 ( 0.000 -5.953 0.000) 5.953 16.302 ( -0.000 0.611 -0.000) 0.611 19.938 ( -0.000 0.467 -0.000) 0.467 19.998 ( -0.000 0.510 -0.000) 0.510 20.615 ( -0.000 5.877 -0.000) 5.877 21.140 ( 0.000 -0.477 0.000) 0.477 21.158 ( 0.000 -4.679 0.000) 4.679 24.432 ( -0.000 0.900 -0.000) 0.900 24.534 ( 0.000 -0.696 0.000) 0.696 ======================= Grid point 125 (37/432) ======================= q-point: ( 0.00 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.502 ( -4.309 0.000 25.044) 25.412 0.657 ( 8.587 -0.000 31.233) 32.392 1.112 ( -7.077 0.000 53.192) 53.661 3.245 ( -0.542 0.000 -2.099) 2.168 3.276 ( -0.460 0.000 4.767) 4.789 3.861 ( -3.145 0.000 5.226) 6.099 3.970 ( 5.344 -0.000 -2.815) 6.040 4.546 ( -1.631 0.000 -5.934) 6.154 4.928 ( 0.208 -0.000 -7.659) 7.662 5.096 ( 14.835 -0.000 -5.438) 15.801 5.445 ( 3.796 -0.000 8.686) 9.479 5.725 ( 1.132 -0.000 12.108) 12.161 5.918 ( -0.526 0.000 2.477) 2.533 7.252 ( -8.798 0.000 8.979) 12.571 7.446 ( -1.444 0.000 -4.984) 5.189 7.543 (-122.405 0.000 2.978) 122.441 9.039 ( 3.327 -0.000 7.411) 8.124 9.458 ( -3.793 0.000 -2.607) 4.602 9.856 ( 1.516 -0.000 3.248) 3.584 10.055 ( -2.205 0.000 -9.364) 9.620 10.456 ( 36.139 -0.000 7.165) 36.843 11.316 ( -1.971 0.000 -3.619) 4.120 12.404 ( -14.378 0.000 10.938) 18.066 12.526 ( -2.127 0.000 -4.955) 5.392 12.811 ( 5.198 -0.000 -3.152) 6.079 13.531 ( -1.599 0.000 4.355) 4.639 14.457 ( -0.920 0.000 -1.679) 1.914 16.231 ( -2.181 0.000 -9.445) 9.693 19.124 ( 2.270 -0.000 -7.131) 7.484 19.458 ( 101.500 -0.000 -0.980) 101.505 19.805 ( 2.212 -0.000 -3.931) 4.511 19.919 ( -3.947 0.000 -0.153) 3.950 21.195 ( 9.448 -0.000 -2.201) 9.701 22.355 (-147.606 0.000 -1.080) 147.610 23.667 ( -2.911 0.000 4.309) 5.200 24.298 ( 2.667 -0.000 -0.329) 2.687 ======================= Grid point 126 (38/432) ======================= q-point: ( 0.09 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.866 ( 8.822 -10.377 21.095) 25.110 1.102 ( 4.441 -9.248 28.160) 29.971 1.862 ( 23.916 -6.391 42.541) 49.219 3.234 ( 4.587 1.887 -3.767) 6.229 3.303 ( -5.149 0.085 6.930) 8.634 3.863 ( -4.235 2.635 6.889) 8.505 4.002 ( 4.535 2.521 -3.425) 6.217 4.457 ( 2.928 0.947 -10.137) 10.593 4.834 ( 1.649 1.914 -9.576) 9.903 5.096 ( -5.544 0.959 -4.707) 7.336 5.527 ( 0.054 0.378 4.853) 4.868 5.908 ( -2.818 0.860 14.828) 15.118 5.919 ( -2.275 -0.724 7.625) 7.990 6.589 ( -22.887 31.743 27.209) 47.663 7.276 ( -3.235 2.036 4.865) 6.187 7.563 ( -10.952 -31.347 -4.870) 33.560 9.183 ( 2.814 0.419 6.800) 7.371 9.479 ( 1.888 -10.733 0.102) 10.898 9.826 ( 0.039 11.715 -4.878) 12.690 10.003 ( 0.476 -8.494 -0.852) 8.550 10.849 ( 25.472 25.492 -2.772) 36.144 11.394 ( 9.507 -29.136 -6.942) 31.424 12.378 ( -5.619 7.761 9.170) 13.262 12.458 ( -1.399 -0.734 1.129) 1.941 12.954 ( 5.565 -20.182 -7.713) 22.310 13.581 ( -0.012 -0.658 6.392) 6.426 14.397 ( -3.490 1.039 -2.814) 4.602 16.015 ( -7.392 3.021 -14.507) 16.560 18.962 ( 0.649 28.993 3.258) 29.183 19.431 ( -27.508 -1.800 -3.670) 27.810 19.807 ( -7.127 -0.373 -4.567) 8.473 19.958 ( -15.466 -0.826 7.605) 17.254 21.280 ( 12.021 10.406 2.571) 16.106 21.671 ( 8.601 -8.469 -4.908) 13.030 23.757 ( -2.810 -14.543 0.457) 14.819 24.334 ( 1.867 -0.379 0.850) 2.086 ======================= Grid point 127 (39/432) ======================= q-point: ( 0.18 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( 13.329 -11.851 16.618) 24.378 1.579 ( 7.369 -13.406 24.809) 29.146 2.678 ( 27.173 -5.291 29.419) 40.396 3.229 ( 4.177 4.659 -3.259) 7.055 3.316 ( -4.389 -0.259 7.745) 8.906 3.861 ( -2.622 3.908 4.954) 6.833 3.941 ( 1.785 7.587 -7.481) 10.804 4.395 ( 5.740 -2.206 -11.038) 12.636 4.721 ( -1.637 5.244 -3.963) 6.774 4.977 ( -7.100 -5.607 -1.303) 9.140 5.563 ( -0.025 1.017 1.396) 1.727 5.873 ( -8.878 -0.781 5.058) 10.248 6.136 ( -1.518 2.908 23.887) 24.112 6.542 ( 1.874 18.589 17.668) 25.714 7.212 ( -6.226 -1.209 -5.065) 8.117 7.633 ( -6.239 -17.267 1.887) 18.456 9.246 ( 3.057 6.683 2.362) 7.719 9.610 ( -1.940 -2.808 -0.383) 3.434 9.719 ( 2.760 -2.783 3.276) 5.108 10.094 ( 3.053 -2.437 3.243) 5.077 10.806 ( 6.444 15.014 -3.470) 16.702 11.752 ( 17.686 -21.549 -5.331) 28.382 12.302 ( -2.531 4.005 -2.732) 5.469 12.505 ( 0.027 2.753 6.406) 6.972 13.099 ( 3.337 -19.877 -6.072) 21.050 13.698 ( 2.901 -2.362 8.736) 9.503 14.287 ( -5.699 2.226 -3.376) 6.988 15.680 ( -10.361 4.710 -17.089) 20.532 18.750 ( -14.550 23.518 15.444) 31.675 19.142 ( -4.513 -0.575 -10.541) 11.480 19.646 ( -9.968 -4.396 -6.906) 12.899 19.800 ( -20.228 -0.316 7.178) 21.467 21.412 ( 16.552 8.886 -0.910) 18.809 21.874 ( 19.231 -7.940 -9.023) 22.678 23.834 ( -0.751 -10.185 -0.644) 10.233 24.367 ( 0.681 -0.004 1.509) 1.655 ======================= Grid point 128 (40/432) ======================= q-point: ( 0.27 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.771 ( 13.518 -10.869 12.677) 21.484 2.071 ( 8.849 -14.304 21.995) 27.689 3.111 ( 1.364 4.151 4.499) 6.272 3.199 ( 3.956 6.900 -3.414) 8.655 3.509 ( 12.857 -4.411 17.932) 22.502 3.729 ( -3.066 14.016 -8.162) 16.507 3.894 ( 7.927 -1.859 -3.427) 8.834 4.385 ( 3.231 -4.691 -7.777) 9.640 4.664 ( -2.200 1.808 5.059) 5.805 4.963 ( -1.927 -7.299 -2.165) 7.853 5.519 ( -4.277 3.814 -1.281) 5.872 5.818 ( -8.918 -0.437 5.474) 10.473 6.352 ( -4.775 5.808 27.499) 28.509 6.649 ( 5.321 9.595 12.268) 16.459 7.039 ( -8.747 -1.771 -8.581) 12.380 7.737 ( -2.720 -11.769 5.604) 13.316 9.164 ( -4.741 9.906 -2.266) 11.213 9.606 ( 5.900 5.165 2.528) 8.239 9.842 ( -3.564 -5.687 3.289) 7.474 10.223 ( 6.069 -0.724 7.069) 9.345 10.782 ( 4.384 -2.743 -1.382) 5.353 12.010 ( 5.486 -0.800 -3.022) 6.314 12.216 ( 6.283 -0.172 -5.127) 8.111 12.554 ( 2.859 -2.271 0.784) 3.735 13.242 ( 0.767 -16.138 -0.767) 16.174 13.891 ( 5.678 -4.840 8.824) 11.555 14.137 ( -7.301 3.460 -2.763) 8.538 15.303 ( -10.521 5.220 -16.487) 20.243 18.546 ( -13.865 11.188 7.494) 19.328 19.057 ( 9.867 5.998 -7.935) 14.010 19.459 ( -9.636 -3.731 -9.888) 14.302 19.625 ( -19.166 -2.079 7.856) 20.818 21.509 ( 14.301 7.574 -6.105) 17.296 22.093 ( 12.733 -8.240 -1.438) 15.235 23.905 ( 2.170 -7.003 -0.954) 7.394 24.380 ( -0.946 1.231 1.737) 2.330 ======================= Grid point 129 (41/432) ======================= q-point: ( 0.36 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( 10.452 -7.500 7.376) 14.829 2.527 ( 6.287 -12.394 18.649) 23.258 3.046 ( -4.167 6.765 1.384) 8.065 3.099 ( -0.635 6.280 -6.483) 9.048 3.447 ( -4.561 13.507 -8.692) 16.697 3.808 ( 12.588 -1.983 -1.706) 12.857 4.128 ( 16.059 -6.955 4.185) 17.994 4.358 ( -4.664 -4.283 -1.450) 6.496 4.735 ( 0.824 -1.613 7.286) 7.508 4.971 ( -1.301 -6.042 -2.688) 6.740 5.349 ( -8.703 7.057 -5.438) 12.455 5.778 ( -6.079 1.396 5.593) 8.378 6.502 ( -8.059 5.544 18.204) 20.666 6.776 ( -0.488 2.025 12.982) 13.148 6.877 ( -6.195 -0.997 0.108) 6.276 7.895 ( 1.120 -8.964 8.767) 12.588 8.954 ( -7.390 10.846 -3.584) 13.605 9.686 ( 1.626 -0.413 3.615) 3.986 9.812 ( -1.083 3.643 -1.173) 3.977 10.345 ( 1.127 0.064 3.134) 3.331 10.979 ( 9.966 -14.826 5.085) 18.574 11.801 ( -8.085 15.812 -8.488) 19.683 12.379 ( 13.497 -2.367 -1.583) 13.794 12.657 ( 4.779 -6.828 1.507) 8.469 13.361 ( -0.427 -9.604 2.004) 9.820 13.916 ( -6.612 5.085 -3.312) 8.974 14.168 ( 5.007 -6.805 7.081) 11.023 14.977 ( -7.092 4.240 -11.037) 13.787 18.358 ( -7.968 3.237 -5.478) 10.197 19.088 ( 11.962 6.119 -6.040) 14.732 19.260 ( -6.392 0.794 -4.265) 7.725 19.523 ( -15.415 -5.590 8.308) 18.382 21.527 ( 11.324 5.659 -10.220) 16.269 22.307 ( 5.244 -8.279 5.455) 11.216 23.989 ( 4.876 -4.690 -1.181) 6.868 24.358 ( -2.527 3.114 1.714) 4.361 ======================= Grid point 130 (42/432) ======================= q-point: (-0.55 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.282 ( 2.446 1.757 -2.946) 4.213 2.674 ( -11.151 6.769 2.834) 13.349 2.967 ( -1.058 2.562 -2.718) 3.882 3.111 ( 6.482 -5.191 9.119) 12.334 3.260 ( 0.471 1.746 -3.723) 4.139 3.938 ( 11.501 -3.112 -7.600) 14.133 4.211 ( -7.700 -0.904 -2.730) 8.220 4.430 ( 1.081 -6.989 3.341) 7.821 4.836 ( -0.155 0.563 7.509) 7.532 4.997 ( 2.731 -6.462 -1.765) 7.234 5.077 ( -7.845 6.893 -9.611) 14.193 5.753 ( -3.207 4.372 4.656) 7.147 6.407 ( -11.405 -0.892 -4.512) 12.297 6.855 ( -3.695 2.879 9.609) 10.690 6.993 ( -7.416 -3.097 28.433) 29.547 8.092 ( 1.442 -1.826 12.430) 12.646 8.743 ( -3.921 5.476 -5.942) 8.981 9.704 ( -11.239 -16.074 -0.575) 19.622 9.777 ( 9.090 16.466 0.284) 18.811 10.340 ( -3.590 -2.820 -2.154) 5.047 11.289 ( 8.029 0.186 0.574) 8.052 11.475 ( -3.246 4.816 -4.207) 7.171 12.518 ( 7.217 0.772 0.738) 7.295 12.790 ( 2.022 -2.731 4.358) 5.526 13.415 ( -0.399 0.101 -0.320) 0.521 13.799 ( -1.286 -0.074 0.422) 1.355 14.252 ( -3.247 -0.425 -4.428) 5.507 14.895 ( 4.702 -2.347 4.185) 6.717 18.131 ( -5.619 -2.012 -18.766) 19.692 19.061 ( 3.768 1.004 -5.844) 7.026 19.280 ( 7.792 4.049 4.171) 9.721 19.496 ( -10.778 -4.866 9.915) 15.432 21.493 ( 9.217 3.336 -12.664) 16.015 22.487 ( -2.642 -8.728 10.715) 14.070 24.078 ( 5.950 -2.176 -1.199) 6.448 24.303 ( -3.072 5.091 1.496) 6.131 ======================= Grid point 131 (43/432) ======================= q-point: (-0.45 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( -7.555 12.128 -12.052) 18.693 2.379 ( -16.070 14.677 -2.336) 21.889 2.995 ( 1.838 -3.705 3.250) 5.261 3.184 ( -0.454 -2.951 0.532) 3.033 3.471 ( 8.732 -11.682 6.468) 15.955 3.845 ( -16.458 0.448 -11.011) 19.807 4.126 ( 3.166 -0.960 -5.761) 6.643 4.407 ( -10.275 -1.253 2.853) 10.737 4.854 ( -5.355 1.639 -4.351) 7.092 4.902 ( 4.729 4.032 1.841) 6.481 5.142 ( 7.782 -10.096 -0.953) 12.783 5.724 ( -0.840 6.337 3.114) 7.111 6.189 ( -10.466 -2.629 -9.928) 14.663 6.868 ( -10.863 -0.491 11.164) 15.584 7.270 ( -10.325 -4.554 33.344) 35.202 8.160 ( -7.029 13.909 13.341) 20.514 8.708 ( 9.382 -9.016 -7.354) 14.946 9.675 ( -11.385 -13.337 -0.028) 17.536 9.763 ( 7.124 9.948 -1.834) 12.373 10.253 ( -7.688 -4.966 -5.747) 10.807 11.055 ( -1.673 20.759 -5.837) 21.629 11.690 ( 9.667 -12.472 1.944) 15.899 12.577 ( 1.226 1.946 2.167) 3.160 12.802 ( -7.608 6.389 5.915) 11.562 13.379 ( 4.084 5.230 -2.594) 7.124 13.905 ( 6.456 -5.818 4.548) 9.809 14.062 ( -8.407 5.966 -6.340) 12.103 15.156 ( 12.136 -6.548 10.988) 17.633 17.816 ( -3.502 -4.926 -30.836) 31.422 19.114 ( 5.564 -2.686 2.630) 6.715 19.374 ( 3.862 0.854 1.103) 4.106 19.570 ( 0.102 0.712 12.549) 12.570 21.429 ( 7.532 1.528 -14.532) 16.439 22.629 ( -10.573 -10.580 15.423) 21.485 24.143 ( 2.814 2.350 1.744) 4.060 24.241 ( 0.438 4.931 -0.699) 5.000 ======================= Grid point 132 (44/432) ======================= q-point: (-0.36 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.686 ( -13.182 14.916 -11.823) 23.153 1.984 ( -18.913 18.509 -1.930) 26.533 3.089 ( 2.042 -3.117 1.105) 3.887 3.217 ( -11.256 -3.071 -3.476) 12.174 3.332 ( -20.227 2.764 -8.416) 22.082 3.687 ( 0.809 -9.107 -1.434) 9.254 4.083 ( -5.933 -2.299 1.563) 6.552 4.400 ( 5.094 -0.606 0.472) 5.151 4.762 ( -4.647 -2.762 -1.457) 5.598 4.956 ( 3.734 2.231 1.991) 4.784 5.310 ( 7.220 -8.599 -1.698) 11.355 5.693 ( 0.607 5.287 -0.178) 5.325 5.973 ( -6.721 -1.084 -9.663) 11.820 6.834 ( -19.732 -6.101 14.055) 24.982 7.513 ( -14.850 -5.393 29.578) 33.533 8.052 ( -6.363 17.142 10.354) 21.013 8.895 ( 14.550 -8.277 -4.913) 17.446 9.640 ( -6.020 -4.355 1.841) 7.655 9.736 ( -1.197 -1.580 -4.902) 5.288 10.131 ( -5.352 -3.029 -3.300) 6.979 10.884 ( 0.736 10.093 -0.171) 10.121 11.868 ( 6.182 -7.413 -4.660) 10.718 12.579 ( -3.431 2.891 4.825) 6.589 12.644 ( -11.303 11.558 4.283) 16.724 13.386 ( 6.454 4.861 -2.618) 8.493 13.861 ( -6.814 9.551 2.584) 12.014 14.107 ( 8.070 -4.634 4.578) 10.371 15.520 ( 14.289 -6.948 11.217) 19.449 17.433 ( 0.443 -6.713 -41.903) 42.440 19.271 ( 1.109 -6.542 6.837) 9.528 19.429 ( 6.848 2.458 1.765) 7.487 19.726 ( 5.821 4.468 10.008) 12.410 21.336 ( 5.799 0.639 -15.511) 16.572 22.742 ( -18.337 -14.965 19.535) 30.689 24.142 ( -2.326 10.004 8.475) 13.316 24.240 ( 6.589 1.212 -4.321) 7.973 ======================= Grid point 133 (45/432) ======================= q-point: (-0.27 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( -17.744 14.971 -6.728) 24.171 1.531 ( -21.534 21.085 -1.309) 30.166 2.503 ( -40.086 14.219 -16.821) 45.739 3.171 ( -0.566 -3.254 3.428) 4.760 3.389 ( -0.833 -7.905 5.264) 9.534 3.653 ( -5.038 -5.740 -5.732) 9.549 4.070 ( -2.855 -0.502 1.767) 3.395 4.515 ( 6.641 -5.732 -0.837) 8.812 4.747 ( -2.541 -3.552 3.447) 5.564 5.007 ( 2.468 0.835 1.882) 3.214 5.424 ( 4.755 -6.570 -3.991) 9.039 5.626 ( -2.862 -0.857 -6.208) 6.889 5.844 ( 1.896 5.206 -3.593) 6.604 6.794 ( -26.909 -15.978 18.355) 36.281 7.594 ( -20.967 -2.736 19.007) 28.431 8.007 ( 0.191 13.813 13.753) 19.493 9.059 ( 13.453 2.356 -3.891) 14.202 9.587 ( 2.240 9.520 -4.663) 10.835 9.713 ( -11.035 -21.339 1.184) 24.052 10.121 ( 3.311 4.745 4.112) 7.099 10.896 ( -1.494 -8.153 4.643) 9.500 11.864 ( 0.536 -3.715 -11.788) 12.371 12.431 ( -15.900 10.167 8.406) 20.659 12.579 ( -0.941 2.270 3.155) 3.999 13.388 ( 5.392 4.283 -3.179) 7.584 13.814 ( -0.131 17.124 16.950) 24.094 14.280 ( 6.796 -2.348 3.260) 7.895 15.880 ( 13.645 -6.088 9.083) 17.486 16.977 ( 3.609 -6.711 -54.420) 54.951 19.344 ( -2.768 -2.376 3.076) 4.771 19.597 ( 11.505 0.908 6.113) 13.060 19.846 ( 5.411 6.928 5.845) 10.556 21.231 ( 4.954 -0.026 -14.376) 15.206 22.850 ( -26.169 -24.128 22.890) 42.320 24.149 ( 1.416 12.799 11.720) 17.412 24.271 ( 5.056 2.624 -0.842) 5.759 ======================= Grid point 134 (46/432) ======================= q-point: (-0.18 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( -21.943 13.907 1.894) 26.048 1.036 ( -25.380 19.343 -1.526) 31.947 1.650 ( -45.836 20.455 -4.129) 50.363 3.220 ( -0.695 -2.023 2.620) 3.382 3.407 ( -10.442 -3.714 1.693) 11.211 3.659 ( 4.375 -5.472 0.468) 7.021 4.033 ( -1.324 -0.140 -3.430) 3.679 4.589 ( -2.716 -5.778 0.324) 6.393 4.865 ( 6.539 -4.825 5.151) 9.621 5.043 ( 1.557 1.521 1.689) 2.755 5.399 ( -3.093 -6.561 -15.139) 16.787 5.559 ( -0.686 0.053 2.122) 2.231 5.838 ( 6.261 6.004 -0.046) 8.674 6.852 ( -30.155 -33.365 23.519) 50.751 7.481 ( -21.272 0.156 11.555) 24.208 8.134 ( 2.316 5.625 19.807) 20.720 9.143 ( 15.268 14.484 -0.192) 21.046 9.495 ( 2.981 6.824 -4.260) 8.579 9.767 ( -8.590 -18.502 -0.006) 20.399 10.187 ( 6.343 9.863 4.830) 12.682 11.080 ( -4.206 -24.507 7.892) 26.087 11.685 ( -7.144 -5.134 -19.423) 21.323 12.273 ( -17.748 -1.352 11.754) 21.330 12.590 ( -1.722 -0.380 2.472) 3.036 13.413 ( 5.285 2.246 -0.065) 5.743 13.947 ( 16.181 34.125 23.751) 44.615 14.398 ( 5.021 -0.492 1.764) 5.345 16.166 ( 10.482 -3.186 6.158) 12.568 16.395 ( -1.688 -1.317 -51.544) 51.588 19.337 ( 1.531 5.019 -0.935) 5.330 19.796 ( 8.178 0.425 5.688) 9.971 19.883 ( 2.389 6.882 2.346) 7.653 21.156 ( 5.781 -0.550 -11.399) 12.793 22.999 ( -33.941 -42.978 24.530) 60.007 24.224 ( 6.603 7.061 4.323) 10.590 24.341 ( 4.877 11.663 16.163) 20.520 ======================= Grid point 135 (47/432) ======================= q-point: (-0.09 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.495 ( -25.318 10.253 7.985) 28.459 0.531 ( -23.624 14.651 10.442) 29.695 1.028 ( -40.300 20.597 34.256) 56.761 3.242 ( -0.942 -0.553 1.633) 1.965 3.305 ( -6.991 -1.255 -0.775) 7.145 3.788 ( 3.458 -3.533 4.084) 6.412 3.977 ( 0.350 -0.036 -4.494) 4.508 4.591 ( -2.693 -2.565 1.258) 3.926 4.981 ( 0.501 -3.518 -3.215) 4.793 5.062 ( 0.069 0.838 -4.544) 4.621 5.272 ( 3.437 -1.202 1.722) 4.028 5.613 ( 0.154 -0.156 6.765) 6.769 5.881 ( 4.195 2.604 1.205) 5.082 7.108 ( -20.723 -47.635 16.920) 54.633 7.357 ( -19.813 -9.305 10.471) 24.265 8.427 ( -3.835 -23.865 14.458) 28.166 9.216 ( 22.008 24.039 -10.577) 34.266 9.487 ( 12.457 15.410 5.893) 20.673 9.804 ( -3.851 -10.044 0.938) 10.798 10.195 ( 3.358 7.847 -1.564) 8.677 10.974 ( -57.670 -27.452 -53.523) 83.332 11.371 ( 0.941 7.183 -1.200) 7.343 12.325 ( -17.899 -32.678 13.190) 39.524 12.577 ( -2.214 -1.281 -1.767) 3.109 13.402 ( 5.676 24.269 -24.447) 34.912 13.645 ( -1.873 48.715 -36.620) 60.973 14.457 ( 1.965 -0.686 -0.201) 2.091 16.266 ( 4.185 -5.176 -1.069) 6.741 16.850 ( 63.948 -15.264 110.521) 128.597 19.274 ( 8.203 16.619 -5.465) 19.322 19.859 ( -0.525 1.765 -1.056) 2.122 19.919 ( 2.356 1.993 4.122) 5.149 21.138 ( 7.368 -0.599 -7.712) 10.682 23.227 ( -43.522 -75.619 12.791) 88.182 24.268 ( 4.289 1.319 -2.080) 4.945 24.458 ( -2.136 18.206 -14.395) 23.308 ======================= Grid point 137 (48/432) ======================= q-point: ( 0.09 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 13.199 -0.000 21.367) 25.115 1.452 ( 6.819 -0.000 26.874) 27.725 2.634 ( 30.108 -0.000 30.725) 43.017 3.277 ( 7.548 -0.000 -4.903) 9.001 3.308 ( -6.730 0.000 8.664) 10.971 3.888 ( -3.615 0.000 3.961) 5.363 4.017 ( 1.523 -0.000 -3.567) 3.878 4.374 ( 5.670 -0.000 -14.561) 15.626 4.788 ( 4.970 -0.000 -7.649) 9.122 4.906 ( -15.711 0.000 0.464) 15.718 5.570 ( 0.110 -0.000 1.881) 1.884 5.866 ( -9.290 0.000 5.767) 10.934 6.159 ( -0.662 0.000 23.643) 23.652 6.775 ( -3.777 0.000 13.085) 13.620 7.174 ( -5.480 0.000 -10.061) 11.457 7.436 ( -4.607 0.000 13.448) 14.215 9.326 ( -4.244 0.000 15.216) 15.797 9.479 ( 5.454 -0.000 -4.731) 7.220 9.752 ( 1.436 -0.000 -5.164) 5.360 10.081 ( 7.270 -0.000 3.611) 8.118 11.036 ( -7.076 0.000 -8.372) 10.962 11.481 ( 34.894 -0.000 -3.021) 35.025 12.336 ( 1.592 -0.000 -7.292) 7.463 12.591 ( -5.743 0.000 19.322) 20.158 12.861 ( 5.168 -0.000 -9.370) 10.701 13.678 ( 2.513 -0.000 8.362) 8.731 14.307 ( -5.328 0.000 -3.423) 6.333 15.720 ( -11.134 0.000 -17.077) 20.386 19.001 ( -33.256 0.000 7.177) 34.022 19.103 ( 10.308 -0.000 -9.170) 13.797 19.605 ( -11.938 0.000 -6.117) 13.414 19.796 ( -21.644 0.000 9.845) 23.778 21.546 ( 8.844 -0.000 9.500) 12.980 21.753 ( 28.468 -0.000 -22.138) 36.062 23.736 ( 1.746 -0.000 2.760) 3.266 24.367 ( 0.924 -0.000 1.834) 2.054 ======================= Grid point 138 (49/432) ======================= q-point: ( 0.18 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( 14.321 -3.205 18.547) 23.651 1.874 ( 8.299 -7.307 23.794) 26.238 3.162 ( 6.095 1.714 5.579) 8.439 3.296 ( 5.327 3.853 -3.911) 7.650 3.451 ( 13.973 -2.355 18.500) 23.303 3.861 ( 0.352 -0.913 -3.678) 3.806 3.938 ( -1.206 8.163 -5.742) 10.053 4.300 ( 5.728 -4.282 -14.505) 16.173 4.718 ( -7.060 4.252 4.586) 9.431 4.836 ( -0.378 -6.882 -1.607) 7.077 5.557 ( -2.889 0.967 -1.044) 3.220 5.816 ( -9.345 0.032 7.684) 12.099 6.412 ( -4.510 1.584 27.520) 27.932 6.822 ( 0.791 9.565 6.591) 11.643 6.993 ( -7.192 -4.013 -10.146) 13.068 7.557 ( -6.094 -7.379 14.008) 16.965 9.312 ( -6.891 8.377 1.051) 10.898 9.474 ( -8.790 -11.188 2.561) 14.457 9.896 ( 17.580 3.090 4.310) 18.363 10.211 ( 6.572 0.291 4.064) 7.732 10.831 ( -3.955 4.164 -7.130) 9.155 11.914 ( 27.060 -5.411 -0.194) 27.597 12.288 ( 4.383 3.502 -6.475) 8.567 12.624 ( -2.695 11.744 5.662) 13.313 12.922 ( -0.148 -20.001 -0.173) 20.003 13.836 ( 5.305 -1.652 8.924) 10.512 14.182 ( -6.692 1.504 -3.336) 7.627 15.361 ( -12.046 1.748 -16.678) 20.647 18.679 ( -19.490 4.200 0.699) 19.950 19.140 ( 12.808 3.018 -9.342) 16.137 19.388 ( -11.850 -3.004 -5.736) 13.504 19.620 ( -19.930 0.338 8.293) 21.589 21.685 ( 12.597 12.409 -1.343) 17.733 21.918 ( 16.003 -12.069 -8.979) 21.963 23.814 ( 3.861 -3.105 1.526) 5.184 24.394 ( -0.461 0.430 2.473) 2.552 ======================= Grid point 139 (50/432) ======================= q-point: ( 0.27 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 12.683 -2.287 13.894) 18.951 2.315 ( 7.734 -11.377 20.432) 24.632 3.134 ( -4.053 3.707 -0.101) 5.494 3.218 ( -2.849 6.607 -5.069) 8.801 3.695 ( -5.046 14.043 -9.761) 17.831 3.791 ( 12.989 1.222 -2.318) 13.251 3.994 ( 15.419 -8.401 3.707) 17.946 4.251 ( -1.771 -8.347 -8.738) 12.213 4.730 ( -0.862 0.929 9.352) 9.437 4.869 ( -1.510 -5.485 -0.531) 5.714 5.437 ( -7.024 3.315 -5.929) 9.771 5.804 ( -5.661 1.465 8.866) 10.621 6.592 ( -11.232 5.076 18.359) 22.113 6.757 ( -7.223 -2.670 3.637) 8.516 6.903 ( -0.978 2.333 3.389) 4.229 7.725 ( -3.476 -9.597 14.648) 17.854 9.118 ( -9.147 8.771 -2.537) 12.924 9.458 ( -12.413 -13.921 0.276) 18.653 10.080 ( 12.639 15.765 2.731) 20.390 10.352 ( 5.335 -0.815 2.919) 6.136 10.793 ( 6.215 -7.296 0.818) 9.619 12.101 ( 3.830 17.961 -6.058) 19.338 12.337 ( 17.322 -2.301 0.219) 17.475 12.588 ( 2.951 -0.186 0.754) 3.051 13.112 ( -2.058 -18.836 5.423) 19.709 13.993 ( -1.149 2.857 -0.252) 3.090 14.075 ( 1.030 -3.254 3.951) 5.221 15.027 ( -9.751 1.811 -12.494) 15.952 18.405 ( -10.978 2.187 -10.091) 15.071 19.146 ( 2.001 0.157 -9.457) 9.668 19.261 ( 2.710 0.535 -2.417) 3.670 19.482 ( -15.462 -0.025 10.061) 18.447 21.674 ( 12.214 11.315 -10.542) 19.706 22.136 ( 5.801 -11.803 2.832) 13.453 23.920 ( 5.945 -3.224 0.850) 6.816 24.400 ( -1.969 1.729 2.877) 3.892 ======================= Grid point 140 (51/432) ======================= q-point: ( 0.36 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( 8.055 1.739 5.442) 9.875 2.668 ( -0.444 -7.037 12.458) 14.315 3.040 ( -4.308 5.652 -5.309) 8.871 3.068 ( -1.005 0.676 3.088) 3.317 3.392 ( -5.450 12.027 -8.997) 15.978 3.885 ( 9.981 -2.608 -8.506) 13.371 4.166 ( -3.550 -5.178 -3.529) 7.202 4.291 ( 5.317 -8.669 1.317) 10.254 4.823 ( 0.701 -3.434 2.609) 4.370 4.900 ( -0.137 -2.121 4.591) 5.059 5.192 ( -8.907 5.244 -10.929) 15.043 5.829 ( -2.069 4.427 7.911) 9.298 6.404 ( -12.602 0.866 -7.536) 14.709 6.851 ( -14.213 -3.380 18.884) 23.876 6.977 ( -1.626 1.076 18.345) 18.448 7.959 ( 0.355 -11.132 14.397) 18.202 8.874 ( -10.466 8.643 -4.279) 14.232 9.408 ( -11.438 -15.177 -1.937) 19.103 10.044 ( -0.601 9.483 -1.707) 9.654 10.382 ( 6.130 9.519 -2.651) 11.628 11.109 ( 14.864 -13.242 8.272) 21.557 11.823 ( -0.691 26.712 -8.038) 27.904 12.528 ( 7.397 0.625 1.741) 7.625 12.741 ( 9.693 -2.946 5.361) 11.462 13.288 ( -1.579 -13.850 4.925) 14.784 13.857 ( -3.818 5.451 -2.250) 7.025 14.205 ( 2.017 -4.344 -2.161) 5.254 14.859 ( -0.880 -1.893 -0.661) 2.190 18.103 ( -8.350 -1.279 -20.596) 22.261 19.047 ( -3.218 -2.290 -3.495) 5.274 19.335 ( 11.330 2.599 -3.370) 12.103 19.460 ( -6.938 -0.004 13.003) 14.738 21.597 ( 9.583 8.728 -13.007) 18.362 22.317 ( -1.908 -11.253 7.235) 13.513 24.039 ( 7.187 -2.258 0.493) 7.549 24.378 ( -2.964 3.627 3.185) 5.664 ======================= Grid point 141 (52/432) ======================= q-point: (-0.55 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -1.738 10.966 -8.087) 13.736 2.585 ( -13.366 8.858 -1.522) 16.107 2.971 ( -0.233 0.652 3.177) 3.252 3.160 ( -4.314 -0.194 -0.188) 4.323 3.291 ( 6.903 -8.171 5.259) 11.919 3.833 ( -8.161 -2.565 -8.789) 12.265 4.125 ( -0.614 1.262 -4.241) 4.467 4.342 ( -4.411 -5.129 0.420) 6.778 4.876 ( -4.159 -2.722 -4.854) 6.947 4.947 ( 0.656 -2.362 -5.963) 6.447 4.988 ( 3.984 -1.333 2.615) 4.949 5.838 ( -0.814 7.114 4.926) 8.691 6.153 ( -10.777 -1.488 -8.878) 14.042 6.843 ( -18.091 -3.046 13.865) 22.996 7.205 ( -7.580 -2.875 28.163) 29.306 8.222 ( -0.388 -7.958 15.012) 16.995 8.632 ( -5.374 2.537 -8.388) 10.280 9.378 ( -9.995 -14.943 -0.989) 18.005 9.924 ( -4.808 -0.104 -4.101) 6.321 10.299 ( 3.203 13.549 -5.879) 15.113 11.488 ( 12.515 3.982 4.744) 13.964 11.514 ( 3.700 16.423 -3.592) 17.213 12.602 ( 0.987 0.993 3.405) 3.682 12.895 ( 1.343 4.540 6.900) 8.368 13.390 ( 0.435 -5.175 0.124) 5.194 13.838 ( 5.602 -0.965 1.848) 5.977 14.118 ( -5.630 0.664 -7.067) 9.060 15.031 ( 10.044 -7.937 8.637) 15.443 17.738 ( -7.460 -4.120 -29.181) 30.400 19.053 ( 0.049 -3.993 3.502) 5.312 19.404 ( 8.232 2.768 -1.987) 8.909 19.592 ( 4.323 1.180 12.092) 12.896 21.491 ( 7.359 5.898 -14.278) 17.112 22.437 ( -9.661 -11.959 10.108) 18.399 24.151 ( 6.920 -0.548 0.564) 6.964 24.338 ( -2.691 5.546 3.469) 7.074 ======================= Grid point 142 (53/432) ======================= q-point: (-0.45 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.961 ( -8.913 16.974 -11.917) 22.574 2.259 ( -16.435 13.530 -3.623) 21.594 3.041 ( 1.031 -1.922 5.047) 5.499 3.128 ( -3.023 -5.531 0.316) 6.311 3.461 ( -12.077 4.809 -5.666) 14.180 3.528 ( -8.300 -4.619 -3.323) 10.063 4.023 ( -6.225 -3.619 -0.481) 7.217 4.379 ( 1.684 -2.193 1.619) 3.204 4.721 ( -3.336 -2.153 -7.922) 8.862 4.991 ( 2.314 0.981 0.802) 2.638 5.125 ( 5.665 -12.332 -1.873) 13.699 5.778 ( -4.201 4.764 -1.904) 6.631 5.978 ( -3.052 1.498 -4.181) 5.388 6.746 ( -26.267 -5.007 14.953) 30.636 7.427 ( -11.511 -4.498 26.268) 29.030 8.275 ( -9.356 9.119 8.237) 15.445 8.660 ( 10.126 -17.481 -4.583) 20.715 9.365 ( -10.307 -14.479 0.376) 17.776 9.855 ( -3.234 -5.945 -3.089) 7.440 10.127 ( 0.080 12.719 -6.580) 14.320 11.257 ( 3.869 30.992 -0.378) 31.235 11.765 ( 10.669 -5.152 0.050) 11.848 12.620 ( -2.595 1.801 4.108) 5.182 12.840 ( -8.672 11.068 5.363) 15.049 13.430 ( 5.993 0.123 -4.073) 7.247 13.925 ( -3.241 -2.763 -2.233) 4.809 14.070 ( 7.684 1.265 7.811) 11.030 15.374 ( 13.579 -10.212 9.054) 19.253 17.322 ( -5.579 -5.926 -36.211) 37.114 19.174 ( 1.912 -4.689 7.560) 9.099 19.484 ( 10.439 3.835 -0.041) 11.121 19.789 ( 7.798 2.742 10.228) 13.151 21.369 ( 5.333 3.372 -15.189) 16.448 22.493 ( -17.802 -14.368 12.259) 25.954 24.243 ( 5.883 1.147 1.422) 6.161 24.302 ( -1.035 6.955 4.307) 8.245 ======================= Grid point 143 (54/432) ======================= q-point: (-0.36 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( -12.455 19.385 -8.411) 24.529 1.846 ( -19.490 15.780 -5.967) 25.778 2.820 ( -31.000 21.331 -7.106) 38.295 3.128 ( 2.237 -0.996 2.643) 3.603 3.243 ( -1.288 -8.362 3.449) 9.137 3.520 ( -5.415 -9.861 -5.465) 12.507 4.042 ( -3.796 -3.238 5.543) 7.457 4.419 ( 1.678 -4.819 -2.876) 5.858 4.678 ( -0.190 -4.686 -0.458) 4.713 5.018 ( 1.657 0.202 0.757) 1.833 5.254 ( 3.267 -12.824 -6.053) 14.552 5.638 ( -5.191 1.766 -3.953) 6.760 5.935 ( 3.292 5.307 -0.555) 6.270 6.589 ( -33.865 -9.339 17.473) 39.235 7.538 ( -16.986 -3.195 19.523) 26.074 8.186 ( -1.663 7.749 4.365) 9.048 8.911 ( 9.982 -17.546 -3.728) 20.528 9.367 ( -10.196 -16.079 1.886) 19.132 9.812 ( -0.016 5.571 -4.473) 7.145 10.042 ( -0.400 -4.402 2.958) 5.319 11.071 ( 2.891 26.849 2.206) 27.094 11.847 ( 4.512 0.993 -6.580) 8.040 12.602 ( -6.811 3.121 5.857) 9.510 12.659 ( -7.439 12.011 1.843) 14.248 13.432 ( 5.519 1.977 -6.747) 8.938 13.949 ( 0.280 -1.927 9.309) 9.511 14.287 ( 10.718 3.641 9.601) 14.843 15.738 ( 13.694 -10.755 7.028) 18.778 16.867 ( -3.896 -5.714 -42.119) 42.683 19.317 ( 4.533 -0.852 5.095) 6.873 19.626 ( 11.254 2.424 4.323) 12.297 19.957 ( 7.505 5.995 7.040) 11.909 21.239 ( 4.132 1.130 -14.719) 15.329 22.487 ( -26.768 -19.053 13.655) 35.581 24.282 ( 4.030 3.576 -2.078) 5.774 24.345 ( 2.529 5.909 11.116) 12.841 ======================= Grid point 144 (55/432) ======================= q-point: (-0.27 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.137 ( -14.445 20.691 -1.780) 25.297 1.339 ( -23.797 16.793 -8.349) 30.299 2.131 ( -30.297 33.810 2.065) 45.446 3.187 ( 0.852 -1.655 2.002) 2.733 3.311 ( -7.538 -7.358 2.487) 10.823 3.523 ( 1.161 -10.365 -0.102) 10.430 4.031 ( -2.338 -0.085 -2.168) 3.190 4.463 ( -2.422 -8.628 0.964) 9.013 4.771 ( 4.482 -6.182 2.539) 8.047 5.053 ( 1.409 -0.534 1.659) 2.241 5.257 ( -1.938 -9.881 -11.523) 15.303 5.571 ( -1.263 1.203 2.319) 2.901 5.938 ( 4.122 5.275 -0.158) 6.696 6.431 ( -40.714 -16.980 22.702) 49.611 7.479 ( -20.157 0.037 12.549) 23.744 8.212 ( 4.532 3.627 4.164) 7.144 9.108 ( 9.694 -13.293 -7.258) 17.982 9.419 ( -8.510 -19.388 2.652) 21.339 9.716 ( 3.492 10.092 -1.474) 10.780 10.195 ( -1.194 -12.186 8.120) 14.692 10.923 ( -2.273 16.965 2.689) 17.327 11.730 ( -1.350 7.345 -9.876) 12.382 12.429 ( -11.324 13.738 5.274) 18.569 12.603 ( -0.990 1.192 0.686) 1.695 13.426 ( 4.217 0.573 -2.926) 5.165 14.138 ( 6.122 -5.704 6.861) 10.821 14.512 ( 14.924 10.713 11.076) 21.452 16.059 ( 12.613 -10.118 2.918) 16.431 16.376 ( -5.554 -0.407 -33.392) 33.853 19.426 ( 10.826 5.115 0.034) 11.974 19.808 ( 8.103 0.982 5.921) 10.083 20.025 ( 3.921 9.431 2.809) 10.593 21.144 ( 5.302 -0.776 -12.034) 13.173 22.418 ( -37.786 -26.745 15.192) 48.722 24.284 ( 4.218 2.820 -2.319) 5.579 24.485 ( 4.168 4.776 13.144) 14.593 ======================= Grid point 145 (56/432) ======================= q-point: (-0.18 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( -16.081 20.093 4.764) 26.173 0.863 ( -14.320 22.499 7.473) 27.696 1.569 ( -24.418 38.723 18.767) 49.477 3.221 ( -1.215 -2.578 1.148) 3.073 3.267 ( -5.016 -2.449 0.240) 5.587 3.672 ( 1.609 -10.004 4.698) 11.169 3.972 ( 1.023 -0.545 -5.701) 5.818 4.508 ( -3.112 -6.992 1.563) 7.812 4.893 ( 2.590 -6.542 -1.828) 7.270 5.063 ( -1.525 -0.944 -4.596) 4.934 5.230 ( 4.072 -3.902 3.394) 6.583 5.611 ( -0.459 -0.077 6.743) 6.759 5.944 ( 1.196 3.429 1.075) 3.788 6.328 ( -50.714 -28.959 31.883) 66.536 7.343 ( -16.627 1.623 9.601) 19.269 8.297 ( 2.372 -0.966 1.603) 3.022 9.218 ( 9.561 -8.934 -13.607) 18.878 9.522 ( -4.723 -19.500 1.680) 20.134 9.765 ( 13.549 4.945 4.026) 14.975 10.277 ( -10.684 -9.426 -1.138) 14.294 10.691 ( -15.915 12.448 -8.858) 22.061 11.560 ( 2.221 13.660 0.932) 13.871 12.257 ( -8.973 10.941 7.893) 16.203 12.582 ( -0.602 0.664 -1.489) 1.738 13.459 ( 3.130 0.009 -0.339) 3.148 14.196 ( 5.067 2.811 -28.940) 29.514 14.544 ( 7.109 13.869 -19.986) 25.344 16.145 ( 4.277 -8.007 -3.382) 9.688 16.589 ( 20.956 -13.411 56.404) 61.648 19.536 ( 21.701 11.195 -5.151) 24.956 19.893 ( 1.256 1.848 -3.821) 4.427 20.006 ( 0.481 8.354 5.848) 10.209 21.120 ( 6.973 -1.443 -8.720) 11.258 22.270 ( -54.081 -35.784 17.251) 67.103 24.292 ( 3.442 1.863 -1.765) 4.294 24.594 ( -0.862 2.249 -1.517) 2.847 ======================= Grid point 146 (57/432) ======================= q-point: (-0.09 0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.727 ( -1.619 20.460 17.450) 26.939 0.803 ( 12.022 14.947 25.685) 32.057 1.362 ( -8.623 27.613 40.807) 50.020 3.218 ( -0.752 -3.234 -1.870) 3.811 3.274 ( -0.723 0.075 4.489) 4.547 3.801 ( -2.690 -7.053 5.894) 9.577 3.960 ( 4.996 -1.483 -4.728) 7.036 4.510 ( -1.454 -4.093 -4.542) 6.285 4.904 ( 0.442 -3.267 -7.199) 7.918 5.067 ( 9.926 -2.553 -3.251) 10.753 5.425 ( 4.519 -2.427 8.532) 9.955 5.721 ( 1.315 -0.554 11.826) 11.912 5.936 ( -3.208 0.839 3.282) 4.665 6.343 ( -53.986 -43.358 42.261) 81.120 7.263 ( -8.698 1.376 8.602) 12.310 8.156 ( -17.002 12.190 -12.444) 24.342 9.178 ( 5.977 0.213 -15.488) 16.602 9.634 ( -3.790 -6.291 -0.412) 7.356 9.803 ( -13.163 14.672 -6.085) 20.629 10.090 ( 0.774 -8.311 -0.978) 8.404 10.401 ( 16.027 9.802 1.086) 18.818 11.547 ( 7.480 19.013 0.595) 20.440 12.236 ( -7.240 -1.851 15.253) 16.986 12.535 ( -0.849 0.690 -4.630) 4.758 13.368 ( 3.620 32.187 -30.587) 44.550 13.565 ( -5.305 8.944 -2.429) 10.679 14.444 ( -1.130 -0.917 -1.980) 2.457 16.171 ( -1.518 -6.802 -9.228) 11.564 18.153 ( 28.813 -66.642 50.460) 88.417 19.710 ( 18.352 9.110 -9.350) 22.521 19.781 ( 5.765 -1.484 -8.319) 10.230 20.001 ( -0.219 6.768 2.598) 7.252 21.137 ( 1.687 -4.400 -2.577) 5.371 21.928 ( -60.310 -20.395 15.668) 65.565 24.182 ( -15.965 26.472 -18.797) 36.180 24.310 ( 2.199 1.660 -0.697) 2.842 ======================= Grid point 149 (58/432) ======================= q-point: ( 0.18 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( 13.520 -0.000 17.392) 22.029 2.202 ( 7.965 -0.000 20.216) 21.729 3.167 ( -4.328 0.000 -0.714) 4.386 3.280 ( -2.765 0.000 -5.063) 5.769 3.798 ( 1.441 -0.000 -9.771) 9.876 3.870 ( 19.770 -0.000 7.929) 21.300 3.911 ( 1.088 -0.000 -3.366) 3.538 4.135 ( -0.505 0.000 -15.322) 15.331 4.749 ( -1.406 0.000 10.882) 10.972 4.811 ( -1.333 0.000 0.204) 1.348 5.463 ( -6.378 0.000 -6.091) 8.819 5.818 ( -5.402 0.000 9.996) 11.363 6.651 ( -11.207 0.000 30.636) 32.621 6.722 ( -9.386 0.000 -12.301) 15.473 6.925 ( -0.453 0.000 3.482) 3.511 7.633 ( -5.822 0.000 18.183) 19.093 9.258 ( -5.488 0.000 -3.755) 6.650 9.272 ( -15.854 0.000 2.076) 15.990 10.272 ( -2.705 0.000 -0.675) 2.787 10.292 ( 24.904 -0.000 9.822) 26.771 10.732 ( 1.105 -0.000 -4.820) 4.945 12.276 ( 25.403 -0.000 3.574) 25.653 12.318 ( 8.331 -0.000 -7.389) 11.136 12.671 ( 0.875 -0.000 -10.016) 10.055 12.842 ( -7.176 0.000 17.415) 18.835 14.003 ( 7.276 -0.000 6.393) 9.686 14.062 ( -7.089 0.000 -2.723) 7.594 15.042 ( -10.744 0.000 -13.027) 16.886 18.425 ( -12.123 0.000 -11.835) 16.942 19.135 ( -5.222 0.000 -7.100) 8.813 19.273 ( 9.754 -0.000 -5.078) 10.996 19.487 ( -15.434 0.000 10.186) 18.493 21.846 ( 17.749 -0.000 -22.380) 28.564 21.961 ( 0.543 -0.000 13.771) 13.781 23.891 ( 6.444 -0.000 1.664) 6.655 24.414 ( -1.751 0.000 3.270) 3.710 ======================= Grid point 150 (59/432) ======================= q-point: ( 0.27 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( 9.961 3.649 11.766) 15.842 2.526 ( 4.976 -7.401 14.106) 16.688 3.085 ( -3.757 0.897 -1.442) 4.123 3.127 ( -7.965 3.184 -4.486) 9.680 3.594 ( -7.166 9.051 -11.182) 16.072 3.876 ( 4.690 2.579 -11.049) 12.277 4.027 ( 2.152 -9.926 -4.864) 11.262 4.179 ( 11.028 -3.859 3.145) 12.100 4.763 ( -5.967 -2.129 -0.782) 6.383 4.899 ( 3.462 0.474 9.719) 10.328 5.247 ( -9.165 1.511 -12.266) 15.386 5.886 ( -1.159 1.928 9.917) 10.169 6.436 ( -11.537 2.136 -11.272) 16.271 6.783 ( -19.887 -3.383 24.283) 31.569 6.995 ( -0.588 0.608 13.313) 13.340 7.803 ( -2.489 -5.557 16.885) 17.950 9.005 ( -14.221 6.221 -4.113) 16.058 9.209 ( -7.083 -8.072 -0.899) 10.777 10.109 ( -11.094 0.833 -7.214) 13.260 10.621 ( 14.385 16.013 2.404) 21.659 10.878 ( 15.647 -14.405 6.412) 22.213 12.249 ( 7.230 19.084 -9.329) 22.438 12.560 ( 6.772 4.902 2.730) 8.794 12.685 ( 14.042 -4.772 4.125) 15.394 13.012 ( -4.953 -15.254 11.887) 19.963 13.937 ( -5.287 3.072 -1.672) 6.339 14.139 ( 5.114 -2.659 -2.100) 6.135 14.834 ( -4.213 -0.868 -3.523) 5.560 18.089 ( -10.081 -0.409 -21.683) 23.916 19.010 ( -5.587 -1.463 -1.472) 5.960 19.372 ( 13.926 1.451 -5.946) 15.212 19.465 ( -6.373 0.123 12.109) 13.684 21.758 ( 11.476 8.488 -17.993) 22.967 22.132 ( -3.526 -9.058 10.306) 14.167 24.010 ( 7.805 -0.952 1.623) 8.028 24.420 ( -2.722 1.285 3.920) 4.942 ======================= Grid point 151 (60/432) ======================= q-point: (-0.64 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( 1.911 8.557 -2.386) 9.086 2.653 ( -7.488 -0.949 0.205) 7.550 2.995 ( -3.297 1.784 2.656) 4.594 3.108 ( -0.864 -4.560 7.081) 8.466 3.299 ( -5.614 7.215 -8.335) 12.371 3.759 ( -5.375 -5.602 -9.282) 12.101 4.129 ( 5.642 -2.140 -0.108) 6.035 4.297 ( 0.606 1.118 -0.146) 1.280 4.721 ( -1.957 -9.868 -2.667) 10.408 4.949 ( -10.097 0.757 -11.933) 15.650 5.016 ( 3.590 1.632 1.917) 4.385 5.952 ( 0.077 5.686 7.230) 9.199 6.145 ( -11.271 0.748 -9.848) 14.985 6.763 ( -23.986 -5.716 17.639) 30.317 7.176 ( -4.940 -0.805 22.885) 23.426 8.034 ( 0.784 -10.156 13.831) 17.177 8.712 ( -12.771 4.535 -7.156) 15.326 9.191 ( -5.932 -7.365 1.011) 9.511 9.866 ( -12.156 -3.804 -8.960) 15.573 10.578 ( 4.551 15.870 -4.775) 17.186 11.321 ( 18.796 -9.900 8.069) 22.725 12.042 ( 6.908 30.259 -4.507) 31.363 12.616 ( 0.383 1.183 4.563) 4.730 12.947 ( 8.996 1.119 6.902) 11.394 13.203 ( -2.744 -15.353 6.839) 17.030 13.871 ( 2.800 3.632 -0.017) 4.586 14.097 ( -2.468 -2.487 -9.458) 10.086 14.910 ( 7.398 -5.753 6.209) 11.241 17.684 ( -10.059 -2.168 -27.738) 29.585 18.996 ( -0.887 -2.486 4.000) 4.792 19.461 ( 11.375 3.635 -3.074) 12.331 19.595 ( 4.824 -0.946 10.443) 11.542 21.615 ( 7.509 7.993 -16.679) 19.962 22.240 ( -9.556 -10.644 9.290) 17.057 24.139 ( 7.709 -0.668 1.427) 7.868 24.412 ( -2.846 3.049 4.468) 6.112 ======================= Grid point 152 (61/432) ======================= q-point: (-0.55 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -5.786 14.371 -10.702) 18.829 2.431 ( -14.239 7.021 -5.245) 16.720 3.034 ( -2.215 0.853 7.084) 7.471 3.057 ( -6.216 -2.413 -1.746) 6.893 3.317 ( 0.017 -10.571 0.794) 10.601 3.627 ( -7.665 2.835 -3.000) 8.706 4.035 ( -9.604 7.166 -2.730) 12.289 4.330 ( 3.395 -2.901 1.768) 4.803 4.683 ( -3.995 -2.537 -12.558) 13.420 4.852 ( 2.381 -15.009 -1.938) 15.320 5.045 ( 0.815 0.716 -0.370) 1.146 5.853 ( -9.212 3.992 -4.779) 11.119 6.018 ( 0.824 3.230 1.159) 3.530 6.649 ( -30.433 -6.631 16.299) 35.154 7.370 ( -7.927 -2.200 23.079) 24.501 8.287 ( -0.885 -10.223 12.655) 16.292 8.464 ( -4.627 -0.943 -10.066) 11.119 9.189 ( -6.242 -6.881 1.618) 9.430 9.681 ( -10.178 -10.193 -7.024) 16.026 10.403 ( 0.864 15.664 -7.259) 17.286 11.673 ( 14.596 -3.088 3.505) 15.325 11.842 ( 7.686 33.560 0.577) 34.433 12.641 ( -3.308 0.937 4.466) 5.636 13.002 ( -5.237 7.861 5.539) 10.950 13.357 ( 3.296 -9.931 1.361) 10.552 13.870 ( -0.441 -1.571 -8.397) 8.554 14.085 ( 7.871 -0.364 7.162) 10.648 15.194 ( 12.638 -10.305 6.440) 17.533 17.243 ( -9.424 -3.395 -31.092) 32.666 19.114 ( 4.376 -2.548 8.159) 9.603 19.554 ( 12.039 4.267 -1.736) 12.890 19.813 ( 9.165 0.094 10.167) 13.688 21.448 ( 4.667 5.836 -16.483) 18.098 22.267 ( -16.742 -12.218 8.876) 22.547 24.251 ( 6.571 0.107 1.047) 6.655 24.402 ( -1.848 4.576 5.380) 7.301 ======================= Grid point 153 (62/432) ======================= q-point: (-0.45 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -9.319 18.514 -9.239) 22.693 2.070 ( -17.578 11.424 -7.554) 22.284 3.000 ( -10.631 -2.241 4.840) 11.894 3.083 ( -4.411 -4.381 3.402) 7.087 3.334 ( -5.816 -11.890 -5.320) 14.265 3.350 ( -6.031 22.037 -4.841) 23.355 3.970 ( -3.799 -4.185 7.672) 9.529 4.361 ( -1.147 -2.390 -4.730) 5.422 4.591 ( 0.427 -5.475 -3.458) 6.490 4.979 ( 1.955 -10.119 -2.515) 10.609 5.045 ( 0.533 -6.375 -3.525) 7.304 5.672 ( -6.541 2.099 -2.958) 7.479 6.017 ( 1.588 4.500 0.955) 4.867 6.453 ( -35.237 -7.371 16.067) 39.423 7.499 ( -11.722 -1.355 18.497) 21.941 8.271 ( -4.196 2.352 -0.942) 4.902 8.584 ( 5.583 -18.446 1.137) 19.306 9.176 ( -6.589 -7.379 0.919) 9.936 9.617 ( -8.658 -16.456 -3.313) 18.887 10.218 ( 1.951 14.213 -4.381) 15.000 11.630 ( 6.320 35.948 2.416) 36.579 11.877 ( 9.071 2.573 -1.373) 9.528 12.619 ( -5.396 0.141 3.341) 6.348 12.865 ( -9.393 10.986 3.594) 14.894 13.450 ( 6.079 -0.935 -5.627) 8.336 13.831 ( -1.962 -9.500 0.521) 9.714 14.348 ( 13.305 2.555 12.300) 18.299 15.529 ( 13.521 -13.367 3.691) 19.368 16.795 ( -8.234 -2.780 -31.640) 32.812 19.312 ( 9.792 0.028 6.926) 11.994 19.673 ( 11.070 3.055 1.720) 11.612 20.040 ( 10.229 3.696 8.873) 14.036 21.273 ( 2.873 2.997 -16.074) 16.602 22.204 ( -24.768 -14.632 8.430) 29.977 24.321 ( 4.546 1.579 -1.066) 4.929 24.430 ( 0.600 3.958 8.411) 9.315 ======================= Grid point 154 (63/432) ======================= q-point: (-0.36 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -11.464 20.318 -4.806) 23.819 1.621 ( -18.570 16.953 -6.397) 25.946 2.682 ( -20.353 28.102 2.820) 34.812 3.124 ( -6.247 -9.084 3.369) 11.528 3.239 ( 3.791 4.022 0.895) 5.599 3.324 ( -2.278 -12.474 -1.485) 12.767 4.023 ( -2.856 -1.125 1.314) 3.339 4.318 ( -3.155 -7.916 -1.357) 8.629 4.662 ( 2.912 -6.606 1.088) 7.301 5.021 ( 0.746 -3.517 -0.119) 3.598 5.074 ( -0.341 -11.414 -7.215) 13.508 5.592 ( -2.913 1.061 2.010) 3.695 5.996 ( -5.347 1.158 3.052) 6.265 6.242 ( -30.960 -6.444 15.145) 35.064 7.491 ( -15.285 1.553 12.298) 19.680 8.243 ( 2.979 -0.335 -1.572) 3.385 8.814 ( 4.444 -18.665 0.016) 19.187 9.177 ( -4.879 -9.824 0.367) 10.975 9.611 ( -10.236 -17.850 -2.463) 20.723 10.155 ( 4.603 7.425 1.807) 8.921 11.423 ( 3.891 36.374 2.291) 36.654 11.870 ( 3.153 8.519 -4.336) 10.066 12.582 ( -5.838 0.585 2.951) 6.567 12.688 ( -6.505 11.628 2.177) 13.501 13.443 ( 4.429 1.398 -4.638) 6.564 13.964 ( 1.874 -13.484 2.183) 13.787 14.636 ( 13.756 4.374 10.464) 17.828 15.838 ( 12.395 -15.247 -1.837) 19.735 16.385 ( -7.005 1.198 -20.256) 21.467 19.503 ( 15.552 4.001 0.035) 16.059 19.828 ( 7.776 1.249 5.499) 9.605 20.185 ( 6.572 9.278 5.279) 12.535 21.133 ( 4.199 -0.352 -13.525) 14.166 22.055 ( -32.838 -17.493 8.803) 38.234 24.332 ( 3.227 2.801 -1.762) 4.622 24.529 ( 1.817 1.146 8.539) 8.806 ======================= Grid point 155 (64/432) ======================= q-point: (-0.27 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( -10.688 21.810 3.821) 24.587 1.252 ( -8.393 23.214 4.589) 25.108 2.223 ( -15.297 36.834 8.531) 40.786 3.129 ( -5.880 -7.854 0.729) 9.838 3.264 ( 2.092 2.446 1.324) 3.481 3.464 ( -0.125 -14.277 5.489) 15.297 3.962 ( -0.362 -0.523 -6.422) 6.454 4.368 ( -3.078 -9.139 2.471) 9.955 4.770 ( 2.191 -7.798 -0.594) 8.122 5.031 ( -0.748 -2.922 -3.933) 4.956 5.135 ( 3.668 -7.526 4.212) 9.372 5.608 ( -2.492 -0.470 6.788) 7.246 5.911 ( -26.032 -7.563 14.532) 30.758 6.119 ( -11.566 0.227 7.546) 13.812 7.386 ( -13.836 3.506 8.796) 16.766 8.285 ( 3.568 -1.708 -2.405) 4.630 9.011 ( 5.851 -15.418 -3.538) 16.866 9.221 ( -3.387 -13.896 -0.638) 14.317 9.618 ( -6.785 -18.320 -0.165) 19.536 10.188 ( 0.193 2.156 0.781) 2.301 11.151 ( -0.016 34.811 -2.461) 34.898 11.789 ( 3.029 12.975 2.353) 13.530 12.480 ( -6.972 12.127 4.940) 14.835 12.596 ( -1.154 1.945 -1.075) 2.504 13.462 ( 3.579 0.607 -0.007) 3.631 14.079 ( 1.597 -11.932 -8.370) 14.662 14.735 ( 6.331 7.431 -16.098) 18.827 15.989 ( 6.317 -11.345 -11.454) 17.315 16.411 ( 6.733 -7.336 31.845) 33.365 19.662 ( 19.358 4.764 -5.695) 20.733 19.925 ( 2.220 1.973 -1.323) 3.252 20.179 ( -0.080 11.583 4.130) 12.298 21.092 ( 6.975 -1.732 -9.542) 11.946 21.853 ( -36.201 -17.622 11.461) 41.862 24.329 ( 2.695 2.514 -1.479) 3.972 24.602 ( -1.823 -0.599 1.381) 2.364 ======================= Grid point 156 (65/432) ======================= q-point: (-0.18 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.091 ( 8.676 19.611 16.949) 27.334 1.105 ( 2.666 22.585 14.934) 27.207 1.921 ( -6.539 35.590 22.050) 42.375 3.137 ( -1.253 -6.221 -1.127) 6.446 3.286 ( -0.557 1.670 3.837) 4.222 3.636 ( -2.283 -12.084 7.283) 14.293 3.918 ( 3.406 -3.354 -7.411) 8.819 4.420 ( -0.526 -6.236 -1.102) 6.355 4.815 ( -0.373 -6.959 -4.961) 8.555 5.034 ( 4.641 -1.380 -1.351) 5.027 5.354 ( 5.739 -6.585 8.745) 12.360 5.698 ( -1.685 -2.900 13.663) 14.068 5.824 ( -28.449 -10.309 23.224) 38.144 6.071 ( -6.521 1.478 5.748) 8.818 7.300 ( -8.631 3.020 7.620) 11.903 8.248 ( -4.451 1.424 -6.639) 8.119 9.101 ( 7.229 -6.996 -11.883) 15.570 9.335 ( -2.256 -20.849 2.154) 21.081 9.785 ( 2.013 -21.443 3.625) 21.840 10.068 ( -5.656 11.773 -3.785) 13.599 10.812 ( 0.288 32.172 -4.346) 32.466 11.814 ( 6.484 12.754 8.032) 16.408 12.357 ( -4.968 12.736 6.704) 15.226 12.548 ( -0.725 0.949 -3.817) 3.999 13.515 ( 3.600 1.717 2.029) 4.475 13.876 ( -2.501 9.839 -31.053) 32.670 14.473 ( -2.376 5.812 -9.061) 11.024 16.019 ( 0.177 -10.780 -10.154) 14.811 17.294 ( 15.588 -36.485 52.691) 65.958 19.752 ( -2.274 -1.141 -12.695) 12.947 19.828 ( 8.408 5.246 -4.763) 10.996 20.122 ( -3.019 7.722 1.788) 8.482 21.087 ( 2.027 -1.494 -4.121) 4.829 21.718 ( -18.000 -8.216 11.065) 22.670 24.328 ( 1.738 1.972 -0.999) 2.812 24.447 ( -9.956 7.245 -10.546) 16.212 ======================= Grid point 157 (66/432) ======================= q-point: (-0.09 0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.138 ( 9.352 19.875 14.032) 26.065 1.344 ( 9.772 16.658 20.734) 28.335 2.080 ( 15.831 19.216 36.495) 44.179 3.175 ( 3.248 -4.994 -3.197) 6.761 3.303 ( -4.687 0.284 6.503) 8.021 3.770 ( -3.319 -8.356 7.917) 11.980 3.928 ( 3.933 -5.868 -7.146) 10.048 4.433 ( 3.558 -1.709 -6.164) 7.319 4.771 ( -1.873 -5.264 -7.488) 9.343 5.079 ( -1.232 -0.667 -1.151) 1.814 5.510 ( 2.230 -2.087 3.694) 4.793 5.876 ( -8.353 -3.929 19.592) 21.658 5.923 ( 0.915 -1.756 7.370) 7.631 6.140 ( -7.854 -15.803 24.477) 30.175 7.275 ( -4.672 0.857 4.907) 6.829 7.963 ( -10.619 14.635 -10.699) 21.010 9.134 ( 7.819 -5.053 -6.182) 11.175 9.522 ( 1.476 -19.587 -0.448) 19.648 9.795 ( -7.329 17.490 6.198) 19.951 10.061 ( 3.987 -7.743 -0.506) 8.723 10.635 ( 9.362 8.437 -1.832) 12.735 11.832 ( 8.896 20.109 -1.395) 22.033 12.311 ( -5.967 1.993 8.744) 10.772 12.481 ( 1.090 2.058 -4.341) 4.926 13.367 ( 3.368 23.561 -19.510) 30.775 13.604 ( 0.014 1.943 7.080) 7.342 14.370 ( -4.090 -1.619 -2.998) 5.323 15.919 ( -6.004 -8.097 -14.644) 17.778 18.283 ( 0.976 -43.250 33.232) 54.552 19.445 ( -17.240 -0.026 -11.244) 20.583 19.833 ( -1.963 2.562 -4.341) 5.410 19.984 ( -13.060 2.210 1.294) 13.309 21.160 ( 12.832 -2.935 -0.824) 13.189 21.766 ( 9.526 2.391 0.351) 9.828 24.060 ( -8.646 16.676 -8.429) 20.589 24.345 ( 1.457 0.975 0.386) 1.795 ======================= Grid point 161 (67/432) ======================= q-point: ( 0.27 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.567 ( 1.804 -0.000 3.428) 3.874 2.587 ( -1.869 0.000 -1.421) 2.347 3.016 ( -5.794 0.000 2.498) 6.309 3.066 ( -1.853 0.000 5.025) 5.356 3.391 ( -10.844 0.000 -10.413) 15.034 3.692 ( -4.643 0.000 -10.035) 11.057 4.098 ( 9.748 -0.000 0.300) 9.753 4.326 ( 7.765 -0.000 2.620) 8.195 4.625 ( -8.797 0.000 -2.946) 9.278 4.953 ( -10.822 0.000 -15.243) 18.694 5.031 ( 3.182 -0.000 2.801) 4.239 6.001 ( 0.983 -0.000 7.976) 8.036 6.162 ( -11.521 0.000 -10.972) 15.910 6.701 ( -26.307 0.000 19.490) 32.740 7.170 ( -4.184 0.000 21.084) 21.495 7.944 ( 0.205 -0.000 14.624) 14.626 8.753 ( -14.482 0.000 -8.406) 16.744 9.129 ( -4.235 0.000 2.738) 5.043 9.832 ( -13.518 0.000 -10.436) 17.078 10.738 ( 0.070 -0.000 -6.251) 6.252 11.214 ( 23.856 -0.000 10.557) 26.088 12.361 ( 11.592 -0.000 -8.795) 14.551 12.657 ( 0.322 -0.000 4.950) 4.960 12.897 ( 7.086 -0.000 7.819) 10.553 13.041 ( -1.994 0.000 12.212) 12.374 13.913 ( 1.158 -0.000 2.002) 2.313 14.066 ( -0.796 0.000 -12.529) 12.554 14.858 ( 6.109 -0.000 5.140) 7.984 17.666 ( -10.908 0.000 -27.170) 29.278 18.975 ( -0.731 0.000 4.155) 4.219 19.503 ( 14.553 -0.000 -5.798) 15.666 19.576 ( 2.512 -0.000 12.149) 12.406 21.703 ( 8.872 -0.000 -20.953) 22.754 22.131 ( -10.881 0.000 12.439) 16.527 24.133 ( 7.930 -0.000 1.839) 8.141 24.438 ( -2.835 0.000 4.702) 5.490 ======================= Grid point 162 (68/432) ======================= q-point: (-0.64 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( -5.471 7.060 -9.483) 13.027 2.496 ( -9.998 0.872 -5.022) 11.222 3.041 ( -1.915 1.262 5.259) 5.737 3.069 ( -10.193 1.542 2.386) 10.582 3.165 ( -6.061 -6.561 -4.417) 9.964 3.612 ( 0.174 -1.918 -0.054) 1.926 4.186 ( -0.721 4.851 0.676) 4.951 4.345 ( 0.078 8.467 0.091) 8.468 4.584 ( 0.429 -14.575 -1.542) 14.662 4.651 ( -6.813 -2.377 -16.385) 17.903 5.056 ( -0.437 0.392 -1.172) 1.311 5.901 ( -10.590 1.456 -7.562) 13.094 6.077 ( 1.476 2.889 4.516) 5.560 6.545 ( -32.106 -4.428 17.465) 36.816 7.349 ( -5.796 -0.530 21.216) 22.000 8.133 ( 2.385 -5.199 11.460) 12.808 8.478 ( -10.648 0.564 -9.289) 14.141 9.120 ( -4.357 -1.711 3.551) 5.875 9.559 ( -12.185 -3.891 -9.491) 15.928 10.597 ( -2.594 6.383 -8.611) 11.028 11.616 ( 18.865 -2.204 7.280) 20.341 12.343 ( 10.254 19.954 -3.972) 22.784 12.682 ( -2.712 5.787 6.428) 9.065 13.085 ( 2.006 -3.722 4.813) 6.406 13.118 ( -6.262 -10.096 8.119) 14.389 13.874 ( -2.228 0.983 -13.423) 13.642 14.067 ( 11.396 -1.116 7.877) 13.898 15.061 ( 11.801 -4.516 4.662) 13.468 17.207 ( -11.043 -1.012 -28.245) 30.344 19.086 ( 5.900 -0.792 8.480) 10.361 19.615 ( 12.942 2.460 -3.998) 13.767 19.800 ( 9.677 -1.002 11.345) 14.945 21.541 ( 4.963 3.960 -19.773) 20.767 22.104 ( -16.808 -5.957 9.725) 20.312 24.251 ( 6.672 -0.033 1.652) 6.873 24.454 ( -2.109 1.548 5.130) 5.758 ======================= Grid point 163 (69/432) ======================= q-point: (-0.55 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -8.065 11.704 -10.041) 17.402 2.239 ( -13.353 8.468 -5.479) 16.734 2.919 ( -8.218 -3.662 0.885) 9.041 3.046 ( -9.189 -2.603 4.622) 10.610 3.141 ( -4.215 -9.271 -4.494) 11.131 3.657 ( 2.033 8.982 2.723) 9.604 3.988 ( -8.322 10.070 2.157) 13.240 4.330 ( -1.900 -1.507 -5.583) 6.087 4.501 ( 0.763 -4.929 -5.529) 7.446 4.729 ( 1.989 -15.580 -0.837) 15.729 5.007 ( -1.688 -1.175 -4.312) 4.777 5.704 ( -7.832 1.479 -3.100) 8.552 6.092 ( -1.217 4.412 2.498) 5.214 6.333 ( -33.599 -6.710 14.839) 37.338 7.491 ( -7.438 0.128 17.783) 19.276 8.274 ( -5.572 -1.300 -7.167) 9.171 8.344 ( 3.128 -9.503 7.597) 12.561 9.106 ( -4.884 -1.364 1.910) 5.419 9.385 ( -9.672 -10.322 -5.808) 15.292 10.410 ( -1.655 8.097 -6.984) 10.820 11.891 ( 12.718 1.431 3.225) 13.199 12.230 ( 8.145 29.483 -0.055) 30.588 12.637 ( -6.296 4.100 3.965) 8.496 13.012 ( -9.287 6.209 3.661) 11.756 13.330 ( 4.259 -14.663 2.368) 15.451 13.711 ( -2.734 -3.273 -9.181) 10.123 14.373 ( 15.002 0.655 12.215) 19.358 15.323 ( 13.217 -9.837 1.066) 16.511 16.767 ( -9.972 -0.822 -25.585) 27.472 19.314 ( 12.650 0.175 8.174) 15.062 19.721 ( 10.737 2.344 -0.872) 11.025 20.081 ( 12.816 1.227 10.886) 16.860 21.334 ( 2.060 3.761 -18.590) 19.078 21.999 ( -23.354 -9.356 6.914) 26.091 24.339 ( 4.640 0.648 0.833) 4.759 24.479 ( -0.654 1.948 5.656) 6.018 ======================= Grid point 164 (70/432) ======================= q-point: (-0.45 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( -10.700 16.107 -6.048) 20.261 1.906 ( -11.860 16.280 -3.324) 20.414 2.931 ( -6.718 -6.237 6.840) 11.438 2.967 ( -10.275 0.423 0.988) 10.331 3.097 ( -5.262 -12.348 -4.068) 14.026 3.506 ( 2.104 23.425 -0.921) 23.537 3.990 ( -1.923 -2.476 6.264) 7.005 4.213 ( -4.867 -4.543 -6.596) 9.372 4.556 ( 2.005 -5.600 0.784) 6.000 4.853 ( 0.885 -13.344 -2.182) 13.550 4.965 ( -0.498 -4.028 -3.268) 5.210 5.605 ( -4.639 0.483 1.471) 4.890 5.981 ( -25.312 -2.124 10.630) 27.535 6.186 ( -9.436 -1.183 4.905) 10.700 7.531 ( -10.354 3.100 12.190) 16.291 8.196 ( 1.290 -4.645 -6.149) 7.813 8.546 ( 1.179 -12.495 6.675) 14.215 9.072 ( -3.436 -2.918 -0.070) 4.508 9.325 ( -9.092 -14.307 -2.915) 17.200 10.286 ( 1.359 6.719 -2.940) 7.459 11.995 ( 6.182 9.519 1.770) 11.487 12.058 ( 5.786 33.447 -0.614) 33.949 12.565 ( -6.023 -0.701 1.698) 6.297 12.868 ( -8.407 8.713 3.617) 12.636 13.455 ( 5.342 -1.598 -4.228) 6.998 13.709 ( -1.117 -15.566 -0.499) 15.614 14.681 ( 12.479 1.526 9.830) 15.959 15.581 ( 11.972 -14.145 -3.670) 18.892 16.407 ( -7.208 1.281 -14.987) 16.679 19.559 ( 17.844 2.561 -0.302) 18.030 19.848 ( 7.345 1.085 4.612) 8.741 20.324 ( 10.328 6.853 8.607) 15.091 21.136 ( 2.431 0.792 -16.102) 16.303 21.810 ( -29.050 -11.769 5.930) 31.899 24.375 ( 2.631 2.201 -0.486) 3.464 24.536 ( 0.334 -0.082 5.524) 5.534 ======================= Grid point 165 (71/432) ======================= q-point: (-0.36 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( -7.397 20.913 3.981) 22.537 1.627 ( -5.370 20.822 2.817) 21.687 2.726 ( -9.665 20.082 0.838) 22.303 2.974 ( -6.044 -10.173 1.799) 11.969 3.205 ( -1.226 -15.717 6.465) 17.038 3.392 ( 3.607 14.364 1.330) 14.870 3.956 ( -2.437 -0.279 -7.339) 7.738 4.218 ( -2.141 -8.292 3.982) 9.444 4.642 ( 0.852 -7.043 0.543) 7.115 4.949 ( 1.810 -9.577 -1.085) 9.806 4.995 ( 1.218 -6.100 1.915) 6.509 5.595 ( -4.484 -0.950 6.145) 7.666 5.793 ( -28.021 -5.759 15.263) 32.424 6.155 ( -0.772 2.323 0.561) 2.511 7.461 ( -10.940 5.358 8.025) 14.587 8.219 ( 3.841 -5.982 -5.651) 9.081 8.740 ( -0.501 -15.327 6.264) 16.565 9.071 ( 0.198 -4.644 -3.042) 5.555 9.311 ( -7.673 -16.104 -0.702) 17.852 10.255 ( 2.315 4.318 -0.296) 4.908 11.778 ( 1.550 38.110 -3.129) 38.270 11.990 ( 3.099 11.113 3.403) 12.028 12.534 ( -3.630 -2.136 0.866) 4.300 12.737 ( -5.285 10.770 3.814) 12.589 13.480 ( 4.296 1.433 -0.344) 4.542 13.835 ( 0.350 -16.995 -4.273) 17.528 14.816 ( 4.415 2.990 -6.771) 8.619 15.762 ( 8.107 -14.720 -10.322) 19.722 16.339 ( 1.713 -1.840 15.769) 15.968 19.718 ( 17.106 2.223 -8.530) 19.243 19.957 ( 2.725 1.794 1.331) 3.524 20.378 ( 0.258 11.640 2.689) 11.950 21.065 ( 7.542 -1.452 -9.283) 12.049 21.611 ( -26.612 -12.011 9.377) 30.665 24.373 ( 1.815 2.622 -0.967) 3.333 24.583 ( -1.872 -1.462 1.660) 2.898 ======================= Grid point 166 (72/432) ======================= q-point: (-0.27 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( 6.808 19.471 13.977) 24.917 1.494 ( 2.152 22.727 10.540) 25.144 2.471 ( -3.564 27.164 8.341) 28.638 3.013 ( -1.679 -8.398 0.356) 8.571 3.349 ( -0.039 5.171 3.019) 5.988 3.416 ( -1.710 -11.631 9.861) 15.344 3.853 ( 0.328 -4.135 -9.944) 10.775 4.316 ( 1.652 -5.662 2.709) 6.491 4.688 ( -1.433 -7.611 -2.805) 8.237 5.012 ( 3.629 -1.798 0.015) 4.050 5.191 ( 3.918 -12.471 9.156) 15.959 5.624 ( -13.156 -4.181 16.056) 21.174 5.731 ( -10.539 -3.142 13.061) 17.075 6.123 ( -1.242 3.256 -0.084) 3.485 7.366 ( -8.525 4.891 6.325) 11.688 8.226 ( 0.083 -3.856 -6.839) 7.851 8.932 ( 0.023 -16.268 4.443) 16.864 9.056 ( -0.194 -7.514 -7.479) 10.603 9.442 ( 2.925 -18.297 4.240) 19.008 10.224 ( -0.696 7.204 0.180) 7.239 11.409 ( -0.815 37.818 -5.102) 38.170 11.999 ( 2.672 9.763 7.249) 12.450 12.501 ( -3.323 0.567 -0.586) 3.422 12.635 ( -1.792 11.607 2.970) 12.114 13.546 ( 3.943 2.094 4.548) 6.373 13.850 ( -0.603 -9.691 -14.827) 17.723 14.608 ( -3.931 8.186 -15.369) 17.851 15.818 ( 2.142 -12.999 -12.166) 17.933 16.847 ( 10.266 -18.387 39.191) 44.490 19.734 ( 1.179 -0.999 -16.029) 16.103 19.904 ( 0.205 3.776 -2.083) 4.318 20.255 ( -5.151 7.780 -3.684) 10.031 21.085 ( 4.197 1.277 -1.093) 4.521 21.596 ( -5.052 -6.837 10.712) 13.676 24.363 ( 1.304 2.135 -0.864) 2.647 24.512 ( -6.644 1.523 -5.308) 8.640 ======================= Grid point 167 (73/432) ======================= q-point: (-0.18 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( 9.675 21.826 10.930) 26.258 1.614 ( 12.632 15.428 15.927) 25.520 2.455 ( 8.483 22.615 23.162) 33.465 3.073 ( 2.042 -6.840 -1.840) 7.372 3.327 ( -4.837 3.364 6.171) 8.532 3.599 ( -2.077 -11.178 8.673) 14.300 3.815 ( 3.192 -7.319 -9.800) 12.641 4.405 ( 4.801 -1.598 -0.759) 5.117 4.672 ( -2.650 -6.177 -4.743) 8.226 5.074 ( 1.744 -0.338 1.057) 2.067 5.427 ( 3.073 -9.006 4.775) 10.647 5.737 ( -11.313 -8.914 23.605) 27.652 5.871 ( 4.104 -3.100 14.417) 15.307 6.071 ( -3.976 2.021 2.978) 5.363 7.301 ( -6.260 2.341 4.105) 7.843 8.104 ( -4.876 3.494 -9.143) 10.935 9.040 ( 6.657 -5.453 -7.470) 11.395 9.149 ( -1.452 -22.709 2.879) 22.936 9.743 ( 7.871 -18.441 5.551) 20.805 10.125 ( -2.885 14.269 4.170) 15.144 11.039 ( -0.371 33.253 -4.292) 33.531 12.042 ( 1.475 6.695 6.076) 9.161 12.408 ( -3.637 4.621 -3.967) 7.093 12.564 ( 1.258 10.056 1.338) 10.222 13.636 ( -4.097 2.315 -6.026) 7.646 13.649 ( 7.811 7.832 -5.760) 12.471 14.370 ( -5.954 2.347 -5.884) 8.694 15.753 ( -3.890 -11.284 -15.293) 19.399 17.648 ( 6.401 -31.155 38.990) 50.317 19.437 ( -13.649 -0.787 -15.661) 20.789 19.881 ( -1.156 2.813 -1.071) 3.224 20.030 ( -11.233 3.006 -7.413) 13.790 21.163 ( 10.665 2.781 0.867) 11.056 21.771 ( 10.465 -1.306 5.058) 11.696 24.269 ( -7.925 8.508 -8.295) 14.283 24.364 ( 0.364 1.205 -0.483) 1.348 ======================= Grid point 168 (74/432) ======================= q-point: (-0.09 0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 12.768 18.824 10.544) 25.071 1.833 ( 10.263 15.074 19.257) 26.522 2.802 ( 18.441 8.406 23.381) 30.942 3.134 ( 2.987 -6.307 -3.080) 7.628 3.327 ( -4.192 2.127 10.419) 11.430 3.718 ( -2.342 -11.806 -1.098) 12.086 3.837 ( 4.839 -4.905 -4.392) 8.171 4.435 ( 4.880 2.050 -5.200) 7.420 4.644 ( -1.429 -3.742 -1.769) 4.378 5.059 ( -2.528 3.818 0.019) 4.579 5.521 ( -1.106 -4.616 1.038) 4.859 5.884 ( -7.679 -0.359 6.829) 10.283 6.059 ( -3.036 -5.535 20.778) 21.715 6.282 ( 7.653 -11.270 18.174) 22.713 7.223 ( -7.215 0.547 -2.053) 7.521 7.881 ( -4.122 11.129 -5.549) 13.101 9.116 ( 3.583 -9.108 -3.237) 10.309 9.370 ( 4.943 -20.254 0.044) 20.849 9.950 ( -3.327 6.446 7.409) 10.369 10.084 ( 3.275 1.578 6.275) 7.252 10.800 ( 4.084 17.190 -2.051) 17.787 12.034 ( 2.047 8.132 -0.356) 8.393 12.269 ( -1.554 3.054 -6.178) 7.065 12.537 ( 3.180 6.313 0.967) 7.134 13.397 ( 1.641 13.152 -8.983) 16.012 13.760 ( 4.792 5.336 9.333) 11.770 14.242 ( -7.035 -2.666 -3.463) 8.281 15.567 ( -8.446 -8.537 -17.265) 21.031 18.304 ( -3.639 -27.340 26.602) 38.319 19.129 ( -7.251 -1.496 -12.821) 14.805 19.728 ( -6.771 4.374 -11.245) 13.836 19.809 ( -17.181 1.279 5.380) 18.049 21.323 ( 15.503 -1.521 -3.064) 15.876 21.966 ( 15.191 3.191 -0.343) 15.526 24.020 ( -3.617 10.669 -4.954) 12.306 24.366 ( 0.015 -0.132 0.664) 0.678 ======================= Grid point 173 (75/432) ======================= q-point: ( 0.36 -0.64 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( -7.693 0.000 -10.307) 12.861 2.321 ( -10.657 0.000 -3.535) 11.228 2.923 ( -10.431 0.000 -2.231) 10.667 2.955 ( -10.650 0.000 -1.327) 10.732 3.086 ( -3.456 0.000 2.745) 4.413 3.699 ( 4.775 -0.000 7.386) 8.795 4.178 ( -6.850 0.000 0.338) 6.858 4.299 ( -6.553 0.000 -13.303) 14.829 4.442 ( 3.654 -0.000 -2.340) 4.339 4.557 ( 2.099 -0.000 1.657) 2.674 4.996 ( -2.431 0.000 -5.201) 5.741 5.717 ( -8.389 0.000 -3.381) 9.044 6.147 ( 1.606 -0.000 1.739) 2.367 6.257 ( -36.590 0.000 15.843) 39.872 7.493 ( -5.652 0.000 17.557) 18.444 8.258 ( -6.607 0.000 -8.760) 10.972 8.264 ( 2.610 -0.000 9.206) 9.569 9.103 ( -3.834 0.000 3.304) 5.061 9.291 ( -10.467 0.000 -7.416) 12.828 10.480 ( -3.230 0.000 -7.958) 8.589 11.902 ( 14.283 -0.000 4.964) 15.121 12.465 ( 2.952 -0.000 -3.554) 4.620 12.815 ( 3.689 -0.000 4.844) 6.089 13.056 ( -9.683 0.000 7.894) 12.493 13.083 ( -1.879 0.000 2.611) 3.217 13.693 ( -2.068 0.000 -12.080) 12.256 14.377 ( 15.775 -0.000 12.216) 19.952 15.235 ( 13.075 -0.000 0.093) 13.076 16.761 ( -10.401 0.000 -23.732) 25.911 19.316 ( 13.534 -0.000 8.615) 16.043 19.743 ( 10.492 -0.000 -2.126) 10.705 20.089 ( 13.949 -0.000 11.934) 18.357 21.372 ( 2.205 -0.000 -20.626) 20.744 21.914 ( -23.315 0.000 7.568) 24.513 24.344 ( 4.671 -0.000 1.497) 4.905 24.496 ( -1.103 0.000 4.750) 4.876 ======================= Grid point 175 (76/432) ======================= q-point: (-0.55 0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( -7.450 8.045 -4.829) 11.981 2.121 ( -9.593 7.464 -2.181) 12.349 2.805 ( -7.563 -3.015 1.826) 8.344 2.872 ( -7.487 -9.395 0.956) 12.052 3.025 ( -6.568 0.457 -0.765) 6.629 3.833 ( 5.428 8.833 4.474) 11.292 4.001 ( -4.121 7.916 -0.782) 8.958 4.145 ( -4.895 -5.024 -8.458) 10.988 4.486 ( 2.016 -2.325 0.998) 3.235 4.644 ( -0.585 -9.351 2.112) 9.604 4.912 ( -0.960 -1.819 -4.690) 5.122 5.609 ( -5.868 0.092 1.031) 5.959 5.950 ( -34.511 -1.121 14.093) 37.295 6.177 ( 0.730 -0.169 0.272) 0.797 7.580 ( -6.585 1.979 12.369) 14.151 8.125 ( -1.424 -2.730 -6.778) 7.444 8.400 ( 0.503 -4.618 7.432) 8.764 9.067 ( -3.830 1.907 0.180) 4.282 9.146 ( -6.967 -7.123 -2.812) 10.353 10.364 ( -0.922 2.377 -4.865) 5.492 12.087 ( 8.409 3.040 2.919) 9.405 12.427 ( 0.625 3.437 -2.213) 4.136 12.749 ( -0.140 26.348 3.119) 26.533 12.969 ( -9.061 3.078 3.994) 10.370 13.251 ( 2.261 -21.952 2.020) 22.160 13.568 ( -0.641 -1.385 -7.239) 7.398 14.698 ( 12.035 0.538 10.041) 15.683 15.402 ( 12.018 -6.009 -4.573) 14.193 16.423 ( -7.229 0.514 -13.227) 15.082 19.588 ( 18.830 0.887 -0.483) 18.857 19.861 ( 7.021 0.438 3.792) 7.992 20.405 ( 13.545 2.501 11.234) 17.774 21.155 ( 1.122 0.959 -19.082) 19.139 21.667 ( -27.805 -4.738 5.706) 28.778 24.402 ( 2.473 0.879 0.793) 2.742 24.533 ( -0.519 -0.196 3.575) 3.617 ======================= Grid point 176 (77/432) ======================= q-point: (-0.45 0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( -4.940 17.014 4.537) 18.288 1.929 ( -4.172 13.853 1.967) 14.600 2.789 ( -5.939 -8.568 0.844) 10.460 2.882 ( -5.588 -5.280 -4.096) 8.711 2.986 ( -1.942 -4.845 10.626) 11.839 3.718 ( 3.639 19.947 -3.400) 20.560 3.958 ( -4.238 1.242 -6.596) 7.938 4.104 ( -0.228 -4.874 5.966) 7.707 4.545 ( -0.109 -4.078 1.553) 4.365 4.730 ( -0.300 -14.116 -1.024) 14.156 4.930 ( 2.093 -2.656 2.398) 4.146 5.580 ( -4.618 -0.751 4.824) 6.720 5.716 ( -26.910 -3.351 14.408) 30.708 6.183 ( 1.085 1.018 -0.769) 1.675 7.558 ( -8.390 5.504 7.342) 12.433 8.110 ( 2.964 -5.903 -5.338) 8.492 8.523 ( -2.687 -9.761 6.396) 11.975 9.033 ( 0.103 -1.041 -0.195) 1.064 9.107 ( -5.416 -7.686 -1.278) 9.489 10.314 ( 1.626 2.488 -1.374) 3.274 12.136 ( 2.787 8.070 1.723) 8.710 12.373 ( 4.303 17.956 -2.446) 18.626 12.530 ( -5.285 14.051 1.040) 15.048 12.881 ( -6.299 5.939 5.221) 10.110 13.465 ( 5.279 -13.890 -1.058) 14.897 13.541 ( -1.261 -7.794 -2.088) 8.167 14.852 ( 3.214 1.492 -1.660) 3.913 15.537 ( 8.846 -10.780 -9.080) 16.640 16.327 ( 0.451 -0.099 7.770) 7.784 19.743 ( 16.079 0.942 -11.130) 19.578 19.982 ( 3.004 1.061 3.000) 4.377 20.551 ( 0.961 8.175 0.406) 8.241 21.046 ( 8.950 -0.644 -7.427) 11.648 21.442 ( -23.438 -7.783 9.077) 26.312 24.414 ( 0.987 2.014 -0.245) 2.257 24.557 ( -1.593 -1.452 1.117) 2.428 ======================= Grid point 177 (78/432) ======================= q-point: (-0.36 0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( 3.455 17.414 9.013) 19.910 1.852 ( 2.718 19.260 11.100) 22.395 2.741 ( -2.514 3.134 -1.492) 4.286 2.876 ( -1.216 -6.494 2.778) 7.167 3.182 ( -0.161 -11.098 10.822) 15.502 3.588 ( 2.217 18.114 1.793) 18.337 3.792 ( -4.365 -1.899 -9.911) 10.995 4.238 ( 4.177 -3.454 5.371) 7.631 4.572 ( -1.904 -5.840 -1.500) 6.323 4.886 ( 1.993 -15.720 2.470) 16.037 5.037 ( 3.043 -2.441 7.009) 8.021 5.577 ( -11.772 -1.511 13.059) 17.646 5.672 ( -6.605 -3.914 10.909) 13.340 6.167 ( -0.130 1.957 -1.185) 2.291 7.460 ( -8.561 5.937 4.729) 11.442 8.141 ( 3.093 -5.180 -6.080) 8.565 8.645 ( -4.908 -15.593 5.379) 17.209 9.011 ( -0.148 -0.095 -4.586) 4.590 9.189 ( 3.591 -11.511 4.591) 12.902 10.318 ( 2.277 4.105 1.569) 4.950 12.026 ( 0.068 29.484 -4.016) 29.757 12.176 ( -0.072 16.253 2.795) 16.492 12.468 ( -2.555 -3.189 -1.354) 4.305 12.820 ( -3.070 9.025 5.849) 11.184 13.577 ( 0.853 -1.855 3.470) 4.026 13.616 ( 3.344 -14.305 -6.161) 15.931 14.718 ( -5.303 4.854 -11.990) 13.980 15.596 ( 3.785 -12.526 -12.809) 18.311 16.634 ( 8.227 -7.935 28.168) 30.399 19.719 ( 2.647 -0.720 -18.826) 19.025 19.955 ( -2.469 2.314 -0.748) 3.466 20.369 ( -6.886 5.399 -10.762) 13.870 21.133 ( 5.499 4.403 5.032) 8.657 21.479 ( 0.223 -7.235 11.816) 13.857 24.398 ( 0.382 1.952 -0.839) 2.158 24.518 ( -4.452 -0.393 -3.145) 5.465 ======================= Grid point 178 (79/432) ======================= q-point: (-0.27 0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 12.203 14.537 9.721) 21.325 1.903 ( 7.658 19.977 13.108) 25.091 2.731 ( 3.839 7.365 8.190) 11.664 2.961 ( 1.659 -5.745 1.321) 6.124 3.364 ( -0.564 -7.679 5.203) 9.293 3.517 ( -3.818 11.794 11.383) 16.830 3.693 ( 2.910 -6.748 -10.962) 13.198 4.379 ( 5.783 -1.529 2.896) 6.646 4.572 ( -1.268 -5.413 -2.330) 6.028 5.036 ( 2.217 -7.008 1.266) 7.459 5.226 ( 0.718 -10.834 9.970) 14.741 5.647 ( -5.010 -2.508 16.198) 17.140 5.810 ( 1.698 -4.219 13.371) 14.123 6.117 ( -2.676 2.700 -0.807) 3.886 7.353 ( -8.094 3.599 2.758) 9.278 8.116 ( 0.496 -0.931 -7.526) 7.599 8.779 ( -5.029 -20.222 2.636) 21.004 8.984 ( 4.027 -1.589 -3.821) 5.774 9.455 ( 8.737 -14.707 6.761) 18.394 10.327 ( 1.349 9.449 5.577) 11.055 11.652 ( -1.534 38.030 -5.480) 38.453 12.125 ( -4.075 4.192 4.018) 7.094 12.426 ( -0.557 -1.011 -5.834) 5.947 12.773 ( -0.433 12.197 5.142) 13.243 13.579 ( -3.255 -9.691 -8.994) 13.616 13.731 ( 7.584 3.475 5.757) 10.136 14.442 ( -8.594 5.241 -9.857) 14.088 15.551 ( -1.822 -12.332 -15.984) 20.270 17.237 ( 9.023 -18.100 34.999) 40.423 19.421 ( -11.270 -0.990 -18.965) 22.083 19.922 ( -1.707 2.085 0.834) 2.820 20.077 ( -9.809 2.461 -14.334) 17.542 21.240 ( 8.449 6.011 4.931) 11.482 21.730 ( 10.701 -3.468 8.944) 14.372 24.365 ( -3.498 3.323 -4.955) 6.916 24.385 ( -2.824 1.384 -2.651) 4.113 ======================= Grid point 179 (80/432) ======================= q-point: (-0.18 0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( 11.580 21.101 7.756) 25.288 2.055 ( 12.989 11.177 14.070) 22.173 2.895 ( 6.707 0.933 10.892) 12.825 3.031 ( 1.549 -5.453 -1.155) 5.785 3.420 ( 0.538 6.454 11.065) 12.821 3.526 ( -4.069 -7.892 -2.116) 9.128 3.761 ( 9.315 -3.284 -0.132) 9.878 4.446 ( 0.520 -1.046 -0.334) 1.215 4.603 ( 4.381 -0.914 -0.506) 4.504 5.092 ( -0.663 -0.781 1.115) 1.514 5.391 ( -3.177 -10.290 4.631) 11.723 5.834 ( -3.346 -4.258 16.826) 17.676 6.012 ( -0.762 -0.275 4.905) 4.972 6.145 ( 5.861 -5.943 15.726) 17.804 7.237 ( -8.596 1.271 -0.949) 8.741 8.010 ( -0.365 4.734 -7.072) 8.518 8.893 ( -3.344 -18.391 -1.604) 18.761 9.094 ( 8.172 -9.714 0.693) 12.713 9.772 ( 7.609 -14.603 6.070) 17.550 10.319 ( -0.654 15.463 10.405) 18.649 11.267 ( -0.720 34.454 -4.314) 34.730 12.053 ( -9.879 -1.995 0.496) 10.091 12.350 ( 4.179 3.407 -9.131) 10.604 12.715 ( 1.750 13.469 2.479) 13.806 13.490 ( -0.953 -2.194 -8.487) 8.817 13.873 ( 7.099 7.105 9.537) 13.850 14.217 ( -9.537 0.077 -4.818) 10.685 15.401 ( -6.243 -10.888 -17.680) 21.682 17.883 ( 4.078 -21.668 30.768) 37.852 19.102 ( -7.907 -1.604 -14.446) 16.546 19.765 ( -9.888 0.566 -14.978) 17.957 19.858 ( -8.615 3.885 3.521) 10.085 21.350 ( 11.618 4.262 -1.472) 12.463 21.990 ( 12.659 -0.177 6.247) 14.118 24.172 ( -3.952 7.266 -6.600) 10.582 24.362 ( -0.897 -0.361 -0.426) 1.057 ======================= Grid point 180 (81/432) ======================= q-point: (-0.09 0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( 11.386 16.096 6.751) 20.840 2.306 ( 11.049 12.657 18.269) 24.820 3.023 ( -3.159 -6.204 2.720) 7.474 3.085 ( 3.175 -6.211 -3.484) 7.797 3.492 ( -4.039 -12.424 -8.509) 15.591 3.603 ( 10.284 5.339 14.594) 18.635 3.927 ( 14.204 2.436 0.849) 14.436 4.433 ( -2.252 0.545 -0.182) 2.324 4.666 ( 4.064 2.049 2.345) 5.120 5.061 ( -1.861 3.798 -1.077) 4.365 5.422 ( -6.527 -7.639 -0.437) 10.057 5.834 ( -7.753 1.410 2.211) 8.184 6.228 ( -2.290 -7.953 25.051) 26.382 6.509 ( 8.232 -7.501 15.662) 19.218 7.067 ( -9.575 1.738 -5.724) 11.290 7.906 ( 0.790 7.721 -0.917) 7.815 8.961 ( -4.399 -14.567 -2.605) 15.438 9.361 ( 12.233 -16.511 2.634) 20.718 9.961 ( -1.994 -1.706 2.527) 3.643 10.289 ( -1.389 12.245 10.523) 16.205 11.010 ( 4.527 23.413 -0.464) 23.851 11.920 ( -11.589 -7.624 -4.900) 14.712 12.303 ( 9.948 5.667 -6.994) 13.416 12.665 ( 3.643 10.363 0.619) 11.002 13.419 ( 0.359 3.967 -2.453) 4.678 13.982 ( 1.402 4.449 3.482) 5.821 14.093 ( -4.078 -0.112 3.112) 5.131 15.188 ( -8.237 -8.333 -16.364) 20.127 18.324 ( -4.548 -14.389 16.579) 22.418 18.964 ( 4.749 -4.657 -8.343) 10.669 19.478 ( -9.186 -0.863 -13.343) 16.222 19.708 ( -14.752 6.772 5.767) 17.226 21.443 ( 12.355 -0.418 -7.012) 14.213 22.194 ( 10.539 3.831 4.933) 12.250 24.028 ( 0.754 7.087 -3.778) 8.066 24.354 ( -1.737 -1.831 0.425) 2.560 ======================= Grid point 186 (82/432) ======================= q-point: ( 0.45 -0.55 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( -1.911 0.000 6.692) 6.959 2.038 ( -5.735 0.000 0.111) 5.736 2.716 ( -5.475 0.000 2.086) 5.859 2.762 ( -4.722 0.000 -0.857) 4.799 2.981 ( -2.898 0.000 5.826) 6.507 3.882 ( -0.230 0.000 -14.996) 14.998 4.040 ( -2.292 0.000 -0.119) 2.295 4.042 ( 4.394 -0.000 9.291) 10.278 4.515 ( -0.100 0.000 3.410) 3.412 4.567 ( -3.609 0.000 -3.058) 4.730 4.907 ( 2.532 -0.000 3.762) 4.535 5.573 ( -4.053 0.000 4.055) 5.733 5.687 ( -27.279 0.000 14.260) 30.781 6.191 ( 1.552 -0.000 -1.077) 1.889 7.613 ( -7.121 0.000 6.934) 9.939 8.053 ( 1.855 -0.000 -3.808) 4.236 8.437 ( -2.823 0.000 4.997) 5.739 9.013 ( -2.853 0.000 0.129) 2.856 9.057 ( -1.865 0.000 -0.599) 1.958 10.335 ( 1.290 -0.000 -1.777) 2.196 12.217 ( 3.388 -0.000 3.146) 4.624 12.392 ( -1.010 0.000 -1.944) 2.191 12.915 ( -6.216 0.000 2.142) 6.575 12.994 ( 2.217 -0.000 1.130) 2.489 13.088 ( -2.136 0.000 -0.348) 2.164 13.529 ( 2.870 -0.000 -1.114) 3.079 14.866 ( 2.658 -0.000 0.192) 2.665 15.439 ( 9.255 -0.000 -9.124) 12.997 16.327 ( 0.214 -0.000 5.595) 5.600 19.751 ( 15.804 -0.000 -12.132) 19.924 19.991 ( 3.098 -0.000 3.543) 4.706 20.625 ( 1.399 -0.000 -1.440) 2.008 21.042 ( 10.356 -0.000 -5.592) 11.769 21.371 ( -23.655 0.000 9.042) 25.324 24.433 ( 0.594 -0.000 0.249) 0.644 24.543 ( -1.389 0.000 0.648) 1.533 ======================= Grid point 188 (83/432) ======================= q-point: (-0.45 0.45 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 1.069 9.259 3.393) 9.919 2.106 ( 2.564 8.999 15.074) 17.742 2.691 ( -1.896 -2.355 -0.557) 3.074 2.762 ( -0.608 -8.003 2.001) 8.272 3.074 ( 0.402 -2.127 10.112) 10.342 3.714 ( 0.434 -0.648 -13.982) 14.004 3.961 ( -1.758 15.466 2.625) 15.786 4.199 ( 5.087 -1.324 5.985) 7.966 4.502 ( -1.727 -2.300 -1.391) 3.195 4.608 ( -0.271 -13.610 2.315) 13.808 5.024 ( 3.189 -0.129 8.254) 8.849 5.569 ( -11.925 0.456 12.916) 17.585 5.610 ( -4.407 -2.961 8.727) 10.215 6.189 ( 0.364 0.609 -1.407) 1.576 7.545 ( -8.841 3.218 2.786) 9.812 8.079 ( 4.757 -1.801 -2.163) 5.527 8.445 ( -6.079 -6.960 2.465) 9.564 9.021 ( -1.076 0.726 -1.883) 2.287 9.058 ( 3.401 -4.044 4.457) 6.913 10.364 ( 3.684 1.344 1.905) 4.360 12.233 ( -1.732 5.536 2.787) 6.435 12.390 ( 1.114 -3.387 -2.133) 4.155 12.693 ( -2.501 30.050 -5.665) 30.681 12.930 ( -3.318 4.803 6.529) 8.758 13.238 ( -1.616 -25.061 -4.630) 25.536 13.613 ( 5.808 0.890 5.864) 8.301 14.775 ( -6.573 1.809 -8.555) 10.939 15.434 ( 4.995 -5.626 -13.004) 15.023 16.554 ( 7.616 -2.078 22.282) 23.639 19.710 ( 3.382 -0.272 -20.508) 20.786 19.982 ( -3.339 0.788 -0.279) 3.442 20.430 ( -7.900 1.814 -15.539) 17.526 21.229 ( 6.275 6.767 10.087) 13.672 21.353 ( 2.129 -7.524 12.310) 14.583 24.424 ( -0.620 0.977 -0.701) 1.353 24.508 ( -2.946 -0.538 -2.528) 3.919 ======================= Grid point 189 (84/432) ======================= q-point: (-0.36 0.45 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 9.661 9.231 6.121) 14.697 2.227 ( 5.407 16.955 14.813) 23.154 2.726 ( 2.192 -4.155 2.192) 5.184 2.874 ( 2.266 -5.979 3.102) 7.107 3.217 ( -0.233 -6.861 6.883) 9.721 3.596 ( 0.696 -4.142 -11.689) 12.421 3.839 ( 0.719 21.647 7.830) 23.030 4.345 ( 5.329 -3.035 3.026) 6.838 4.504 ( 0.648 -2.039 0.630) 2.231 4.787 ( 0.320 -18.496 3.517) 18.830 5.157 ( 1.413 -0.256 9.213) 9.324 5.628 ( -2.350 -0.072 13.713) 13.913 5.733 ( 1.137 -4.477 11.564) 12.453 6.153 ( -1.865 1.504 -1.729) 2.954 7.412 ( -9.706 3.018 0.742) 10.191 8.114 ( 3.969 1.673 -3.826) 5.761 8.475 ( -5.960 -15.376 1.400) 16.550 8.984 ( 0.913 1.105 -2.061) 2.510 9.261 ( 8.163 -8.234 7.718) 13.929 10.444 ( 4.918 4.587 6.107) 9.085 12.161 ( -6.197 6.514 2.315) 9.284 12.307 ( -3.662 32.063 -7.942) 33.234 12.398 ( 2.289 -1.904 -4.843) 5.685 12.935 ( -1.047 6.516 7.060) 9.664 13.325 ( -2.742 -19.689 -7.757) 21.339 13.780 ( 6.885 2.216 10.252) 12.547 14.519 ( -11.012 3.497 -9.991) 15.275 15.362 ( -0.133 -9.082 -16.328) 18.685 17.023 ( 10.244 -7.843 30.247) 32.884 19.406 ( -9.628 -0.686 -21.175) 23.271 19.950 ( -1.727 1.148 0.913) 2.266 20.108 ( -9.605 1.185 -17.701) 20.174 21.351 ( 6.643 6.601 7.719) 12.136 21.659 ( 11.018 -4.629 12.077) 16.991 24.392 ( -1.198 0.655 -1.401) 1.956 24.412 ( -4.139 1.246 -5.508) 7.001 ======================= Grid point 190 (85/432) ======================= q-point: (-0.27 0.45 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 14.889 7.346 10.221) 19.496 2.285 ( 7.804 19.428 7.534) 22.251 2.851 ( 3.356 -4.416 4.805) 7.338 2.950 ( -0.339 -4.621 -0.301) 4.643 3.318 ( -1.074 -9.169 -0.749) 9.262 3.549 ( 2.292 -1.873 -2.389) 3.804 3.847 ( 8.256 15.706 11.241) 21.005 4.408 ( -2.546 -2.905 1.695) 4.218 4.600 ( 8.922 -0.185 1.407) 9.034 4.965 ( -1.465 -14.741 3.056) 15.125 5.266 ( -2.214 -2.732 7.946) 8.690 5.790 ( 0.839 -0.717 14.748) 14.789 5.975 ( 6.362 -5.041 9.967) 12.855 6.094 ( -2.591 0.038 3.891) 4.675 7.263 ( -9.801 1.605 -0.981) 9.980 8.063 ( 0.410 2.396 -6.082) 6.550 8.579 ( -2.258 -17.126 1.272) 17.321 9.003 ( 4.343 -2.441 -0.852) 5.055 9.557 ( 9.581 -10.367 8.623) 16.542 10.536 ( 3.313 10.020 10.097) 14.606 11.881 ( -1.829 36.627 -7.197) 37.372 12.018 ( -14.167 -1.404 -1.776) 14.346 12.380 ( 5.363 0.690 -7.684) 9.396 12.931 ( 0.059 10.978 5.279) 12.181 13.343 ( -2.019 -14.608 -7.612) 16.596 13.972 ( 6.829 4.476 12.040) 14.547 14.239 ( -12.100 2.049 -7.076) 14.166 15.216 ( -4.362 -10.385 -18.146) 21.358 17.592 ( 8.568 -12.810 30.556) 34.222 19.078 ( -7.684 -1.171 -15.662) 17.484 19.769 ( -10.330 0.113 -17.193) 20.058 19.914 ( -4.655 2.427 1.721) 5.524 21.447 ( 8.936 6.633 0.425) 11.137 21.966 ( 10.282 -2.424 11.652) 15.728 24.267 ( -3.024 4.089 -6.835) 8.520 24.354 ( -1.836 -0.543 -1.552) 2.464 ======================= Grid point 191 (86/432) ======================= q-point: (-0.18 0.45 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.286 ( 7.604 16.648 2.647) 18.493 2.480 ( 13.103 8.045 14.365) 21.042 2.913 ( -4.460 -6.481 -0.279) 7.872 2.993 ( 3.507 -4.783 -2.525) 6.446 3.316 ( -2.681 -7.994 -5.991) 10.343 3.661 ( 9.165 0.150 5.186) 10.532 4.014 ( 13.882 8.996 8.848) 18.760 4.413 ( -5.523 -2.236 5.288) 7.967 4.715 ( 8.407 2.950 -0.021) 8.910 5.050 ( -2.994 -6.912 1.219) 7.630 5.300 ( -6.649 -4.670 2.058) 8.382 5.862 ( -5.625 1.824 -0.038) 5.913 6.119 ( 0.794 -4.322 19.505) 19.994 6.380 ( 8.541 -8.019 16.703) 20.402 7.098 ( -9.546 1.888 -3.232) 10.254 7.983 ( -0.047 1.121 -4.144) 4.293 8.703 ( -1.086 -14.179 0.000) 14.221 9.138 ( 8.476 -9.760 1.199) 12.982 9.847 ( 7.589 -8.171 6.896) 13.111 10.552 ( -3.504 15.600 10.192) 18.961 11.498 ( 0.494 31.666 -5.808) 32.198 11.805 ( -15.333 -4.681 -4.843) 16.747 12.365 ( 7.948 2.042 -7.424) 11.066 12.868 ( 0.342 12.570 1.622) 12.679 13.366 ( -0.383 -9.866 -3.633) 10.521 14.010 ( -9.690 0.455 -4.374) 10.641 14.156 ( 4.828 5.316 11.785) 13.800 15.031 ( -5.905 -9.867 -16.410) 20.037 18.094 ( 3.198 -12.061 22.450) 25.685 18.903 ( 1.148 -2.646 -9.036) 9.485 19.456 ( -8.625 -1.346 -16.143) 18.352 19.816 ( -10.287 5.417 3.952) 12.279 21.485 ( 9.689 4.915 -6.421) 12.620 22.227 ( 7.869 0.289 11.231) 13.716 24.133 ( 0.237 5.252 -5.727) 7.774 24.320 ( -2.518 -2.065 -1.210) 3.473 ======================= Grid point 192 (87/432) ======================= q-point: (-0.09 0.45 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 5.552 9.187 -0.068) 10.734 2.675 ( -2.065 3.020 12.278) 12.812 2.947 ( 4.594 -3.261 0.880) 5.702 3.011 ( 0.416 -4.023 -4.094) 5.755 3.284 ( -1.361 -4.995 -4.291) 6.724 3.835 ( 13.223 0.745 -1.787) 13.364 4.223 ( 11.902 4.465 4.546) 13.501 4.405 ( -6.169 1.788 6.724) 9.298 4.779 ( 2.983 3.117 3.145) 5.338 5.041 ( -1.257 0.387 -1.862) 2.280 5.221 ( -9.587 -6.227 -4.289) 12.210 5.763 ( -6.226 -0.346 0.890) 6.299 6.409 ( -2.763 -5.154 19.869) 20.712 6.699 ( 2.308 -6.064 13.882) 15.324 6.929 ( -7.638 3.937 1.781) 8.776 7.980 ( 1.348 -0.017 3.698) 3.936 8.769 ( -2.182 -9.800 -2.789) 10.421 9.415 ( 11.952 -17.475 2.818) 21.358 9.969 ( -2.718 5.841 1.595) 6.637 10.430 ( -6.452 11.881 5.218) 14.492 11.279 ( 5.648 18.471 -1.854) 19.404 11.601 ( -12.314 -5.836 -6.091) 14.926 12.408 ( 10.140 1.002 -3.366) 10.731 12.795 ( 0.825 9.015 1.230) 9.136 13.403 ( -0.106 -5.097 -1.075) 5.210 13.862 ( -6.965 -0.656 -1.982) 7.272 14.273 ( 2.598 4.834 5.923) 8.074 14.889 ( -2.898 -5.907 -8.297) 10.589 18.300 ( -3.582 -3.575 1.123) 5.184 18.974 ( 10.992 -6.692 -2.143) 13.046 19.229 ( -5.162 -2.357 -8.066) 9.862 19.648 ( -14.037 8.088 5.886) 17.236 21.489 ( 9.904 1.005 -10.697) 14.612 22.412 ( 3.499 4.226 10.982) 12.276 24.066 ( 3.716 4.199 -3.464) 6.590 24.299 ( -3.030 -3.733 -0.167) 4.810 ======================= Grid point 199 (88/432) ======================= q-point: (-0.45 0.55 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( 8.027 -0.000 3.530) 8.769 2.398 ( 3.263 -0.000 19.529) 19.800 2.684 ( 2.949 -0.000 -0.242) 2.959 2.789 ( 4.332 -0.000 3.200) 5.386 3.159 ( -1.048 0.000 6.321) 6.407 3.560 ( 0.734 -0.000 -12.049) 12.072 4.110 ( 2.059 -0.000 8.166) 8.422 4.271 ( 4.586 -0.000 -1.171) 4.733 4.539 ( -1.028 0.000 1.282) 1.643 4.539 ( 2.273 0.000 6.040) 6.453 5.159 ( 1.171 -0.000 9.382) 9.455 5.634 ( -2.179 0.000 14.815) 14.974 5.685 ( 1.789 -0.000 9.228) 9.400 6.166 ( -1.588 0.000 -1.901) 2.477 7.440 ( -10.310 0.000 -0.531) 10.324 8.159 ( 8.034 -0.000 1.020) 8.099 8.310 ( -9.248 0.000 -2.044) 9.472 8.999 ( -0.044 0.000 -1.725) 1.725 9.188 ( 7.809 -0.000 8.319) 11.410 10.483 ( 6.233 -0.000 6.235) 8.816 12.200 ( -10.535 0.000 0.797) 10.565 12.377 ( 4.198 -0.000 -3.953) 5.767 12.761 ( 1.866 -0.000 -11.035) 11.192 12.934 ( -6.026 0.000 -0.554) 6.051 13.055 ( -1.379 0.000 4.096) 4.322 13.799 ( 6.724 -0.000 11.055) 12.940 14.550 ( -12.210 0.000 -9.350) 15.379 15.280 ( 0.702 -0.000 -16.541) 16.556 16.959 ( 10.628 -0.000 28.315) 30.244 19.400 ( -9.023 0.000 -21.971) 23.752 19.960 ( -1.553 0.000 0.729) 1.715 20.118 ( -9.799 0.000 -18.587) 21.012 21.423 ( 5.078 -0.000 7.696) 9.221 21.605 ( 12.066 -0.000 14.206) 18.639 24.397 ( -2.057 0.000 -1.495) 2.543 24.422 ( -2.929 0.000 -5.221) 5.987 ======================= Grid point 201 (89/432) ======================= q-point: (-0.36 0.55 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( 13.614 2.673 7.181) 15.622 2.569 ( 3.814 13.019 11.115) 17.538 2.773 ( 3.911 -4.978 3.151) 7.072 2.876 ( 2.869 -3.336 -1.958) 4.816 3.198 ( -1.756 -4.314 1.499) 4.893 3.496 ( 5.410 -2.360 -6.131) 8.511 4.157 ( 4.736 17.849 10.503) 21.244 4.361 ( -0.336 -2.847 2.657) 3.908 4.553 ( 5.094 -7.651 -0.770) 9.224 4.723 ( 1.441 -8.352 8.430) 11.954 5.254 ( -1.630 0.085 7.579) 7.753 5.807 ( 3.676 2.672 13.511) 14.255 5.879 ( 5.987 -5.406 12.134) 14.571 6.105 ( -3.677 0.574 -1.032) 3.862 7.284 ( -10.377 0.741 -1.546) 10.518 8.114 ( -6.835 3.595 -4.509) 8.943 8.347 ( 6.141 -9.441 1.782) 11.403 8.986 ( 1.255 -0.096 -1.322) 1.825 9.435 ( 10.410 -3.804 10.279) 15.116 10.650 ( 6.321 3.469 9.937) 12.277 11.991 ( -17.034 -0.751 -5.312) 17.859 12.384 ( 5.851 0.053 -6.806) 8.975 12.476 ( 0.010 31.681 -7.961) 32.666 12.985 ( -2.668 -18.296 -0.512) 18.496 13.092 ( -1.849 -1.022 2.054) 2.946 14.023 ( 6.210 1.505 13.632) 15.055 14.268 ( -13.959 1.038 -7.860) 16.054 15.082 ( -3.074 -4.628 -18.586) 19.399 17.451 ( 10.623 -4.093 29.441) 31.565 19.064 ( -7.324 -0.435 -16.347) 17.918 19.771 ( -9.840 0.072 -19.178) 21.555 19.939 ( -3.614 0.714 1.720) 4.066 21.544 ( 8.378 3.784 0.284) 9.197 21.923 ( 8.273 -2.008 15.989) 18.114 24.315 ( -1.810 1.679 -6.728) 7.166 24.344 ( -2.853 -0.618 -2.321) 3.729 ======================= Grid point 202 (90/432) ======================= q-point: (-0.27 0.55 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( 5.290 8.066 4.351) 10.582 2.596 ( 7.495 6.936 5.800) 11.744 2.817 ( -1.781 -4.613 -3.261) 5.923 2.933 ( 4.408 -1.848 0.536) 4.809 3.225 ( 2.129 -3.039 -1.705) 4.084 3.617 ( 11.944 -4.140 0.163) 12.643 4.220 ( 7.658 14.575 9.300) 18.910 4.375 ( -6.118 -1.895 7.674) 9.995 4.719 ( 9.257 -5.882 -1.382) 11.054 4.873 ( -3.166 -8.557 6.988) 11.493 5.273 ( -4.596 0.053 2.607) 5.284 5.894 ( -2.995 1.986 -2.278) 4.255 6.086 ( 2.332 0.136 15.907) 16.078 6.243 ( 7.541 -7.824 16.369) 19.647 7.126 ( -9.276 1.284 -1.945) 9.565 7.956 ( -7.940 -3.162 -4.387) 9.606 8.531 ( 8.049 -6.013 1.398) 10.144 9.024 ( 4.144 -4.072 -0.393) 5.823 9.733 ( 10.744 -4.879 10.018) 15.479 10.769 ( 0.470 9.522 10.022) 13.832 11.673 ( -18.360 -3.784 -11.275) 21.876 12.116 ( -0.923 33.351 -4.319) 33.642 12.386 ( 7.019 0.760 -7.053) 9.980 13.052 ( -2.946 8.026 2.416) 8.885 13.107 ( -1.756 -20.074 -2.755) 20.338 14.019 ( -11.052 0.527 -4.604) 11.985 14.228 ( 4.067 2.862 12.463) 13.418 14.878 ( -3.760 -7.393 -16.455) 18.427 17.937 ( 7.654 -6.428 24.806) 26.744 18.872 ( -0.391 -1.181 -9.289) 9.372 19.438 ( -7.843 -0.703 -18.479) 20.087 19.883 ( -7.553 2.531 3.295) 8.620 21.582 ( 8.586 5.548 -6.322) 12.019 22.212 ( 4.899 -1.580 16.866) 17.634 24.204 ( 0.161 3.260 -6.642) 7.400 24.286 ( -3.027 -1.939 -2.768) 4.537 ======================= Grid point 203 (91/432) ======================= q-point: (-0.18 0.55 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.401 ( -2.878 4.801 -8.159) 9.895 2.629 ( -11.917 -5.784 1.405) 13.321 2.925 ( 8.714 0.011 2.555) 9.081 3.001 ( 7.034 2.435 3.841) 8.376 3.277 ( 7.315 3.037 -0.683) 7.949 3.822 ( 15.198 -2.402 -2.273) 15.553 4.284 ( 0.698 2.813 3.016) 4.183 4.438 ( -3.085 2.665 14.046) 14.625 4.814 ( 4.690 -0.624 -3.625) 5.960 4.944 ( -6.155 -8.009 4.204) 10.941 5.199 ( -4.059 1.641 -2.491) 5.037 5.765 ( -5.952 0.542 -4.009) 7.197 6.346 ( 1.566 -1.821 19.266) 19.415 6.585 ( 3.748 -7.414 15.147) 17.276 6.991 ( -6.904 3.111 2.899) 8.109 7.889 ( -6.060 -9.211 0.851) 11.058 8.669 ( 7.197 -2.024 -1.366) 7.600 9.172 ( 8.241 -11.106 1.128) 13.876 9.990 ( 7.522 -1.116 7.039) 10.362 10.683 ( -9.795 15.457 4.587) 18.865 11.345 ( -15.390 -6.608 -14.128) 21.912 11.834 ( 1.618 28.286 0.676) 28.341 12.416 ( 8.313 0.014 -4.311) 9.365 12.942 ( -5.560 7.815 1.132) 9.657 13.212 ( -1.302 -16.498 -2.401) 16.723 13.879 ( -4.474 1.749 -0.373) 4.818 14.312 ( -2.873 -0.166 0.972) 3.038 14.797 ( 2.816 -4.354 -2.864) 5.924 18.243 ( 1.126 -2.964 7.746) 8.370 18.880 ( 8.060 -4.245 -1.992) 9.325 19.193 ( -2.971 -1.685 -11.208) 11.717 19.767 ( -11.711 5.599 4.831) 13.850 21.546 ( 8.527 5.016 -11.244) 14.977 22.452 ( 0.994 0.723 17.323) 17.367 24.125 ( 1.817 2.707 -4.794) 5.797 24.239 ( -2.342 -3.158 -2.774) 4.811 ======================= Grid point 204 (92/432) ======================= q-point: (-0.09 -0.45 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -5.928 -4.305 -10.445) 12.758 2.506 ( -15.153 -11.429 -2.829) 19.189 2.974 ( 2.190 3.635 1.723) 4.580 3.157 ( 3.904 1.249 5.287) 6.689 3.357 ( 11.838 9.962 3.235) 15.807 3.977 ( 13.826 1.405 -6.771) 15.459 4.213 ( -10.701 -0.260 -1.893) 10.870 4.508 ( -5.961 1.793 7.234) 9.543 4.810 ( -0.926 -3.211 0.778) 3.432 4.935 ( -5.470 -5.198 -1.965) 7.797 5.138 ( 5.066 6.607 -2.446) 8.678 5.687 ( -4.077 -3.345 0.727) 5.324 6.424 ( -8.518 1.079 -1.756) 8.764 6.789 ( 1.036 -4.297 9.852) 10.798 7.055 ( -7.481 3.680 28.377) 29.576 7.977 ( -4.461 -13.878 8.869) 17.063 8.723 ( 7.118 2.389 -5.204) 9.135 9.441 ( 10.761 -17.555 1.664) 20.658 10.014 ( -5.823 14.076 0.634) 15.246 10.449 ( -9.013 10.033 -0.089) 13.487 11.095 ( -9.580 -11.863 -12.231) 19.548 11.697 ( 5.679 20.441 2.570) 21.371 12.500 ( 6.607 -1.324 -0.378) 6.749 12.830 ( -7.705 1.998 3.349) 8.636 13.300 ( 1.047 -11.885 -2.617) 12.215 13.852 ( 1.775 4.638 2.930) 5.766 14.209 ( -7.899 -5.243 -7.686) 12.205 14.935 ( 9.183 2.284 8.710) 12.861 18.168 ( -2.862 2.171 -16.751) 17.132 19.019 ( 9.374 -3.619 -4.300) 10.930 19.212 ( 5.372 -3.511 7.560) 9.916 19.606 ( -12.916 7.174 6.687) 16.217 21.484 ( 8.498 1.987 -13.723) 16.263 22.605 ( -4.149 5.145 17.064) 18.299 24.102 ( 2.219 0.171 -1.768) 2.842 24.221 ( -0.721 -4.064 -2.153) 4.655 ======================= Grid point 212 (93/432) ======================= q-point: (-0.36 0.64 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( 8.534 -0.000 9.212) 12.558 2.674 ( -7.353 0.000 -4.232) 8.484 2.772 ( 5.374 -0.000 -4.625) 7.090 2.926 ( 5.461 -0.000 5.406) 7.684 3.201 ( 5.882 -0.000 -0.111) 5.883 3.572 ( 12.905 -0.000 -1.100) 12.951 4.358 ( -6.232 0.000 7.670) 9.883 4.449 ( 2.879 -0.000 6.967) 7.539 4.531 ( 5.760 -0.000 3.389) 6.683 4.831 ( 3.443 -0.000 5.935) 6.861 5.276 ( -4.167 0.000 2.659) 4.943 5.916 ( -2.074 0.000 -5.178) 5.578 6.110 ( 5.150 -0.000 20.829) 21.457 6.149 ( 4.830 -0.000 12.048) 12.980 7.137 ( -9.142 0.000 -1.616) 9.284 7.922 ( -12.719 0.000 -3.857) 13.291 8.484 ( 13.167 -0.000 1.532) 13.256 8.991 ( 2.249 -0.000 -1.053) 2.484 9.692 ( 11.693 -0.000 11.139) 16.149 10.853 ( 2.903 -0.000 10.145) 10.553 11.635 ( -20.856 0.000 -11.270) 23.706 12.383 ( 7.173 -0.000 -8.073) 10.799 12.590 ( 4.230 -0.000 -12.393) 13.094 12.754 ( -7.474 0.000 3.484) 8.247 13.128 ( -4.231 0.000 4.543) 6.208 14.024 ( -11.288 0.000 -4.673) 12.217 14.251 ( 3.226 -0.000 12.422) 12.834 14.811 ( -2.665 0.000 -16.413) 16.628 17.882 ( 9.078 -0.000 25.328) 26.906 18.862 ( -0.775 0.000 -9.334) 9.366 19.432 ( -7.517 0.000 -19.360) 20.768 19.903 ( -6.679 0.000 3.155) 7.387 21.635 ( 8.774 -0.000 -6.957) 11.197 22.194 ( 3.268 -0.000 19.709) 19.978 24.240 ( 1.902 -0.000 -7.999) 8.222 24.260 ( -4.929 0.000 -2.311) 5.444 ======================= Grid point 214 (94/432) ======================= q-point: (-0.27 -0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.439 ( -9.989 0.560 -12.426) 15.953 2.546 ( -12.954 -3.072 -3.254) 13.705 2.941 ( 12.937 0.995 6.182) 14.372 3.052 ( 4.257 2.522 6.367) 8.064 3.333 ( 15.116 2.347 -1.062) 15.334 3.772 ( 16.834 -2.430 -1.791) 17.102 4.319 ( -7.128 1.251 4.068) 8.302 4.501 ( -3.731 4.332 10.843) 12.258 4.706 ( 2.856 -7.991 1.984) 8.715 4.898 ( -1.950 0.196 3.497) 4.009 5.224 ( -1.843 0.835 -1.603) 2.582 5.775 ( -5.551 0.427 -7.262) 9.150 6.361 ( 4.047 3.606 17.771) 18.579 6.457 ( 4.966 -7.276 16.390) 18.607 7.027 ( -6.394 1.155 3.418) 7.342 7.752 ( -12.165 -5.088 0.550) 13.198 8.668 ( 13.316 0.711 -1.024) 13.375 9.043 ( 5.109 -4.058 -0.262) 6.530 9.971 ( 10.904 -0.740 9.881) 14.734 10.897 ( -6.113 8.540 4.754) 11.529 11.228 ( -20.680 -5.678 -13.585) 25.386 12.331 ( 2.830 27.123 -6.376) 28.006 12.415 ( 6.698 0.599 -4.796) 8.260 12.868 ( -1.566 -22.076 0.198) 22.132 13.045 ( -11.948 2.991 2.230) 12.517 13.902 ( -2.555 0.778 0.118) 2.673 14.289 ( -6.462 -1.472 -4.800) 8.183 14.751 ( 6.641 -1.228 2.626) 7.246 18.207 ( 4.132 -1.148 11.652) 12.416 18.833 ( 5.950 -1.363 -2.804) 6.717 19.174 ( -1.604 -0.557 -12.947) 13.058 19.830 ( -10.015 1.844 4.479) 11.125 21.623 ( 8.230 3.026 -12.253) 15.067 22.449 ( -1.314 -0.475 22.261) 22.305 24.157 ( -3.610 1.056 -3.211) 4.946 24.200 ( 2.483 -1.389 -6.798) 7.369 ======================= Grid point 215 (95/432) ======================= q-point: (-0.18 -0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( -11.721 -3.671 -13.447) 18.212 2.332 ( -17.761 -8.232 -5.346) 20.293 3.070 ( 4.223 6.703 3.507) 8.664 3.178 ( 5.271 0.850 5.231) 7.475 3.510 ( 16.507 7.062 1.565) 18.022 3.982 ( 17.345 -0.776 -4.765) 18.004 4.222 ( -12.770 2.020 0.011) 12.928 4.468 ( -14.911 -6.373 2.560) 16.417 4.765 ( 4.062 -0.413 -1.411) 4.320 4.888 ( -8.216 -1.745 6.925) 10.886 5.226 ( 6.887 3.614 -1.370) 7.898 5.643 ( -4.415 -1.752 -3.651) 5.991 6.448 ( -6.331 1.927 -0.177) 6.620 6.720 ( 5.814 -3.852 10.951) 12.983 7.107 ( -6.412 2.315 27.322) 28.160 7.723 ( -9.815 -13.388 6.726) 17.911 8.782 ( 12.157 3.751 -4.849) 13.615 9.202 ( 8.854 -10.545 0.786) 13.792 10.165 ( 4.587 4.766 5.682) 8.721 10.638 ( -16.517 10.357 -4.624) 20.037 10.946 ( -11.001 -6.150 -8.569) 15.241 12.085 ( 3.192 24.262 -3.972) 24.791 12.478 ( 5.910 -1.182 -1.361) 6.179 12.855 ( -16.804 0.801 2.725) 17.043 13.048 ( 2.648 -17.264 1.046) 17.497 13.921 ( 3.826 3.081 3.186) 5.855 14.107 ( -9.206 -5.588 -10.651) 15.147 14.966 ( 10.894 1.249 11.407) 15.823 18.200 ( -0.843 1.478 -15.243) 15.338 18.958 ( 10.557 -3.055 -0.061) 10.990 19.170 ( 5.755 -1.500 5.437) 8.058 19.709 ( -12.599 4.515 5.493) 14.467 21.539 ( 7.707 3.629 -15.366) 17.570 22.661 ( -5.874 1.738 23.768) 24.545 24.078 ( -5.330 -2.298 -0.665) 5.843 24.184 ( 5.803 -0.587 -7.075) 9.169 ======================= Grid point 216 (96/432) ======================= q-point: (-0.09 -0.36 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -12.687 -9.226 -13.102) 20.438 2.125 ( -19.458 -14.459 -3.730) 24.527 3.084 ( 1.945 6.195 2.429) 6.933 3.249 ( 2.872 4.287 2.075) 5.562 3.656 ( 10.275 9.523 3.017) 14.331 3.845 ( -23.539 0.983 -13.606) 27.205 4.134 ( 6.554 -0.196 -4.225) 7.800 4.367 ( -9.750 -5.642 2.974) 11.651 4.848 ( -5.834 -1.504 9.875) 11.568 4.849 ( 4.806 0.316 -5.499) 7.310 5.279 ( 8.518 5.955 -1.028) 10.444 5.626 ( -0.932 -5.246 1.082) 5.437 6.238 ( -9.124 3.053 -11.213) 14.775 6.881 ( -3.436 1.610 10.658) 11.313 7.343 ( -11.807 3.521 36.761) 38.771 7.857 ( -7.700 -19.802 10.865) 23.864 8.836 ( 13.120 5.328 -7.201) 15.886 9.449 ( 9.712 -14.890 0.859) 17.798 10.050 ( -10.748 18.688 -0.321) 21.561 10.324 ( -11.536 1.600 -7.312) 13.751 10.845 ( -1.252 -4.097 -2.790) 5.113 11.930 ( 5.401 16.114 -3.325) 17.317 12.540 ( 1.874 -2.377 0.386) 3.052 12.694 ( -16.493 -5.625 5.436) 18.254 13.240 ( 5.418 -11.119 1.508) 12.461 13.932 ( -9.172 -7.742 -7.073) 13.932 14.004 ( 6.407 4.553 3.819) 8.739 15.244 ( 13.230 3.822 12.642) 18.694 17.893 ( 0.418 3.911 -32.154) 32.393 19.135 ( 11.727 -0.059 2.657) 12.025 19.363 ( 4.377 -0.748 7.595) 8.798 19.588 ( -8.302 2.653 8.277) 12.020 21.433 ( 7.122 1.633 -16.115) 17.695 22.783 ( -11.238 7.526 23.376) 27.007 24.055 ( -5.028 -6.658 2.990) 8.863 24.200 ( 6.944 -0.767 -6.011) 9.216 ======================= Grid point 225 (97/432) ======================= q-point: (-0.27 -0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -13.815 0.000 -13.555) 19.355 2.258 ( -18.558 0.000 -6.765) 19.752 3.155 ( 0.738 -0.000 4.425) 4.486 3.169 ( 9.593 -0.000 5.020) 10.827 3.571 ( 18.421 -0.000 -0.346) 18.424 3.969 ( 18.096 -0.000 -2.856) 18.320 4.269 ( -9.817 0.000 5.572) 11.288 4.373 ( -18.665 0.000 -7.392) 20.076 4.774 ( 4.231 -0.000 2.744) 5.043 4.868 ( -10.227 0.000 8.667) 13.405 5.256 ( 7.254 -0.000 -0.972) 7.318 5.629 ( -4.418 0.000 -5.832) 7.316 6.473 ( -7.071 0.000 -0.405) 7.083 6.679 ( 10.348 -0.000 11.956) 15.812 7.127 ( -6.042 0.000 26.895) 27.566 7.600 ( -12.675 0.000 6.431) 14.214 8.821 ( 13.463 -0.000 -5.271) 14.458 9.106 ( 7.756 -0.000 0.540) 7.774 10.202 ( 7.785 -0.000 7.705) 10.953 10.739 ( -22.385 0.000 -14.444) 26.641 10.887 ( -6.717 0.000 1.391) 6.860 12.380 ( 2.812 -0.000 -14.316) 14.589 12.461 ( 3.919 -0.000 -1.716) 4.278 12.813 ( 2.119 -0.000 9.563) 9.795 12.872 ( -18.927 0.000 3.430) 19.235 13.948 ( 4.567 -0.000 3.128) 5.536 14.055 ( -8.869 0.000 -12.046) 14.959 14.976 ( 11.204 -0.000 12.301) 16.638 18.213 ( -0.088 0.000 -14.711) 14.711 18.930 ( 10.406 -0.000 1.771) 10.556 19.158 ( 6.338 -0.000 4.166) 7.585 19.748 ( -12.108 0.000 5.218) 13.185 21.575 ( 7.466 -0.000 -16.350) 17.974 22.673 ( -6.758 0.000 26.910) 27.746 24.055 ( -7.202 0.000 -1.019) 7.274 24.181 ( 7.302 -0.000 -8.325) 11.074 ======================= Grid point 226 (98/432) ======================= q-point: (-0.18 -0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.793 ( -16.310 -3.063 -11.651) 20.276 1.935 ( -21.956 -6.700 -6.526) 23.865 3.172 ( -0.261 3.276 1.576) 3.644 3.309 ( 6.390 2.218 2.475) 7.203 3.767 ( 12.157 3.297 0.248) 12.599 3.874 ( -30.467 1.568 -15.592) 34.261 4.145 ( 6.003 2.953 -0.865) 6.746 4.245 ( -0.558 -7.820 0.699) 7.870 4.842 ( -3.317 0.809 8.049) 8.743 4.856 ( -1.597 -0.300 3.095) 3.495 5.343 ( 7.969 1.865 -1.067) 8.254 5.558 ( -0.858 -2.315 -1.313) 2.796 6.281 ( -7.948 1.655 -11.743) 14.277 6.924 ( 6.782 2.709 10.240) 12.577 7.369 ( -16.430 -0.724 38.866) 42.202 7.586 ( -9.369 -9.241 10.018) 16.539 8.891 ( 11.640 1.581 -9.324) 14.997 9.271 ( 10.937 -5.651 2.033) 12.477 10.274 ( -7.833 7.075 -0.043) 10.555 10.318 ( -13.497 -0.968 -9.159) 16.340 10.850 ( 0.543 1.805 2.373) 3.031 12.191 ( 2.988 11.802 -12.339) 17.334 12.488 ( 0.737 -3.525 -1.342) 3.843 12.659 ( -21.015 1.967 8.789) 22.863 13.026 ( 3.445 -11.705 7.876) 14.523 13.829 ( -8.149 -3.412 -9.890) 13.261 14.060 ( 6.841 1.784 3.881) 8.065 15.286 ( 13.674 1.206 13.536) 19.279 17.940 ( 2.754 1.473 -32.918) 33.066 19.127 ( 13.023 -0.456 4.238) 13.703 19.352 ( 7.178 -0.425 10.250) 12.521 19.632 ( -12.611 1.787 5.384) 13.828 21.464 ( 6.581 1.328 -17.789) 19.014 22.872 ( -11.382 2.791 30.478) 32.653 23.965 ( -7.293 -3.174 0.606) 7.977 24.194 ( 7.941 -0.184 -7.492) 10.918 ======================= Grid point 227 (99/432) ======================= q-point: (-0.09 -0.27 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -18.137 -7.836 -9.794) 22.052 1.677 ( -22.865 -16.145 -2.877) 28.137 3.108 ( -11.687 -0.914 -13.241) 17.685 3.244 ( -23.932 2.817 -4.300) 24.478 3.383 ( 0.988 4.570 2.143) 5.144 3.805 ( 0.048 4.612 -3.481) 5.779 4.095 ( -6.293 -0.190 2.885) 6.925 4.402 ( 13.154 -0.527 -1.040) 13.205 4.808 ( -8.724 2.505 6.113) 10.943 4.931 ( 5.120 -0.571 1.275) 5.307 5.405 ( 6.572 2.973 -1.254) 7.321 5.608 ( 3.215 -4.399 0.661) 5.489 6.009 ( -7.276 2.628 -13.696) 15.730 6.977 ( -9.841 11.470 13.060) 19.974 7.592 ( -17.443 3.069 34.758) 39.010 7.713 ( -6.660 -21.632 12.059) 25.646 8.932 ( 11.915 -2.117 -9.108) 15.146 9.492 ( 9.221 -6.649 0.727) 11.392 9.984 ( -13.405 6.202 -1.377) 14.834 10.140 ( -6.213 5.683 -4.959) 9.772 10.899 ( 3.983 6.664 3.965) 8.717 12.016 ( 3.482 9.010 -10.891) 14.557 12.486 ( -13.768 -5.522 5.857) 15.949 12.540 ( -6.541 -1.290 7.177) 9.796 13.244 ( 3.347 -12.468 4.325) 13.615 13.694 ( -7.213 -7.799 -2.402) 10.892 14.176 ( 7.126 3.074 3.718) 8.605 15.606 ( 14.801 3.343 12.377) 19.582 17.530 ( 6.393 4.395 -46.092) 46.740 19.357 ( 12.750 1.456 5.789) 14.078 19.432 ( -6.884 4.732 4.226) 9.361 19.643 ( 3.192 -5.359 8.793) 10.781 21.339 ( 5.749 0.635 -16.654) 17.630 22.981 ( -16.839 12.485 30.217) 36.776 23.963 ( -5.182 -10.225 5.582) 12.750 24.222 ( 7.132 -0.849 -5.726) 9.186 ======================= Grid point 237 (100/432) ======================= q-point: (-0.18 -0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( -20.975 0.000 -5.915) 21.793 1.515 ( -24.933 0.000 -6.460) 25.756 3.096 ( -19.400 0.000 -18.290) 26.662 3.279 ( -21.867 0.000 -1.688) 21.932 3.425 ( 4.678 -0.000 2.832) 5.469 3.842 ( -1.313 0.000 -3.739) 3.962 4.093 ( -5.972 0.000 2.970) 6.670 4.393 ( 17.506 -0.000 -1.831) 17.602 4.833 ( -10.521 0.000 9.874) 14.428 4.929 ( 5.351 -0.000 0.582) 5.383 5.427 ( 5.791 -0.000 -1.352) 5.946 5.566 ( 4.086 -0.000 0.746) 4.154 6.036 ( -6.923 0.000 -14.854) 16.388 7.158 ( 8.252 -0.000 7.858) 11.395 7.424 ( -22.853 0.000 25.578) 34.300 7.631 ( -16.497 0.000 28.937) 33.309 8.901 ( 8.616 -0.000 -11.796) 14.608 9.440 ( 11.988 -0.000 2.536) 12.253 9.987 ( -11.754 0.000 -5.856) 13.132 10.244 ( -8.661 0.000 -1.127) 8.734 10.969 ( 7.295 -0.000 5.387) 9.069 12.097 ( 2.102 -0.000 -15.787) 15.926 12.460 ( -0.308 0.000 -0.463) 0.556 12.548 ( -22.734 0.000 20.786) 30.804 13.080 ( -0.204 0.000 5.282) 5.286 13.631 ( -5.740 0.000 -5.801) 8.161 14.203 ( 6.958 -0.000 3.557) 7.815 15.634 ( 15.013 -0.000 12.720) 19.677 17.569 ( 8.892 -0.000 -47.583) 48.407 19.359 ( 12.528 -0.000 5.630) 13.735 19.526 ( -11.159 0.000 3.693) 11.754 19.557 ( 6.134 -0.000 9.427) 11.247 21.346 ( 5.637 -0.000 -17.345) 18.238 23.103 ( -14.848 0.000 38.299) 41.076 23.859 ( -7.657 0.000 1.170) 7.746 24.215 ( 7.306 -0.000 -6.403) 9.715 ======================= Grid point 238 (101/432) ======================= q-point: (-0.09 -0.18 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.088 ( -24.405 -2.426 -2.955) 24.702 1.201 ( -26.040 -15.272 0.101) 30.188 2.352 ( -44.697 -4.151 -22.040) 50.008 3.218 ( -2.558 1.757 4.001) 5.063 3.487 ( -1.450 3.236 5.329) 6.400 3.711 ( -4.836 1.402 -5.653) 7.570 4.073 ( -1.077 0.116 -0.563) 1.220 4.585 ( 12.368 2.160 -0.605) 12.570 4.795 ( -6.373 1.788 6.873) 9.542 4.996 ( 2.424 -0.344 1.712) 2.988 5.476 ( 4.192 0.732 -1.091) 4.393 5.654 ( 5.482 1.146 -1.444) 5.783 5.781 ( -4.567 -1.672 -12.854) 13.744 7.143 ( -11.167 24.931 14.963) 31.147 7.546 ( -8.664 -14.796 6.603) 18.373 7.772 ( -19.490 -7.830 42.110) 47.058 8.914 ( 8.491 -8.154 -8.301) 14.404 9.531 ( 2.857 0.202 -5.679) 6.361 9.942 ( 1.176 -0.457 6.816) 6.932 10.061 ( -7.791 5.520 -3.092) 10.037 11.099 ( 6.355 8.546 5.701) 12.079 11.940 ( 2.126 2.234 -15.500) 15.804 12.412 ( -12.024 8.657 11.009) 18.458 12.562 ( -10.278 1.511 18.518) 21.233 13.184 ( -0.521 -20.171 5.069) 20.805 13.563 ( -4.205 -6.597 2.498) 8.213 14.319 ( 5.961 1.440 2.737) 6.715 15.946 ( 13.721 1.930 9.444) 16.769 17.066 ( 10.715 3.095 -63.321) 64.296 19.386 ( -8.762 1.872 1.745) 9.128 19.600 ( 11.704 1.082 5.640) 13.037 19.740 ( 4.237 -4.788 6.319) 8.989 21.234 ( 5.292 0.190 -14.605) 15.535 23.270 ( -18.827 22.706 38.692) 48.653 23.873 ( -4.425 -17.721 10.017) 20.831 24.242 ( 5.553 -0.899 -4.214) 7.029 ======================= Grid point 249 (102/432) ======================= q-point: (-0.09 -0.09 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.733 ( -28.031 0.000 1.700) 28.082 0.799 ( -29.997 0.000 9.666) 31.516 1.482 ( -52.812 0.000 -10.200) 53.788 3.241 ( -1.563 0.000 3.056) 3.433 3.436 ( -11.427 0.000 1.184) 11.488 3.704 ( 5.728 -0.000 0.540) 5.754 4.035 ( -1.123 0.000 -3.613) 3.784 4.640 ( -3.061 0.000 -0.546) 3.109 4.915 ( 9.083 -0.000 7.802) 11.974 5.021 ( 0.033 -0.000 0.110) 0.115 5.457 ( -2.701 0.000 -15.625) 15.856 5.566 ( -2.174 0.000 0.316) 2.197 5.775 ( 7.682 -0.000 0.925) 7.737 7.330 ( -13.394 0.000 8.356) 15.786 7.442 ( 3.924 -0.000 2.423) 4.612 8.043 ( -17.514 0.000 64.165) 66.512 8.881 ( 6.345 -0.000 -5.032) 8.099 9.476 ( 1.880 -0.000 -7.924) 8.144 9.940 ( -8.363 0.000 -1.867) 8.569 10.088 ( 6.695 -0.000 4.397) 8.010 11.274 ( 5.629 -0.000 2.803) 6.289 11.777 ( 0.491 -0.000 -21.045) 21.050 12.490 ( 4.431 -0.000 -0.808) 4.504 12.927 ( -10.450 0.000 57.578) 58.518 12.970 ( -6.396 0.000 -3.768) 7.423 13.514 ( -2.703 0.000 2.513) 3.690 14.416 ( 4.105 -0.000 1.456) 4.356 16.190 ( 9.807 -0.000 3.955) 10.574 16.406 ( -0.869 0.000 -59.640) 59.647 19.286 ( -6.381 0.000 -1.735) 6.613 19.795 ( 8.339 -0.000 4.285) 9.376 19.818 ( 1.678 -0.000 4.098) 4.429 21.160 ( 5.910 -0.000 -11.273) 12.728 23.712 ( -6.679 0.000 3.016) 7.328 23.855 ( -4.297 0.000 58.068) 58.227 24.263 ( 3.392 -0.000 -1.051) 3.551 ======================= Grid point 250 (103/432) ======================= q-point: ( 0.00 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( -3.133 0.000 25.734) 25.924 1.241 ( 5.411 -0.000 26.291) 26.842 2.109 ( -4.482 0.000 44.480) 44.706 3.183 ( -1.267 0.000 -3.973) 4.170 3.415 ( 0.186 -0.000 8.656) 8.658 3.882 ( 7.772 -0.000 -5.632) 9.598 4.009 ( -4.071 0.000 8.293) 9.239 4.355 ( -3.244 0.000 -12.770) 13.175 4.725 ( 0.909 -0.000 -11.387) 11.424 5.029 ( 4.395 -0.000 -1.075) 4.525 5.582 ( 3.434 -0.000 4.568) 5.715 5.988 ( 0.101 -0.000 4.224) 4.225 6.103 ( 1.397 -0.000 24.873) 24.913 7.307 ( -2.814 0.000 -8.342) 8.804 7.443 ( -29.603 0.000 7.292) 30.488 7.733 ( -33.217 0.000 18.669) 38.103 9.262 ( 5.488 -0.000 14.315) 15.331 9.400 ( -6.659 0.000 -2.571) 7.138 9.873 ( -6.856 0.000 -8.063) 10.584 9.927 ( 3.373 -0.000 3.215) 4.660 10.608 ( 24.311 -0.000 8.078) 25.618 11.209 ( -3.963 0.000 -6.832) 7.898 12.383 ( -1.529 0.000 -9.156) 9.283 12.685 ( -5.560 0.000 15.763) 16.715 12.727 ( 4.046 -0.000 -4.863) 6.326 13.633 ( -0.344 0.000 5.104) 5.115 14.410 ( -1.640 0.000 -2.794) 3.240 15.962 ( -3.353 0.000 -16.650) 16.984 18.925 ( 5.126 -0.000 -12.316) 13.340 19.421 ( 34.298 -0.000 -3.184) 34.445 19.690 ( 9.588 -0.000 -7.060) 11.907 19.884 ( -7.821 0.000 -3.657) 8.634 21.177 ( 17.492 -0.000 1.277) 17.539 22.326 ( -74.066 0.000 -1.662) 74.085 23.774 ( -5.395 0.000 5.729) 7.869 24.283 ( 5.370 -0.000 -1.344) 5.536 ======================= Grid point 251 (104/432) ======================= q-point: ( 0.09 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.336 ( 4.088 -3.776 24.749) 25.367 1.605 ( 6.720 -5.575 21.718) 23.407 2.665 ( 12.713 -3.894 34.753) 37.209 3.145 ( 3.905 1.430 -4.803) 6.352 3.488 ( -5.757 0.108 11.006) 12.421 3.879 ( 4.452 5.051 -7.225) 9.876 4.000 ( -5.774 3.379 2.693) 7.211 4.195 ( 2.832 -3.199 -15.157) 15.748 4.656 ( 4.891 0.629 -5.391) 7.306 5.019 ( -3.816 -1.282 -1.489) 4.292 5.616 ( -2.360 0.981 2.535) 3.600 6.011 ( -4.663 0.285 5.289) 7.057 6.431 ( 0.469 1.613 30.946) 30.992 7.001 ( -17.415 18.275 11.597) 27.781 7.252 ( -14.839 -10.062 -2.128) 18.055 7.776 ( -14.675 -5.447 23.301) 28.071 9.271 ( 6.050 14.062 1.214) 15.356 9.597 ( -1.157 -15.600 10.453) 18.814 9.701 ( -1.484 1.693 -3.825) 4.439 10.043 ( 3.822 -4.645 2.302) 6.441 10.840 ( 11.568 23.612 -0.169) 26.294 11.288 ( 12.010 -28.289 -2.875) 30.868 12.260 ( -0.822 -0.929 -9.419) 9.500 12.633 ( 1.204 11.644 -0.987) 11.747 12.912 ( -0.469 -15.754 8.305) 17.815 13.715 ( 2.546 -1.154 6.174) 6.777 14.335 ( -3.972 0.867 -3.188) 5.166 15.674 ( -7.374 2.991 -18.555) 20.190 18.851 ( 9.258 7.106 -10.166) 15.477 19.239 ( -16.403 2.057 -13.322) 21.231 19.686 ( -6.924 2.770 -6.605) 9.962 19.963 ( 10.743 -2.307 -4.516) 11.880 21.401 ( 6.931 10.053 8.224) 14.722 21.703 ( -19.445 -6.922 3.904) 21.006 23.803 ( -3.795 -6.580 3.027) 8.177 24.338 ( 4.368 -0.139 -0.500) 4.398 ======================= Grid point 252 (105/432) ======================= q-point: ( 0.18 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 7.999 -3.762 20.607) 22.423 2.016 ( 10.486 -10.030 18.674) 23.649 3.136 ( 7.614 3.857 -2.636) 8.933 3.155 ( 5.726 -0.876 13.841) 15.004 3.554 ( -2.197 -2.435 11.943) 12.385 3.752 ( 3.557 10.807 -9.578) 14.872 3.859 ( -5.806 4.109 -5.185) 8.802 4.171 ( 6.714 -8.862 -10.491) 15.287 4.716 ( 4.813 1.548 4.337) 6.662 4.964 ( -6.992 -4.527 1.958) 8.557 5.576 ( -3.669 1.840 -1.052) 4.238 5.986 ( -7.374 1.211 5.831) 9.479 6.768 ( 0.340 3.731 28.486) 28.731 6.857 ( -11.356 9.034 14.685) 20.644 7.107 ( -14.311 -4.137 1.913) 15.019 7.888 ( -12.028 -2.921 21.117) 24.477 9.232 ( 2.627 10.722 -3.101) 11.466 9.608 ( 5.464 7.753 2.800) 9.890 9.866 ( -6.978 -15.468 6.526) 18.180 10.179 ( 7.024 -4.149 6.062) 10.164 10.736 ( 2.393 8.528 -3.819) 9.645 11.708 ( 19.263 -17.105 1.051) 25.782 12.161 ( 0.486 1.447 -9.053) 9.181 12.521 ( 2.635 6.915 -6.840) 10.077 13.132 ( -0.685 -14.571 8.655) 16.961 13.857 ( 5.009 -3.287 6.431) 8.789 14.222 ( -5.882 1.947 -2.839) 6.815 15.323 ( -8.844 4.688 -17.369) 20.047 18.778 ( -6.075 8.666 -8.554) 13.608 18.887 ( 1.910 1.183 -13.573) 13.758 19.491 ( -9.237 -0.648 -6.925) 11.563 19.927 ( -11.433 0.799 2.593) 11.751 21.364 ( 3.898 9.726 -1.586) 10.597 21.886 ( 11.628 -10.338 6.502) 16.863 23.843 ( -1.144 -5.726 0.890) 5.906 24.383 ( 2.943 0.608 0.111) 3.007 ======================= Grid point 253 (106/432) ======================= q-point: ( 0.27 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( 8.328 -2.822 14.718) 17.145 2.455 ( 11.726 -11.362 16.204) 23.004 3.094 ( 1.782 6.114 -5.302) 8.286 3.206 ( -7.288 4.688 3.391) 9.305 3.518 ( -0.277 12.960 -10.583) 16.734 3.638 ( 3.768 1.176 -7.344) 8.337 3.948 ( 10.418 -7.870 8.976) 15.844 4.240 ( 4.955 -10.706 -6.849) 13.641 4.814 ( 0.928 1.544 7.559) 7.770 4.968 ( -5.431 -5.003 5.542) 9.233 5.444 ( -7.361 3.748 -5.893) 10.147 5.940 ( -6.922 2.708 6.062) 9.592 6.722 ( -9.103 2.051 -4.246) 10.252 6.962 ( -4.474 3.174 9.716) 11.157 7.170 ( -12.874 0.703 41.420) 43.380 8.000 ( -7.432 -2.661 17.846) 19.514 9.087 ( -3.926 10.559 -3.794) 11.888 9.702 ( 5.353 4.704 6.265) 9.489 9.848 ( -6.074 -2.501 -2.439) 7.006 10.367 ( 0.336 -2.024 5.486) 5.858 10.779 ( 8.832 -9.772 1.668) 13.277 11.913 ( -3.564 8.992 -8.459) 12.849 12.130 ( 17.425 -3.848 -0.985) 17.872 12.513 ( 8.693 -3.976 -4.113) 10.406 13.318 ( -1.358 -11.177 6.952) 13.232 13.990 ( -0.957 0.211 0.383) 1.053 14.128 ( -0.864 -2.848 1.868) 3.513 15.002 ( -6.785 4.558 -12.357) 14.815 18.422 ( -12.656 2.658 -15.765) 20.390 18.897 ( 13.096 3.358 -8.179) 15.801 19.314 ( -7.265 -0.191 -4.100) 8.344 19.789 ( -15.464 -1.042 6.256) 16.714 21.327 ( 9.406 7.056 -9.236) 14.952 22.206 ( 9.120 -9.966 9.664) 16.610 23.894 ( 2.465 -4.024 -0.544) 4.750 24.403 ( 1.072 2.231 0.706) 2.574 ======================= Grid point 254 (107/432) ======================= q-point: ( 0.36 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( 3.125 1.577 5.560) 6.570 2.839 ( 2.701 -7.572 11.298) 13.867 2.987 ( -0.813 4.926 -2.099) 5.415 3.080 ( -2.713 4.180 1.131) 5.110 3.285 ( -2.828 8.766 -7.140) 11.654 3.675 ( 12.926 -1.676 -8.251) 15.426 4.188 ( 4.216 -6.030 0.548) 7.378 4.323 ( 3.772 -11.416 -3.421) 12.501 4.879 ( -0.488 -0.995 4.674) 4.804 5.013 ( -5.778 -2.751 8.811) 10.890 5.187 ( -11.436 5.774 -9.454) 15.922 5.897 ( -4.887 4.910 5.490) 8.839 6.496 ( -12.438 -0.875 -8.213) 14.930 7.003 ( -2.698 3.384 10.721) 11.561 7.491 ( -15.204 -0.959 45.656) 48.131 8.154 ( -0.331 -4.510 13.234) 13.985 8.878 ( -8.581 11.955 -1.730) 14.817 9.707 ( -14.447 -18.851 -3.262) 23.973 9.822 ( 11.372 21.142 4.081) 24.351 10.351 ( -5.533 -3.668 -2.505) 7.096 11.098 ( 13.702 -11.310 6.124) 18.793 11.587 ( -6.399 15.921 -11.906) 20.885 12.381 ( 14.828 0.232 1.000) 14.864 12.693 ( 11.150 -6.882 2.363) 13.314 13.430 ( -2.383 -4.559 4.203) 6.643 13.864 ( -6.357 3.805 -1.723) 7.606 14.220 ( -0.041 -5.643 -1.705) 5.895 14.854 ( 1.856 -0.107 -1.239) 2.234 18.047 ( -11.112 -0.651 -22.248) 24.878 18.945 ( 9.753 3.002 -4.963) 11.347 19.253 ( 0.733 -1.122 0.524) 1.439 19.700 ( -12.058 -2.840 7.496) 14.479 21.273 ( 9.788 5.618 -13.115) 17.303 22.501 ( 3.244 -11.177 12.138) 16.816 23.962 ( 5.954 -1.975 -1.869) 6.545 24.389 ( -0.850 4.399 1.630) 4.768 ======================= Grid point 255 (108/432) ======================= q-point: (-0.55 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( -6.809 9.042 -3.978) 11.997 2.697 ( -16.040 10.202 0.551) 19.017 2.990 ( 0.627 -0.222 2.773) 2.852 3.170 ( -0.703 -0.092 -2.633) 2.726 3.305 ( 12.231 -8.876 7.338) 16.800 3.767 ( 9.579 -2.547 -7.417) 12.379 4.156 ( -8.579 1.116 -2.274) 8.945 4.426 ( 2.282 -10.506 -3.697) 11.369 4.849 ( -9.695 7.459 -9.857) 15.709 4.960 ( 0.791 -6.697 2.028) 7.042 5.069 ( -4.389 -1.824 7.890) 9.211 5.847 ( -3.516 6.818 3.898) 8.604 6.243 ( -12.730 -1.359 -8.253) 15.232 7.062 ( -4.034 2.402 11.252) 12.193 7.800 ( -18.741 -4.025 43.498) 47.535 8.366 ( 6.621 -6.811 8.237) 12.573 8.627 ( -12.551 12.008 0.495) 17.378 9.662 ( -10.852 -19.402 -3.070) 22.442 9.803 ( 5.238 17.321 1.984) 18.204 10.259 ( -7.706 -5.862 -5.310) 11.043 11.180 ( 2.821 23.958 -7.923) 25.392 11.490 ( 7.604 -12.460 2.940) 14.890 12.529 ( 9.247 2.290 -0.820) 9.562 12.920 ( 6.116 -1.931 8.392) 10.562 13.385 ( -4.660 5.851 -2.049) 7.756 13.836 ( 2.012 -4.305 2.784) 5.507 14.146 ( -6.207 0.732 -3.908) 7.371 15.019 ( 11.054 -7.116 5.935) 14.424 17.623 ( -10.998 -1.668 -28.475) 30.570 19.030 ( 9.115 0.815 2.199) 9.412 19.323 ( 3.761 -3.314 0.753) 5.069 19.694 ( -5.056 -1.750 8.021) 9.642 21.194 ( 9.397 4.271 -15.803) 18.876 22.751 ( -3.886 -13.597 14.235) 20.065 24.037 ( 8.600 0.339 -3.268) 9.206 24.350 ( -2.203 6.487 3.591) 7.735 ======================= Grid point 256 (109/432) ======================= q-point: (-0.45 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.914 ( -13.834 11.956 -3.658) 18.647 2.363 ( -19.148 13.255 -0.606) 23.296 3.056 ( 2.291 -1.461 1.893) 3.312 3.191 ( 1.233 -5.235 1.233) 5.518 3.547 ( 2.613 -7.485 0.820) 7.970 3.657 ( -17.543 3.486 -5.576) 18.735 4.055 ( 3.463 -1.600 -0.335) 3.830 4.453 ( -7.829 -2.537 1.607) 8.385 4.637 ( 4.785 -1.292 -11.625) 12.638 5.017 ( -2.382 -0.412 3.756) 4.467 5.157 ( 2.125 -8.985 1.544) 9.361 5.776 ( -3.475 6.655 1.652) 7.687 6.011 ( -9.969 0.305 -6.060) 11.670 7.101 ( -8.475 0.135 11.821) 14.546 8.022 ( -21.651 -5.525 34.442) 41.056 8.376 ( -11.090 8.919 -0.454) 14.239 8.620 ( 8.669 -6.713 7.422) 13.240 9.664 ( -8.633 -18.154 -2.864) 20.305 9.733 ( 2.041 13.490 0.729) 13.663 10.146 ( -7.396 -6.111 -3.393) 10.177 10.965 ( 4.643 20.427 -2.939) 21.153 11.698 ( 6.517 -7.671 -0.677) 10.089 12.577 ( 6.022 4.335 -3.066) 8.028 12.991 ( -12.694 7.108 12.414) 19.124 13.283 ( 5.773 2.621 -6.097) 8.796 13.978 ( 1.966 -5.596 2.113) 6.297 14.051 ( 0.334 4.282 5.259) 6.790 15.332 ( 14.708 -9.492 5.528) 18.357 17.149 ( -10.589 -1.188 -31.692) 33.436 19.217 ( 9.301 -2.212 6.953) 11.822 19.392 ( 1.383 -3.589 0.424) 3.870 19.773 ( 2.886 1.501 7.353) 8.040 21.093 ( 9.093 3.005 -17.914) 20.313 22.948 ( -11.216 -17.337 14.983) 25.512 24.103 ( 9.854 2.457 -4.998) 11.319 24.322 ( -1.947 7.715 8.052) 11.320 ======================= Grid point 257 (110/432) ======================= q-point: (-0.36 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( -18.553 11.819 1.631) 22.059 1.960 ( -22.173 14.586 -1.792) 26.601 2.964 ( -19.132 13.004 -5.078) 23.684 3.238 ( -11.256 -2.718 4.636) 12.473 3.353 ( -0.501 -6.784 4.708) 8.273 3.613 ( -2.970 -7.652 -4.581) 9.400 4.143 ( -2.877 -0.614 2.903) 4.133 4.388 ( 3.860 -1.474 -1.010) 4.254 4.683 ( 5.394 -7.655 -4.478) 10.380 5.022 ( -1.314 0.827 2.640) 3.062 5.261 ( 2.710 -9.724 -4.463) 11.037 5.681 ( -5.961 3.456 0.946) 6.955 5.862 ( -1.974 4.833 -2.157) 5.649 7.107 ( -14.242 -4.740 12.721) 19.675 8.069 ( -22.945 1.929 19.774) 30.351 8.219 ( -7.887 -0.203 5.560) 9.652 8.840 ( 9.387 -5.635 -0.071) 10.949 9.609 ( 3.718 12.457 -4.907) 13.895 9.706 ( -11.869 -18.273 2.722) 21.959 10.143 ( 1.394 -0.752 4.277) 4.561 10.902 ( 3.571 6.148 2.293) 7.470 11.754 ( 1.089 -2.266 -5.908) 6.420 12.552 ( 4.732 6.921 -5.634) 10.102 12.832 ( -17.470 6.372 9.687) 20.968 13.313 ( 4.533 -0.223 -1.288) 4.718 14.010 ( 0.563 3.886 7.244) 8.239 14.204 ( 8.629 1.006 5.504) 10.284 15.666 ( 15.888 -9.959 2.249) 18.885 16.666 ( -10.788 0.634 -27.224) 29.290 19.367 ( -2.590 -5.750 0.968) 6.380 19.510 ( 11.779 1.237 6.818) 13.666 19.880 ( 5.282 4.863 5.468) 9.025 20.985 ( 9.362 1.427 -18.610) 20.881 23.089 ( -17.497 -22.932 13.773) 31.965 24.134 ( 8.453 3.868 -5.763) 10.937 24.375 ( 1.271 7.728 13.351) 15.478 ======================= Grid point 258 (111/432) ======================= q-point: (-0.27 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( -21.717 11.218 7.687) 25.624 1.494 ( -26.234 13.498 -3.024) 29.658 2.416 ( -36.865 20.439 10.065) 43.337 3.237 ( -2.448 -3.852 2.105) 5.026 3.491 ( -4.871 -7.358 2.180) 9.090 3.576 ( 0.902 -5.470 0.184) 5.547 4.048 ( -5.819 1.584 -3.083) 6.773 4.540 ( 5.459 -6.138 3.667) 8.996 4.769 ( 4.148 -7.259 -1.737) 8.539 5.037 ( 1.868 1.259 0.803) 2.391 5.255 ( -1.514 -7.406 -10.846) 13.220 5.632 ( -3.592 1.515 6.599) 7.665 5.819 ( 4.343 6.562 -0.265) 7.874 7.116 ( -16.982 -12.434 13.414) 24.958 7.894 ( -19.906 7.408 10.090) 23.514 8.269 ( -6.456 -9.029 10.373) 15.192 8.954 ( 10.479 -2.833 -8.811) 13.981 9.518 ( 5.198 14.526 0.186) 15.429 9.741 ( -10.433 -18.865 1.129) 21.587 10.223 ( 6.583 9.621 3.867) 12.282 11.004 ( -0.808 -13.146 5.003) 14.089 11.637 ( -5.186 1.761 -9.767) 11.198 12.456 ( 0.924 8.496 -5.097) 9.951 12.697 ( -13.483 -1.697 6.091) 14.892 13.368 ( 2.465 -0.692 1.570) 3.004 14.045 ( 5.330 11.796 -3.499) 13.409 14.339 ( 7.301 2.432 1.880) 7.922 15.937 ( 13.069 -9.334 -3.816) 16.507 16.362 ( -6.235 1.523 6.226) 8.942 19.341 ( -1.754 -0.245 -3.726) 4.126 19.732 ( 9.921 0.909 5.953) 11.606 19.941 ( 3.217 7.024 4.688) 9.036 20.908 ( 10.778 -0.424 -17.120) 20.235 23.195 ( -22.103 -31.137 11.311) 39.825 24.148 ( 7.831 3.507 -4.670) 9.769 24.504 ( 3.438 7.425 13.123) 15.465 ======================= Grid point 259 (112/432) ======================= q-point: (-0.18 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( -24.756 10.103 7.030) 27.646 1.048 ( -22.175 13.977 10.627) 28.284 1.994 ( -37.222 17.074 31.753) 51.819 3.258 ( -0.700 -2.158 1.103) 2.523 3.394 ( -10.090 -3.066 -2.180) 10.769 3.724 ( 6.424 -3.750 2.927) 7.993 3.950 ( -3.340 -1.350 -2.124) 4.182 4.624 ( -4.729 -5.072 1.722) 7.146 4.867 ( 4.589 -6.282 -5.132) 9.320 5.025 ( -0.091 1.776 -6.578) 6.814 5.211 ( 5.376 -2.127 0.919) 5.854 5.700 ( -1.180 -0.010 11.264) 11.326 5.851 ( 6.386 4.590 1.155) 7.948 7.185 ( -14.646 -20.195 11.225) 27.356 7.691 ( -18.114 6.262 9.576) 21.425 8.411 ( -4.885 -15.129 6.810) 17.295 8.968 ( 11.087 -0.002 -15.274) 18.874 9.530 ( 9.315 14.519 6.963) 18.602 9.773 ( -6.330 -14.121 0.066) 15.475 10.214 ( 5.219 13.292 -1.554) 14.364 11.020 ( -26.006 -21.744 -14.500) 36.870 11.426 ( -0.383 10.899 -2.991) 11.308 12.381 ( 0.202 -0.214 -0.719) 0.777 12.618 ( -9.904 -4.233 1.856) 10.930 13.348 ( 0.463 10.826 -11.166) 15.559 13.745 ( -4.753 18.876 -15.168) 24.677 14.410 ( 3.818 -0.552 -0.341) 3.873 16.102 ( 8.042 -7.891 -5.503) 12.539 16.872 ( 27.647 -10.908 56.006) 63.403 19.245 ( 2.457 7.406 -8.352) 11.430 19.841 ( 1.768 -0.833 -1.140) 2.262 19.982 ( 2.206 7.115 7.057) 10.261 20.897 ( 13.109 -1.156 -13.511) 18.861 23.287 ( -26.926 -41.956 6.661) 50.296 24.178 ( 7.550 2.347 -3.714) 8.735 24.534 ( -2.648 11.002 -3.539) 11.857 ======================= Grid point 260 (113/432) ======================= q-point: (-0.09 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.884 ( -4.742 6.726 25.140) 26.453 0.898 ( -10.869 9.084 22.828) 26.866 1.874 ( -29.547 7.934 43.230) 52.960 3.268 ( -6.569 -1.417 -2.490) 7.167 3.310 ( 2.003 -0.377 4.742) 5.162 3.831 ( 8.451 -1.051 -4.858) 9.804 3.951 ( -3.554 -2.806 6.758) 8.135 4.539 ( -7.288 -2.016 -7.238) 10.468 4.846 ( -0.397 -1.809 -9.599) 9.776 4.964 ( 4.339 0.684 -1.432) 4.620 5.411 ( 10.595 -1.075 6.949) 12.716 5.852 ( -0.150 -0.783 16.850) 16.869 5.923 ( 4.474 1.780 3.001) 5.674 7.300 ( -8.617 -21.736 2.740) 23.541 7.549 ( -15.816 3.455 12.959) 20.737 8.314 ( -24.545 -3.403 -16.533) 29.789 9.010 ( 8.181 -5.544 2.494) 10.192 9.594 ( 2.293 15.727 2.517) 16.092 9.822 ( -1.540 -10.724 -0.198) 10.836 10.128 ( 0.987 15.420 -3.940) 15.946 10.437 ( -31.413 -9.184 -4.934) 33.098 11.345 ( 1.399 11.038 -2.934) 11.507 12.442 ( 5.194 -4.318 -3.877) 7.788 12.563 ( -10.317 -8.796 6.047) 14.845 12.927 ( -4.553 26.178 -8.808) 27.993 13.605 ( -2.755 1.252 4.033) 5.043 14.437 ( 1.059 -0.727 -1.727) 2.152 16.120 ( 2.254 -3.880 -12.047) 12.855 18.276 ( 60.031 -28.858 36.102) 75.762 19.113 ( 10.840 17.181 -10.056) 22.668 19.797 ( -4.674 -2.949 -5.207) 7.594 19.991 ( -2.164 5.456 2.130) 6.244 20.979 ( 15.890 -0.870 -6.664) 17.253 23.220 ( -52.773 -47.671 -9.652) 71.768 24.026 ( -18.206 32.858 -9.758) 38.811 24.233 ( 5.410 1.266 -2.675) 6.166 ======================= Grid point 262 (114/432) ======================= q-point: ( 0.09 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( 7.884 -0.000 24.195) 25.447 1.915 ( 9.196 -0.000 19.194) 21.283 3.143 ( 10.617 -0.000 17.813) 20.737 3.175 ( 7.618 -0.000 -5.170) 9.207 3.532 ( -3.714 0.000 12.001) 12.562 3.851 ( -2.787 0.000 -5.947) 6.568 3.932 ( -1.052 0.000 -7.235) 7.311 4.055 ( 6.540 -0.000 -15.500) 16.823 4.730 ( 6.160 -0.000 3.078) 6.886 4.922 ( -8.953 0.000 3.250) 9.524 5.590 ( -3.665 0.000 -0.889) 3.772 5.997 ( -7.559 0.000 6.611) 10.042 6.797 ( -3.059 0.000 34.112) 34.249 6.963 ( -6.829 0.000 -10.201) 12.276 7.047 ( -15.681 0.000 16.769) 22.959 7.859 ( -14.742 0.000 26.385) 30.224 9.365 ( 0.008 -0.000 -5.751) 5.751 9.611 ( -8.786 0.000 10.941) 14.032 9.741 ( 11.881 -0.000 4.213) 12.606 10.143 ( 8.440 -0.000 3.143) 9.006 10.856 ( -6.563 0.000 -9.162) 11.270 11.528 ( 29.426 -0.000 6.387) 30.112 12.168 ( 3.610 -0.000 -9.190) 9.874 12.631 ( 3.462 -0.000 -13.033) 13.485 12.960 ( -4.568 0.000 16.839) 17.447 13.829 ( 4.864 -0.000 5.963) 7.695 14.240 ( -5.461 0.000 -3.010) 6.236 15.363 ( -9.660 0.000 -17.459) 19.953 18.861 ( -17.113 0.000 -15.128) 22.841 18.890 ( 12.518 -0.000 -11.468) 16.977 19.482 ( -11.469 0.000 -5.642) 12.781 19.934 ( -10.873 0.000 1.906) 11.039 21.500 ( 1.334 -0.000 -5.726) 5.879 21.752 ( 12.902 -0.000 10.961) 16.930 23.791 ( 0.113 -0.000 2.366) 2.369 24.389 ( 3.373 -0.000 0.303) 3.387 ======================= Grid point 263 (115/432) ======================= q-point: ( 0.18 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( 8.834 1.674 20.087) 22.007 2.282 ( 10.159 -7.403 17.015) 21.154 3.187 ( 2.687 4.495 -4.693) 7.032 3.243 ( -3.928 -0.498 0.153) 3.962 3.672 ( 4.365 5.380 -3.639) 7.825 3.736 ( -0.461 6.023 -9.870) 11.572 3.833 ( 7.127 -1.970 3.451) 8.160 4.051 ( 4.627 -10.840 -9.133) 14.911 4.835 ( 0.918 0.805 6.099) 6.220 4.906 ( -5.568 -2.057 9.413) 11.128 5.483 ( -6.511 1.060 -6.132) 9.006 5.975 ( -6.681 1.132 7.359) 10.004 6.741 ( -9.285 0.458 -9.582) 13.351 6.997 ( -4.491 0.979 8.931) 10.044 7.181 ( -14.460 0.374 43.255) 45.609 7.962 ( -13.190 -1.412 23.188) 26.715 9.242 ( -3.598 7.203 -3.820) 8.912 9.540 ( -15.514 -9.972 -0.670) 18.454 10.023 ( 19.318 10.026 8.578) 23.393 10.312 ( 3.998 -4.502 5.545) 8.185 10.691 ( -0.637 -1.572 -6.448) 6.667 11.983 ( 23.351 -0.353 5.921) 24.093 12.124 ( 7.422 2.213 -9.235) 12.052 12.518 ( 5.421 3.129 -9.661) 11.512 13.118 ( -4.649 -9.524 13.226) 16.948 13.966 ( 5.667 -1.523 3.267) 6.716 14.126 ( -6.283 0.865 -2.025) 6.658 15.052 ( -8.923 1.464 -13.141) 15.952 18.456 ( -14.320 1.139 -18.566) 23.475 18.938 ( 13.594 1.287 -9.868) 16.847 19.295 ( -8.892 -1.171 -3.504) 9.629 19.785 ( -16.037 0.138 5.633) 16.998 21.457 ( 10.307 6.163 -11.521) 16.642 22.055 ( 7.884 -6.357 11.936) 15.654 23.843 ( 3.524 -1.752 1.010) 4.063 24.429 ( 1.896 0.779 1.089) 2.321 ======================= Grid point 264 (116/432) ======================= q-point: ( 0.27 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.316 ( 6.170 4.579 11.879) 14.147 2.662 ( 6.710 -11.085 13.942) 19.033 3.080 ( -1.756 4.543 -4.371) 6.544 3.150 ( -5.796 3.317 -2.037) 6.982 3.470 ( -4.371 11.500 -10.976) 16.487 3.665 ( 10.291 1.871 -7.153) 12.672 4.046 ( 4.956 -11.556 -2.992) 12.925 4.139 ( 6.683 -8.775 -0.181) 11.031 4.862 ( -4.933 -0.674 3.443) 6.053 4.988 ( -3.132 -0.552 11.208) 11.651 5.257 ( -10.485 2.512 -10.679) 15.175 5.972 ( -3.556 3.470 7.006) 8.589 6.489 ( -12.084 0.229 -9.109) 15.134 7.030 ( -4.139 0.101 8.674) 9.612 7.478 ( -18.377 -0.627 45.777) 49.332 8.074 ( -7.642 -4.152 17.206) 19.279 9.058 ( -9.200 9.436 -2.349) 13.386 9.416 ( -12.928 -14.769 -4.225) 20.078 10.131 ( 0.907 12.327 0.870) 12.390 10.359 ( 5.019 6.611 -0.860) 8.344 10.872 ( 13.290 -14.463 6.511) 20.693 11.912 ( 3.396 19.239 -11.840) 22.844 12.388 ( 17.561 1.000 3.901) 18.017 12.592 ( 12.801 -5.122 1.327) 13.851 13.279 ( -3.985 -11.201 9.365) 15.134 13.949 ( -5.254 5.256 -2.588) 7.869 14.115 ( 1.722 -5.972 -1.409) 6.373 14.852 ( -2.998 -0.202 -4.840) 5.697 18.041 ( -12.525 -0.151 -23.011) 26.199 18.984 ( 8.171 1.540 -5.606) 10.028 19.219 ( 0.674 -2.193 -1.957) 3.016 19.674 ( -11.297 -0.610 7.190) 13.405 21.393 ( 10.442 7.427 -13.879) 18.889 22.323 ( 1.931 -9.119 12.241) 15.386 23.931 ( 6.701 -1.540 -0.027) 6.876 24.447 ( 0.197 2.371 2.006) 3.112 ======================= Grid point 265 (117/432) ======================= q-point: (-0.64 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( -1.884 9.471 -0.703) 9.682 2.791 ( -11.539 -0.682 0.068) 11.559 3.016 ( 0.265 3.442 3.053) 4.609 3.176 ( 7.957 -5.539 6.422) 11.629 3.225 ( -4.627 6.854 -6.108) 10.281 3.715 ( 6.814 -3.517 -7.262) 10.561 4.125 ( 0.637 -6.821 -1.304) 6.974 4.282 ( 3.995 -4.559 -1.296) 6.199 4.822 ( -6.622 -6.248 -2.093) 9.342 4.943 ( -9.533 2.135 -8.912) 13.224 5.072 ( -3.588 1.139 6.934) 7.890 5.965 ( -1.840 6.796 5.010) 8.641 6.225 ( -12.950 -0.443 -7.622) 15.033 7.075 ( -6.293 -0.986 9.933) 11.800 7.737 ( -22.259 -3.299 43.917) 49.346 8.226 ( -0.060 -7.980 9.476) 12.389 8.796 ( -15.164 6.970 -1.692) 16.775 9.365 ( -8.316 -13.548 -1.672) 15.985 9.973 ( -9.029 -0.386 -5.405) 10.530 10.328 ( 5.434 15.678 -2.424) 16.769 11.266 ( 14.566 -12.282 7.126) 20.342 11.650 ( 5.871 27.782 -8.224) 29.563 12.562 ( 9.358 1.857 0.558) 9.557 12.886 ( 12.989 -2.395 8.797) 15.869 13.388 ( -4.609 -5.865 4.629) 8.779 13.822 ( -1.728 3.014 -1.482) 3.777 14.108 ( -3.452 -4.649 -4.753) 7.491 14.902 ( 7.389 -6.290 2.493) 10.019 17.600 ( -12.275 -1.037 -26.806) 29.501 19.032 ( 4.181 -0.750 2.025) 4.706 19.277 ( 7.789 -1.605 -2.585) 8.363 19.673 ( -2.526 -0.989 7.542) 8.015 21.294 ( 8.921 6.980 -15.353) 19.080 22.533 ( -4.871 -11.813 12.439) 17.833 24.037 ( 8.776 -0.271 -0.957) 8.832 24.442 ( -1.177 4.259 3.365) 5.554 ======================= Grid point 266 (118/432) ======================= q-point: (-0.55 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -8.924 13.586 -5.272) 17.088 2.536 ( -16.625 6.929 -3.895) 18.427 3.067 ( 2.181 2.870 5.176) 6.307 3.120 ( -1.930 -2.635 -0.846) 3.374 3.399 ( 3.417 -9.279 2.854) 10.292 3.698 ( -6.713 -0.822 -3.457) 7.595 4.074 ( -5.571 4.844 -0.001) 7.382 4.352 ( 2.294 -7.160 0.435) 7.531 4.632 ( -5.201 -1.145 -13.212) 14.245 4.923 ( 1.313 -10.564 -0.156) 10.647 5.078 ( -3.771 -0.091 3.391) 5.072 5.895 ( -6.025 7.193 0.460) 9.394 6.021 ( -6.555 0.985 -2.824) 7.205 7.089 ( -12.470 -2.050 11.381) 17.007 7.927 ( -24.434 -5.403 36.566) 44.309 8.378 ( 4.473 -7.774 -7.444) 11.656 8.573 ( -14.271 0.971 10.971) 18.026 9.366 ( -7.620 -12.974 -0.239) 15.048 9.835 ( -7.452 -7.556 -4.188) 11.409 10.189 ( 0.999 15.461 -4.487) 16.130 11.429 ( 8.023 30.821 -2.899) 31.980 11.585 ( 12.189 -5.180 3.386) 13.670 12.636 ( 5.197 2.727 -0.813) 5.925 13.090 ( -1.794 4.177 11.951) 12.787 13.331 ( -1.398 2.383 -5.480) 6.137 13.863 ( 2.390 -6.607 0.434) 7.040 14.081 ( 1.232 -1.084 3.650) 4.002 15.152 ( 13.213 -11.354 2.402) 17.586 17.134 ( -12.005 -0.587 -27.914) 30.392 19.158 ( 3.806 -4.124 5.987) 8.206 19.373 ( 9.565 0.757 -0.602) 9.614 19.785 ( 5.692 -0.100 6.740) 8.822 21.166 ( 7.530 5.501 -16.819) 19.231 22.672 ( -12.183 -15.003 11.945) 22.720 24.137 ( 9.359 1.504 -2.092) 9.708 24.433 ( -1.456 5.357 6.054) 8.214 ======================= Grid point 267 (119/432) ======================= q-point: (-0.45 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( -13.088 15.369 -1.868) 20.273 2.169 ( -19.911 10.226 -5.656) 23.088 3.125 ( 2.940 3.538 2.732) 5.351 3.176 ( -1.527 -6.744 5.233) 8.672 3.369 ( -23.936 12.578 -0.541) 27.045 3.464 ( -4.942 -9.549 -3.617) 11.344 4.099 ( 0.007 -3.923 6.248) 7.377 4.363 ( -3.375 -1.553 -3.816) 5.326 4.560 ( 6.139 -6.933 -6.006) 11.037 5.011 ( 0.060 -4.313 0.076) 4.314 5.082 ( -0.382 -8.916 -2.818) 9.358 5.742 ( -8.674 3.580 1.036) 9.441 5.950 ( 0.952 5.534 -0.614) 5.649 7.032 ( -21.157 -4.622 13.135) 25.328 8.004 ( -25.098 -5.522 26.428) 36.863 8.260 ( -3.847 0.588 -8.181) 9.060 8.695 ( 1.533 -9.909 6.740) 12.082 9.370 ( -8.760 -14.422 0.010) 16.874 9.803 ( -3.404 -6.018 -2.052) 7.212 10.063 ( 0.505 5.786 0.844) 5.869 11.260 ( 7.846 31.453 0.721) 32.425 11.743 ( 6.881 0.559 -1.707) 7.111 12.641 ( 2.798 3.621 -2.468) 5.200 12.990 ( -15.886 10.794 7.533) 20.631 13.309 ( 6.101 0.024 -4.448) 7.550 13.937 ( -0.394 -9.060 1.039) 9.128 14.261 ( 11.189 2.887 9.938) 15.241 15.461 ( 15.314 -13.954 -1.028) 20.743 16.681 ( -11.380 1.154 -22.671) 25.394 19.284 ( 2.486 -4.000 1.533) 4.953 19.536 ( 12.202 1.807 6.038) 13.733 19.946 ( 8.851 2.886 5.473) 10.799 21.024 ( 6.932 3.248 -18.028) 19.586 22.733 ( -19.481 -19.068 10.464) 29.200 24.198 ( 7.963 3.575 -3.707) 9.483 24.473 ( 0.289 4.278 10.065) 10.940 ======================= Grid point 268 (120/432) ======================= q-point: (-0.36 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( -15.974 15.807 3.985) 22.824 1.720 ( -22.879 13.259 -5.059) 26.923 2.823 ( -27.910 26.168 7.653) 39.017 3.185 ( 0.269 -1.545 1.802) 2.389 3.340 ( -3.558 -10.388 4.228) 11.767 3.447 ( -2.384 -9.590 0.069) 9.882 4.074 ( -6.981 1.150 -2.969) 7.672 4.411 ( 2.325 -8.693 3.115) 9.523 4.653 ( 5.807 -6.421 -2.345) 8.969 5.033 ( 0.840 -1.812 0.295) 2.019 5.108 ( -0.703 -9.809 -7.104) 12.131 5.667 ( -5.035 2.401 6.604) 8.645 5.926 ( 4.145 6.037 -0.912) 7.380 6.929 ( -27.408 -9.986 15.600) 33.080 7.933 ( -27.320 -1.692 16.374) 31.896 8.187 ( 1.922 -2.508 -2.552) 4.061 8.844 ( 5.826 -8.104 -2.911) 10.397 9.389 ( -8.532 -17.207 0.378) 19.210 9.752 ( -0.892 4.136 -0.963) 4.339 10.160 ( 0.438 -11.158 6.361) 12.851 11.112 ( 3.790 26.116 1.430) 26.428 11.726 ( 2.147 7.394 -4.435) 8.886 12.600 ( 2.788 5.631 -4.713) 7.854 12.764 ( -15.027 9.413 5.823) 18.663 13.352 ( 3.670 -0.847 -0.065) 3.767 14.029 ( 2.223 -8.789 -2.723) 9.466 14.460 ( 11.960 7.856 2.485) 14.523 15.737 ( 13.700 -14.220 -6.249) 20.711 16.387 ( -7.163 1.491 1.437) 7.456 19.338 ( 4.939 -0.105 -2.885) 5.721 19.752 ( 9.819 1.431 6.243) 11.724 20.069 ( 6.917 7.647 5.064) 11.488 20.904 ( 8.604 0.082 -17.686) 19.668 22.723 ( -26.491 -24.587 8.986) 37.243 24.214 ( 6.665 4.262 -3.855) 8.800 24.581 ( 1.329 2.305 10.224) 10.564 ======================= Grid point 269 (121/432) ======================= q-point: (-0.27 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.206 ( -18.405 16.308 6.621) 25.466 1.315 ( -17.489 17.009 8.394) 25.800 2.376 ( -28.400 26.234 19.887) 43.477 3.226 ( 1.464 -0.968 1.524) 2.325 3.311 ( -8.629 -6.746 -1.651) 11.077 3.612 ( 3.043 -9.534 7.041) 12.236 3.937 ( -4.313 -0.139 -5.225) 6.776 4.505 ( -4.053 -8.738 0.972) 9.682 4.761 ( 5.299 -6.162 -2.928) 8.639 5.025 ( -1.277 -1.746 -5.722) 6.117 5.155 ( 6.047 -4.706 3.099) 8.266 5.709 ( -2.203 0.873 10.836) 11.092 5.936 ( 5.235 5.108 -0.179) 7.316 6.857 ( -30.037 -17.813 18.353) 39.451 7.742 ( -24.091 0.754 11.449) 26.684 8.254 ( 1.645 -5.581 1.675) 6.055 8.912 ( 8.368 -4.413 -10.946) 14.467 9.446 ( -6.288 -18.339 0.741) 19.401 9.740 ( 2.317 2.487 3.327) 4.757 10.282 ( -4.567 -10.558 -0.145) 11.504 10.907 ( -6.781 18.404 -4.279) 20.075 11.641 ( 4.350 13.665 0.965) 14.373 12.494 ( -0.754 11.192 -2.577) 11.510 12.616 ( -8.364 2.249 3.681) 9.411 13.405 ( 3.216 0.221 -0.479) 3.259 13.972 ( -0.087 3.005 -20.044) 20.268 14.459 ( 4.852 7.459 -6.005) 10.735 15.923 ( 8.547 -12.948 -6.629) 16.871 16.677 ( 13.070 -10.962 39.279) 42.824 19.359 ( 10.065 5.127 -6.918) 13.246 19.852 ( 2.907 1.959 -2.522) 4.319 20.125 ( 2.367 9.592 7.288) 12.277 20.870 ( 12.685 -1.869 -13.837) 18.864 22.656 ( -34.265 -31.422 8.017) 47.178 24.226 ( 6.276 3.382 -3.238) 7.830 24.640 ( -2.601 2.665 1.627) 4.064 ======================= Grid point 270 (122/432) ======================= q-point: (-0.18 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.075 ( -1.469 15.174 21.970) 26.741 1.135 ( -11.518 16.688 16.884) 26.386 2.127 ( -22.564 20.888 32.416) 44.679 3.222 ( -6.674 -3.958 -1.625) 7.927 3.300 ( 3.196 -0.466 3.834) 5.013 3.785 ( 4.833 -5.453 0.944) 7.347 3.875 ( -3.323 -4.861 1.410) 6.055 4.474 ( -5.297 -5.445 -5.591) 9.432 4.793 ( 0.978 -4.221 -7.175) 8.382 4.979 ( 2.372 0.757 -1.237) 2.780 5.370 ( 9.581 -4.004 6.767) 12.394 5.836 ( -0.521 -0.872 15.113) 15.147 5.969 ( 3.425 3.334 2.079) 5.212 6.858 ( -30.540 -25.858 19.767) 44.632 7.578 ( -19.574 0.919 12.303) 23.138 8.270 ( -7.621 -1.951 -4.026) 8.837 8.921 ( 8.924 -4.254 -10.081) 14.119 9.548 ( -3.196 -17.443 0.929) 17.758 9.844 ( 8.177 4.163 3.718) 9.900 10.188 ( -17.545 -11.700 -4.013) 21.467 10.532 ( -6.295 27.640 -4.790) 28.749 11.624 ( 7.340 18.610 1.816) 20.088 12.408 ( -0.010 4.229 2.003) 4.680 12.537 ( -6.172 1.372 0.580) 6.349 13.317 ( 1.767 15.976 -15.452) 22.296 13.665 ( -4.203 6.541 -4.146) 8.812 14.425 ( 0.594 0.003 -2.001) 2.087 15.996 ( 2.841 -10.452 -11.868) 16.067 17.695 ( 31.918 -34.383 40.743) 62.136 19.378 ( 20.162 11.316 -10.573) 25.423 19.760 ( -4.840 -0.165 -8.408) 9.703 20.113 ( -2.503 7.975 2.888) 8.844 20.957 ( 14.780 -1.362 -5.546) 15.845 22.499 ( -45.788 -34.426 5.920) 57.591 24.249 ( 5.452 2.332 -2.524) 6.445 24.423 ( -12.972 13.449 -9.671) 21.040 ======================= Grid point 271 (123/432) ======================= q-point: (-0.09 0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( -3.662 11.922 21.932) 25.230 1.317 ( 7.307 8.743 24.183) 26.733 2.218 ( -3.918 12.506 40.381) 42.455 3.162 ( -1.634 -2.458 -3.564) 4.627 3.408 ( 0.562 -0.610 8.353) 8.395 3.845 ( 6.211 -4.166 -6.666) 10.019 3.955 ( -4.240 -6.140 8.371) 11.214 4.352 ( -2.161 -0.450 -10.716) 10.941 4.712 ( 0.696 -1.534 -10.587) 10.720 5.032 ( 3.953 0.463 0.164) 3.983 5.559 ( 3.572 -2.748 4.573) 6.420 5.990 ( 0.108 0.095 4.152) 4.154 6.089 ( 1.294 -1.361 22.729) 22.806 6.924 ( -26.555 -27.686 17.682) 42.242 7.479 ( -16.361 0.856 10.113) 19.253 7.955 ( -18.954 14.027 -1.939) 23.659 9.051 ( 7.522 -11.398 0.667) 13.673 9.641 ( -3.162 -8.133 0.200) 8.728 9.761 ( -3.031 15.321 1.008) 15.650 10.097 ( -6.140 4.607 1.734) 7.870 10.449 ( 15.766 -4.429 3.418) 16.730 11.495 ( 4.654 25.735 -4.767) 26.583 12.397 ( -0.443 1.413 -8.951) 9.072 12.503 ( -3.761 -6.626 9.028) 11.814 13.028 ( 1.268 20.042 -4.385) 20.555 13.645 ( -0.176 1.410 5.178) 5.369 14.398 ( -1.908 -1.242 -2.598) 3.454 15.904 ( -2.886 -6.725 -16.551) 18.096 18.621 ( 15.525 -30.267 6.071) 34.554 19.521 ( 14.203 8.171 -9.006) 18.697 19.577 ( 6.763 -7.928 -11.181) 15.284 19.999 ( -2.966 8.136 -2.841) 9.114 21.145 ( 12.590 -2.920 3.257) 13.328 22.121 ( -51.627 -17.011 4.796) 54.569 23.993 ( -11.352 18.798 -2.634) 22.117 24.291 ( 4.977 1.018 -1.422) 5.275 ======================= Grid point 274 (124/432) ======================= q-point: ( 0.18 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( 7.468 -0.000 15.935) 17.598 2.534 ( 6.379 -0.000 12.737) 14.245 3.121 ( -4.654 0.000 -4.065) 6.180 3.177 ( -2.431 0.000 -4.274) 4.917 3.570 ( -1.386 0.000 -11.254) 11.339 3.783 ( 2.100 -0.000 -12.070) 12.252 3.842 ( 6.986 -0.000 -3.342) 7.744 4.063 ( 9.120 -0.000 4.549) 10.192 4.857 ( -6.375 0.000 3.428) 7.238 4.985 ( -2.009 0.000 11.793) 11.963 5.277 ( -10.325 0.000 -11.183) 15.220 6.002 ( -2.964 0.000 7.543) 8.104 6.495 ( -11.359 0.000 -9.436) 14.767 7.026 ( -4.972 0.000 7.596) 9.079 7.472 ( -19.563 0.000 45.768) 49.774 8.036 ( -11.181 0.000 19.766) 22.710 9.205 ( -17.753 0.000 -8.337) 19.613 9.221 ( -2.852 0.000 0.680) 2.932 10.208 ( -12.018 0.000 -6.372) 13.603 10.528 ( 24.795 -0.000 13.667) 28.313 10.667 ( 5.670 -0.000 -1.874) 5.972 12.104 ( 8.874 -0.000 -13.123) 15.842 12.413 ( 23.377 -0.000 9.781) 25.341 12.533 ( 8.414 -0.000 -4.302) 9.450 13.156 ( -6.346 0.000 13.617) 15.023 14.022 ( -6.687 0.000 -1.228) 6.799 14.037 ( 4.208 -0.000 -3.140) 5.250 14.849 ( -4.760 0.000 -5.983) 7.646 18.040 ( -13.107 0.000 -23.345) 26.773 18.997 ( 6.632 -0.000 -5.422) 8.566 19.198 ( 2.010 -0.000 -2.797) 3.445 19.670 ( -11.061 0.000 6.584) 12.872 21.468 ( 10.801 -0.000 -15.503) 18.894 22.236 ( 1.056 -0.000 13.642) 13.683 23.917 ( 7.037 -0.000 0.666) 7.069 24.467 ( 0.560 -0.000 2.132) 2.204 ======================= Grid point 275 (125/432) ======================= q-point: ( 0.27 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( 0.308 9.649 2.750) 10.038 2.692 ( -4.108 -8.868 1.935) 9.963 3.080 ( -1.263 3.018 2.156) 3.918 3.116 ( 1.076 -2.014 3.666) 4.319 3.372 ( -5.689 7.907 -8.651) 13.028 3.654 ( 0.435 -3.322 -9.960) 10.509 3.983 ( 9.979 -6.536 -1.105) 11.980 4.245 ( 8.562 -1.123 3.441) 9.296 4.760 ( -11.239 -1.345 -0.098) 11.320 4.952 ( -12.033 -0.335 -12.510) 17.361 5.090 ( -2.878 0.743 5.857) 6.568 6.049 ( -0.453 2.520 5.662) 6.214 6.234 ( -12.734 1.022 -7.513) 14.820 7.043 ( -7.967 -1.848 8.689) 11.933 7.697 ( -24.290 -1.306 43.948) 50.231 8.130 ( -5.753 -2.963 14.761) 16.117 8.859 ( -16.002 1.160 -10.108) 18.963 9.224 ( -4.015 -3.590 3.066) 6.198 9.933 ( -14.062 -1.893 -9.846) 17.270 10.614 ( 4.138 14.026 -3.026) 14.933 11.058 ( 20.119 -10.743 10.799) 25.235 12.043 ( 11.990 14.910 -9.878) 21.532 12.607 ( 8.575 3.685 0.956) 9.383 12.827 ( 16.532 -4.522 9.597) 19.643 13.254 ( -5.508 -6.631 11.582) 14.438 13.905 ( -3.128 5.707 -2.922) 7.134 14.015 ( -1.937 -5.829 -6.524) 8.960 14.824 ( 4.271 -2.555 0.131) 4.978 17.589 ( -12.960 -0.326 -25.837) 28.907 19.015 ( 0.618 -0.798 2.213) 2.432 19.268 ( 12.419 0.053 -4.312) 13.147 19.659 ( -2.157 -0.522 6.757) 7.112 21.396 ( 8.655 3.925 -16.648) 19.170 22.380 ( -5.749 -5.285 12.972) 15.142 24.032 ( 8.969 -0.211 0.347) 8.978 24.491 ( -0.685 1.477 3.224) 3.612 ======================= Grid point 276 (126/432) ======================= q-point: (-0.64 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.351 ( -6.323 11.527 -5.592) 14.287 2.590 ( -11.807 -0.471 -5.625) 13.087 3.083 ( -2.194 0.134 1.470) 2.644 3.173 ( -4.887 6.741 2.624) 8.729 3.255 ( 0.822 -6.968 3.316) 7.761 3.626 ( 0.542 -6.450 -3.373) 7.299 4.147 ( 5.523 -0.512 1.585) 5.768 4.307 ( -1.381 5.170 1.372) 5.525 4.585 ( -6.670 -3.466 -13.245) 15.229 4.742 ( -6.219 -10.295 -2.538) 12.292 5.089 ( -4.004 0.749 1.907) 4.498 5.985 ( -12.380 2.318 -3.925) 13.193 6.065 ( 0.352 4.681 2.602) 5.367 7.030 ( -14.973 -4.389 10.230) 18.657 7.851 ( -25.619 -3.318 37.624) 45.639 8.259 ( 0.190 -4.747 6.613) 8.143 8.561 ( -14.452 -2.278 -5.401) 15.596 9.235 ( -4.914 -3.478 3.447) 6.937 9.688 ( -12.184 -7.156 -8.148) 16.311 10.460 ( -0.054 13.511 -6.842) 15.145 11.478 ( 16.709 -5.090 7.736) 19.104 11.954 ( 12.664 26.480 -3.990) 29.623 12.679 ( 4.397 3.004 0.808) 5.386 13.115 ( 6.831 -2.109 8.090) 10.797 13.326 ( -7.688 -2.841 5.898) 10.098 13.796 ( -0.972 -0.705 -6.798) 6.903 14.032 ( 4.824 -3.943 3.644) 7.218 14.979 ( 11.245 -8.138 -0.240) 13.883 17.129 ( -12.726 -0.116 -25.279) 28.302 19.100 ( 3.352 -2.556 5.137) 6.645 19.397 ( 13.217 1.601 -1.521) 13.401 19.774 ( 6.840 -0.991 6.324) 9.368 21.262 ( 6.208 5.081 -17.271) 19.043 22.460 ( -12.654 -9.539 11.221) 19.418 24.154 ( 9.085 0.600 0.002) 9.105 24.502 ( -1.325 2.790 4.590) 5.533 ======================= Grid point 277 (127/432) ======================= q-point: (-0.55 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( -9.442 14.081 -4.511) 17.543 2.309 ( -15.532 6.569 -6.736) 18.159 3.057 ( -3.885 -5.740 2.819) 7.482 3.171 ( -1.738 2.542 5.258) 6.093 3.287 ( -6.746 -10.456 -1.946) 12.595 3.600 ( -7.490 9.493 -0.378) 12.098 4.072 ( -5.798 3.370 5.536) 8.697 4.328 ( -2.695 -2.556 -4.152) 5.571 4.452 ( 5.114 -5.732 -7.129) 10.480 4.824 ( 1.209 -13.674 -0.716) 13.746 5.030 ( -4.203 -1.137 -1.872) 4.740 5.795 ( -10.169 2.547 0.850) 10.517 6.046 ( 1.437 5.750 0.182) 5.929 6.939 ( -24.954 -6.419 12.052) 28.446 7.925 ( -23.958 -3.685 27.669) 36.785 8.234 ( -2.100 -1.832 -11.494) 11.827 8.533 ( -4.559 -9.437 11.426) 15.504 9.220 ( -6.675 -3.962 1.834) 7.976 9.570 ( -9.079 -14.225 -3.800) 17.298 10.272 ( 0.415 12.468 -5.629) 13.686 11.743 ( 11.837 4.328 3.866) 13.183 11.841 ( 10.771 29.534 -0.744) 31.445 12.684 ( -0.203 2.250 -0.617) 2.342 13.157 ( -13.611 8.248 8.863) 18.217 13.301 ( 6.325 -1.970 -5.637) 8.699 13.762 ( -2.619 -10.543 -2.428) 11.131 14.280 ( 13.952 -0.280 10.637) 17.547 15.222 ( 14.405 -13.336 -3.691) 19.974 16.701 ( -11.609 1.108 -19.750) 22.936 19.232 ( 6.859 -2.193 1.441) 7.344 19.568 ( 12.374 1.840 4.764) 13.387 19.976 ( 12.258 0.764 5.772) 13.570 21.090 ( 4.460 4.204 -18.086) 19.096 22.457 ( -19.765 -13.402 8.889) 25.482 24.249 ( 7.520 2.348 -1.012) 7.943 24.527 ( -0.801 2.271 6.757) 7.174 ======================= Grid point 278 (128/432) ======================= q-point: (-0.45 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( -11.828 16.081 0.369) 19.966 1.940 ( -17.061 12.859 -4.372) 21.807 3.116 ( -12.842 2.133 3.224) 13.412 3.155 ( -5.665 -10.360 4.511) 12.640 3.265 ( -5.847 -11.583 0.114) 12.976 3.323 ( -3.736 22.265 2.776) 22.746 4.075 ( -6.007 -1.130 -1.130) 6.216 4.271 ( -0.224 -7.214 -0.176) 7.220 4.553 ( 5.789 -5.399 -0.825) 7.959 4.929 ( 0.655 -10.769 -1.577) 10.904 4.984 ( -1.236 -4.080 -2.574) 4.980 5.704 ( -6.745 1.836 6.191) 9.338 6.021 ( 2.890 5.301 -1.017) 6.123 6.769 ( -32.435 -9.196 14.440) 36.676 7.896 ( -24.223 -1.742 18.125) 30.303 8.130 ( 2.758 -4.201 -9.336) 10.602 8.705 ( 0.243 -8.851 8.264) 12.111 9.181 ( -7.357 -6.842 0.396) 10.055 9.569 ( -9.313 -18.486 -1.476) 20.752 10.169 ( 3.372 7.727 -1.021) 8.492 11.666 ( 7.515 35.826 0.388) 36.608 11.855 ( 6.672 7.534 0.316) 10.068 12.639 ( -2.243 0.379 -1.572) 2.766 12.961 ( -12.107 12.044 4.459) 17.650 13.342 ( 5.245 -0.611 -2.563) 5.870 13.833 ( -0.152 -13.772 -1.992) 13.916 14.554 ( 13.178 3.591 5.005) 14.547 15.476 ( 14.095 -16.031 -7.547) 22.641 16.411 ( -7.796 1.362 -2.896) 8.427 19.337 ( 10.077 -0.065 -4.145) 10.896 19.777 ( 9.641 1.444 6.955) 11.976 20.185 ( 12.187 5.803 5.978) 14.762 20.915 ( 5.249 1.307 -18.515) 19.289 22.371 ( -26.435 -17.252 7.215) 32.380 24.286 ( 5.448 4.129 -2.150) 7.166 24.597 ( -0.322 -0.073 7.531) 7.538 ======================= Grid point 279 (129/432) ======================= q-point: (-0.36 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( -12.852 18.481 6.185) 23.344 1.609 ( -12.158 17.661 5.192) 22.061 2.790 ( -20.800 19.659 7.271) 29.530 3.171 ( -8.493 -9.508 0.129) 12.749 3.265 ( 3.657 7.000 2.638) 8.327 3.418 ( 0.094 -12.489 9.968) 15.979 3.939 ( -4.936 0.219 -7.033) 8.595 4.347 ( -2.999 -9.483 0.963) 9.992 4.663 ( 4.025 -5.442 -0.424) 6.782 4.974 ( 0.073 -4.091 -2.423) 4.755 5.047 ( 4.319 -7.989 2.826) 9.511 5.721 ( -3.995 0.346 10.353) 11.103 6.014 ( 3.400 4.117 -0.612) 5.375 6.596 ( -35.100 -13.235 17.914) 41.570 7.750 ( -21.763 0.848 11.257) 24.516 8.158 ( 4.620 -6.387 -4.122) 8.895 8.850 ( 3.745 -3.855 2.009) 5.738 9.165 ( -7.059 -13.015 -0.215) 14.808 9.582 ( -10.095 -18.222 0.139) 20.832 10.186 ( 2.988 1.508 0.586) 3.398 11.411 ( 1.967 35.631 -3.420) 35.849 11.863 ( 5.867 12.430 3.391) 14.157 12.592 ( -1.307 0.089 -2.447) 2.776 12.762 ( -8.958 13.853 4.619) 17.131 13.402 ( 4.982 -0.343 0.291) 5.002 13.886 ( 0.138 -10.627 -9.629) 14.341 14.607 ( 6.199 8.354 -9.474) 14.070 15.677 ( 9.974 -15.846 -8.924) 20.741 16.524 ( 4.587 -7.026 25.698) 27.033 19.412 ( 13.389 1.476 -8.613) 15.988 19.898 ( 3.858 3.128 -0.206) 4.971 20.295 ( 3.587 10.271 5.509) 12.195 20.837 ( 12.442 -1.919 -14.001) 18.828 22.227 ( -31.414 -20.261 7.401) 38.107 24.290 ( 4.662 4.092 -2.355) 6.635 24.651 ( -3.153 -0.874 3.245) 4.608 ======================= Grid point 280 (130/432) ======================= q-point: (-0.27 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -2.378 18.418 16.559) 24.881 1.435 ( -6.559 18.929 12.749) 23.746 2.506 ( -15.053 21.781 17.946) 31.985 3.134 ( -6.711 -6.584 -0.432) 9.411 3.314 ( 4.368 2.925 3.755) 6.461 3.634 ( -0.829 -11.353 10.004) 15.154 3.818 ( -2.474 -2.316 -6.412) 7.252 4.367 ( -2.248 -6.933 -3.116) 7.927 4.712 ( 0.537 -5.204 -4.447) 6.867 4.985 ( 1.773 -0.043 0.676) 1.898 5.266 ( 8.082 -8.512 6.463) 13.399 5.821 ( -2.030 -1.177 13.711) 13.911 6.024 ( 1.889 2.939 1.346) 3.744 6.493 ( -34.579 -17.421 22.996) 45.033 7.599 ( -17.799 1.867 10.890) 20.949 8.212 ( -0.291 -5.568 -3.568) 6.619 8.888 ( 5.430 0.586 -6.935) 8.827 9.234 ( -5.134 -18.827 2.397) 19.661 9.658 ( -4.456 -19.570 3.972) 20.460 10.174 ( -1.295 5.341 -0.714) 5.542 11.065 ( -0.810 34.903 -4.912) 35.256 11.898 ( 7.226 13.396 5.766) 16.277 12.532 ( 0.289 3.142 -5.200) 6.083 12.603 ( -7.673 11.644 5.706) 15.067 13.459 ( 6.045 3.665 -3.576) 7.923 13.757 ( -2.905 0.957 -13.988) 14.318 14.469 ( -0.215 5.694 -6.242) 8.452 15.782 ( 4.218 -14.536 -12.444) 19.594 17.196 ( 17.360 -24.341 38.057) 48.396 19.472 ( 15.983 0.745 -13.540) 20.961 19.814 ( -2.148 5.910 -8.047) 10.212 20.239 ( -4.164 6.612 -0.557) 7.834 20.947 ( 15.216 0.556 -2.475) 15.426 22.060 ( -32.314 -19.186 8.166) 38.458 24.293 ( 4.303 2.993 -2.102) 5.647 24.556 ( -9.451 3.663 -4.480) 11.083 ======================= Grid point 281 (131/432) ======================= q-point: (-0.18 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.371 ( -1.460 16.327 15.355) 22.461 1.513 ( 7.861 13.937 20.207) 25.775 2.489 ( -2.297 17.878 29.713) 34.753 3.103 ( -2.414 -4.371 -2.115) 5.423 3.405 ( 1.401 0.532 7.165) 7.320 3.755 ( 1.226 -5.973 -6.095) 8.621 3.816 ( -3.692 -9.909 7.287) 12.842 4.338 ( 1.014 -1.233 -6.480) 6.674 4.672 ( -0.136 -3.219 -7.886) 8.519 5.044 ( 3.195 0.799 2.527) 4.151 5.484 ( 4.308 -6.357 4.561) 8.931 5.980 ( 0.183 -1.757 7.907) 8.101 6.075 ( 0.101 0.085 14.603) 14.603 6.519 ( -28.939 -20.023 28.185) 45.086 7.495 ( -14.933 1.352 10.065) 18.059 8.099 ( -9.734 3.255 -5.638) 11.710 8.915 ( 8.020 -4.730 -4.375) 10.287 9.365 ( -2.602 -18.891 0.737) 19.084 9.886 ( 3.039 -19.980 6.228) 21.148 10.068 ( -2.228 15.476 3.821) 16.096 10.737 ( 1.028 29.459 -3.038) 29.633 11.901 ( 6.564 19.263 0.021) 20.350 12.433 ( -2.035 2.413 -7.022) 7.699 12.491 ( -4.183 6.121 3.533) 8.213 13.331 ( 3.862 14.598 -11.469) 18.962 13.675 ( 0.214 1.813 4.856) 5.187 14.382 ( -2.816 -0.015 -2.756) 3.940 15.745 ( -1.515 -11.836 -16.588) 20.434 18.063 ( 15.945 -32.925 24.804) 44.199 19.450 ( -2.586 -6.455 -16.833) 18.213 19.667 ( 11.647 8.175 -10.661) 17.780 20.096 ( -6.073 3.277 -3.523) 7.749 21.121 ( 7.422 0.972 6.296) 9.781 21.893 ( -22.970 -9.768 6.150) 25.708 24.252 ( -10.428 10.375 -5.711) 15.779 24.320 ( 1.918 2.908 -2.161) 4.099 ======================= Grid point 282 (132/432) ======================= q-point: (-0.09 0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( 4.458 11.328 18.559) 22.196 1.755 ( 9.856 10.848 19.111) 24.084 2.784 ( 9.845 9.332 29.748) 32.694 3.102 ( 2.344 -3.336 -3.465) 5.351 3.487 ( -4.438 0.203 11.316) 12.157 3.748 ( 2.317 -9.381 -10.263) 14.096 3.900 ( -5.229 -7.926 2.681) 9.867 4.269 ( 4.589 4.785 -9.510) 11.593 4.636 ( 3.129 -1.794 -3.493) 5.021 5.057 ( -2.066 2.941 0.117) 3.596 5.580 ( -1.215 -3.412 2.212) 4.244 6.003 ( -4.274 -0.547 3.763) 5.720 6.381 ( 2.316 -4.116 27.747) 28.146 6.688 ( -17.984 -17.917 25.651) 36.089 7.352 ( -14.993 3.184 0.523) 15.336 7.899 ( -11.095 7.127 8.357) 15.612 9.068 ( 8.952 -9.850 -0.923) 13.342 9.487 ( -0.097 -15.653 -2.178) 15.804 9.974 ( -2.349 19.651 11.277) 22.778 10.104 ( 1.332 -4.195 3.418) 5.573 10.616 ( 8.072 4.168 -0.259) 9.089 11.755 ( 8.338 25.686 -5.117) 27.486 12.283 ( -4.064 1.164 -7.668) 8.756 12.490 ( 1.167 -3.643 -0.855) 3.919 13.187 ( 2.603 15.349 0.799) 15.589 13.752 ( 3.239 3.138 7.062) 8.379 14.310 ( -4.715 -1.760 -2.892) 5.804 15.576 ( -6.167 -8.357 -18.521) 21.234 18.613 ( 8.878 -20.318 4.122) 22.553 19.178 ( -14.480 -4.648 -14.672) 21.131 19.653 ( 2.516 -0.227 -10.458) 10.759 19.995 ( -1.470 0.599 -2.075) 2.612 21.252 ( -2.235 -4.899 8.580) 10.130 21.807 ( 0.525 4.637 2.818) 5.451 23.971 ( -7.381 11.358 -1.679) 13.650 24.342 ( 3.585 0.347 -0.777) 3.685 ======================= Grid point 286 (133/432) ======================= q-point: ( 0.27 -0.73 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( -9.292 0.000 -6.617) 11.407 2.548 ( -4.925 0.000 -4.544) 6.701 3.095 ( -2.899 0.000 0.693) 2.981 3.175 ( -3.103 0.000 3.979) 5.046 3.265 ( -8.763 0.000 2.428) 9.093 3.548 ( 4.537 -0.000 -4.314) 6.260 4.122 ( 11.443 -0.000 1.764) 11.578 4.398 ( 8.005 -0.000 3.557) 8.759 4.572 ( -13.250 0.000 -2.413) 13.468 4.607 ( -13.190 0.000 -15.091) 20.043 5.096 ( -4.175 0.000 1.301) 4.373 5.998 ( -11.653 0.000 -4.188) 12.383 6.119 ( -0.066 0.000 2.927) 2.928 6.983 ( -16.082 0.000 9.901) 18.885 7.822 ( -25.585 0.000 37.688) 45.552 8.222 ( -2.655 0.000 13.436) 13.696 8.534 ( -12.374 0.000 -12.917) 17.888 9.212 ( -4.776 0.000 5.428) 7.230 9.626 ( -13.195 0.000 -9.549) 16.288 10.583 ( -2.614 0.000 -9.001) 9.373 11.428 ( 19.820 -0.000 10.652) 22.500 12.204 ( 15.077 -0.000 -6.557) 16.441 12.731 ( 5.728 -0.000 1.212) 5.855 13.050 ( 5.035 -0.000 6.895) 8.538 13.296 ( -7.388 0.000 13.123) 15.060 13.806 ( -4.193 0.000 -12.192) 12.893 13.987 ( 7.940 -0.000 5.376) 9.589 14.907 ( 10.249 -0.000 -1.278) 10.329 17.128 ( -12.920 0.000 -24.372) 27.585 19.078 ( 3.702 -0.000 4.907) 6.147 19.412 ( 14.319 -0.000 -2.171) 14.483 19.763 ( 6.984 -0.000 6.380) 9.459 21.310 ( 5.807 -0.000 -18.026) 18.939 22.375 ( -12.895 0.000 11.540) 17.305 24.159 ( 9.007 -0.000 0.749) 9.038 24.525 ( -1.303 0.000 4.092) 4.295 ======================= Grid point 288 (134/432) ======================= q-point: (-0.64 0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -9.171 6.088 -6.098) 12.584 2.389 ( -8.889 2.724 -6.078) 11.107 3.004 ( -7.030 -0.295 -0.161) 7.039 3.122 ( -8.778 -6.977 -1.442) 11.305 3.221 ( -7.843 1.793 7.212) 10.804 3.655 ( 7.676 -0.407 2.542) 8.096 4.216 ( -9.009 9.540 -0.409) 13.128 4.291 ( -1.944 -1.465 -6.160) 6.624 4.386 ( 1.162 -0.803 -5.254) 5.440 4.598 ( 1.863 -11.779 3.259) 12.362 5.017 ( -5.577 -0.403 -3.244) 6.464 5.825 ( -10.462 0.904 0.531) 10.514 6.128 ( 0.830 3.137 0.199) 3.251 6.841 ( -26.220 -3.953 11.335) 28.837 7.884 ( -22.555 -1.198 28.239) 36.161 8.241 ( -5.326 2.564 -10.070) 11.677 8.385 ( -2.992 -7.109 10.633) 13.135 9.198 ( -6.161 0.203 4.291) 7.511 9.396 ( -10.746 -5.732 -6.355) 13.737 10.421 ( -2.039 4.696 -8.650) 10.052 11.762 ( 14.829 0.386 7.272) 16.520 12.265 ( 12.227 14.503 -3.526) 19.294 12.761 ( 1.317 7.535 0.812) 7.693 13.173 ( 1.195 -8.649 2.251) 9.017 13.278 ( -12.176 2.240 8.481) 15.007 13.634 ( -3.339 -3.635 -9.478) 10.686 14.269 ( 16.593 -0.545 11.338) 20.105 15.053 ( 13.641 -5.722 -5.373) 15.738 16.715 ( -11.662 0.450 -18.487) 21.862 19.208 ( 9.276 -0.683 1.234) 9.383 19.592 ( 12.368 0.836 3.580) 12.903 19.980 ( 14.274 -0.066 6.284) 15.596 21.148 ( 3.114 2.138 -18.746) 19.123 22.298 ( -19.748 -5.089 8.805) 22.213 24.275 ( 7.302 0.787 0.897) 7.398 24.552 ( -1.450 0.746 4.653) 4.930 ======================= Grid point 289 (135/432) ======================= q-point: (-0.55 0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( -9.251 11.039 -1.174) 14.451 2.143 ( -10.380 10.499 -3.807) 15.247 2.981 ( -6.383 -7.807 4.787) 11.163 3.066 ( -7.815 -10.548 -0.678) 13.145 3.150 ( -10.463 0.922 3.530) 11.081 3.670 ( 0.684 15.707 -0.882) 15.747 4.046 ( -4.903 -1.441 -0.609) 5.146 4.187 ( -4.291 -2.507 -3.232) 5.928 4.477 ( 5.480 -3.376 1.642) 6.643 4.751 ( 0.816 -9.749 3.330) 10.334 4.919 ( -3.085 -3.222 -4.335) 6.220 5.727 ( -8.192 0.923 5.529) 9.926 6.103 ( 1.644 4.248 -1.341) 4.748 6.626 ( -33.519 -7.293 12.898) 36.648 7.882 ( -19.813 -0.150 18.695) 27.241 8.075 ( -0.002 -1.698 -10.042) 10.185 8.554 ( -1.837 -8.052 11.701) 14.323 9.137 ( -7.456 0.304 2.166) 7.770 9.301 ( -8.314 -12.011 -2.880) 14.889 10.287 ( 0.793 5.212 -5.298) 7.474 11.965 ( 9.516 5.125 3.996) 11.523 12.213 ( 9.133 24.764 -1.305) 26.427 12.671 ( -4.177 6.823 -0.728) 8.033 13.132 ( -13.211 7.423 7.463) 16.892 13.299 ( 6.616 -6.385 -4.414) 10.199 13.595 ( -2.424 -12.538 -3.165) 13.157 14.596 ( 14.158 1.799 7.945) 16.334 15.232 ( 14.445 -11.744 -9.110) 20.726 16.430 ( -8.009 0.841 -5.451) 9.725 19.336 ( 13.159 -0.042 -5.857) 14.403 19.798 ( 9.423 0.904 7.449) 12.046 20.257 ( 17.079 2.801 6.734) 18.571 20.944 ( 2.129 1.801 -19.381) 19.581 22.145 ( -25.687 -9.422 6.827) 28.199 24.346 ( 4.683 2.767 0.019) 5.439 24.587 ( -1.372 -0.757 4.920) 5.163 ======================= Grid point 290 (136/432) ======================= q-point: (-0.45 0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( -8.441 17.243 6.402) 20.237 1.895 ( -7.613 15.636 2.454) 17.563 2.959 ( -13.002 -0.074 -0.393) 13.008 3.005 ( -7.460 -8.038 0.816) 10.997 3.183 ( -1.765 -11.507 9.234) 14.859 3.521 ( 0.530 17.489 2.625) 17.693 3.947 ( -4.289 1.356 -6.388) 7.813 4.202 ( -2.087 -7.337 1.809) 7.840 4.583 ( 2.244 -3.857 1.813) 4.817 4.854 ( -0.680 -10.850 2.366) 11.126 4.935 ( 3.236 -3.820 0.815) 5.073 5.718 ( -6.013 -0.568 9.499) 11.256 6.077 ( 0.714 3.472 -0.290) 3.557 6.406 ( -33.169 -9.544 14.700) 37.515 7.781 ( -17.507 2.801 10.530) 20.621 8.052 ( 3.914 -5.609 -5.792) 8.962 8.728 ( -2.184 -10.001 10.276) 14.505 9.062 ( -5.816 -0.366 -0.379) 5.840 9.283 ( -8.461 -15.009 -0.734) 17.245 10.241 ( 3.373 3.493 -1.599) 5.112 11.980 ( 4.346 23.166 -3.488) 23.827 12.089 ( 5.899 20.757 3.604) 21.877 12.575 ( -4.291 -0.514 -0.641) 4.369 12.980 ( -9.488 11.045 6.444) 15.923 13.388 ( 7.839 -2.146 -2.120) 8.400 13.659 ( -1.452 -15.363 -4.475) 16.067 14.723 ( 6.646 5.666 -5.505) 10.324 15.409 ( 11.625 -15.231 -10.900) 22.044 16.439 ( 0.754 -3.265 16.378) 16.717 19.421 ( 14.779 -0.062 -11.711) 18.856 19.946 ( 4.384 2.441 2.979) 5.835 20.456 ( 5.364 8.350 3.070) 10.388 20.809 ( 12.547 -1.378 -13.847) 18.736 21.956 ( -28.084 -12.239 7.602) 31.564 24.359 ( 3.000 3.963 -1.047) 5.080 24.623 ( -3.101 -2.226 2.900) 4.794 ======================= Grid point 291 (137/432) ======================= q-point: (-0.36 0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( -3.889 17.642 10.586) 20.939 1.765 ( -1.159 19.932 11.427) 23.004 2.779 ( -9.160 8.883 5.130) 13.752 3.007 ( -5.468 -8.044 1.355) 9.821 3.354 ( 1.300 -6.186 3.908) 7.432 3.499 ( 0.070 3.258 10.214) 10.721 3.801 ( -5.373 1.462 -5.025) 7.500 4.255 ( 1.099 -5.971 -0.894) 6.137 4.626 ( -1.069 -4.807 -1.662) 5.197 4.966 ( 1.303 -3.981 3.031) 5.171 5.094 ( 6.371 -9.955 6.494) 13.486 5.790 ( -4.137 -2.469 12.577) 13.468 6.059 ( -3.673 1.013 4.396) 5.818 6.268 ( -26.138 -9.514 16.161) 32.170 7.646 ( -15.112 3.695 9.073) 18.009 8.097 ( 2.651 -7.081 -5.067) 9.102 8.891 ( -1.457 -8.980 7.454) 11.761 8.974 ( -4.993 -3.633 -4.423) 7.595 9.343 ( -3.687 -16.354 3.905) 17.213 10.258 ( 3.398 4.036 1.070) 5.383 11.677 ( 0.821 36.598 -5.912) 37.081 12.089 ( 4.212 10.197 4.405) 11.879 12.530 ( -3.868 -1.716 -1.139) 4.382 12.845 ( -5.678 14.050 5.677) 16.183 13.493 ( 8.933 0.302 -1.693) 9.097 13.673 ( -2.173 -9.641 -7.481) 12.395 14.594 ( -0.602 8.142 -10.065) 12.960 15.522 ( 6.266 -15.872 -13.829) 21.964 16.874 ( 10.356 -14.253 31.605) 36.184 19.452 ( 12.665 -2.142 -17.487) 21.697 19.918 ( -0.908 5.745 -4.560) 7.391 20.329 ( -6.117 3.962 -8.112) 10.905 20.981 ( 18.089 3.366 2.141) 18.524 21.810 ( -22.773 -11.425 9.104) 27.056 24.347 ( 2.539 3.381 -1.584) 4.514 24.578 ( -7.196 -0.427 -1.810) 7.432 ======================= Grid point 292 (138/432) ======================= q-point: (-0.27 0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 3.370 15.956 10.223) 19.248 1.781 ( 4.531 18.129 15.694) 24.403 2.745 ( -0.566 10.258 15.551) 18.638 3.023 ( -2.398 -4.761 1.177) 5.460 3.423 ( 2.384 -0.089 2.367) 3.361 3.642 ( -1.211 -9.091 6.969) 11.519 3.684 ( -6.330 -0.545 -0.450) 6.370 4.311 ( 5.164 -1.827 -2.740) 6.125 4.610 ( -1.430 -3.906 -3.933) 5.725 5.050 ( 2.262 -0.716 4.265) 4.881 5.340 ( 5.046 -10.568 5.430) 12.909 5.929 ( -1.646 -4.148 11.964) 12.769 6.083 ( -2.952 0.132 10.339) 10.753 6.252 ( -22.383 -11.376 23.148) 34.151 7.529 ( -14.114 2.649 8.434) 16.654 8.086 ( -2.780 -3.584 -5.710) 7.292 8.888 ( 2.293 0.307 -4.642) 5.186 9.047 ( -4.502 -17.690 4.328) 18.760 9.562 ( 4.578 -17.450 7.329) 19.472 10.274 ( 2.215 9.191 5.158) 10.770 11.301 ( -0.476 36.340 -5.457) 36.750 12.109 ( 3.504 7.249 2.139) 8.331 12.446 ( -6.657 -0.497 -3.823) 7.693 12.710 ( -1.825 16.729 1.628) 16.907 13.484 ( 4.637 2.530 -13.745) 14.725 13.695 ( 2.767 0.971 6.871) 7.471 14.416 ( -4.293 4.201 -5.144) 7.909 15.519 ( 0.607 -14.608 -17.227) 22.595 17.574 ( 12.979 -24.503 30.986) 41.581 19.353 ( -0.331 -5.151 -20.716) 21.350 19.795 ( 4.897 6.992 -10.001) 13.149 20.118 ( -9.016 -0.228 -6.763) 11.273 21.184 ( 7.450 6.131 8.748) 13.024 21.768 ( -7.266 -5.830 6.171) 11.174 24.334 ( 1.134 2.388 -2.166) 3.418 24.401 ( -9.182 4.279 -4.854) 11.233 ======================= Grid point 293 (139/432) ======================= q-point: (-0.18 0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( 7.442 16.672 11.192) 21.414 1.939 ( 10.165 10.867 15.967) 21.825 2.912 ( 5.901 3.012 13.697) 15.215 3.059 ( 0.304 -0.603 4.475) 4.525 3.492 ( 0.924 -1.579 5.325) 5.630 3.606 ( -4.544 -5.012 -3.862) 7.790 3.761 ( -2.096 -7.075 3.741) 8.273 4.343 ( 6.832 3.858 -4.755) 9.174 4.599 ( 1.199 -2.513 -0.740) 2.881 5.103 ( -0.568 1.969 2.528) 3.255 5.493 ( 0.331 -7.093 2.063) 7.394 5.993 ( -3.438 -0.884 2.273) 4.215 6.298 ( 3.329 -5.608 21.687) 22.646 6.415 ( -17.803 -14.055 32.319) 39.484 7.391 ( -14.800 1.917 2.680) 15.163 7.982 ( -6.119 2.691 0.362) 6.694 8.933 ( 6.032 -6.787 -2.574) 9.438 9.193 ( -0.886 -17.541 2.001) 17.677 9.871 ( 5.769 -16.633 6.703) 18.838 10.284 ( 1.229 15.319 10.837) 18.805 10.959 ( 0.294 30.364 -3.625) 30.581 12.077 ( 3.465 10.835 -3.360) 11.862 12.279 ( -9.424 -1.178 -6.742) 11.648 12.572 ( 3.364 13.663 -3.411) 14.479 13.381 ( 3.033 6.397 -4.593) 8.439 13.820 ( 5.372 5.070 8.850) 11.528 14.289 ( -6.261 -0.322 -2.866) 6.893 15.401 ( -4.077 -12.167 -18.804) 22.765 18.225 ( 8.971 -23.824 19.028) 31.782 19.099 ( -9.264 -4.467 -17.176) 20.020 19.671 ( 1.711 1.758 -15.096) 15.294 19.985 ( -5.671 -1.250 -0.607) 5.839 21.254 ( -2.400 4.414 7.078) 8.680 21.863 ( 9.677 2.178 3.983) 10.689 24.140 ( -8.566 8.193 -4.584) 12.709 24.349 ( 2.056 0.417 -1.208) 2.421 ======================= Grid point 294 (140/432) ======================= q-point: (-0.09 0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( 8.622 10.938 13.739) 19.564 2.195 ( 13.002 10.127 16.191) 23.104 3.052 ( 4.825 -5.603 -3.556) 8.204 3.161 ( -1.813 -0.973 10.906) 11.098 3.545 ( -0.743 -10.945 -10.730) 15.345 3.612 ( 1.102 1.435 9.298) 9.472 3.807 ( 2.337 -0.628 1.986) 3.131 4.316 ( 6.558 8.232 -6.262) 12.247 4.683 ( 3.431 -2.305 5.684) 7.028 5.054 ( -4.574 5.472 1.344) 7.257 5.522 ( -3.811 -4.698 -1.304) 6.189 5.962 ( -6.796 -1.486 3.656) 7.859 6.640 ( -0.139 -11.454 15.281) 19.098 6.723 ( -8.580 -6.460 37.373) 38.886 7.169 ( -14.711 3.279 -0.816) 15.094 7.941 ( -6.892 3.013 11.918) 14.093 9.050 ( 2.616 -11.143 -3.218) 11.890 9.391 ( 7.239 -15.871 2.783) 17.664 10.044 ( -4.723 -2.095 2.228) 5.627 10.294 ( 0.556 13.549 12.538) 18.469 10.769 ( 5.591 15.138 -1.074) 16.173 11.985 ( 6.026 12.710 -3.356) 14.461 12.105 ( -4.516 -4.104 -9.500) 11.291 12.508 ( 6.637 6.506 -4.986) 10.546 13.344 ( 1.388 8.936 3.073) 9.551 13.937 ( 5.109 6.044 7.229) 10.719 14.185 ( -6.566 -1.952 -1.863) 7.099 15.209 ( -6.737 -8.825 -17.265) 20.527 18.584 ( -1.284 -13.894 2.463) 14.169 18.856 ( -0.597 -2.208 -13.517) 13.709 19.486 ( -6.382 -1.635 -10.552) 12.440 19.916 ( -9.974 -0.093 3.103) 10.446 21.265 ( 3.070 -1.389 -1.705) 3.776 22.039 ( 13.228 7.635 6.348) 16.540 23.957 ( -3.128 7.073 -1.968) 7.980 24.368 ( 1.738 -1.168 -0.419) 2.136 ======================= Grid point 299 (141/432) ======================= q-point: ( 0.36 -0.64 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.119 ( -7.328 0.000 -1.020) 7.399 2.244 ( -7.468 0.000 -4.070) 8.505 2.926 ( -7.403 0.000 3.837) 8.338 2.945 ( -10.469 0.000 0.343) 10.475 3.161 ( -10.479 0.000 3.414) 11.021 3.799 ( 8.248 -0.000 -0.584) 8.268 4.041 ( -5.459 0.000 -8.085) 9.755 4.176 ( -8.532 0.000 -0.517) 8.547 4.448 ( 5.431 -0.000 3.118) 6.262 4.651 ( 0.683 -0.000 6.738) 6.773 4.890 ( -3.895 0.000 -5.100) 6.418 5.735 ( -8.768 0.000 5.178) 10.183 6.145 ( 1.646 -0.000 -1.918) 2.527 6.556 ( -33.882 0.000 12.683) 36.178 7.881 ( -17.708 0.000 18.853) 25.865 8.066 ( -2.234 0.000 -9.902) 10.151 8.477 ( -2.030 0.000 12.525) 12.688 9.161 ( -6.423 0.000 2.872) 7.036 9.181 ( -8.767 0.000 -3.485) 9.434 10.332 ( -0.281 0.000 -6.611) 6.617 12.012 ( 10.832 -0.000 5.867) 12.319 12.391 ( 4.590 -0.000 -3.516) 5.782 12.872 ( 5.587 -0.000 0.288) 5.595 13.104 ( -4.062 0.000 -0.731) 4.128 13.224 ( -12.014 0.000 8.844) 14.918 13.490 ( 0.259 -0.000 -7.842) 7.846 14.614 ( 14.640 -0.000 9.755) 17.592 15.124 ( 14.623 -0.000 -10.436) 17.965 16.438 ( -8.048 0.000 -6.261) 10.197 19.336 ( 14.181 -0.000 -6.602) 15.643 19.806 ( 9.317 -0.000 7.598) 12.022 20.280 ( 19.024 -0.000 6.986) 20.266 20.962 ( 0.974 -0.000 -19.817) 19.841 22.064 ( -25.443 0.000 6.979) 26.383 24.371 ( 4.502 -0.000 1.249) 4.672 24.579 ( -1.811 0.000 3.566) 3.999 ======================= Grid point 301 (142/432) ======================= q-point: (-0.55 0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( -4.079 9.796 7.185) 12.815 2.097 ( -5.573 6.611 0.747) 8.679 2.851 ( -8.932 -4.707 2.308) 10.357 2.898 ( -9.005 -7.216 1.681) 11.661 3.092 ( -4.782 -0.623 6.349) 7.972 3.730 ( 0.457 5.384 -11.137) 12.379 4.013 ( 0.691 5.703 2.282) 6.181 4.111 ( -2.546 -3.401 2.287) 4.825 4.542 ( 1.447 -0.834 3.492) 3.871 4.676 ( -6.348 -8.084 1.426) 10.377 4.895 ( 4.656 -1.161 3.573) 5.982 5.708 ( -7.432 -0.436 8.594) 11.371 6.133 ( 0.524 2.907 -1.226) 3.198 6.278 ( -32.235 -5.174 13.761) 35.429 7.830 ( -14.902 2.192 10.928) 18.609 7.984 ( 2.670 -2.203 -6.416) 7.290 8.587 ( -5.308 -5.114 11.157) 13.371 9.073 ( -5.516 -0.228 1.545) 5.733 9.115 ( -5.697 -4.102 -0.591) 7.045 10.283 ( 2.455 1.326 -3.006) 4.101 12.162 ( 6.215 5.537 4.055) 9.259 12.372 ( 1.761 2.322 -3.243) 4.360 12.763 ( -0.892 25.346 -1.397) 25.400 13.098 ( -10.304 -0.583 7.481) 12.747 13.238 ( 2.356 -15.281 -2.662) 15.689 13.474 ( 2.669 -3.724 -2.098) 5.040 14.801 ( 5.993 3.179 -0.418) 6.797 15.204 ( 13.425 -7.610 -13.879) 20.755 16.406 ( -0.551 -0.876 11.728) 11.773 19.418 ( 15.388 -0.170 -13.787) 20.662 19.975 ( 4.553 0.887 4.823) 6.691 20.558 ( 6.803 3.361 1.087) 7.665 20.793 ( 12.869 -0.492 -13.526) 18.676 21.815 ( -26.743 -4.345 8.412) 28.369 24.413 ( 1.845 2.094 0.397) 2.819 24.587 ( -2.808 -1.532 1.776) 3.659 ======================= Grid point 302 (143/432) ======================= q-point: (-0.45 0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( -4.325 12.836 4.932) 14.415 2.084 ( 1.923 16.926 13.312) 21.620 2.797 ( -8.120 -4.592 1.449) 9.441 2.883 ( -4.089 -7.216 2.511) 8.665 3.198 ( -0.090 -7.038 8.609) 11.120 3.585 ( 0.673 1.799 -9.132) 9.332 3.933 ( -5.449 13.461 6.002) 15.713 4.175 ( 4.230 -3.338 0.047) 5.389 4.560 ( -2.852 -2.599 0.795) 3.939 4.774 ( -0.578 -15.268 4.677) 15.979 5.031 ( 5.226 -0.062 7.031) 8.760 5.746 ( -5.619 -2.414 11.236) 12.792 6.050 ( -20.801 -1.906 14.822) 25.612 6.171 ( -5.403 -2.367 2.488) 6.402 7.714 ( -13.621 3.831 7.176) 15.865 8.002 ( 4.464 -3.706 -4.715) 7.476 8.672 ( -8.772 -11.193 8.097) 16.365 9.018 ( -3.143 3.196 -0.382) 4.499 9.131 ( -1.003 -8.593 4.096) 9.572 10.307 ( 4.671 1.891 0.987) 5.135 12.166 ( 2.975 14.396 0.063) 14.701 12.304 ( 2.646 14.984 -4.401) 15.839 12.531 ( -6.128 8.622 -0.566) 10.593 13.034 ( -8.012 7.614 9.350) 14.477 13.367 ( 3.133 -17.172 -8.691) 19.499 13.562 ( 5.872 -1.032 4.254) 7.324 14.722 ( -1.692 6.733 -8.549) 11.013 15.273 ( 8.883 -12.717 -16.048) 22.320 16.705 ( 7.355 -6.275 26.165) 27.894 19.418 ( 11.893 -1.609 -20.240) 23.530 19.994 ( -1.605 3.081 -1.274) 3.700 20.374 ( -7.006 1.637 -14.963) 16.603 21.047 ( 22.159 3.802 4.931) 23.017 21.661 ( -19.381 -6.373 11.112) 23.232 24.403 ( 0.649 2.974 -0.847) 3.160 24.556 ( -5.352 -1.816 -1.162) 5.770 ======================= Grid point 303 (144/432) ======================= q-point: (-0.36 0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( 3.724 12.121 7.012) 14.490 2.112 ( 3.569 20.384 12.244) 24.044 2.797 ( -2.069 -2.862 5.304) 6.372 2.951 ( -0.437 -4.650 5.209) 6.996 3.335 ( -0.189 -8.212 2.713) 8.651 3.520 ( 1.421 -5.491 -7.500) 9.404 3.823 ( -7.040 15.002 12.142) 20.543 4.281 ( 8.454 -1.781 -0.367) 8.648 4.549 ( -2.655 -2.943 -0.191) 3.968 4.957 ( 0.268 -12.578 5.437) 13.705 5.197 ( 4.928 -3.537 7.496) 9.643 5.852 ( -3.715 -4.447 12.693) 13.953 6.040 ( -15.822 -4.884 22.244) 27.731 6.158 ( -3.702 -0.814 3.152) 4.930 7.578 ( -13.907 2.814 5.737) 15.304 8.028 ( 2.852 -1.976 -4.258) 5.493 8.727 ( -9.230 -15.684 2.635) 18.388 8.959 ( -0.948 3.144 1.181) 3.490 9.318 ( 5.595 -11.203 7.990) 14.854 10.387 ( 5.637 4.593 5.586) 9.169 11.919 ( 0.515 35.608 -6.766) 36.249 12.205 ( 0.925 5.162 -1.192) 5.378 12.422 ( -7.572 -2.129 -2.812) 8.354 12.969 ( -4.295 12.675 7.593) 15.387 13.394 ( 0.798 -12.237 -11.645) 16.911 13.731 ( 8.602 2.809 8.871) 12.672 14.511 ( -6.133 6.397 -7.730) 11.760 15.271 ( 3.324 -14.163 -18.620) 23.630 17.249 ( 11.047 -14.162 30.620) 35.499 19.279 ( 1.399 -3.576 -23.276) 23.591 19.899 ( 0.664 5.226 -7.611) 9.257 20.102 ( -9.471 -1.503 -11.414) 14.908 21.308 ( 9.461 8.112 10.075) 16.026 21.677 ( -0.908 -5.295 7.601) 9.308 24.371 ( 0.169 2.115 -1.949) 2.881 24.441 ( -7.709 0.807 -4.001) 8.723 ======================= Grid point 304 (145/432) ======================= q-point: (-0.27 0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( 12.771 14.056 6.741) 20.152 2.139 ( 5.050 14.423 11.895) 19.365 2.883 ( 2.468 -4.074 2.421) 5.343 3.052 ( -1.836 -2.374 8.682) 9.187 3.384 ( -0.539 -8.256 -4.874) 9.603 3.533 ( 1.059 -7.594 -3.390) 8.384 3.798 ( -1.910 12.186 14.330) 18.908 4.395 ( 8.671 2.188 -0.514) 8.957 4.554 ( -0.129 -2.688 1.384) 3.026 5.092 ( -0.738 -4.989 5.055) 7.140 5.358 ( 1.476 -7.171 3.802) 8.250 5.964 ( -2.436 -2.798 4.740) 6.019 6.200 ( -3.415 -5.179 13.199) 14.584 6.235 ( -9.236 -7.465 31.122) 33.311 7.421 ( -14.549 1.602 2.335) 14.822 8.009 ( -0.856 1.512 -1.077) 2.045 8.767 ( -4.106 -14.845 -1.520) 15.478 8.994 ( 1.193 -4.087 4.039) 5.869 9.615 ( 8.006 -13.035 8.649) 17.573 10.493 ( 4.803 9.581 10.628) 15.094 11.529 ( -0.888 35.632 -6.958) 36.315 12.160 ( -3.304 1.507 -1.197) 3.823 12.265 ( -5.926 -0.474 -9.591) 11.284 12.860 ( -0.439 17.594 1.186) 17.640 13.375 ( 0.943 -7.039 -6.448) 9.592 13.919 ( 8.403 6.139 10.354) 14.680 14.307 ( -8.462 2.417 -4.169) 9.738 15.180 ( -1.484 -13.648 -19.744) 24.048 17.862 ( 9.786 -18.384 26.210) 33.477 19.031 ( -5.171 -3.584 -18.946) 19.964 19.699 ( -3.285 1.343 -18.521) 18.858 19.966 ( -3.759 -0.786 -0.356) 3.857 21.368 ( -2.455 8.167 6.693) 10.841 21.883 ( 14.344 0.257 6.278) 15.660 24.243 ( -7.409 4.233 -5.625) 10.220 24.356 ( -0.050 0.390 -1.581) 1.629 ======================= Grid point 305 (146/432) ======================= q-point: (-0.18 0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( 9.190 15.999 6.705) 19.631 2.339 ( 14.351 6.891 13.428) 20.826 2.963 ( 3.388 -4.642 -2.119) 6.125 3.109 ( -8.126 -5.249 7.005) 11.944 3.362 ( -2.278 -9.666 -8.100) 12.815 3.590 ( 4.752 -4.457 -3.691) 7.488 3.892 ( 6.400 9.995 13.625) 18.069 4.442 ( 5.540 6.537 -1.283) 8.664 4.639 ( 3.384 -2.909 5.218) 6.866 5.123 ( -3.605 1.825 3.259) 5.192 5.420 ( -3.893 -6.867 -0.741) 7.928 5.940 ( -5.762 -1.048 0.867) 5.921 6.438 ( -2.820 -11.399 19.820) 23.037 6.607 ( -2.780 -7.529 33.977) 34.912 7.219 ( -14.168 2.604 -0.271) 14.408 7.986 ( -3.135 2.579 6.139) 7.360 8.838 ( -1.407 -14.565 -2.597) 14.862 9.149 ( 5.767 -11.178 4.325) 13.301 9.899 ( 5.266 -10.675 6.099) 13.375 10.558 ( -1.160 14.901 12.333) 19.378 11.175 ( 1.204 29.907 -4.892) 30.328 11.993 ( -14.740 -4.648 -6.536) 16.781 12.158 ( 8.044 4.865 -8.738) 12.834 12.720 ( 4.107 16.582 -2.994) 17.344 13.397 ( 0.819 -2.981 0.070) 3.092 14.045 ( 1.312 5.916 4.563) 7.586 14.177 ( -3.662 1.481 2.464) 4.656 15.033 ( -4.014 -11.720 -17.509) 21.449 18.336 ( 3.081 -14.662 13.502) 20.169 18.819 ( -0.784 -2.088 -13.054) 13.243 19.441 ( -6.441 -3.234 -15.061) 16.697 19.926 ( -5.386 1.072 1.965) 5.833 21.310 ( 0.368 5.922 -2.182) 6.322 22.143 ( 14.715 4.823 8.469) 17.649 24.064 ( -3.934 5.349 -4.405) 7.968 24.345 ( -0.017 -1.527 -1.138) 1.905 ======================= Grid point 306 (147/432) ======================= q-point: (-0.09 0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( 6.499 8.048 7.655) 12.869 2.630 ( 14.725 8.853 13.718) 21.986 2.992 ( 0.387 -5.648 -4.644) 7.322 3.101 ( -10.472 -7.449 4.618) 13.655 3.321 ( -2.166 -9.515 -7.756) 12.465 3.629 ( 9.435 -0.700 -8.839) 12.947 4.079 ( 10.520 7.661 9.630) 16.189 4.407 ( 3.125 9.260 -2.685) 10.135 4.782 ( 2.743 -2.430 7.227) 8.103 5.061 ( -5.856 5.406 3.827) 8.841 5.357 ( -8.779 -6.336 -5.198) 12.010 5.892 ( -7.044 -2.821 3.690) 8.437 6.655 ( -5.634 -6.129 6.747) 10.716 6.896 ( -5.498 -4.600 9.534) 11.929 7.165 ( -10.267 0.274 34.671) 36.160 8.040 ( -2.170 1.865 12.546) 12.868 8.887 ( -4.119 -13.199 -3.441) 14.249 9.438 ( 11.571 -17.407 4.931) 21.476 9.991 ( -5.443 3.906 0.408) 6.712 10.469 ( -7.355 12.502 6.197) 15.773 11.015 ( 9.253 17.748 0.891) 20.035 11.761 ( -13.248 -7.523 -10.229) 18.351 12.198 ( 14.277 3.320 -3.072) 14.977 12.648 ( 7.914 11.391 -2.352) 14.068 13.429 ( -0.419 0.985 3.090) 3.270 13.960 ( -8.139 -1.878 -2.065) 8.604 14.226 ( 3.905 7.325 5.386) 9.896 14.900 ( -3.119 -7.411 -10.702) 13.386 18.372 ( -9.377 -3.261 -10.393) 14.373 18.833 ( 11.671 -4.067 -5.723) 13.620 19.279 ( -5.249 -4.277 -4.421) 8.087 19.829 ( -12.064 3.543 4.998) 13.530 21.263 ( 6.755 -0.113 -9.366) 11.548 22.364 ( 10.277 8.463 10.625) 17.033 23.965 ( 1.311 4.053 -2.867) 5.135 24.356 ( -0.417 -3.306 -0.010) 3.333 ======================= Grid point 312 (148/432) ======================= q-point: ( 0.45 -0.55 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( -4.229 0.000 1.927) 4.647 2.256 ( 3.362 -0.000 16.386) 16.727 2.752 ( -8.158 0.000 1.041) 8.224 2.777 ( -4.397 0.000 2.995) 5.320 3.147 ( -0.183 0.000 8.011) 8.013 3.591 ( -0.530 0.000 -13.207) 13.218 4.095 ( -2.300 0.000 6.978) 7.348 4.147 ( 5.468 -0.000 -0.043) 5.468 4.562 ( -6.234 0.000 5.420) 8.261 4.580 ( -0.786 0.000 1.566) 1.752 5.034 ( 5.345 -0.000 7.943) 9.574 5.723 ( -6.058 0.000 10.486) 12.110 6.028 ( -27.450 0.000 18.321) 33.003 6.157 ( 2.474 -0.000 -2.013) 3.189 7.750 ( -13.696 0.000 5.899) 14.913 7.974 ( 6.190 -0.000 -3.954) 7.345 8.570 ( -10.759 0.000 8.527) 13.729 9.047 ( -3.895 0.000 0.753) 3.967 9.058 ( 0.240 -0.000 4.262) 4.269 10.323 ( 4.986 -0.000 0.793) 5.048 12.299 ( 2.250 -0.000 4.382) 4.926 12.330 ( 0.379 -0.000 -4.480) 4.496 12.855 ( -6.228 0.000 -9.453) 11.320 13.006 ( 1.313 -0.000 0.118) 1.318 13.151 ( -7.484 0.000 7.784) 10.798 13.559 ( 9.429 -0.000 3.619) 10.100 14.792 ( -3.781 0.000 -5.547) 6.713 15.148 ( 11.518 -0.000 -18.760) 22.014 16.653 ( 6.562 -0.000 24.098) 24.976 19.404 ( 11.791 -0.000 -21.221) 24.276 20.020 ( -2.042 0.000 0.047) 2.043 20.388 ( -7.138 0.000 -17.466) 18.869 21.084 ( 24.738 -0.000 5.239) 25.286 21.605 ( -19.571 0.000 12.486) 23.215 24.433 ( -0.420 0.000 -0.216) 0.472 24.535 ( -4.348 0.000 -1.416) 4.573 ======================= Grid point 314 (149/432) ======================= q-point: (-0.45 0.45 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( 1.937 5.280 3.846) 6.813 2.432 ( 4.006 15.646 14.055) 21.410 2.725 ( -2.622 -4.289 4.751) 6.917 2.827 ( 0.240 -8.813 3.299) 9.413 3.233 ( -0.563 -2.953 4.639) 5.528 3.455 ( 0.108 -2.085 -11.017) 11.213 4.091 ( -1.732 14.345 7.650) 16.350 4.241 ( 6.946 -3.906 2.274) 8.287 4.532 ( -2.613 1.957 1.349) 3.532 4.699 ( -1.288 -14.321 8.640) 16.775 5.187 ( 4.164 0.535 7.800) 8.858 5.795 ( -3.257 -1.981 11.502) 12.117 5.974 ( -17.365 -2.268 22.956) 28.873 6.159 ( 0.182 0.244 -0.665) 0.731 7.611 ( -13.866 0.935 2.856) 14.187 8.033 ( 7.740 1.572 -2.286) 8.222 8.514 ( -13.586 -7.959 5.210) 16.585 9.008 ( -2.837 1.960 1.557) 3.784 9.189 ( 5.815 -4.114 8.136) 10.814 10.436 ( 7.537 1.374 5.523) 9.445 12.266 ( 1.083 4.521 -2.730) 5.391 12.342 ( -2.226 -0.196 -0.121) 2.238 12.515 ( -5.176 22.899 -12.702) 26.693 13.071 ( -4.076 -9.092 3.573) 10.585 13.164 ( -3.544 -4.459 1.575) 5.910 13.767 ( 10.986 1.210 8.957) 14.226 14.607 ( -9.082 4.069 -7.188) 12.276 15.078 ( 6.818 -7.309 -21.074) 23.324 17.093 ( 10.286 -4.526 29.120) 31.214 19.237 ( 2.340 -1.305 -24.571) 24.717 19.966 ( -1.782 2.466 -2.606) 4.006 20.076 ( -8.913 -1.245 -17.585) 19.754 21.439 ( 15.285 6.748 9.370) 19.156 21.585 ( -3.132 -5.384 10.047) 11.821 24.403 ( -1.469 1.484 -1.545) 2.597 24.439 ( -5.837 -0.679 -3.913) 7.060 ======================= Grid point 315 (150/432) ======================= q-point: (-0.36 0.45 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 12.089 5.768 6.156) 14.741 2.435 ( 3.109 19.044 7.066) 20.549 2.816 ( 2.331 -3.370 3.634) 5.478 2.959 ( -2.557 -8.813 6.038) 10.985 3.266 ( -2.220 -4.987 -2.099) 5.849 3.404 ( 3.360 -6.415 -6.642) 9.827 4.053 ( 1.548 16.160 9.941) 19.036 4.410 ( 8.169 -0.775 4.461) 9.340 4.513 ( -1.001 -1.992 0.801) 2.369 4.915 ( -1.444 -13.416 9.881) 16.725 5.302 ( 1.576 -0.401 5.307) 5.551 5.910 ( -0.954 -2.817 7.870) 8.413 6.125 ( -9.213 -4.272 26.779) 28.640 6.160 ( -1.729 -1.413 6.935) 7.286 7.441 ( -14.000 0.752 0.961) 14.053 8.065 ( 3.039 5.584 -0.032) 6.357 8.499 ( -8.892 -15.252 2.303) 17.804 8.985 ( -1.412 1.161 2.522) 3.115 9.443 ( 8.976 -7.139 10.015) 15.227 10.610 ( 8.131 4.496 10.287) 13.862 12.083 ( -6.339 21.842 -14.300) 26.865 12.201 ( -4.467 10.720 1.057) 11.661 12.257 ( 0.045 -0.423 -8.821) 8.831 13.106 ( -3.503 10.711 7.382) 13.472 13.167 ( -1.561 -16.620 -5.393) 17.543 14.006 ( 9.940 3.811 11.570) 15.723 14.360 ( -11.339 3.336 -5.841) 13.184 14.966 ( 1.565 -10.769 -21.587) 24.175 17.625 ( 10.598 -9.515 28.270) 31.655 18.982 ( -2.708 -2.063 -19.892) 20.181 19.714 ( -7.886 0.546 -20.271) 21.758 19.960 ( -0.765 -0.128 -0.633) 1.001 21.500 ( -3.256 6.666 6.166) 9.647 21.873 ( 17.380 -1.156 9.080) 19.643 24.290 ( -5.717 1.582 -6.137) 8.535 24.361 ( -2.015 0.258 -1.744) 2.677 ======================= Grid point 316 (151/432) ======================= q-point: (-0.27 0.45 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( 12.431 14.962 1.460) 19.507 2.435 ( 9.520 5.918 10.710) 15.503 2.905 ( 3.446 -2.280 0.544) 4.168 2.996 ( -11.047 -7.595 4.534) 14.152 3.235 ( -1.412 -5.392 -5.251) 7.658 3.488 ( 9.110 -7.166 -5.715) 12.923 4.093 ( 6.146 13.001 9.718) 17.356 4.530 ( 0.627 3.641 8.150) 8.948 4.583 ( 7.124 -3.759 -0.376) 8.064 5.074 ( -4.074 -7.775 7.890) 11.803 5.340 ( -3.136 -1.683 0.933) 3.679 5.925 ( -4.210 -0.806 -1.198) 4.450 6.285 ( -1.560 -6.351 17.583) 18.760 6.476 ( -1.542 -7.593 31.479) 32.419 7.255 ( -13.125 1.687 0.397) 13.239 8.038 ( -3.697 3.892 4.999) 7.335 8.578 ( -1.744 -15.229 -0.319) 15.332 9.027 ( 1.762 -3.953 3.227) 5.399 9.741 ( 8.968 -7.542 9.319) 14.972 10.766 ( 2.880 9.610 12.019) 15.656 11.660 ( -4.447 21.329 -14.334) 26.080 11.977 ( -13.169 7.723 -2.584) 15.484 12.210 ( 7.225 1.981 -8.404) 11.258 12.993 ( -0.284 13.633 -2.095) 13.796 13.258 ( -1.589 -12.083 1.731) 12.309 14.114 ( -8.694 2.559 -2.403) 9.376 14.234 ( 4.514 4.340 9.912) 11.724 14.830 ( -0.975 -11.808 -18.439) 21.917 18.118 ( 6.619 -10.557 20.400) 23.905 18.789 ( 0.045 -1.495 -12.573) 12.662 19.391 ( -7.570 -2.396 -18.537) 20.166 19.945 ( -1.723 0.955 0.519) 2.037 21.431 ( -1.232 7.433 -2.149) 7.834 22.203 ( 15.258 2.326 11.407) 19.193 24.134 ( -3.538 3.009 -6.211) 7.755 24.320 ( -1.996 -1.413 -1.740) 3.001 ======================= Grid point 317 (152/432) ======================= q-point: (-0.18 0.45 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( 1.803 9.682 0.090) 9.848 2.744 ( 17.392 4.712 11.593) 21.427 2.913 ( -8.093 -4.754 -0.807) 9.420 2.968 ( -4.493 -6.377 2.300) 8.133 3.216 ( 0.830 -3.086 -3.885) 5.030 3.598 ( 13.296 -3.249 -8.951) 16.354 4.202 ( 8.080 6.832 5.899) 12.115 4.553 ( 0.110 7.992 3.562) 8.750 4.726 ( 5.315 -4.414 4.136) 8.053 5.114 ( -6.647 -0.808 5.771) 8.839 5.265 ( -8.675 -2.620 -3.298) 9.644 5.849 ( -6.974 -2.197 0.641) 7.340 6.534 ( -0.733 -7.257 13.531) 15.371 6.803 ( -4.900 -6.602 12.635) 15.075 7.181 ( -8.519 1.497 25.353) 26.788 8.056 ( -3.841 -0.079 11.020) 11.671 8.663 ( -1.288 -12.300 -2.869) 12.696 9.187 ( 6.802 -11.888 3.609) 14.165 9.980 ( 5.359 -2.890 6.171) 8.669 10.729 ( -9.379 15.473 6.282) 19.153 11.314 ( -1.551 12.832 -12.637) 18.076 11.726 ( -10.082 7.645 -2.146) 12.834 12.237 ( 11.499 1.382 -4.963) 12.601 12.864 ( 3.178 13.014 -2.691) 13.665 13.348 ( -2.508 -9.799 2.001) 10.310 13.951 ( -8.736 0.530 -1.554) 8.889 14.329 ( 0.879 3.797 2.932) 4.877 14.768 ( 2.572 -7.448 -6.575) 10.263 18.315 ( -4.737 -3.348 -2.881) 6.477 18.770 ( 9.230 -3.156 -4.352) 10.681 19.192 ( -3.509 -5.339 -6.374) 9.025 19.891 ( -7.081 3.295 2.816) 8.303 21.315 ( 3.313 5.604 -9.755) 11.727 22.485 ( 10.794 5.805 13.515) 18.244 24.023 ( 0.737 2.786 -5.285) 6.019 24.297 ( -2.279 -3.566 -0.863) 4.319 ======================= Grid point 318 (153/432) ======================= q-point: (-0.09 -0.55 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( -2.884 -0.532 -1.522) 3.304 2.801 ( -14.162 -8.381 1.469) 16.522 2.972 ( -1.785 -0.763 3.260) 3.794 3.075 ( 15.757 4.012 7.387) 17.859 3.206 ( 1.513 0.020 -3.127) 3.474 3.696 ( 15.462 0.443 -9.195) 17.995 4.260 ( 0.362 2.808 -1.198) 3.075 4.504 ( 2.602 10.057 -0.622) 10.407 4.860 ( 1.154 -4.744 3.755) 6.159 5.074 ( -7.643 0.953 5.618) 9.534 5.098 ( -10.037 -0.027 -4.552) 11.021 5.816 ( -6.031 -4.656 3.684) 8.464 6.509 ( -11.194 0.421 -6.502) 12.953 6.920 ( -0.467 -6.201 11.080) 12.705 7.507 ( -10.945 0.815 45.012) 46.331 8.191 ( 0.857 -1.223 14.262) 14.340 8.676 ( -4.964 -10.576 -4.330) 12.459 9.475 ( 10.232 -18.987 3.032) 21.781 9.990 ( -6.694 12.658 0.769) 14.340 10.481 ( -10.483 12.175 -0.322) 16.069 11.142 ( 0.030 -6.592 -11.139) 12.944 11.542 ( -2.577 12.066 0.260) 12.341 12.373 ( 12.972 -0.760 -0.755) 13.016 12.823 ( 6.030 8.426 1.429) 10.459 13.394 ( -4.250 -8.317 0.410) 9.349 13.853 ( -3.720 2.114 0.890) 4.370 14.268 ( -4.860 -0.820 -4.678) 6.795 14.864 ( 8.003 1.333 4.435) 9.246 18.063 ( -9.503 1.194 -21.451) 23.492 18.890 ( 10.137 -3.288 -3.175) 11.120 19.240 ( 3.020 -2.599 4.829) 6.261 19.772 ( -11.449 5.230 5.552) 13.757 21.227 ( 8.071 0.264 -14.205) 16.340 22.681 ( 4.256 9.911 14.735) 18.261 23.991 ( 5.258 1.324 -4.345) 6.948 24.304 ( -2.438 -5.570 1.006) 6.163 ======================= Grid point 325 (154/432) ======================= q-point: (-0.45 0.55 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( 10.530 -0.000 5.202) 11.745 2.719 ( -0.250 0.000 3.551) 3.560 2.741 ( 3.243 -0.000 13.232) 13.624 2.810 ( 1.572 -0.000 -1.193) 1.973 3.226 ( -3.382 0.000 0.820) 3.480 3.346 ( 3.327 -0.000 -8.966) 9.563 4.256 ( 8.476 -0.000 0.370) 8.484 4.364 ( 3.037 -0.000 11.923) 12.303 4.493 ( -3.393 0.000 -0.703) 3.465 4.772 ( -0.268 0.000 14.529) 14.532 5.304 ( 1.184 -0.000 5.548) 5.673 5.885 ( 0.376 -0.000 7.808) 7.818 6.086 ( -8.455 0.000 28.184) 29.425 6.152 ( -2.374 0.000 2.783) 3.658 7.447 ( -13.604 0.000 0.322) 13.607 8.158 ( 11.475 -0.000 -1.242) 11.542 8.323 ( -17.612 0.000 5.334) 18.402 8.999 ( -2.855 0.000 2.080) 3.533 9.382 ( 9.375 -0.000 10.605) 14.155 10.648 ( 9.445 -0.000 10.123) 13.845 12.154 ( -16.833 0.000 -8.323) 18.778 12.251 ( 4.192 -0.000 -8.340) 9.335 12.502 ( 4.819 -0.000 -10.883) 11.902 12.933 ( -5.671 0.000 -0.051) 5.671 13.200 ( -4.396 0.000 9.297) 10.284 14.039 ( 10.329 -0.000 12.206) 15.990 14.395 ( -13.607 0.000 -6.023) 14.880 14.864 ( 3.845 -0.000 -23.226) 23.542 17.545 ( 10.938 -0.000 28.532) 30.556 18.965 ( -1.881 0.000 -20.184) 20.272 19.719 ( -9.564 0.000 -20.724) 22.824 19.959 ( 0.390 -0.000 -0.847) 0.933 21.562 ( -4.425 0.000 5.360) 6.951 21.859 ( 19.256 -0.000 10.835) 22.095 24.303 ( -5.031 0.000 -6.347) 8.099 24.364 ( -2.759 0.000 -1.768) 3.277 ======================= Grid point 327 (155/432) ======================= q-point: (-0.36 0.55 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( 18.240 1.421 7.369) 19.724 2.635 ( -2.171 13.389 -0.599) 13.577 2.824 ( -5.237 -8.934 -0.556) 10.371 2.923 ( 2.259 0.001 7.670) 7.996 3.176 ( -2.087 -1.747 -2.551) 3.731 3.377 ( 11.542 -4.622 -6.705) 14.126 4.310 ( 6.265 12.290 1.336) 13.859 4.485 ( 5.197 -7.820 -1.496) 9.508 4.574 ( 0.201 0.915 14.030) 14.061 4.940 ( -2.782 -5.388 12.605) 13.988 5.336 ( -3.114 0.271 2.273) 3.865 5.914 ( -2.545 -0.389 -2.098) 3.321 6.223 ( 0.414 -1.438 12.889) 12.976 6.375 ( -2.699 -3.604 31.408) 31.729 7.275 ( -12.325 0.571 0.718) 12.359 8.123 ( -12.594 5.603 6.966) 15.445 8.356 ( 6.617 -9.919 -0.330) 11.928 8.992 ( -1.561 -0.763 2.059) 2.694 9.654 ( 10.647 -2.660 11.133) 15.632 10.876 ( 6.139 3.364 11.969) 13.866 11.773 ( -17.291 0.090 -16.642) 23.999 12.208 ( 5.592 2.326 -9.519) 11.282 12.346 ( 0.908 20.677 -4.590) 21.200 12.942 ( -3.319 -15.846 -2.870) 16.442 13.220 ( -4.642 5.236 8.461) 10.980 14.145 ( -13.067 1.071 -4.265) 13.787 14.290 ( 6.142 1.827 11.641) 13.288 14.671 ( 2.222 -5.732 -19.862) 20.792 17.996 ( 8.595 -3.747 23.220) 25.042 18.771 ( 0.805 -0.554 -12.274) 12.313 19.364 ( -8.343 -0.809 -20.238) 21.905 19.956 ( -0.129 0.332 -0.277) 0.451 21.528 ( -1.476 3.338 -2.350) 4.340 22.225 ( 15.197 0.550 13.797) 20.533 24.167 ( -2.711 0.958 -7.430) 7.968 24.302 ( -3.581 -0.608 -1.914) 4.106 ======================= Grid point 328 (156/432) ======================= q-point: (-0.27 0.55 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.447 ( -6.711 6.913 -5.331) 11.011 2.776 ( -14.771 -8.732 1.555) 17.229 2.792 ( 19.060 1.174 9.385) 21.278 2.983 ( 4.221 6.005 2.524) 7.761 3.190 ( 4.579 -1.359 -1.063) 4.893 3.525 ( 16.404 -4.730 -8.269) 18.970 4.306 ( 4.631 5.516 -0.471) 7.218 4.630 ( 3.975 -6.301 3.283) 8.141 4.672 ( 0.293 5.497 6.719) 8.686 5.047 ( -6.005 -4.608 8.381) 11.293 5.272 ( -7.249 1.531 0.762) 7.448 5.820 ( -6.761 -1.241 -2.394) 7.279 6.440 ( 3.571 -3.523 13.941) 14.816 6.687 ( -4.187 -6.363 15.570) 17.333 7.207 ( -7.693 1.259 19.821) 21.299 8.038 ( -14.077 -1.730 13.157) 19.346 8.508 ( 8.270 -5.667 -3.253) 10.540 9.040 ( 2.113 -5.715 2.058) 6.431 9.934 ( 9.681 -2.127 9.770) 13.917 10.946 ( -5.577 9.966 6.403) 13.092 11.363 ( -15.024 -2.776 -18.605) 24.074 12.052 ( -0.245 24.558 -1.711) 24.619 12.255 ( 9.042 1.492 -5.592) 10.736 12.983 ( 1.264 -6.172 -5.410) 8.304 13.198 ( -8.202 -0.909 6.998) 10.820 13.963 ( -8.034 0.666 -1.024) 8.126 14.331 ( -4.771 -3.052 -6.511) 8.630 14.683 ( 9.441 -2.243 2.543) 10.031 18.266 ( -0.436 -2.276 3.900) 4.536 18.731 ( 6.840 -1.493 -4.473) 8.308 19.118 ( -2.263 -3.156 -9.142) 9.933 19.932 ( -3.607 1.585 1.368) 4.170 21.417 ( 1.381 5.428 -9.990) 11.453 22.557 ( 10.628 2.791 16.734) 20.019 24.058 ( 0.871 1.364 -7.447) 7.621 24.244 ( -4.103 -2.481 -1.378) 4.989 ======================= Grid point 329 (157/432) ======================= q-point: (-0.18 -0.45 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( -10.523 -0.326 -5.389) 11.827 2.638 ( -18.814 -10.184 0.759) 21.407 2.998 ( 3.224 4.243 3.337) 6.288 3.124 ( 12.214 2.311 6.401) 13.982 3.264 ( 11.079 4.482 0.535) 11.963 3.685 ( 18.365 -1.558 -8.996) 20.510 4.295 ( -1.940 1.882 -2.465) 3.658 4.653 ( 3.923 5.739 -3.966) 8.003 4.721 ( -7.891 -8.637 3.501) 12.211 5.051 ( -5.647 -0.718 3.462) 6.663 5.178 ( -5.637 5.027 4.482) 8.782 5.743 ( -6.907 -3.917 1.715) 8.123 6.513 ( -8.674 0.448 -4.162) 9.632 6.803 ( 2.528 -7.519 9.271) 12.201 7.517 ( -6.733 0.310 43.205) 43.727 8.094 ( -11.509 -8.887 18.924) 23.865 8.576 ( 6.512 -1.291 -7.203) 9.796 9.203 ( 7.086 -13.046 1.843) 14.960 10.123 ( 3.971 4.303 6.257) 8.569 10.713 ( -14.952 12.666 -2.787) 19.792 11.029 ( -10.176 -4.842 -15.625) 19.264 11.848 ( 0.445 21.792 0.725) 21.808 12.357 ( 11.449 -1.040 -2.044) 11.676 12.961 ( 1.736 6.617 0.063) 6.841 13.198 ( -7.859 -13.002 1.619) 15.279 13.900 ( -0.925 2.746 2.187) 3.630 14.194 ( -7.889 -7.110 -8.229) 13.435 14.897 ( 11.215 2.219 8.934) 14.509 18.085 ( -8.196 1.225 -20.876) 22.461 18.840 ( 10.183 -2.494 -0.937) 10.526 19.184 ( 5.125 -3.386 7.776) 9.910 19.855 ( -8.739 4.112 3.486) 10.268 21.271 ( 5.610 4.141 -15.659) 17.142 22.825 ( 4.838 6.829 18.840) 20.615 24.006 ( 4.935 0.486 -6.937) 8.527 24.212 ( -4.281 -5.061 0.242) 6.633 ======================= Grid point 330 (158/432) ======================= q-point: (-0.09 -0.45 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( -12.863 -6.772 -4.657) 15.264 2.494 ( -19.293 -13.183 1.122) 23.394 3.029 ( 2.465 4.399 2.467) 5.614 3.201 ( 1.714 2.947 0.404) 3.434 3.450 ( 14.683 7.838 4.927) 17.358 3.802 ( 11.241 1.856 -8.252) 14.068 4.133 ( -12.211 -1.220 -4.724) 13.149 4.588 ( -4.893 7.413 -0.217) 8.885 4.682 ( -1.180 -10.640 -8.827) 13.875 5.022 ( -4.809 1.645 4.839) 7.018 5.157 ( 0.843 6.935 5.202) 8.710 5.740 ( -4.724 -5.896 3.398) 8.284 6.266 ( -12.192 1.366 -9.429) 15.473 7.004 ( 0.176 -4.230 11.059) 11.842 7.863 ( -14.246 3.072 42.041) 44.496 8.294 ( -11.809 -14.982 22.605) 29.578 8.555 ( 9.106 4.159 -10.537) 14.534 9.466 ( 9.404 -18.120 0.622) 20.424 10.027 ( -10.142 19.227 0.993) 21.760 10.384 ( -12.048 6.584 -6.453) 15.170 10.873 ( -1.176 -10.700 -8.693) 13.836 11.725 ( 3.765 15.386 0.533) 15.849 12.484 ( 8.464 -2.902 -2.459) 9.280 12.953 ( -4.670 1.948 8.935) 10.268 13.240 ( 0.192 -10.129 -3.157) 10.612 13.924 ( 3.929 5.152 3.799) 7.511 14.077 ( -8.347 -7.288 -3.623) 11.659 15.127 ( 12.993 5.468 8.766) 16.601 17.653 ( -9.497 1.775 -30.299) 31.802 19.013 ( 11.602 -1.068 3.146) 12.069 19.363 ( 5.024 1.030 6.092) 7.964 19.740 ( -8.943 3.697 5.957) 11.364 21.159 ( 9.018 0.014 -17.830) 19.981 22.974 ( -2.720 12.507 18.512) 22.506 24.024 ( 8.592 -1.113 -6.059) 10.572 24.230 ( -3.801 -7.503 3.506) 9.113 ======================= Grid point 338 (159/432) ======================= q-point: (-0.36 -0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( -13.516 0.000 -6.513) 15.003 2.680 ( -10.380 0.000 -0.525) 10.393 2.802 ( 18.102 -0.000 9.895) 20.630 3.079 ( 4.149 -0.000 7.315) 8.410 3.152 ( 7.041 -0.000 -3.778) 7.990 3.476 ( 18.148 -0.000 -7.697) 19.713 4.367 ( 2.153 -0.000 -4.879) 5.333 4.555 ( 6.060 -0.000 0.664) 6.096 4.725 ( -2.100 0.000 12.201) 12.380 5.003 ( -4.184 0.000 9.541) 10.418 5.286 ( -7.122 0.000 2.178) 7.448 5.809 ( -6.602 0.000 -3.790) 7.612 6.413 ( 6.118 -0.000 13.000) 14.368 6.625 ( -4.982 0.000 16.703) 17.430 7.218 ( -7.415 0.000 18.265) 19.712 8.019 ( -20.374 0.000 14.593) 25.061 8.464 ( 14.291 -0.000 -3.544) 14.723 8.993 ( 0.017 -0.000 1.311) 1.311 9.916 ( 10.935 -0.000 10.983) 15.498 11.040 ( -2.413 0.000 7.467) 7.847 11.325 ( -18.637 0.000 -19.292) 26.823 12.233 ( 10.733 -0.000 -6.076) 12.333 12.385 ( -0.292 0.000 -7.526) 7.532 12.808 ( -2.150 0.000 0.949) 2.351 13.239 ( -9.339 0.000 6.218) 11.219 13.969 ( -7.809 0.000 -0.842) 7.854 14.290 ( -5.752 0.000 -11.554) 12.906 14.671 ( 11.139 -0.000 6.735) 13.017 18.245 ( 1.276 -0.000 6.518) 6.642 18.719 ( 5.900 -0.000 -4.715) 7.553 19.091 ( -1.833 0.000 -10.340) 10.501 19.945 ( -2.477 0.000 0.899) 2.635 21.467 ( 0.973 -0.000 -10.153) 10.200 22.580 ( 10.396 -0.000 18.227) 20.983 24.070 ( 1.192 -0.000 -8.518) 8.601 24.221 ( -5.027 0.000 -1.385) 5.214 ======================= Grid point 339 (160/432) ======================= q-point: (-0.27 -0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( -16.088 0.850 -4.881) 16.834 2.493 ( -18.972 -5.665 -1.305) 19.843 3.076 ( 8.004 3.283 5.298) 10.144 3.169 ( 4.832 2.735 4.869) 7.384 3.306 ( 17.940 0.276 -0.112) 17.942 3.658 ( 20.974 -1.085 -7.473) 22.292 4.336 ( -0.347 2.780 -2.688) 3.882 4.537 ( -7.790 -7.500 -7.165) 12.972 4.770 ( -3.183 3.577 4.725) 6.727 5.040 ( -3.069 -0.588 5.292) 6.146 5.241 ( -4.948 2.138 6.319) 8.305 5.692 ( -7.493 -1.745 -0.209) 7.696 6.538 ( -8.218 2.466 -4.496) 9.687 6.681 ( 6.419 -5.918 9.346) 12.790 7.518 ( -4.203 -0.039 40.799) 41.015 7.970 ( -20.140 -4.309 21.585) 29.835 8.587 ( 12.737 1.176 -6.658) 14.420 9.047 ( 4.253 -5.094 0.591) 6.662 10.164 ( 8.520 1.084 9.466) 12.782 10.845 ( -17.668 2.885 -16.261) 24.185 10.996 ( -9.474 0.375 -3.022) 9.952 12.201 ( -1.517 16.357 -5.508) 17.325 12.343 ( 10.631 -0.515 -2.708) 10.982 12.893 ( 3.811 -11.300 0.959) 11.963 13.126 ( -14.970 2.749 6.020) 16.367 13.933 ( 0.528 1.047 2.649) 2.897 14.079 ( -7.848 -4.664 -11.032) 14.319 14.926 ( 11.661 0.978 10.797) 15.923 18.100 ( -7.479 0.527 -20.619) 21.939 18.811 ( 10.196 -0.935 0.723) 10.264 19.141 ( 6.356 -1.402 8.651) 10.826 19.902 ( -6.546 1.392 2.460) 7.131 21.334 ( 4.071 2.421 -16.649) 17.310 22.904 ( 5.011 2.437 22.261) 22.947 24.010 ( 5.149 0.117 -8.987) 10.358 24.147 ( -5.864 -2.173 -0.179) 6.256 ======================= Grid point 340 (161/432) ======================= q-point: (-0.18 -0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -17.832 -1.855 -2.575) 18.112 2.279 ( -22.081 -11.376 -0.193) 24.840 3.127 ( 3.097 6.543 1.509) 7.395 3.245 ( 3.331 1.486 1.597) 3.982 3.553 ( 16.775 4.081 2.562) 17.454 3.840 ( 16.024 2.652 -7.247) 17.785 4.123 ( -17.545 0.457 -6.968) 18.883 4.463 ( -7.942 -11.873 -1.923) 14.413 4.718 ( 2.630 5.090 -4.014) 6.995 5.045 ( -5.756 1.093 5.696) 8.172 5.256 ( 1.486 4.380 4.687) 6.585 5.652 ( -5.701 -4.336 3.411) 7.934 6.290 ( -11.281 1.418 -10.568) 15.523 6.930 ( 6.275 -4.062 9.652) 12.208 7.878 ( -9.162 -2.433 31.408) 32.807 8.073 ( -20.889 -7.837 35.555) 41.976 8.629 ( 12.116 3.785 -9.379) 15.783 9.213 ( 9.320 -11.367 0.041) 14.699 10.272 ( -1.232 9.486 4.831) 10.716 10.426 ( -16.528 -1.043 -14.775) 22.194 10.838 ( -2.717 4.093 -2.911) 5.710 11.992 ( -0.809 14.982 -4.083) 15.549 12.437 ( 7.087 -2.481 -3.856) 8.441 12.980 ( -17.235 0.766 9.764) 19.824 13.077 ( 8.462 -8.116 1.054) 11.773 13.930 ( -9.005 -8.591 -5.107) 13.452 13.995 ( 4.920 2.918 3.780) 6.857 15.197 ( 13.472 2.812 10.452) 17.281 17.679 ( -8.331 1.138 -31.685) 32.782 18.999 ( 12.600 -0.552 4.151) 13.278 19.363 ( 6.670 -0.594 10.547) 12.493 19.802 ( -10.195 3.081 3.508) 11.214 21.180 ( 7.811 1.872 -20.036) 21.586 23.155 ( -1.266 8.279 24.178) 25.588 24.005 ( 8.674 -1.039 -8.561) 12.232 24.112 ( -5.774 -5.897 2.370) 8.586 ======================= Grid point 341 (162/432) ======================= q-point: (-0.09 -0.36 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( -19.170 -6.338 -0.701) 20.203 2.112 ( -22.057 -15.758 1.491) 27.149 3.099 ( -0.851 3.010 -2.359) 3.918 3.282 ( 3.536 5.165 2.025) 6.579 3.590 ( -25.453 0.081 -5.700) 26.084 3.689 ( 5.645 5.329 -1.946) 8.003 4.085 ( 9.514 1.577 -0.224) 9.646 4.407 ( -9.732 -6.578 0.564) 11.760 4.705 ( 10.192 5.297 -7.392) 13.659 5.017 ( -6.003 0.267 5.514) 8.156 5.291 ( 4.206 6.070 1.294) 7.497 5.674 ( -3.136 -5.370 2.744) 6.797 6.013 ( -11.015 0.587 -9.059) 14.274 7.098 ( -1.573 0.003 10.337) 10.456 8.045 ( -14.693 -7.537 20.379) 26.230 8.234 ( -19.879 -1.573 27.252) 33.769 8.700 ( 13.055 1.778 -1.155) 13.226 9.444 ( 9.196 -13.821 -2.183) 16.744 10.054 ( -13.819 20.602 0.994) 24.827 10.154 ( -6.581 -4.759 -7.878) 11.314 10.825 ( 4.378 2.278 0.649) 4.977 11.845 ( 1.017 9.490 -4.123) 10.397 12.496 ( 5.531 -5.085 -5.447) 9.281 12.891 ( -17.564 -3.046 12.766) 21.926 13.239 ( 7.654 -3.270 -0.893) 8.371 13.894 ( -6.730 -11.108 3.808) 13.534 14.085 ( 6.771 4.344 3.667) 8.841 15.460 ( 15.348 5.668 8.040) 18.230 17.171 ( -8.838 1.239 -35.288) 36.399 19.234 ( 13.184 0.232 6.604) 14.747 19.479 ( -1.766 5.767 3.693) 7.072 19.740 ( -2.108 -2.166 6.346) 7.030 21.065 ( 9.869 -0.482 -19.894) 22.213 23.241 ( -8.988 16.969 20.367) 27.992 24.059 ( 10.387 -2.578 -7.688) 13.177 24.175 ( -3.339 -9.686 8.915) 13.581 ======================= Grid point 350 (163/432) ======================= q-point: (-0.27 -0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -19.860 0.000 0.007) 19.860 2.165 ( -23.080 0.000 -2.364) 23.201 3.209 ( -0.967 0.000 0.144) 0.977 3.239 ( 7.741 -0.000 2.257) 8.063 3.586 ( 17.806 -0.000 1.832) 17.900 3.869 ( 20.549 -0.000 -5.597) 21.297 4.144 ( -24.768 0.000 -10.602) 26.941 4.334 ( -3.614 0.000 0.662) 3.674 4.763 ( 1.022 -0.000 -3.571) 3.715 5.055 ( -5.072 0.000 5.982) 7.843 5.295 ( 0.913 -0.000 4.631) 4.720 5.611 ( -6.152 0.000 3.501) 7.078 6.305 ( -10.924 0.000 -11.236) 15.671 6.890 ( 9.755 -0.000 8.904) 13.208 7.832 ( -11.434 0.000 22.406) 25.154 8.027 ( -20.597 0.000 46.424) 50.788 8.666 ( 11.335 -0.000 -9.432) 14.746 9.110 ( 9.665 -0.000 -0.376) 9.672 10.353 ( 2.299 -0.000 7.605) 7.945 10.406 ( -16.161 0.000 -18.331) 24.437 10.890 ( -4.350 0.000 -1.289) 4.537 12.144 ( -3.685 0.000 -8.321) 9.100 12.411 ( 5.702 -0.000 -4.399) 7.202 12.965 ( 7.147 -0.000 5.020) 8.734 13.019 ( -16.702 0.000 11.464) 20.258 13.845 ( -8.402 0.000 -6.939) 10.897 14.020 ( 5.261 -0.000 3.713) 6.440 15.221 ( 13.500 -0.000 11.016) 17.424 17.689 ( -7.902 0.000 -32.201) 33.157 18.994 ( 12.883 -0.000 4.568) 13.668 19.356 ( 7.108 -0.000 11.985) 13.934 19.830 ( -10.032 0.000 2.714) 10.392 21.200 ( 7.153 -0.000 -21.002) 22.187 23.229 ( -0.370 0.000 27.446) 27.449 23.996 ( 8.936 -0.000 -9.878) 13.320 24.057 ( -7.128 0.000 1.408) 7.266 ======================= Grid point 351 (164/432) ======================= q-point: (-0.18 -0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.717 ( -22.710 1.798 3.241) 23.010 1.873 ( -24.886 -10.924 0.623) 27.185 3.137 ( -5.754 1.194 -6.474) 8.744 3.352 ( 6.527 2.605 2.395) 7.425 3.606 ( -29.809 1.016 -6.214) 30.466 3.757 ( 8.085 2.231 -1.709) 8.559 4.120 ( 15.321 2.870 -0.386) 15.592 4.281 ( -8.249 -6.748 1.324) 10.739 4.775 ( 10.552 2.412 -5.513) 12.147 5.028 ( -8.108 0.665 5.452) 9.793 5.355 ( 3.891 1.721 1.403) 4.480 5.605 ( -3.432 -2.373 4.296) 5.988 6.027 ( -10.757 0.698 -11.295) 15.613 7.103 ( 7.374 0.412 7.337) 10.411 7.870 ( -17.309 -7.602 17.285) 25.616 8.279 ( -22.625 2.946 43.311) 48.953 8.692 ( 9.891 -1.388 -8.431) 13.070 9.287 ( 13.470 -4.661 -1.681) 14.352 10.061 ( -9.594 -3.136 -11.868) 15.580 10.326 ( -9.378 8.842 1.937) 13.034 10.897 ( 6.347 3.288 2.167) 7.469 11.978 ( -3.188 4.755 -7.464) 9.406 12.420 ( 3.981 -2.994 -6.390) 8.102 12.935 ( -14.900 7.840 16.597) 23.642 13.143 ( 3.819 -8.405 4.728) 10.373 13.721 ( -7.873 -6.810 0.113) 10.410 14.136 ( 6.748 1.562 3.403) 7.717 15.523 ( 15.486 1.836 9.349) 18.182 17.186 ( -7.639 0.520 -37.392) 38.168 19.235 ( 13.735 0.002 6.390) 15.149 19.557 ( 3.681 2.806 8.891) 10.024 19.709 ( -9.967 -1.241 2.228) 10.288 21.066 ( 9.863 0.243 -21.488) 23.645 23.485 ( -5.160 10.024 28.356) 30.515 24.014 ( -4.738 -6.022 2.226) 7.979 24.029 ( 9.100 -2.386 -6.058) 11.190 ======================= Grid point 352 (165/432) ======================= q-point: (-0.09 -0.27 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( -24.151 -3.668 4.401) 24.822 1.697 ( -24.607 -15.442 3.564) 29.269 2.789 ( -32.244 -6.981 -9.769) 34.406 3.303 ( -9.469 4.216 4.533) 11.313 3.455 ( 4.585 4.398 4.504) 7.788 3.716 ( -3.081 4.537 -4.903) 7.357 4.131 ( -6.614 -1.242 0.459) 6.746 4.400 ( 13.269 -0.244 1.092) 13.316 4.812 ( 5.619 7.309 -2.917) 9.670 4.997 ( -2.765 -2.089 3.106) 4.654 5.383 ( 3.875 4.444 -3.151) 6.685 5.635 ( -1.972 -1.767 1.678) 3.135 5.795 ( -7.030 -2.826 -5.620) 9.434 7.203 ( -3.122 6.526 9.170) 11.680 7.908 ( -15.772 -12.710 11.784) 23.434 8.328 ( -17.337 9.581 23.374) 30.638 8.823 ( 8.602 -8.003 1.535) 11.849 9.411 ( 6.648 -6.192 -8.192) 12.233 10.011 ( 1.180 -7.289 3.222) 8.056 10.063 ( -10.573 15.355 -2.316) 18.786 10.986 ( 6.723 8.399 4.722) 11.749 11.819 ( -3.076 4.325 -7.665) 9.323 12.433 ( 3.707 -5.874 -6.913) 9.800 12.838 ( -15.509 8.663 12.954) 21.986 13.295 ( 2.862 -3.824 3.932) 6.186 13.800 ( -2.585 -16.969 9.723) 19.727 14.240 ( 6.656 2.795 2.382) 7.602 15.789 ( 15.811 4.765 5.033) 17.264 16.660 ( -9.962 -0.133 -31.693) 33.222 19.469 ( -4.879 5.775 -0.425) 7.572 19.495 ( 9.299 -0.350 6.814) 11.534 19.791 ( 3.104 -5.265 6.073) 8.616 20.972 ( 10.785 -0.285 -19.332) 22.139 23.490 ( -12.146 23.975 17.830) 32.252 24.070 ( 6.986 -4.182 -4.756) 9.429 24.206 ( 2.241 -11.892 13.696) 18.277 ======================= Grid point 362 (166/432) ======================= q-point: (-0.18 -0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( -27.354 0.000 1.077) 27.375 1.510 ( -25.616 0.000 10.344) 27.626 2.731 ( -35.505 0.000 -11.472) 37.312 3.346 ( -10.517 0.000 4.642) 11.495 3.490 ( 6.748 -0.000 3.629) 7.662 3.757 ( -3.690 0.000 -4.758) 6.022 4.119 ( -8.445 0.000 -0.024) 8.445 4.393 ( 17.997 -0.000 1.640) 18.071 4.895 ( 11.397 -0.000 -3.104) 11.812 4.962 ( -9.036 0.000 3.645) 9.743 5.417 ( 3.975 -0.000 -1.763) 4.349 5.621 ( 0.843 -0.000 3.175) 3.285 5.772 ( -10.098 0.000 -8.783) 13.383 7.280 ( 7.680 -0.000 4.256) 8.780 7.769 ( -20.940 0.000 16.113) 26.422 8.453 ( -22.228 0.000 37.509) 43.601 8.693 ( 8.563 -0.000 -8.077) 11.771 9.372 ( 9.433 -0.000 -10.337) 13.994 9.924 ( 2.334 -0.000 0.009) 2.334 10.223 ( -12.014 0.000 -1.001) 12.056 11.061 ( 9.284 -0.000 3.707) 9.997 11.856 ( -4.252 0.000 -7.617) 8.723 12.383 ( 4.772 -0.000 -7.209) 8.645 13.103 ( -10.655 0.000 28.742) 30.653 13.104 ( -1.925 0.000 -1.574) 2.486 13.619 ( -5.961 0.000 3.608) 6.968 14.265 ( 6.605 -0.000 2.416) 7.033 15.829 ( 15.615 -0.000 6.070) 16.753 16.659 ( -9.557 0.000 -33.536) 34.871 19.489 ( 12.643 -0.000 7.169) 14.534 19.535 ( -11.262 0.000 -3.016) 11.659 19.734 ( 3.610 -0.000 7.745) 8.545 20.971 ( 11.191 -0.000 -19.673) 22.634 23.827 ( -1.935 0.000 27.597) 27.665 23.916 ( -8.738 0.000 4.624) 9.886 24.094 ( 10.449 -0.000 -2.839) 10.828 ======================= Grid point 363 (167/432) ======================= q-point: (-0.09 -0.18 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( -26.536 -3.275 7.243) 27.701 1.296 ( -28.317 -8.025 3.885) 29.687 2.179 ( -44.623 -7.185 9.980) 46.287 3.294 ( -4.021 2.183 2.549) 5.237 3.578 ( -7.658 2.678 0.159) 8.115 3.631 ( 3.881 1.304 0.156) 4.097 4.029 ( -4.035 -0.519 -2.610) 4.834 4.609 ( 8.923 2.037 3.143) 9.677 4.885 ( 0.576 5.792 1.285) 5.960 4.995 ( 3.408 -3.369 -1.080) 4.912 5.345 ( -1.555 2.937 -13.285) 13.694 5.628 ( -3.601 1.201 5.740) 6.882 5.717 ( 4.608 -4.807 1.261) 6.777 7.337 ( -1.470 12.041 5.510) 13.323 7.717 ( -17.172 -10.998 11.108) 23.221 8.493 ( -9.364 16.402 19.034) 26.814 8.845 ( 8.144 -15.354 1.361) 17.434 9.343 ( 5.314 -3.761 -8.708) 10.872 10.006 ( -8.704 8.811 -2.565) 12.648 10.051 ( 5.006 -5.716 2.302) 7.939 11.192 ( 7.042 4.609 3.313) 9.045 11.675 ( -8.314 3.193 -11.205) 14.313 12.384 ( 5.650 -0.674 -6.198) 8.414 12.881 ( -12.876 21.010 3.095) 24.835 13.333 ( -0.058 -8.308 3.056) 8.852 13.692 ( -2.596 -20.812 2.681) 21.144 14.356 ( 5.405 1.501 0.638) 5.645 16.045 ( 12.878 3.405 -0.131) 13.321 16.338 ( -6.199 -0.965 8.499) 10.564 19.346 ( -7.466 0.214 -6.274) 9.754 19.723 ( 10.040 -0.203 6.757) 12.104 19.851 ( 1.508 -3.120 4.739) 5.871 20.914 ( 11.723 0.225 -16.866) 20.541 23.715 ( -11.301 26.952 9.777) 30.818 24.088 ( 8.010 -4.818 -2.427) 9.657 24.327 ( 4.188 -11.547 16.039) 20.202 ======================= Grid point 374 (168/432) ======================= q-point: (-0.09 -0.09 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.895 ( -29.436 0.000 4.679) 29.806 0.905 ( -23.873 0.000 13.830) 27.590 1.847 ( -41.689 0.000 37.714) 56.217 3.279 ( -1.898 0.000 1.105) 2.196 3.418 ( -10.651 0.000 -2.309) 10.899 3.752 ( 7.849 -0.000 0.561) 7.869 3.966 ( -2.704 0.000 -0.300) 2.721 4.668 ( -4.803 0.000 2.086) 5.236 4.956 ( 0.448 -0.000 -6.489) 6.504 4.976 ( 4.242 -0.000 -6.030) 7.372 5.229 ( 4.566 -0.000 -0.588) 4.604 5.704 ( -1.434 0.000 11.678) 11.766 5.805 ( 7.417 -0.000 1.804) 7.633 7.444 ( 2.448 -0.000 -2.340) 3.386 7.560 ( -18.682 0.000 15.179) 24.071 8.688 ( -1.177 0.000 -4.478) 4.630 8.859 ( 8.631 -0.000 3.294) 9.239 9.357 ( 6.842 -0.000 4.777) 8.345 9.923 ( -6.778 0.000 -0.206) 6.781 10.075 ( 4.903 -0.000 -4.715) 6.802 11.267 ( -31.958 0.000 -25.962) 41.175 11.296 ( 3.788 -0.000 -0.446) 3.815 12.423 ( 9.001 -0.000 -5.644) 10.624 12.886 ( -7.524 0.000 -3.916) 8.482 12.951 ( -20.982 0.000 -17.816) 27.526 13.593 ( -3.993 0.000 4.536) 6.043 14.421 ( 3.690 -0.000 -0.606) 3.740 16.171 ( 8.066 -0.000 -5.876) 9.979 16.979 ( 38.301 -0.000 65.552) 75.921 19.168 ( -4.029 0.000 -9.852) 10.644 19.870 ( -1.338 0.000 0.815) 1.567 19.900 ( 4.919 -0.000 5.979) 7.742 20.907 ( 13.327 -0.000 -13.346) 18.861 23.814 ( -8.603 0.000 6.813) 10.974 24.136 ( 7.286 -0.000 -5.327) 9.025 24.342 ( -8.490 0.000 -10.261) 13.318 ======================= Grid point 375 (169/432) ======================= q-point: ( 0.00 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -1.481 0.000 26.027) 26.069 1.714 ( 2.221 -0.000 20.647) 20.766 2.860 ( -0.152 0.000 28.573) 28.573 3.090 ( -1.618 0.000 -4.962) 5.219 3.608 ( 3.163 -0.000 10.114) 10.597 3.740 ( 9.540 -0.000 -8.293) 12.640 4.051 ( -6.566 0.000 -16.607) 17.858 4.119 ( -8.334 0.000 -0.866) 8.379 4.563 ( 4.665 -0.000 -0.813) 4.735 5.057 ( -1.980 0.000 3.888) 4.363 5.628 ( 3.392 -0.000 0.283) 3.404 6.076 ( 1.851 -0.000 4.058) 4.461 6.694 ( 3.040 -0.000 32.029) 32.173 7.135 ( -4.503 0.000 -7.978) 9.161 7.573 ( -18.673 0.000 7.291) 20.046 8.255 ( -20.369 0.000 30.685) 36.831 9.377 ( -6.946 0.000 0.714) 6.983 9.584 ( 6.735 -0.000 16.310) 17.646 9.749 ( -10.195 0.000 -3.613) 10.817 9.969 ( 4.747 -0.000 0.615) 4.787 10.792 ( 21.679 -0.000 10.321) 24.011 11.047 ( -5.743 0.000 -8.960) 10.642 12.151 ( 2.093 -0.000 -13.954) 14.110 12.621 ( -2.435 0.000 -5.676) 6.176 13.007 ( -2.649 0.000 15.531) 15.755 13.718 ( 2.317 -0.000 3.061) 3.839 14.351 ( -2.132 0.000 -2.863) 3.570 15.587 ( -3.066 0.000 -19.759) 19.995 18.641 ( 8.712 -0.000 -15.285) 17.593 19.284 ( -4.927 0.000 -11.453) 12.468 19.565 ( 25.702 -0.000 -4.076) 26.023 19.782 ( -9.693 0.000 -5.828) 11.311 21.257 ( 22.120 -0.000 6.435) 23.036 22.290 ( -50.801 0.000 -1.865) 50.836 23.883 ( -7.449 0.000 4.777) 8.849 24.240 ( 8.089 -0.000 -2.857) 8.579 ======================= Grid point 376 (170/432) ======================= q-point: ( 0.09 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( 1.983 0.292 24.651) 24.732 1.994 ( 6.363 -4.934 17.320) 19.100 3.043 ( 4.006 1.659 -4.556) 6.290 3.206 ( 6.685 -1.818 17.785) 19.087 3.673 ( -4.840 6.056 -8.806) 11.732 3.709 ( 2.629 3.763 2.561) 5.256 3.894 ( 7.248 -7.836 -10.754) 15.152 3.932 ( -9.118 -0.070 -8.553) 12.502 4.693 ( 6.531 0.329 7.945) 10.290 5.063 ( -5.584 -1.680 6.003) 8.369 5.619 ( -2.338 0.916 -1.849) 3.118 6.112 ( -2.729 1.130 4.244) 5.170 6.946 ( -4.106 5.347 0.132) 6.743 7.078 ( -3.317 -3.225 17.881) 18.470 7.500 ( -16.782 0.660 25.194) 30.279 8.335 ( -19.145 2.281 29.424) 35.178 9.287 ( -0.716 11.460 1.306) 11.556 9.644 ( 1.841 6.376 3.117) 7.332 9.877 ( -4.028 -16.803 9.956) 19.942 10.069 ( 8.006 -5.555 1.310) 9.832 10.788 ( -1.017 13.948 -5.229) 14.931 11.320 ( 21.032 -17.046 6.303) 27.796 12.039 ( 3.454 -1.555 -12.570) 13.128 12.473 ( -1.644 5.034 -11.178) 12.369 13.173 ( -2.277 -6.161 13.724) 15.215 13.811 ( 5.095 -1.878 3.080) 6.242 14.276 ( -4.181 0.663 -2.437) 4.885 15.297 ( -5.705 2.834 -17.964) 19.060 18.612 ( 12.200 1.630 -12.454) 17.510 18.918 ( -16.137 1.682 -18.251) 24.420 19.564 ( -7.956 3.387 -5.241) 10.111 19.853 ( 15.061 -2.696 -5.488) 16.255 21.583 ( 3.625 8.566 9.168) 13.060 21.773 ( -16.544 -6.235 3.015) 17.935 23.859 ( -5.153 -3.551 2.254) 6.651 24.313 ( 6.878 -0.028 -1.890) 7.133 ======================= Grid point 377 (171/432) ======================= q-point: ( 0.18 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( 4.481 2.182 18.901) 19.547 2.357 ( 10.302 -8.551 15.648) 20.594 3.043 ( 5.509 3.439 -4.028) 7.642 3.342 ( -7.318 -0.735 1.430) 7.492 3.462 ( 5.486 10.325 -10.723) 15.864 3.642 ( -5.179 6.547 -8.350) 11.807 3.849 ( 4.263 -8.787 2.375) 10.051 3.999 ( 6.817 -9.580 -5.201) 12.857 4.858 ( 3.789 1.078 8.673) 9.526 5.096 ( -5.967 -2.787 10.164) 12.111 5.513 ( -6.830 1.706 -4.539) 8.376 6.089 ( -4.938 2.497 3.894) 6.766 6.794 ( -9.064 -0.401 -5.495) 10.607 7.158 ( -7.582 1.994 10.706) 13.269 7.729 ( -9.872 1.721 42.237) 43.409 8.361 ( -16.984 5.450 22.985) 29.094 9.185 ( -2.221 9.077 0.418) 9.354 9.740 ( 7.665 8.963 9.544) 15.171 9.882 ( -10.948 -10.412 -3.668) 15.547 10.357 ( 7.427 -9.083 9.892) 15.346 10.641 ( 1.114 0.267 -5.831) 5.942 11.794 ( 20.805 -8.301 7.264) 23.548 11.950 ( 0.717 2.001 -11.867) 12.056 12.310 ( 7.538 2.336 -12.164) 14.500 13.342 ( -2.497 -8.057 10.493) 13.463 13.941 ( 5.210 -4.489 1.772) 7.101 14.179 ( -5.458 1.355 -1.383) 5.791 15.008 ( -5.503 4.165 -13.388) 15.062 18.467 ( -15.455 1.908 -19.818) 25.204 18.659 ( 14.002 1.044 -9.097) 16.730 19.383 ( -8.421 0.607 -3.966) 9.328 19.911 ( 0.588 -0.270 -2.999) 3.068 21.353 ( -12.478 7.458 -0.396) 14.542 22.063 ( 15.015 -7.419 10.486) 19.760 23.855 ( -1.728 -3.317 0.005) 3.740 24.375 ( 5.215 0.875 -0.790) 5.347 ======================= Grid point 378 (172/432) ======================= q-point: ( 0.27 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( 2.540 3.626 11.113) 11.962 2.733 ( 12.165 -8.336 10.838) 18.301 3.014 ( 0.690 4.204 -0.938) 4.363 3.209 ( -8.184 -0.534 -4.912) 9.560 3.323 ( 0.117 10.745 -7.716) 13.229 3.487 ( 3.795 3.193 -4.343) 6.592 4.041 ( 7.280 -12.343 -3.454) 14.740 4.109 ( 6.985 -7.728 -2.488) 10.710 4.952 ( -1.863 0.556 6.766) 7.040 5.165 ( -5.256 -2.078 9.924) 11.420 5.302 ( -12.551 2.704 -6.526) 14.402 6.039 ( -4.374 4.113 3.216) 6.811 6.591 ( -12.789 -0.809 -5.536) 13.960 7.174 ( -5.210 1.502 10.391) 11.721 8.064 ( -9.724 1.312 39.271) 40.478 8.337 ( -10.711 5.881 15.426) 19.680 9.092 ( -7.034 8.269 6.198) 12.501 9.715 ( -16.656 -18.686 -5.516) 25.632 9.905 ( 11.409 20.495 9.542) 25.323 10.382 ( -8.013 -3.437 -4.107) 9.638 10.865 ( 14.806 -13.033 6.309) 20.709 11.672 ( -5.924 12.224 -14.061) 19.551 12.164 ( 19.349 0.434 1.307) 19.398 12.440 ( 18.029 -7.284 -1.044) 19.473 13.472 ( -2.968 -6.617 7.692) 10.572 13.967 ( -5.528 2.108 -1.632) 6.137 14.146 ( 0.508 -5.923 -0.627) 5.978 14.821 ( -0.376 1.905 -6.049) 6.353 18.021 ( -14.975 0.126 -22.157) 26.743 18.764 ( 14.264 1.398 -3.996) 14.879 19.261 ( -4.638 -1.378 -2.024) 5.244 19.853 ( -6.693 -1.446 0.527) 6.868 21.168 ( -1.561 6.667 -6.727) 9.599 22.433 ( 10.428 -9.098 12.509) 18.655 23.870 ( 2.571 -1.764 -2.094) 3.756 24.415 ( 3.126 2.483 0.696) 4.052 ======================= Grid point 379 (173/432) ======================= q-point: (-0.64 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( -5.384 6.556 1.960) 8.707 2.933 ( -6.489 2.211 1.349) 6.987 3.009 ( -2.929 -0.456 -1.738) 3.436 3.127 ( 6.402 -1.815 2.189) 7.005 3.189 ( 3.258 2.870 0.786) 4.412 3.558 ( 11.225 -0.340 -1.876) 11.386 4.151 ( 4.776 -12.445 -7.316) 15.206 4.234 ( 5.043 -2.189 -0.759) 5.549 4.964 ( -8.371 -4.112 0.812) 9.362 4.998 ( -11.915 4.513 -5.551) 13.898 5.209 ( -7.131 -1.398 8.146) 10.916 5.977 ( -3.294 5.973 1.986) 7.104 6.357 ( -14.465 -0.512 -4.472) 15.150 7.227 ( -3.391 1.303 10.500) 11.111 8.233 ( -1.426 1.019 4.369) 4.708 8.433 ( -12.081 1.117 33.190) 35.338 8.989 ( -14.903 7.247 12.833) 20.960 9.624 ( -12.603 -18.231 -3.133) 22.383 9.923 ( 2.397 15.994 4.554) 16.801 10.265 ( -7.160 -5.416 -4.816) 10.188 11.189 ( 13.471 6.907 0.712) 15.155 11.374 ( -1.334 1.997 -6.377) 6.814 12.357 ( 15.864 2.163 -5.101) 16.804 12.779 ( 17.834 -4.507 6.597) 19.542 13.532 ( -6.812 -0.078 6.684) 9.544 13.842 ( -4.557 0.655 -0.775) 4.669 14.159 ( -2.987 -4.526 -3.037) 6.215 14.862 ( 8.292 -5.690 0.237) 10.059 17.562 ( -15.332 -0.156 -23.656) 28.190 18.920 ( 12.743 1.501 2.465) 13.065 19.247 ( 1.107 -4.866 -1.443) 5.194 19.799 ( -6.106 -2.693 2.423) 7.100 21.025 ( 3.498 6.825 -11.383) 13.726 22.766 ( 3.477 -12.295 13.788) 18.798 23.901 ( 7.044 0.857 -4.403) 8.351 24.435 ( 1.082 4.129 3.056) 5.249 ======================= Grid point 380 (174/432) ======================= q-point: (-0.55 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( -12.522 7.792 1.507) 14.825 2.676 ( -17.681 6.197 -3.485) 19.057 3.036 ( 3.534 2.222 1.463) 4.423 3.146 ( 1.601 -3.111 0.919) 3.618 3.408 ( 9.015 -6.170 2.132) 11.130 3.704 ( 7.260 -2.829 1.764) 7.989 4.136 ( -9.401 3.489 0.223) 10.030 4.306 ( 10.739 -7.310 -7.246) 14.875 4.678 ( -14.901 1.222 -6.103) 16.149 4.996 ( -1.149 -6.144 0.939) 6.321 5.196 ( -7.212 -2.455 3.749) 8.491 5.895 ( -3.060 6.929 0.830) 7.619 6.131 ( -13.564 0.383 -2.436) 13.786 7.289 ( -3.764 1.485 10.279) 11.047 8.225 ( 4.198 -2.063 -8.553) 9.748 8.588 ( -16.872 0.625 25.118) 30.265 8.900 ( -17.291 2.559 18.006) 25.095 9.608 ( -8.572 -15.140 -0.938) 17.424 9.844 ( -2.401 8.473 1.542) 8.940 10.168 ( -7.579 -5.467 -2.220) 9.605 11.044 ( 7.717 25.497 -4.822) 27.072 11.547 ( 6.948 -9.721 2.648) 12.239 12.438 ( 13.002 4.635 -8.835) 16.389 13.081 ( 12.336 -2.074 4.987) 13.467 13.409 ( -15.459 8.544 7.127) 19.046 13.891 ( 4.062 -6.543 2.220) 8.015 14.120 ( -2.104 -0.717 0.825) 2.370 15.084 ( 12.823 -11.057 0.026) 16.932 17.094 ( -15.624 0.915 -21.231) 26.376 19.131 ( 11.848 0.294 7.252) 13.894 19.312 ( 2.902 -7.225 -2.024) 8.045 19.802 ( -0.740 -1.860 2.873) 3.502 20.881 ( 5.816 6.818 -14.652) 17.175 23.033 ( -4.997 -16.406 13.150) 21.611 23.939 ( 11.007 3.927 -6.310) 13.282 24.456 ( 0.084 4.956 6.791) 8.407 ======================= Grid point 381 (175/432) ======================= q-point: (-0.45 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( -17.391 7.840 5.986) 19.994 2.316 ( -20.783 8.457 -4.339) 22.853 3.068 ( 2.439 3.159 -0.138) 3.993 3.259 ( 3.896 -6.003 5.125) 8.802 3.521 ( 1.246 -6.339 -2.370) 6.881 3.647 ( -22.341 4.277 3.819) 23.065 4.107 ( 8.288 -0.353 4.726) 9.547 4.408 ( 1.370 -1.742 -9.941) 10.185 4.476 ( -1.793 -5.166 0.175) 5.471 5.045 ( 0.533 -3.992 -0.664) 4.082 5.161 ( -5.027 -6.307 -1.642) 8.231 5.808 ( -3.052 6.240 1.317) 7.070 5.951 ( -9.621 2.370 0.261) 9.912 7.328 ( -6.300 0.772 9.852) 11.719 8.192 ( 2.186 -5.494 -9.805) 11.450 8.550 ( -19.812 3.679 16.700) 26.172 8.872 ( -12.065 -2.171 8.734) 15.052 9.605 ( -4.671 -5.674 -0.512) 7.367 9.774 ( -5.752 -0.629 2.024) 6.130 10.155 ( -1.940 -5.099 3.895) 6.703 10.944 ( 7.956 17.747 1.156) 19.483 11.676 ( 2.220 -4.014 -1.317) 4.772 12.430 ( 11.259 7.240 -11.465) 17.625 13.144 ( -7.637 4.805 -2.804) 9.448 13.308 ( -4.963 1.102 13.646) 14.562 14.001 ( 1.109 -6.570 -0.586) 6.689 14.185 ( 6.840 3.783 6.139) 9.939 15.358 ( 14.828 -13.218 -2.671) 20.043 16.692 ( -14.275 1.923 -10.077) 17.579 19.322 ( 1.040 -7.354 -1.463) 7.570 19.426 ( 10.945 0.034 6.478) 12.719 19.871 ( 5.198 0.766 2.548) 5.839 20.736 ( 7.307 5.759 -16.575) 19.007 23.202 ( -12.555 -20.700 9.819) 26.126 23.979 ( 12.305 5.752 -6.719) 15.154 24.520 ( 0.967 4.790 10.700) 11.763 ======================= Grid point 382 (176/432) ======================= q-point: (-0.36 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.715 ( -20.574 8.448 9.893) 24.342 1.896 ( -23.823 9.830 -3.332) 25.986 3.008 ( -9.399 11.736 7.093) 16.625 3.326 ( -17.458 -0.727 4.836) 18.131 3.457 ( 0.996 -6.692 3.696) 7.709 3.540 ( -2.205 -5.995 -1.191) 6.498 4.155 ( -9.489 1.344 -1.262) 9.667 4.418 ( 10.807 -4.514 4.723) 12.628 4.587 ( 7.615 -7.765 -5.415) 12.149 5.049 ( -1.836 -0.218 0.172) 1.857 5.125 ( -1.137 -7.108 -8.003) 10.763 5.757 ( -0.361 5.104 2.642) 5.759 5.856 ( -4.696 3.440 4.528) 7.375 7.335 ( -9.311 -1.752 9.097) 13.135 8.152 ( -4.162 -4.151 -3.809) 7.004 8.438 ( -17.033 -1.636 11.232) 20.469 8.811 ( -3.377 -0.231 -2.498) 4.207 9.578 ( -0.830 3.858 2.170) 4.503 9.750 ( -7.799 -9.729 1.128) 12.520 10.239 ( 4.602 3.944 3.446) 6.972 10.980 ( 3.173 0.662 4.910) 5.883 11.643 ( -3.275 0.973 -4.929) 5.997 12.363 ( 10.054 8.702 -12.714) 18.397 12.949 ( -13.644 3.876 2.442) 14.393 13.391 ( -2.621 -1.387 7.223) 7.808 14.007 ( -0.376 -0.634 -7.352) 7.389 14.291 ( 7.272 5.408 1.812) 9.242 15.624 ( 14.357 -13.223 -4.531) 20.038 16.549 ( -6.463 -0.428 14.856) 16.207 19.300 ( -2.066 -4.369 -7.794) 9.171 19.659 ( 10.804 1.237 6.574) 12.707 19.969 ( 6.935 3.954 3.968) 8.915 20.615 ( 9.343 2.796 -17.061) 19.652 23.288 ( -16.921 -25.470 6.133) 31.187 24.014 ( 10.929 5.426 -5.804) 13.512 24.625 ( 1.454 4.861 10.158) 11.355 ======================= Grid point 383 (177/432) ======================= q-point: (-0.27 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -23.863 9.593 5.587) 26.319 1.532 ( -19.863 12.265 10.915) 25.770 2.827 ( -28.559 12.007 26.696) 40.896 3.235 ( -2.536 -4.736 -2.387) 5.879 3.456 ( -7.013 -4.805 -2.637) 8.901 3.626 ( 5.713 -1.531 -0.134) 5.916 4.023 ( -8.816 -2.016 2.855) 9.483 4.621 ( -1.315 -9.479 -3.089) 10.056 4.688 ( 10.416 -3.745 0.959) 11.110 4.980 ( -1.255 1.353 -7.729) 7.947 5.123 ( 4.765 -2.346 -0.403) 5.326 5.775 ( 5.766 4.040 0.948) 7.104 5.881 ( -2.773 1.887 12.359) 12.806 7.327 ( -9.612 -4.858 6.758) 12.714 8.031 ( -13.912 1.406 3.176) 14.339 8.441 ( -8.487 -11.306 6.287) 15.472 8.752 ( 3.216 1.440 -4.326) 5.580 9.594 ( 2.013 4.278 5.799) 7.482 9.746 ( -5.049 -8.645 -0.587) 10.028 10.244 ( 5.158 12.609 -1.452) 13.700 11.041 ( -11.872 -14.456 -1.879) 18.800 11.499 ( -2.065 8.831 -3.525) 9.730 12.282 ( 9.462 6.624 -11.566) 16.346 12.793 ( -12.495 0.758 4.084) 13.168 13.381 ( -4.228 5.177 -2.144) 7.020 13.814 ( -5.239 7.235 -9.175) 12.805 14.350 ( 4.918 1.201 -0.097) 5.063 15.830 ( 11.320 -11.018 -8.520) 17.948 16.938 ( 12.774 -9.339 38.781) 41.885 19.177 ( 0.605 2.719 -12.795) 13.095 19.792 ( 3.270 -1.180 -0.046) 3.477 20.076 ( 4.965 7.727 8.456) 12.485 20.565 ( 14.073 -0.551 -16.054) 21.356 23.336 ( -20.424 -31.597 3.239) 37.762 24.050 ( 9.893 4.031 -4.808) 11.715 24.645 ( -2.961 8.248 1.597) 8.908 ======================= Grid point 384 (178/432) ======================= q-point: (-0.18 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -10.637 8.747 19.323) 23.728 1.358 ( -15.547 11.965 17.653) 26.391 2.687 ( -32.663 5.085 32.477) 46.341 3.275 ( 5.472 -2.530 1.094) 6.127 3.341 ( -9.679 -2.248 -2.771) 10.316 3.663 ( 8.106 1.526 -6.984) 10.808 4.045 ( -4.711 -4.707 9.328) 11.461 4.537 ( -6.757 -5.811 -10.978) 14.140 4.762 ( -2.271 -1.537 -6.912) 7.436 4.926 ( 4.388 1.921 1.835) 5.130 5.289 ( 12.999 -1.449 4.014) 13.682 5.859 ( 8.512 1.856 1.209) 8.796 6.028 ( -1.151 -0.424 19.526) 19.564 7.311 ( -6.949 -5.650 1.345) 9.057 7.888 ( -13.869 0.176 5.889) 15.068 8.396 ( -12.253 -2.252 -1.233) 12.519 8.874 ( 5.716 -10.397 8.713) 14.720 9.679 ( 3.527 3.869 6.654) 8.466 9.748 ( -1.271 -4.845 -2.301) 5.512 10.167 ( 6.246 14.748 -2.189) 16.165 10.755 ( -34.278 -11.809 -9.153) 37.393 11.401 ( 3.451 14.460 -1.728) 14.966 12.263 ( 10.102 0.461 -9.788) 14.074 12.702 ( -10.182 -2.355 5.146) 11.649 13.128 ( -7.614 16.785 -4.630) 19.004 13.687 ( -3.789 1.347 2.080) 4.527 14.391 ( 2.814 -0.336 -1.443) 3.181 15.896 ( 6.475 -7.466 -14.383) 17.451 17.814 ( 31.969 -18.931 34.851) 50.941 19.004 ( 6.288 9.603 -15.079) 18.950 19.777 ( -4.147 -4.437 -5.204) 7.998 20.102 ( -2.010 8.234 3.300) 9.096 20.662 ( 20.770 -0.500 -7.882) 22.220 23.322 ( -28.962 -36.738 -2.473) 46.846 24.099 ( 9.384 2.631 -4.073) 10.563 24.389 ( -13.439 18.757 -6.444) 23.958 ======================= Grid point 385 (179/432) ======================= q-point: (-0.09 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( -8.394 6.184 23.161) 25.400 1.431 ( 2.085 3.409 25.292) 25.605 2.653 ( -20.479 2.416 31.816) 37.914 3.198 ( -6.966 -0.725 -4.186) 8.160 3.430 ( 6.923 -1.550 7.060) 10.008 3.694 ( 10.194 0.324 -7.391) 12.596 4.131 ( -4.728 -3.543 8.677) 10.498 4.325 ( -8.441 -0.551 -12.617) 15.190 4.621 ( -0.798 0.170 -11.231) 11.261 5.010 ( 1.918 0.786 5.014) 5.425 5.510 ( 10.863 -1.071 2.955) 11.308 5.978 ( 6.436 0.047 2.920) 7.068 6.307 ( 1.747 -1.958 27.034) 27.161 7.256 ( -4.260 -3.006 -4.862) 7.129 7.762 ( -13.000 -0.226 0.146) 13.003 8.240 ( -21.061 0.922 17.487) 27.390 9.189 ( 3.351 -18.556 11.700) 22.191 9.624 ( -3.026 19.204 1.515) 19.500 9.797 ( -1.802 -14.187 -1.525) 14.382 10.078 ( -3.721 19.913 -0.850) 20.275 10.468 ( -4.889 -12.391 5.246) 14.316 11.255 ( -1.003 13.518 -5.834) 14.757 12.258 ( 6.188 -0.274 -12.584) 14.026 12.672 ( -6.288 -5.741 1.306) 8.614 12.943 ( -4.339 11.849 9.556) 15.828 13.680 ( -1.070 0.559 2.979) 3.214 14.393 ( 0.329 -0.377 -2.501) 2.550 15.805 ( 1.312 -3.602 -18.484) 18.877 18.623 ( 16.208 -19.650 -2.059) 25.555 18.961 ( 31.819 13.441 0.575) 34.546 19.643 ( -9.159 -5.360 -10.153) 14.686 19.977 ( -6.455 6.007 -3.582) 9.518 20.917 ( 22.658 0.324 1.020) 22.683 22.993 ( -49.867 -20.909 -10.434) 55.071 24.000 ( -11.461 15.166 3.275) 19.290 24.169 ( 8.791 0.972 -3.831) 9.638 ======================= Grid point 387 (180/432) ======================= q-point: ( 0.09 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( 4.397 -0.000 22.876) 23.294 2.249 ( 9.588 -0.000 14.346) 17.255 3.075 ( 7.244 -0.000 -4.278) 8.413 3.332 ( -8.144 0.000 -0.247) 8.148 3.605 ( 8.996 -0.000 -5.568) 10.580 3.712 ( -7.831 0.000 -9.813) 12.555 3.724 ( 5.335 -0.000 -8.952) 10.421 3.899 ( 4.267 -0.000 1.772) 4.620 4.868 ( 3.848 -0.000 8.740) 9.550 5.073 ( -5.713 0.000 10.812) 12.229 5.526 ( -6.714 0.000 -4.736) 8.216 6.111 ( -4.947 0.000 4.193) 6.485 6.790 ( -9.262 0.000 -6.390) 11.252 7.174 ( -7.968 0.000 10.209) 12.950 7.743 ( -10.342 0.000 42.593) 43.831 8.410 ( -19.607 0.000 26.654) 33.088 9.291 ( -3.616 0.000 -0.274) 3.627 9.677 ( -15.311 0.000 -4.961) 16.094 9.921 ( 16.659 -0.000 13.522) 21.456 10.246 ( 10.991 -0.000 6.802) 12.926 10.665 ( -6.487 0.000 -10.180) 12.071 11.714 ( 26.517 -0.000 11.813) 29.030 11.963 ( 5.469 -0.000 -11.242) 12.502 12.349 ( 3.872 -0.000 -14.420) 14.931 13.260 ( -3.737 0.000 12.725) 13.263 13.901 ( 5.770 -0.000 1.042) 5.863 14.193 ( -5.463 0.000 -1.496) 5.664 15.043 ( -6.421 0.000 -13.795) 15.217 18.484 ( -16.280 0.000 -21.057) 26.616 18.668 ( 14.596 -0.000 -9.643) 17.493 19.384 ( -10.093 0.000 -4.012) 10.861 19.908 ( 0.836 -0.000 -3.137) 3.247 21.433 ( -13.714 0.000 -2.305) 13.906 21.988 ( 15.171 -0.000 12.393) 19.589 23.824 ( -0.955 0.000 0.859) 1.285 24.382 ( 5.779 -0.000 -0.759) 5.829 ======================= Grid point 388 (181/432) ======================= q-point: ( 0.18 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( 4.306 6.430 14.462) 16.403 2.582 ( 9.600 -8.547 12.715) 18.080 3.093 ( 1.209 4.783 -3.677) 6.153 3.171 ( -3.943 -3.548 -6.684) 8.533 3.502 ( -3.945 5.754 -9.578) 11.850 3.565 ( 4.526 9.717 -5.117) 11.879 3.807 ( 6.369 -14.341 -7.033) 17.196 4.011 ( 6.802 -3.529 3.085) 8.261 4.962 ( -2.794 0.417 6.112) 6.733 5.144 ( -4.246 -0.546 11.295) 12.079 5.330 ( -11.933 0.728 -7.603) 14.168 6.090 ( -3.631 1.634 3.581) 5.355 6.584 ( -12.179 -0.081 -5.114) 13.209 7.176 ( -6.480 -0.446 8.454) 10.661 8.079 ( -11.706 0.442 40.144) 41.818 8.424 ( -18.580 3.332 23.603) 30.222 9.222 ( -5.560 7.760 1.989) 9.751 9.427 ( -15.606 -13.720 -8.285) 22.370 10.229 ( 9.508 15.930 8.563) 20.433 10.356 ( -2.686 -0.359 -1.796) 3.251 10.629 ( 12.031 -13.274 2.484) 18.087 11.857 ( 3.553 6.949 -14.055) 16.077 12.186 ( 22.903 1.968 9.500) 24.873 12.344 ( 15.239 -3.860 -6.108) 16.865 13.359 ( -4.215 -4.897 10.193) 12.068 13.965 ( 2.725 -1.380 -2.707) 4.082 14.102 ( -5.803 -0.076 -0.378) 5.816 14.842 ( -3.596 0.650 -8.085) 8.873 18.024 ( -15.576 0.149 -22.699) 27.530 18.780 ( 15.112 0.525 -4.899) 15.895 19.236 ( -6.885 -1.047 -2.599) 7.433 19.837 ( -7.518 -0.488 0.171) 7.535 21.270 ( -0.988 3.982 -7.732) 8.753 22.315 ( 8.737 -4.156 13.687) 16.761 23.846 ( 3.581 -0.821 -0.787) 3.757 24.444 ( 4.145 0.870 0.568) 4.273 ======================= Grid point 389 (182/432) ======================= q-point: ( 0.27 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( -1.938 8.883 2.452) 9.417 2.840 ( -2.411 -10.047 1.260) 10.409 3.032 ( 5.122 1.882 0.398) 5.472 3.138 ( 0.347 1.754 2.483) 3.060 3.301 ( -3.386 9.017 -4.552) 10.653 3.551 ( 6.379 -0.280 -3.519) 7.290 3.926 ( 7.500 -13.030 -6.713) 16.465 4.184 ( 7.874 -3.534 2.804) 9.074 4.923 ( -10.817 -0.697 1.658) 10.965 5.042 ( -13.699 0.888 -8.831) 16.323 5.198 ( -5.802 -0.146 8.151) 10.006 6.067 ( -1.384 4.166 2.118) 4.874 6.356 ( -14.346 0.508 -3.490) 14.773 7.211 ( -4.555 -2.266 8.175) 9.629 8.271 ( -8.290 2.571 16.298) 18.465 8.460 ( -18.716 2.470 33.267) 38.250 9.030 ( -17.869 -3.392 -0.886) 18.209 9.361 ( -6.898 -8.960 1.888) 11.464 10.049 ( -12.500 -1.663 -8.235) 15.061 10.380 ( 7.523 17.613 1.867) 19.243 11.029 ( 15.193 -14.235 8.779) 22.595 11.666 ( 7.826 18.442 -11.555) 23.127 12.397 ( 16.214 2.987 -4.490) 17.088 12.709 ( 20.205 -4.087 10.193) 22.997 13.461 ( -3.804 -6.220 8.875) 11.486 13.889 ( -5.655 3.261 -3.586) 7.448 14.064 ( -2.787 -5.452 -2.159) 6.493 14.785 ( 3.540 -3.251 -3.296) 5.828 17.560 ( -15.406 -0.003 -22.801) 27.518 18.942 ( 12.887 1.020 1.694) 13.038 19.174 ( -0.533 -3.385 -2.743) 4.389 19.763 ( -5.869 -1.534 2.015) 6.392 21.141 ( 3.657 6.050 -11.286) 13.317 22.589 ( 1.158 -8.057 13.874) 16.086 23.910 ( 7.949 0.210 -2.217) 8.255 24.488 ( 2.229 2.209 2.247) 3.859 ======================= Grid point 390 (183/432) ======================= q-point: (-0.64 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( -7.847 9.521 -1.907) 12.484 2.711 ( -13.176 -2.072 -7.287) 15.199 3.113 ( 1.713 2.687 5.054) 5.975 3.135 ( 0.613 5.751 -1.331) 5.935 3.309 ( 4.932 -5.114 4.134) 8.220 3.630 ( 4.707 -6.122 -0.469) 7.737 4.083 ( 9.474 -8.059 -2.848) 12.760 4.285 ( 1.407 2.874 1.841) 3.691 4.666 ( -16.574 -1.435 -8.860) 18.848 4.890 ( -7.313 -5.809 0.159) 9.341 5.178 ( -6.779 -0.182 2.886) 7.370 6.020 ( -0.984 7.263 0.318) 7.336 6.136 ( -13.763 0.412 -0.954) 13.802 7.266 ( -5.416 -3.691 7.896) 10.262 8.243 ( -1.486 4.192 -2.269) 4.993 8.566 ( -21.355 -2.013 28.389) 35.581 8.863 ( -21.166 -8.962 9.085) 24.715 9.380 ( -6.648 -6.718 4.684) 10.548 9.847 ( -10.778 -7.934 -6.007) 14.670 10.277 ( 0.579 15.338 -2.981) 15.636 11.400 ( 12.520 -7.407 6.194) 15.811 11.515 ( 12.962 27.098 -4.837) 30.425 12.506 ( 13.723 3.465 -6.931) 15.759 13.055 ( 13.139 -1.253 5.999) 14.498 13.514 ( -11.193 2.896 9.734) 15.114 13.794 ( 0.154 -3.952 -1.204) 4.134 14.062 ( -0.386 -5.369 -0.061) 5.383 14.901 ( 9.950 -9.885 -3.013) 14.345 17.109 ( -15.388 0.790 -19.725) 25.030 19.118 ( 5.160 -2.212 4.718) 7.333 19.228 ( 9.998 -2.226 -1.015) 10.293 19.769 ( 1.001 -1.918 2.394) 3.227 21.001 ( 4.487 6.814 -13.493) 15.767 22.787 ( -6.948 -12.276 12.241) 18.677 23.995 ( 11.000 2.535 -3.139) 11.717 24.523 ( 0.700 2.986 4.710) 5.621 ======================= Grid point 391 (184/432) ======================= q-point: (-0.55 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( -12.028 9.945 1.659) 15.695 2.418 ( -16.900 3.720 -7.407) 18.823 3.124 ( 2.794 1.329 0.060) 3.095 3.180 ( 1.330 -0.538 6.113) 6.279 3.405 ( -1.153 -7.150 -0.574) 7.265 3.695 ( -8.365 -0.765 1.599) 8.551 4.135 ( -0.763 4.592 5.611) 7.290 4.337 ( 9.552 -4.365 -4.913) 11.594 4.414 ( -12.142 -3.900 -4.661) 13.578 4.912 ( -0.437 -10.336 -0.941) 10.388 5.103 ( -6.837 -1.523 -0.725) 7.042 5.921 ( -6.596 6.499 2.596) 9.617 5.992 ( -4.874 2.806 -0.696) 5.667 7.295 ( -9.759 -4.684 8.154) 13.552 8.138 ( -0.586 -0.400 -9.385) 9.412 8.551 ( -23.834 -2.481 18.232) 30.110 8.818 ( -14.265 -6.584 10.880) 19.110 9.395 ( -8.812 -8.160 4.659) 12.882 9.779 ( -6.738 -11.525 -1.088) 13.394 10.131 ( -0.878 9.207 -1.295) 9.339 11.394 ( 12.293 31.002 -0.699) 33.357 11.642 ( 9.117 -0.469 2.399) 9.439 12.539 ( 11.118 5.419 -9.288) 15.468 13.182 ( 3.056 0.409 -5.154) 6.006 13.386 ( -14.485 6.799 13.211) 20.750 13.863 ( -0.905 -9.335 -0.640) 9.400 14.204 ( 10.214 -1.310 6.868) 12.378 15.116 ( 13.349 -14.764 -5.318) 20.602 16.723 ( -14.055 1.659 -10.345) 17.530 19.200 ( 2.424 -6.310 -3.519) 7.621 19.444 ( 13.311 1.506 8.288) 15.752 19.869 ( 8.196 -0.761 1.885) 8.444 20.840 ( 4.125 6.312 -14.972) 16.764 22.886 ( -14.283 -16.430 8.718) 23.451 24.074 ( 11.322 5.154 -3.754) 12.994 24.577 ( 0.403 2.168 7.875) 8.177 ======================= Grid point 392 (185/432) ======================= q-point: (-0.45 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -15.459 10.640 7.103) 20.067 2.052 ( -19.250 8.540 -4.721) 21.582 3.144 ( 4.115 2.884 -1.513) 5.248 3.323 ( 1.670 -6.893 7.493) 10.318 3.418 ( -7.799 -3.843 1.478) 8.819 3.427 ( -21.528 6.624 4.460) 22.962 4.164 ( -9.990 -0.705 -4.454) 10.960 4.313 ( 6.606 -6.567 4.682) 10.425 4.486 ( 7.619 -4.593 -2.092) 9.139 4.983 ( 0.662 -8.972 -2.921) 9.459 5.028 ( -3.933 -2.547 -1.515) 4.924 5.842 ( -5.434 4.543 6.552) 9.649 5.922 ( 0.107 4.568 -0.438) 4.590 7.268 ( -16.323 -6.375 9.473) 19.921 8.058 ( 0.861 -5.354 -8.841) 10.372 8.407 ( -24.965 -2.483 11.442) 27.574 8.822 ( -4.521 -0.161 5.875) 7.415 9.396 ( -10.310 -11.599 3.604) 15.932 9.778 ( -3.624 -4.120 -0.251) 5.493 10.128 ( -0.279 -6.343 3.891) 7.447 11.280 ( 8.610 29.988 0.812) 31.210 11.713 ( 4.916 6.214 -0.957) 7.981 12.504 ( 9.711 7.275 -11.375) 16.632 13.039 ( -9.806 5.977 -1.406) 11.570 13.377 ( -5.261 0.077 9.425) 10.794 13.906 ( -0.639 -9.394 -4.515) 10.442 14.391 ( 9.680 4.890 1.860) 11.003 15.368 ( 14.062 -16.725 -6.155) 22.702 16.542 ( -8.344 -0.395 8.891) 12.200 19.222 ( 3.298 -4.601 -7.389) 9.309 19.690 ( 10.956 2.181 7.363) 13.379 20.024 ( 12.213 2.442 2.636) 12.730 20.673 ( 4.282 4.050 -15.805) 16.868 22.894 ( -19.851 -20.778 5.382) 29.236 24.116 ( 9.547 6.492 -4.068) 12.241 24.669 ( 0.194 0.797 8.712) 8.751 ======================= Grid point 393 (186/432) ======================= q-point: (-0.36 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -18.354 13.227 6.357) 23.500 1.739 ( -16.064 12.009 8.998) 21.982 3.066 ( -26.142 13.695 13.691) 32.533 3.173 ( 3.182 -1.614 -2.729) 4.492 3.363 ( -7.485 -5.173 0.885) 9.141 3.556 ( 4.218 -6.534 6.929) 10.417 3.985 ( -9.445 -2.464 -3.703) 10.440 4.457 ( -1.161 -9.370 -2.568) 9.784 4.629 ( 8.187 -3.408 3.360) 9.484 4.968 ( -0.208 -2.387 -4.941) 5.492 5.067 ( 3.549 -4.520 1.645) 5.978 5.844 ( 1.294 3.817 4.130) 5.771 5.923 ( -0.042 3.093 6.740) 7.416 7.205 ( -20.225 -9.551 11.078) 24.960 8.008 ( -5.554 -3.999 -5.050) 8.506 8.280 ( -13.720 -7.278 8.188) 17.557 8.815 ( -0.591 5.307 2.359) 5.838 9.412 ( -8.988 -14.797 2.627) 17.511 9.771 ( -1.196 -0.737 2.547) 2.909 10.234 ( -2.420 -11.516 0.680) 11.788 11.107 ( -0.542 23.910 -2.109) 24.009 11.691 ( 6.061 12.723 0.772) 14.114 12.422 ( 9.374 8.870 -12.974) 18.300 12.857 ( -11.274 5.969 3.479) 13.223 13.412 ( -2.881 -0.137 4.436) 5.291 13.858 ( -2.406 -2.875 -10.743) 11.378 14.416 ( 4.654 6.301 -2.669) 8.275 15.600 ( 11.328 -15.938 -8.462) 21.306 16.779 ( 5.149 -8.963 30.528) 32.230 19.196 ( 5.870 -0.569 -11.514) 12.937 19.810 ( 4.141 2.996 -0.888) 5.188 20.203 ( 9.504 7.060 8.155) 14.376 20.556 ( 9.868 -0.459 -16.018) 18.820 22.847 ( -24.569 -25.665 3.683) 35.719 24.135 ( 8.378 5.878 -3.909) 10.955 24.724 ( -3.112 1.685 4.015) 5.352 ======================= Grid point 394 (187/432) ======================= q-point: (-0.27 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( -8.622 14.667 16.678) 23.825 1.579 ( -14.089 13.363 15.821) 25.048 2.811 ( -25.145 8.686 19.414) 32.934 3.234 ( 4.214 -3.044 -1.230) 5.342 3.298 ( -6.754 -1.148 2.106) 7.167 3.683 ( 5.372 0.595 -1.763) 5.685 3.930 ( -6.639 -8.562 5.963) 12.367 4.425 ( -3.673 -7.022 -8.223) 11.420 4.717 ( -2.126 -3.462 -2.733) 4.896 4.961 ( 3.177 1.974 1.741) 4.126 5.241 ( 11.095 -4.585 4.172) 12.710 5.897 ( 6.414 2.379 0.606) 6.868 6.027 ( -1.341 0.420 16.086) 16.147 7.160 ( -19.552 -12.110 11.237) 25.597 7.877 ( -11.839 -1.318 1.230) 11.976 8.312 ( -6.896 -7.947 3.777) 11.179 8.799 ( 0.175 2.231 4.230) 4.785 9.471 ( -5.498 -15.546 1.809) 16.588 9.835 ( 2.490 -0.856 6.081) 6.627 10.227 ( -7.528 -7.530 -3.919) 11.346 10.808 ( -8.289 22.410 -4.522) 24.318 11.687 ( 8.737 17.726 1.755) 19.840 12.323 ( 8.959 7.022 -12.869) 17.181 12.723 ( -10.232 3.745 4.572) 11.816 13.345 ( -3.850 8.255 -3.975) 9.938 13.717 ( -3.439 1.555 -2.541) 4.550 14.400 ( 1.801 1.938 -1.471) 3.027 15.717 ( 6.569 -13.454 -13.798) 20.360 17.463 ( 19.274 -20.894 34.284) 44.535 19.135 ( 11.238 4.585 -15.163) 19.423 19.746 ( -2.959 1.447 -7.203) 7.920 20.236 ( -3.314 6.905 1.183) 7.750 20.657 ( 21.941 0.137 -5.016) 22.507 22.755 ( -30.658 -29.430 2.461) 42.569 24.156 ( 8.047 4.233 -3.670) 9.805 24.606 ( -10.228 7.622 -3.332) 13.184 ======================= Grid point 395 (188/432) ======================= q-point: (-0.18 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( -9.470 12.329 20.419) 25.664 1.538 ( 1.179 9.175 22.189) 24.040 2.732 ( -13.698 6.546 24.343) 28.689 3.173 ( -6.957 -2.402 -2.894) 7.909 3.395 ( 7.332 -1.879 4.738) 8.930 3.703 ( 4.954 0.819 -3.301) 6.010 4.020 ( -4.896 -9.240 6.038) 12.075 4.305 ( -4.882 -1.758 -9.019) 10.405 4.621 ( -1.850 -0.350 -8.517) 8.722 5.035 ( 1.990 2.088 5.951) 6.613 5.470 ( 9.979 -3.914 3.137) 11.169 5.980 ( 5.615 0.171 1.484) 5.810 6.258 ( 0.971 -3.260 23.429) 23.674 7.144 ( -15.115 -10.470 9.012) 20.477 7.756 ( -11.678 -0.354 1.569) 11.788 8.254 ( -15.388 -0.585 9.339) 18.010 8.924 ( 0.638 -10.345 8.719) 13.544 9.555 ( -3.609 -14.941 0.034) 15.371 9.927 ( 4.135 13.493 4.714) 14.878 10.174 ( -8.554 -17.985 2.465) 20.068 10.475 ( -2.022 26.565 -1.296) 26.673 11.599 ( 5.873 24.298 -4.144) 25.339 12.261 ( 7.723 1.543 -12.548) 14.815 12.615 ( -9.554 -0.548 2.175) 9.814 13.173 ( -3.056 13.194 2.505) 13.773 13.697 ( -0.364 1.302 3.256) 3.525 14.385 ( -0.382 -0.219 -1.977) 2.025 15.687 ( 1.556 -10.095 -17.971) 20.670 18.240 ( 18.821 -24.451 14.896) 34.264 19.133 ( 22.664 5.334 -11.971) 26.180 19.562 ( -9.122 -1.634 -11.132) 14.485 20.094 ( -5.825 6.118 -4.508) 9.575 20.934 ( 21.968 2.036 3.019) 22.268 22.554 ( -39.367 -26.118 0.553) 47.246 24.192 ( 7.147 2.727 -3.144) 8.270 24.289 ( -13.668 14.340 -3.850) 20.181 ======================= Grid point 396 (189/432) ======================= q-point: (-0.09 0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( -3.860 6.151 24.063) 25.135 1.760 ( 4.235 5.573 19.642) 20.852 2.893 ( 1.578 3.308 23.274) 23.561 3.088 ( -2.172 0.006 -2.133) 3.044 3.566 ( 6.274 -4.658 3.820) 8.697 3.724 ( 1.339 -1.235 -1.978) 2.689 4.022 ( -2.980 -4.714 -8.685) 10.321 4.134 ( -7.063 2.503 -6.221) 9.739 4.567 ( 4.051 0.404 -0.655) 4.124 5.078 ( -1.779 2.465 4.414) 5.360 5.608 ( 3.412 -2.443 0.495) 4.225 6.064 ( 1.723 -1.295 3.357) 3.989 6.629 ( 3.469 -6.508 27.798) 28.760 7.122 ( -8.980 -2.835 3.926) 10.202 7.582 ( -17.017 1.087 4.321) 17.590 8.238 ( -18.623 -2.128 25.965) 32.024 9.123 ( -0.385 -15.634 5.579) 16.604 9.610 ( -4.300 -12.291 -1.909) 13.161 9.877 ( 4.070 20.631 9.156) 22.935 10.142 ( -5.971 11.824 2.351) 13.454 10.534 ( 12.349 -13.479 4.713) 18.878 11.381 ( 5.251 26.472 -5.716) 27.587 12.169 ( 3.354 2.164 -13.784) 14.350 12.546 ( -5.107 -6.208 -3.195) 8.650 13.125 ( -1.333 11.028 10.954) 15.601 13.738 ( 2.696 2.202 3.664) 5.054 14.344 ( -2.523 -0.731 -2.605) 3.699 15.532 ( -2.807 -6.398 -19.520) 20.733 18.568 ( 9.960 -8.584 -9.296) 16.103 19.283 ( -13.965 -3.405 -14.781) 20.617 19.426 ( 25.939 -7.460 -3.219) 27.182 19.899 ( -3.558 8.245 -6.424) 11.041 21.258 ( 19.399 0.389 7.525) 20.811 22.171 ( -41.802 -11.688 0.929) 43.416 23.992 ( -10.095 10.813 1.341) 14.854 24.248 ( 7.527 0.940 -2.839) 8.099 ======================= Grid point 399 (190/432) ======================= q-point: ( 0.18 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( 0.443 -0.000 3.138) 3.169 2.696 ( -2.491 0.000 1.757) 3.048 3.048 ( 5.716 -0.000 -0.596) 5.747 3.156 ( -0.542 0.000 2.631) 2.686 3.408 ( -2.757 0.000 -2.948) 4.036 3.553 ( -0.800 0.000 -10.852) 10.881 3.783 ( 11.656 -0.000 -2.140) 11.851 4.147 ( 9.343 -0.000 3.232) 9.886 4.922 ( -10.654 0.000 2.684) 10.986 5.045 ( -15.479 0.000 -10.252) 18.566 5.198 ( -5.101 0.000 7.978) 9.469 6.103 ( -0.756 0.000 2.124) 2.254 6.365 ( -13.852 0.000 -3.097) 14.194 7.186 ( -5.122 0.000 7.186) 8.825 8.295 ( -11.466 0.000 24.024) 26.620 8.495 ( -22.777 0.000 34.978) 41.740 8.962 ( -16.987 0.000 -15.037) 22.687 9.307 ( -3.701 0.000 8.239) 9.032 10.024 ( -14.640 0.000 -10.983) 18.302 10.616 ( 3.004 -0.000 -4.351) 5.287 10.835 ( 21.807 -0.000 16.147) 27.135 11.837 ( 11.932 -0.000 -12.269) 17.114 12.440 ( 15.896 -0.000 -6.328) 17.109 12.659 ( 21.032 -0.000 14.036) 25.286 13.396 ( -3.996 0.000 10.475) 11.212 13.918 ( -1.165 0.000 -7.215) 7.309 14.014 ( -6.720 0.000 0.479) 6.737 14.757 ( 1.505 -0.000 -4.601) 4.841 17.561 ( -15.435 0.000 -22.522) 27.304 18.951 ( 12.895 -0.000 1.432) 12.974 19.144 ( -0.878 0.000 -2.929) 3.058 19.750 ( -5.817 0.000 1.744) 6.073 21.197 ( 3.689 -0.000 -11.880) 12.440 22.518 ( 0.284 -0.000 14.288) 14.291 23.911 ( 8.253 -0.000 -1.345) 8.362 24.507 ( 2.625 -0.000 1.950) 3.270 ======================= Grid point 400 (191/432) ======================= q-point: (-0.73 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.477 ( -5.792 9.523 -4.883) 12.169 2.624 ( -8.099 -7.529 -7.159) 13.173 3.144 ( -3.146 1.902 1.769) 4.079 3.218 ( 6.822 -1.535 5.906) 9.153 3.316 ( -2.910 9.428 0.717) 9.893 3.496 ( 1.430 -9.580 -3.576) 10.325 3.974 ( 14.134 -3.703 0.732) 14.629 4.300 ( 8.129 -0.734 0.895) 8.211 4.688 ( -18.303 4.204 -6.663) 19.927 4.794 ( -13.625 -5.753 -1.411) 14.857 5.179 ( -6.459 0.154 2.201) 6.826 6.100 ( -1.047 1.564 -0.397) 1.924 6.159 ( -12.366 2.200 0.105) 12.560 7.200 ( -6.350 -2.853 6.071) 9.237 8.346 ( -7.016 6.387 9.668) 13.546 8.549 ( -22.937 0.937 22.484) 32.133 8.659 ( -19.299 -11.989 3.113) 22.931 9.347 ( -6.160 0.162 9.579) 11.390 9.734 ( -13.222 -3.920 -9.220) 16.589 10.498 ( -1.375 8.156 -8.324) 11.735 11.294 ( 18.266 -4.082 11.988) 22.227 11.874 ( 16.644 12.460 -6.794) 21.873 12.560 ( 14.377 2.668 -6.371) 15.950 13.026 ( 11.508 -1.944 8.273) 14.305 13.507 ( -3.725 -1.753 14.988) 15.543 13.774 ( -5.179 0.547 -7.710) 9.304 13.976 ( -0.150 -3.471 0.807) 3.566 14.779 ( 7.355 -3.972 -4.964) 9.722 17.119 ( -15.195 0.312 -18.964) 24.303 19.079 ( 1.220 -1.501 1.428) 2.404 19.218 ( 14.629 0.074 1.776) 14.737 19.744 ( 1.547 -0.857 2.070) 2.722 21.089 ( 3.856 3.001 -13.933) 14.764 22.639 ( -7.956 -4.727 12.355) 15.437 24.023 ( 10.906 0.840 -1.042) 10.988 24.556 ( 1.012 1.015 3.350) 3.643 ======================= Grid point 401 (192/432) ======================= q-point: (-0.64 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.259 ( -8.137 8.880 -2.745) 12.353 2.443 ( -10.825 -0.688 -8.333) 13.678 3.100 ( -3.520 -0.784 1.851) 4.054 3.233 ( -3.196 -0.632 -0.886) 3.377 3.322 ( -1.326 1.666 5.505) 5.902 3.617 ( 3.777 -7.160 1.223) 8.187 4.191 ( 10.014 -0.520 2.888) 10.435 4.321 ( -3.683 -3.075 -9.145) 10.327 4.369 ( -12.792 6.570 2.500) 14.596 4.733 ( -3.965 -10.768 0.706) 11.496 5.086 ( -7.614 -0.573 -1.668) 7.815 5.987 ( -12.389 1.516 4.241) 13.182 6.069 ( 1.138 5.492 -2.448) 6.120 7.192 ( -10.952 -6.259 5.441) 13.738 8.180 ( -5.646 4.811 -9.450) 12.014 8.498 ( -23.255 -3.758 19.248) 30.420 8.660 ( -14.423 -9.398 14.925) 22.784 9.351 ( -8.989 0.653 9.190) 12.872 9.558 ( -10.777 -10.924 -4.164) 15.900 10.308 ( -1.085 8.711 -7.981) 11.864 11.635 ( 13.969 0.353 7.611) 15.912 11.885 ( 15.633 23.395 -2.816) 28.278 12.616 ( 10.518 4.290 -7.649) 13.694 13.174 ( 4.356 -1.782 -2.034) 5.127 13.496 ( -14.691 5.846 8.839) 18.115 13.704 ( -4.698 -8.742 -0.555) 9.940 14.161 ( 14.657 -2.990 8.090) 17.007 14.895 ( 11.519 -10.320 -7.455) 17.169 16.746 ( -13.903 0.950 -10.758) 17.604 19.119 ( 4.584 -3.299 -4.221) 7.051 19.468 ( 13.596 1.192 8.728) 16.200 19.852 ( 10.024 -1.030 1.738) 10.225 20.934 ( 2.392 4.375 -15.031) 15.837 22.665 ( -15.082 -9.363 8.617) 19.732 24.144 ( 10.668 3.042 -0.643) 11.112 24.600 ( -0.110 0.729 5.073) 5.126 ======================= Grid point 402 (193/432) ======================= q-point: (-0.55 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( -10.391 10.277 3.264) 14.975 2.180 ( -12.550 6.549 -5.242) 15.096 3.118 ( -0.084 -4.966 -1.073) 5.081 3.229 ( -4.107 -6.141 5.121) 8.989 3.310 ( -7.421 -1.952 2.656) 8.120 3.607 ( -7.309 7.912 1.063) 10.823 4.126 ( -9.217 -3.512 -7.246) 12.239 4.248 ( -1.749 -0.203 5.892) 6.149 4.423 ( 8.377 -2.979 1.387) 8.999 4.830 ( 1.851 -8.679 1.420) 8.987 4.979 ( -6.186 -3.071 -2.323) 7.287 5.900 ( -9.625 2.276 8.981) 13.359 6.009 ( 2.680 5.369 -3.759) 7.080 7.130 ( -18.665 -9.108 6.579) 21.786 8.001 ( -1.417 -1.255 -9.892) 10.071 8.370 ( -26.506 -1.495 13.835) 29.937 8.759 ( -4.192 -6.466 10.842) 13.302 9.307 ( -11.613 -0.089 7.564) 13.860 9.531 ( -9.783 -17.811 0.355) 20.324 10.174 ( 1.675 6.344 -4.148) 7.762 11.808 ( 9.436 19.778 -1.715) 21.981 11.835 ( 12.150 17.437 4.251) 21.674 12.596 ( 6.469 4.193 -8.702) 11.626 13.136 ( -0.238 4.846 -6.350) 7.991 13.389 ( -11.161 0.916 9.728) 14.834 13.723 ( -3.599 -11.664 -1.791) 12.337 14.448 ( 13.101 2.340 4.570) 14.071 15.085 ( 13.705 -15.956 -8.109) 22.543 16.537 ( -9.563 -0.152 4.363) 10.512 19.154 ( 7.109 -3.285 -8.346) 11.444 19.726 ( 10.895 1.878 8.866) 14.172 20.050 ( 16.499 0.831 1.792) 16.617 20.743 ( 0.809 3.952 -15.674) 16.184 22.602 ( -20.677 -13.615 5.333) 25.325 24.222 ( 8.194 5.724 -1.353) 10.087 24.663 ( -0.819 -1.248 6.344) 6.517 ======================= Grid point 403 (194/432) ======================= q-point: (-0.45 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( -12.206 14.203 6.784) 19.918 1.936 ( -10.960 11.389 5.414) 16.707 3.121 ( -3.959 -3.134 -2.114) 5.474 3.171 ( -13.974 -3.090 -0.309) 14.315 3.337 ( -2.805 -5.493 3.699) 7.192 3.502 ( -2.502 7.274 13.024) 15.126 3.947 ( -6.810 -1.347 -8.161) 10.714 4.316 ( -3.159 -7.371 1.136) 8.100 4.577 ( 6.466 -2.663 3.731) 7.926 4.917 ( 2.726 -3.206 -0.444) 4.232 4.969 ( -0.514 -6.993 2.369) 7.402 5.893 ( -5.068 1.837 9.257) 10.712 5.983 ( 3.402 3.936 -0.111) 5.204 7.018 ( -24.928 -11.995 9.809) 29.351 7.930 ( -0.012 -4.188 -7.266) 8.386 8.199 ( -18.762 -2.605 8.747) 20.864 8.873 ( -0.948 -0.489 8.517) 8.584 9.233 ( -12.844 -4.697 5.699) 14.816 9.569 ( -10.802 -19.300 1.896) 22.198 10.154 ( 3.718 1.718 -0.686) 4.153 11.624 ( 4.864 32.781 -4.232) 33.409 11.906 ( 8.560 12.943 3.895) 15.999 12.538 ( 5.899 4.245 -9.183) 11.711 12.989 ( -4.797 9.763 -1.273) 10.952 13.392 ( -4.160 -2.393 6.126) 7.782 13.742 ( -2.169 -9.899 -5.602) 11.579 14.530 ( 6.204 6.601 -4.400) 10.071 15.311 ( 11.683 -17.783 -8.833) 23.038 16.650 ( 0.077 -6.124 23.262) 24.055 19.167 ( 9.167 -2.426 -12.544) 15.725 19.876 ( 5.143 4.220 1.711) 6.869 20.304 ( 16.815 4.701 5.917) 18.435 20.555 ( 3.413 0.466 -16.446) 16.803 22.485 ( -24.642 -17.265 4.301) 30.394 24.241 ( 6.225 6.575 -2.207) 9.319 24.718 ( -3.355 -1.990 4.331) 5.829 ======================= Grid point 404 (195/432) ======================= q-point: (-0.36 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.715 ( -6.967 16.471 13.495) 22.404 1.803 ( -10.250 13.621 13.313) 21.629 2.933 ( -15.795 4.994 5.984) 17.613 3.141 ( -3.276 -7.337 -2.167) 8.323 3.339 ( -0.304 3.512 3.228) 4.779 3.669 ( 0.782 -4.139 13.556) 14.195 3.803 ( -4.686 -2.299 -5.737) 7.756 4.309 ( -3.527 -6.728 -3.739) 8.467 4.657 ( -1.396 -3.336 -0.961) 3.741 4.989 ( 2.895 1.414 4.707) 5.704 5.127 ( 8.081 -9.026 4.485) 12.918 5.930 ( 2.218 1.234 2.510) 3.570 6.043 ( -0.176 1.352 10.908) 10.992 6.925 ( -25.937 -14.854 14.111) 33.052 7.854 ( -7.775 -1.131 -0.598) 7.879 8.164 ( -5.989 -8.437 3.697) 10.987 8.899 ( -2.542 7.440 5.300) 9.482 9.221 ( -9.770 -13.265 6.034) 17.545 9.624 ( -9.350 -19.342 3.904) 21.836 10.190 ( 3.055 2.153 0.528) 3.775 11.313 ( 0.528 34.102 -5.742) 34.586 11.949 ( 8.049 12.974 3.665) 15.702 12.468 ( 7.647 7.952 -10.359) 15.133 12.827 ( -7.097 9.596 0.629) 11.952 13.414 ( -1.211 0.361 -0.137) 1.271 13.704 ( -2.324 -3.646 -3.495) 5.559 14.466 ( 1.168 5.701 -3.902) 7.007 15.457 ( 6.955 -16.927 -13.296) 22.620 17.147 ( 10.817 -16.157 32.146) 37.569 19.152 ( 11.567 -1.719 -17.040) 20.667 19.822 ( -1.077 6.755 -6.695) 9.571 20.319 ( -5.161 2.771 -5.179) 7.819 20.675 ( 24.648 2.025 -0.196) 24.732 22.347 ( -27.369 -19.125 4.801) 33.732 24.239 ( 5.687 5.450 -2.693) 8.324 24.672 ( -8.459 0.865 -0.706) 8.533 ======================= Grid point 405 (196/432) ======================= q-point: (-0.27 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( -7.440 10.632 16.306) 20.839 1.763 ( -1.375 15.795 18.195) 24.134 2.845 ( -6.176 5.853 13.000) 15.537 3.115 ( -4.938 -4.475 -1.098) 6.754 3.381 ( 4.521 -0.067 1.733) 4.842 3.727 ( -1.841 0.611 -0.482) 1.999 3.846 ( -2.648 -8.607 7.957) 12.017 4.263 ( -1.683 -3.307 -5.698) 6.800 4.608 ( -2.014 -1.032 -4.679) 5.197 5.074 ( 1.430 2.323 7.553) 8.030 5.371 ( 8.721 -8.004 3.800) 12.432 5.982 ( 4.100 0.019 0.162) 4.103 6.210 ( -0.276 -2.280 19.115) 19.252 6.919 ( -21.890 -15.309 18.221) 32.335 7.754 ( -10.119 0.271 2.588) 10.448 8.183 ( -8.407 -7.660 2.530) 11.651 8.870 ( -3.166 3.022 7.305) 8.516 9.299 ( -6.774 -15.041 4.151) 17.010 9.768 ( -2.493 -20.218 6.666) 21.434 10.200 ( 2.868 9.618 3.698) 10.696 10.969 ( -0.319 32.319 -4.536) 32.638 11.958 ( 6.542 14.880 -0.535) 16.263 12.364 ( 8.655 11.541 -12.242) 18.920 12.645 ( -9.998 4.755 -2.131) 11.274 13.344 ( -1.463 6.376 -0.788) 6.589 13.715 ( 0.927 0.536 4.198) 4.332 14.398 ( -1.531 2.089 -2.056) 3.307 15.475 ( 2.109 -14.722 -17.282) 22.800 17.836 ( 15.036 -22.767 24.863) 36.913 19.129 ( 13.047 -4.306 -19.102) 23.530 19.619 ( -3.708 7.287 -11.085) 13.775 20.158 ( -6.341 1.370 -6.236) 8.998 20.991 ( 22.274 4.587 5.213) 23.331 22.185 ( -29.049 -17.274 4.623) 34.112 24.244 ( 5.608 3.535 -2.851) 7.216 24.465 ( -12.857 6.651 -4.050) 15.032 ======================= Grid point 406 (197/432) ======================= q-point: (-0.18 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -4.964 8.389 18.778) 21.157 1.896 ( 5.417 10.214 17.807) 21.231 2.933 ( 2.108 0.499 7.741) 8.039 3.104 ( -0.182 1.894 6.469) 6.743 3.475 ( 5.289 -5.388 -1.942) 7.796 3.705 ( -4.654 -1.959 2.078) 5.460 3.915 ( -4.026 -5.839 1.070) 7.173 4.184 ( 0.617 2.744 -7.850) 8.338 4.576 ( 2.436 0.685 0.697) 2.624 5.132 ( -1.419 3.516 5.915) 7.026 5.542 ( 3.555 -5.660 1.166) 6.785 6.037 ( 1.383 -1.728 1.631) 2.749 6.511 ( 2.733 -6.995 23.094) 24.284 7.009 ( -14.437 -10.507 19.564) 26.487 7.606 ( -14.830 1.467 1.343) 14.963 8.175 ( -12.801 -5.423 14.236) 19.898 8.944 ( -0.389 -5.521 6.905) 8.849 9.379 ( -4.535 -14.495 1.549) 15.266 10.024 ( 2.053 -17.858 7.017) 19.297 10.203 ( 4.294 16.659 8.768) 19.309 10.692 ( 1.358 25.032 -1.169) 25.096 11.822 ( 4.962 22.860 -7.111) 24.450 12.242 ( 6.640 8.358 -12.464) 16.411 12.465 ( -8.824 -2.746 -4.701) 10.369 13.302 ( -0.175 8.558 6.281) 10.617 13.788 ( 3.927 3.676 5.546) 7.726 14.334 ( -3.599 -0.127 -2.085) 4.161 15.378 ( -2.074 -11.689 -18.987) 22.393 18.361 ( 11.418 -15.463 5.239) 19.923 19.113 ( -2.619 -12.103 -15.005) 19.455 19.438 ( 9.210 4.666 -10.973) 15.066 19.996 ( -3.868 3.015 -6.211) 7.914 21.286 ( 14.223 3.400 9.224) 17.290 21.980 ( -24.530 -9.725 2.876) 26.544 24.173 ( -11.841 9.252 -2.451) 15.225 24.272 ( 5.477 2.028 -2.809) 6.481 ======================= Grid point 407 (198/432) ======================= q-point: (-0.09 0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( 0.776 3.475 20.080) 20.393 2.114 ( 8.888 8.252 16.814) 20.732 2.997 ( 3.707 -3.475 -3.542) 6.194 3.245 ( 4.443 1.717 11.685) 12.619 3.523 ( 0.612 -8.287 -9.637) 12.725 3.682 ( -3.133 -2.745 0.859) 4.254 3.883 ( -6.219 -1.736 0.813) 6.508 4.071 ( 6.706 9.690 -9.626) 15.216 4.685 ( 5.629 -0.463 7.706) 9.554 5.116 ( -5.138 4.337 5.969) 8.991 5.585 ( -2.080 -3.225 -1.478) 4.113 6.078 ( -2.582 -2.737 3.294) 5.001 6.832 ( -0.056 -7.787 11.329) 13.748 7.110 ( -7.577 -0.569 13.200) 15.230 7.479 ( -16.473 -1.582 21.944) 27.485 8.260 ( -15.349 -6.221 22.954) 28.305 9.086 ( 2.057 -10.066 3.018) 10.708 9.481 ( 1.060 -12.287 2.982) 12.688 10.144 ( -6.936 2.319 1.468) 7.459 10.236 ( 5.938 17.656 12.125) 22.226 10.615 ( 5.170 1.575 -0.152) 5.407 11.663 ( 12.255 20.423 -3.085) 24.016 12.095 ( 0.560 5.477 -10.984) 12.286 12.360 ( -0.663 -6.279 -10.357) 12.130 13.319 ( -0.576 8.955 9.677) 13.197 13.873 ( 5.537 5.305 4.646) 8.966 14.258 ( -5.025 -1.237 -2.177) 5.614 15.204 ( -4.771 -8.118 -17.570) 19.934 18.557 ( 11.430 -5.071 -7.848) 14.763 18.862 ( -14.604 -4.733 -16.660) 22.654 19.482 ( 1.132 -5.514 -5.789) 8.074 19.908 ( 5.918 2.789 -5.784) 8.732 21.443 ( -12.113 -6.215 9.105) 16.379 21.870 ( 4.900 4.956 3.630) 7.858 23.956 ( -7.235 7.103 -0.282) 10.143 24.314 ( 5.760 0.074 -1.949) 6.081 ======================= Grid point 411 (199/432) ======================= q-point: ( 0.27 -0.73 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( -9.697 0.000 -5.120) 10.966 2.413 ( -4.494 0.000 -7.927) 9.112 3.107 ( -6.256 0.000 3.156) 7.007 3.185 ( -6.588 0.000 -3.500) 7.460 3.401 ( -7.133 0.000 7.264) 10.181 3.518 ( 12.885 -0.000 1.170) 12.938 4.177 ( 13.070 -0.000 4.150) 13.713 4.277 ( -5.995 0.000 -11.291) 12.784 4.528 ( -16.364 0.000 -1.899) 16.474 4.563 ( -1.264 0.000 6.584) 6.704 5.082 ( -8.056 0.000 -2.155) 8.339 5.998 ( -11.673 0.000 3.968) 12.329 6.123 ( 0.438 -0.000 -2.447) 2.486 7.131 ( -11.505 0.000 4.679) 12.420 8.247 ( -9.281 0.000 -15.052) 17.684 8.439 ( -15.111 0.000 18.902) 24.200 8.579 ( -19.913 0.000 23.556) 30.845 9.362 ( -9.508 0.000 10.560) 14.210 9.462 ( -11.367 0.000 -6.451) 13.070 10.384 ( -2.041 0.000 -10.344) 10.544 11.638 ( 15.753 -0.000 9.832) 18.570 12.096 ( 17.001 -0.000 -4.207) 17.514 12.671 ( 12.436 -0.000 -7.768) 14.662 13.140 ( 1.225 -0.000 1.569) 1.991 13.579 ( -13.887 0.000 14.337) 19.960 13.594 ( -6.239 0.000 -8.662) 10.675 14.131 ( 17.143 -0.000 8.833) 19.285 14.803 ( 10.495 -0.000 -8.390) 13.436 16.754 ( -13.846 0.000 -10.941) 17.647 19.091 ( 5.356 -0.000 -4.446) 6.961 19.479 ( 13.640 -0.000 8.827) 16.247 19.842 ( 10.628 -0.000 1.758) 10.772 20.973 ( 1.895 -0.000 -15.379) 15.495 22.584 ( -15.332 0.000 8.810) 17.683 24.171 ( 10.445 -0.000 0.775) 10.474 24.606 ( -0.309 0.000 3.809) 3.821 ======================= Grid point 413 (200/432) ======================= q-point: (-0.64 0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( -7.563 4.618 0.605) 8.882 2.263 ( -5.562 2.872 -5.471) 8.314 3.054 ( -5.336 -1.126 -0.112) 5.455 3.107 ( -7.144 -6.157 3.575) 10.086 3.332 ( -10.850 1.864 3.840) 11.659 3.671 ( 6.609 0.796 -1.314) 6.785 4.068 ( -7.242 -2.470 -6.948) 10.335 4.294 ( -10.751 3.527 1.381) 11.399 4.389 ( 8.854 -1.014 3.946) 9.746 4.710 ( 3.726 -4.701 7.307) 9.454 4.938 ( -8.456 -1.386 -3.572) 9.283 5.923 ( -10.332 0.645 8.929) 13.671 6.083 ( 1.912 2.707 -4.612) 5.679 7.003 ( -18.966 -4.625 4.934) 20.136 8.002 ( -3.368 0.567 -11.904) 12.385 8.355 ( -26.558 -0.422 16.677) 31.363 8.667 ( -4.756 -3.213 15.320) 16.360 9.304 ( -9.406 -7.572 -2.547) 12.341 9.328 ( -12.439 1.213 9.669) 15.801 10.255 ( 0.543 2.655 -7.515) 7.989 11.904 ( 11.908 2.842 6.364) 13.797 12.205 ( 12.664 11.653 -2.402) 17.376 12.693 ( 8.628 7.483 -8.098) 14.000 13.150 ( 1.073 -3.630 -3.866) 5.410 13.419 ( -9.507 3.317 0.794) 10.100 13.549 ( -10.599 -7.714 4.783) 13.954 14.481 ( 16.499 1.458 8.402) 18.572 14.873 ( 12.729 -7.642 -11.137) 18.560 16.536 ( -10.082 -0.018 2.009) 10.280 19.116 ( 8.958 -1.174 -9.168) 12.872 19.749 ( 10.727 0.735 9.802) 14.550 20.057 ( 18.738 0.106 1.508) 18.799 20.794 ( -0.609 1.696 -16.187) 16.287 22.445 ( -20.819 -4.804 5.766) 22.131 24.295 ( 7.523 2.524 1.297) 8.040 24.640 ( -1.478 -0.999 3.918) 4.305 ======================= Grid point 414 (201/432) ======================= q-point: (-0.55 0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( -6.363 10.888 5.934) 13.937 2.111 ( -5.630 8.774 3.181) 10.900 3.011 ( -4.727 -6.942 -1.481) 8.528 3.133 ( -13.016 -5.763 4.980) 15.081 3.213 ( -4.670 -2.730 3.098) 6.234 3.630 ( -1.930 3.701 -3.475) 5.431 3.971 ( -1.183 3.745 -2.458) 4.633 4.218 ( -5.816 -3.600 2.956) 7.451 4.542 ( 5.192 -1.422 4.027) 6.723 4.845 ( -5.661 -6.613 0.398) 8.714 4.876 ( 4.716 -1.835 6.286) 8.070 5.910 ( -8.546 0.405 11.002) 13.937 6.046 ( 3.808 3.146 -3.240) 5.908 6.834 ( -25.300 -8.796 7.755) 27.885 7.883 ( 1.563 -1.410 -8.156) 8.424 8.180 ( -21.174 -0.096 9.336) 23.141 8.811 ( -3.655 -4.492 13.526) 14.714 9.234 ( -12.830 2.017 6.155) 14.373 9.273 ( -9.947 -13.415 2.631) 16.907 10.199 ( 3.577 2.417 -3.259) 5.409 12.024 ( 7.779 11.645 0.624) 14.018 12.189 ( 8.082 18.674 -0.889) 20.367 12.607 ( 2.602 8.044 -5.580) 10.130 13.144 ( 5.997 4.501 -6.982) 10.245 13.322 ( -10.005 -4.049 6.077) 12.386 13.561 ( -4.712 -10.403 0.940) 11.459 14.638 ( 8.370 6.557 -3.341) 11.146 15.026 ( 12.076 -15.253 -9.832) 21.798 16.574 ( -2.498 -2.926 18.398) 18.796 19.129 ( 10.816 -1.826 -14.035) 17.813 19.936 ( 5.779 2.702 4.966) 8.084 20.357 ( 23.508 1.710 2.868) 23.744 20.571 ( -2.173 1.191 -16.875) 17.056 22.266 ( -23.784 -8.697 5.402) 25.894 24.346 ( 4.314 5.414 0.011) 6.922 24.671 ( -3.232 -3.174 3.143) 5.514 ======================= Grid point 415 (202/432) ======================= q-point: (-0.45 0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( -7.261 12.319 7.627) 16.207 2.057 ( -2.900 16.412 13.412) 21.393 2.975 ( -12.006 -1.614 1.708) 12.234 3.014 ( -4.500 -5.749 0.511) 7.318 3.312 ( 0.722 -6.870 2.562) 7.368 3.562 ( -3.755 -5.289 -1.509) 6.659 3.915 ( 1.188 12.022 5.299) 13.191 4.201 ( -4.393 -5.593 -1.043) 7.188 4.611 ( -1.133 -2.019 0.604) 2.392 4.940 ( 1.183 -12.000 5.613) 13.301 5.016 ( 5.508 1.227 7.418) 9.320 5.934 ( -3.186 -0.676 6.458) 7.233 6.071 ( 1.743 1.872 5.035) 5.647 6.692 ( -26.252 -12.078 12.948) 31.665 7.844 ( -1.037 -0.096 -2.819) 3.005 8.053 ( -11.020 -4.590 3.668) 12.489 8.946 ( -3.601 -5.058 11.203) 12.808 9.103 ( -14.364 2.042 6.179) 15.769 9.318 ( -7.389 -15.416 4.315) 17.631 10.230 ( 5.611 2.005 0.795) 6.012 11.879 ( 3.814 30.326 -6.549) 31.259 12.140 ( 4.341 10.643 -0.079) 11.495 12.547 ( 1.098 2.891 -1.818) 3.587 13.047 ( 1.163 14.687 -3.167) 15.070 13.351 ( -1.396 -8.361 -0.631) 8.500 13.609 ( -1.179 -6.750 2.235) 7.207 14.577 ( 2.153 7.319 -6.709) 10.159 15.167 ( 7.341 -16.963 -12.856) 22.515 16.929 ( 6.010 -9.684 29.048) 31.204 19.107 ( 11.196 -2.914 -19.055) 22.292 19.942 ( -0.234 6.684 -3.718) 7.651 20.335 ( -5.934 -0.380 -12.173) 13.547 20.716 ( 27.172 2.473 2.379) 27.387 22.102 ( -23.662 -10.343 6.867) 26.722 24.335 ( 2.959 5.718 -1.382) 6.585 24.653 ( -6.884 -2.569 0.220) 7.351 ======================= Grid point 416 (203/432) ======================= q-point: (-0.36 0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( -6.040 10.865 10.707) 16.406 2.049 ( -0.682 17.993 14.893) 23.367 2.904 ( -5.160 0.512 5.373) 7.467 3.034 ( -1.242 -4.450 2.086) 5.070 3.364 ( 1.692 -2.655 -1.558) 3.513 3.577 ( -3.386 -12.754 -2.878) 13.506 3.918 ( -2.805 11.938 13.451) 18.202 4.194 ( 1.973 -4.719 -4.537) 6.837 4.591 ( -2.124 -0.875 -0.850) 2.450 5.091 ( -0.748 -2.831 8.970) 9.436 5.219 ( 8.105 -7.520 5.661) 12.422 5.975 ( 1.588 -1.044 0.932) 2.117 6.180 ( -1.110 -1.332 14.425) 14.529 6.664 ( -22.138 -14.059 19.713) 32.807 7.769 ( -8.571 1.522 2.002) 8.933 8.039 ( -3.812 -8.202 -0.388) 9.053 8.965 ( -8.864 6.239 6.714) 12.750 9.064 ( -9.335 -12.029 9.096) 17.736 9.459 ( -0.249 -15.670 7.296) 17.287 10.318 ( 6.393 4.506 5.095) 9.334 11.545 ( 1.185 35.040 -7.427) 35.838 12.106 ( 3.594 5.260 -3.827) 7.432 12.507 ( -2.781 2.693 -0.787) 3.950 12.856 ( 1.114 19.455 -8.183) 21.135 13.367 ( -1.079 -4.024 -2.060) 4.647 13.712 ( 3.746 -0.746 7.061) 8.028 14.459 ( -2.172 5.041 -4.066) 6.831 15.207 ( 2.771 -16.641 -16.599) 23.667 17.499 ( 11.102 -16.746 28.953) 35.242 19.040 ( 9.044 -5.373 -22.264) 24.624 19.760 ( -2.617 8.605 -11.421) 14.537 20.147 ( -6.990 -2.258 -7.942) 10.818 21.076 ( 24.773 5.004 5.422) 25.848 21.967 ( -21.195 -9.086 6.551) 23.973 24.309 ( 2.856 4.132 -2.269) 5.512 24.526 ( -10.717 1.104 -3.033) 11.193 ======================= Grid point 417 (204/432) ======================= q-point: (-0.27 0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( -0.902 9.708 12.194) 15.612 2.094 ( 2.538 13.267 15.304) 20.413 2.911 ( -0.988 -2.578 0.539) 2.813 3.123 ( 3.546 -0.320 6.533) 7.441 3.395 ( 1.182 -4.490 -1.567) 4.900 3.596 ( -2.788 -10.546 -4.161) 11.675 3.916 ( -7.317 5.790 11.034) 14.451 4.219 ( 8.120 1.573 -6.263) 10.375 4.588 ( 0.324 0.725 3.649) 3.735 5.181 ( -1.671 1.495 8.013) 8.321 5.420 ( 3.929 -8.240 2.684) 9.515 6.009 ( 0.892 -1.699 -0.003) 1.919 6.400 ( 0.278 -6.235 19.375) 20.355 6.796 ( -14.821 -13.647 25.652) 32.618 7.627 ( -14.068 0.968 0.716) 14.119 8.069 ( -4.078 -6.299 4.858) 8.939 8.912 ( -7.288 -0.091 8.083) 10.884 9.148 ( -6.202 -11.754 6.481) 14.786 9.726 ( 5.048 -16.096 8.646) 18.956 10.429 ( 6.529 9.855 9.791) 15.349 11.188 ( 0.274 32.552 -5.752) 33.058 12.044 ( 3.302 5.220 -8.447) 10.465 12.383 ( -11.464 0.491 -2.659) 11.778 12.590 ( 6.599 22.548 -13.298) 26.997 13.377 ( -0.608 -0.130 3.347) 3.405 13.857 ( 6.566 4.362 8.349) 11.482 14.348 ( -4.946 1.946 -2.201) 5.752 15.150 ( -1.075 -15.035 -18.489) 23.855 18.078 ( 11.046 -17.048 18.619) 27.556 18.936 ( 1.731 -8.684 -19.160) 21.107 19.525 ( 0.852 5.269 -15.145) 16.058 20.009 ( -4.711 -1.034 -5.077) 7.002 21.374 ( 12.442 6.726 9.355) 16.958 21.855 ( -10.634 -5.313 2.846) 12.224 24.275 ( -4.627 3.156 -3.342) 6.523 24.325 ( -3.868 3.880 -3.069) 6.279 ======================= Grid point 418 (205/432) ======================= q-point: (-0.18 0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( 3.041 8.110 13.840) 16.326 2.252 ( 8.386 7.994 15.018) 18.967 2.936 ( 2.483 -3.454 -2.298) 4.835 3.231 ( 2.751 -3.395 1.065) 4.497 3.419 ( -3.212 -4.737 -0.175) 5.726 3.580 ( -2.310 -8.764 -7.351) 11.670 3.910 ( -2.393 4.865 9.187) 10.667 4.221 ( 9.852 8.040 -7.359) 14.692 4.681 ( 3.042 0.034 8.800) 9.311 5.195 ( -4.473 4.526 6.604) 9.171 5.507 ( -1.699 -5.981 -0.539) 6.241 6.028 ( -2.400 -2.994 1.658) 4.180 6.687 ( 0.015 -9.432 15.623) 18.249 7.038 ( -7.388 -7.863 20.459) 23.129 7.459 ( -15.849 -0.555 13.097) 20.568 8.150 ( -7.122 -5.958 12.744) 15.768 8.954 ( -3.278 -6.510 5.756) 9.287 9.265 ( -1.078 -12.101 6.288) 13.680 9.999 ( 2.597 -13.184 5.728) 14.608 10.528 ( 4.345 15.203 12.191) 19.965 10.893 ( 0.127 25.789 -2.911) 25.953 11.920 ( 6.278 9.033 -10.260) 15.042 12.160 ( -14.604 -1.693 -6.311) 15.999 12.404 ( 11.926 16.088 -11.926) 23.309 13.422 ( -0.351 2.333 6.535) 6.948 13.984 ( 6.288 7.571 6.995) 12.074 14.244 ( -6.046 -0.042 -1.581) 6.250 15.030 ( -3.196 -12.340 -17.073) 21.307 18.439 ( 9.223 -8.812 2.172) 12.939 18.770 ( -7.986 -5.752 -14.908) 17.864 19.395 ( 1.651 -4.490 -10.408) 11.455 19.934 ( 1.433 0.451 -4.474) 4.719 21.404 ( -14.588 1.693 6.897) 16.225 21.943 ( 15.618 3.717 4.278) 16.614 24.070 ( -8.632 5.826 -2.722) 10.764 24.316 ( 3.588 0.152 -1.986) 4.104 ======================= Grid point 419 (206/432) ======================= q-point: (-0.09 0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 4.197 2.974 14.320) 15.216 2.493 ( 12.274 7.131 13.411) 19.528 2.977 ( 2.944 -3.867 -2.698) 5.558 3.286 ( 1.902 -7.787 -3.849) 8.892 3.360 ( -7.257 -1.699 -2.810) 7.965 3.521 ( -2.864 -7.588 -8.256) 11.573 3.983 ( 6.003 7.166 6.469) 11.368 4.178 ( 8.915 11.017 -7.946) 16.248 4.838 ( 2.905 -1.228 9.352) 9.870 5.163 ( -6.275 4.882 8.700) 11.785 5.465 ( -7.227 -4.035 -3.812) 9.113 6.034 ( -4.914 -3.793 3.056) 6.919 6.790 ( -7.514 -1.569 -1.323) 7.790 7.101 ( -7.487 -4.783 9.692) 13.147 7.680 ( -8.212 -4.101 41.267) 42.276 8.252 ( -9.461 -6.461 14.653) 18.600 9.032 ( -3.986 -9.137 3.900) 10.705 9.505 ( 7.791 -15.173 8.997) 19.284 10.052 ( -8.719 3.237 -1.240) 9.382 10.513 ( -5.551 12.691 7.262) 15.640 10.760 ( 10.026 14.204 0.576) 17.395 11.886 ( -10.570 -5.032 -12.230) 16.930 11.935 ( 13.832 6.797 -1.233) 15.461 12.358 ( 14.493 9.227 -8.696) 19.257 13.463 ( -1.364 4.723 7.539) 9.000 14.026 ( -0.605 3.991 1.551) 4.325 14.176 ( -1.267 2.639 0.652) 2.999 14.905 ( -2.990 -8.006 -12.169) 14.870 18.426 ( -13.099 -2.798 -16.160) 20.989 18.636 ( 12.481 -1.617 -7.899) 14.859 19.346 ( -4.683 -4.231 -3.455) 7.195 19.916 ( 0.542 0.307 -2.638) 2.711 21.252 ( -11.980 -3.143 -0.182) 12.386 22.198 ( 16.951 8.013 9.138) 20.858 23.922 ( -3.285 4.220 -1.850) 5.658 24.354 ( 3.592 -1.617 -0.851) 4.030 ======================= Grid point 424 (207/432) ======================= q-point: ( 0.36 -0.64 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.186 ( -3.978 0.000 -0.728) 4.044 2.198 ( -2.069 0.000 8.609) 8.854 2.946 ( -6.408 0.000 -0.885) 6.469 3.053 ( -10.796 0.000 7.402) 13.090 3.211 ( -9.046 0.000 1.535) 9.175 3.649 ( -1.174 0.000 -9.856) 9.925 4.008 ( 3.419 -0.000 0.522) 3.459 4.198 ( -6.961 0.000 3.513) 7.797 4.530 ( 4.750 -0.000 4.093) 6.271 4.779 ( -9.788 0.000 1.102) 9.850 4.861 ( 6.122 -0.000 7.668) 9.812 5.912 ( -9.659 0.000 11.188) 14.781 6.075 ( 3.621 -0.000 -4.182) 5.532 6.754 ( -25.013 0.000 7.185) 26.024 7.873 ( 1.969 -0.000 -8.877) 9.093 8.182 ( -22.068 0.000 9.772) 24.134 8.770 ( -5.742 0.000 15.836) 16.844 9.149 ( -6.733 0.000 0.194) 6.736 9.261 ( -13.867 0.000 8.429) 16.228 10.220 ( 3.111 -0.000 -4.201) 5.228 12.122 ( 9.423 -0.000 4.287) 10.352 12.316 ( 3.853 -0.000 -4.465) 5.898 12.814 ( 13.669 -0.000 -5.973) 14.917 13.039 ( -5.048 0.000 -5.403) 7.395 13.377 ( 2.523 -0.000 -3.350) 4.194 13.425 ( -14.780 0.000 10.695) 18.243 14.734 ( 8.839 -0.000 2.565) 9.203 14.851 ( 12.774 -0.000 -15.528) 20.107 16.550 ( -3.251 0.000 16.692) 17.006 19.113 ( 11.309 -0.000 -14.650) 18.508 19.960 ( 5.970 -0.000 6.356) 8.720 20.369 ( 25.461 -0.000 1.452) 25.502 20.583 ( -3.594 0.000 -17.102) 17.476 22.193 ( -23.410 0.000 6.027) 24.174 24.399 ( 3.580 -0.000 1.531) 3.893 24.637 ( -3.151 0.000 1.939) 3.700 ======================= Grid point 426 (208/432) ======================= q-point: (-0.55 0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( -5.441 5.508 3.657) 8.562 2.301 ( 2.200 10.024 14.223) 17.538 2.886 ( -6.165 -4.056 1.197) 7.476 2.948 ( -13.200 -4.763 3.530) 14.470 3.213 ( 0.417 -2.640 4.253) 5.023 3.507 ( -2.326 -1.543 -10.034) 10.415 4.061 ( 5.862 1.417 -0.916) 6.100 4.179 ( -5.211 4.608 7.288) 10.075 4.593 ( -0.488 -0.135 1.383) 1.473 4.748 ( -4.064 -8.651 6.060) 11.317 5.037 ( 5.062 0.833 9.798) 11.060 5.918 ( -6.594 -0.777 8.460) 10.755 6.098 ( 2.699 1.109 1.764) 3.410 6.544 ( -25.144 -4.823 11.983) 28.268 7.847 ( 5.186 0.201 -5.248) 7.381 8.006 ( -16.357 -1.178 4.032) 16.888 8.854 ( -10.848 -3.364 15.373) 19.114 9.131 ( -3.111 -4.890 3.213) 6.626 9.166 ( -12.146 1.545 7.744) 14.487 10.252 ( 5.826 0.630 0.100) 5.861 12.208 ( 5.274 9.625 -1.426) 11.068 12.285 ( 3.227 1.903 -5.545) 6.691 12.711 ( -2.439 19.770 -3.135) 20.165 13.082 ( 5.219 -18.247 -8.086) 20.629 13.307 ( -6.843 10.325 7.917) 14.701 13.491 ( 2.960 -7.480 4.195) 9.073 14.714 ( 3.523 9.177 -8.012) 12.681 14.908 ( 7.448 -13.321 -12.718) 19.866 16.821 ( 3.916 -3.173 26.871) 27.340 19.070 ( 11.091 -1.241 -20.205) 23.082 20.027 ( -0.157 2.882 0.188) 2.893 20.322 ( -6.149 -0.711 -17.209) 18.288 20.747 ( 28.857 0.978 2.055) 28.946 21.990 ( -21.678 -3.226 8.637) 23.557 24.419 ( 0.727 3.557 0.082) 3.632 24.603 ( -5.439 -2.593 -0.235) 6.030 ======================= Grid point 427 (209/432) ======================= q-point: (-0.45 0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -4.785 7.967 6.002) 11.063 2.358 ( 1.129 18.170 12.485) 22.075 2.860 ( -6.137 -4.205 3.156) 8.081 2.955 ( -1.959 -7.165 5.462) 9.220 3.292 ( 0.573 -4.535 0.861) 4.652 3.413 ( -1.177 -5.587 -6.641) 8.758 4.104 ( -2.627 -1.072 -1.249) 3.100 4.159 ( 5.050 10.751 7.853) 14.239 4.580 ( -2.679 -0.385 1.672) 3.181 4.918 ( -0.380 -13.402 9.422) 16.387 5.197 ( 4.338 1.558 9.217) 10.306 5.947 ( -1.670 -2.020 3.758) 4.581 6.167 ( -0.896 -0.154 9.430) 9.474 6.472 ( -19.807 -8.246 18.533) 28.351 7.801 ( -9.613 1.884 0.705) 9.822 7.931 ( 1.628 -4.331 -2.264) 5.151 8.879 ( -17.866 -7.818 13.769) 23.873 9.077 ( -6.977 4.825 6.826) 10.888 9.255 ( 2.140 -8.422 7.888) 11.736 10.365 ( 8.265 1.505 4.864) 9.708 12.088 ( 4.406 25.204 -8.348) 26.914 12.184 ( 1.515 5.962 -8.212) 10.261 12.523 ( -9.009 1.546 -0.168) 9.142 13.133 ( 5.677 2.761 -11.165) 12.826 13.252 ( -7.066 -0.285 9.368) 11.738 13.687 ( 9.447 -2.373 7.638) 12.378 14.563 ( -1.756 7.294 -7.274) 10.450 14.936 ( 3.034 -15.041 -15.686) 21.942 17.284 ( 8.675 -8.674 29.659) 32.096 18.965 ( 8.163 -3.237 -23.647) 25.225 19.896 ( -4.081 7.396 -11.026) 13.890 20.091 ( -6.927 -4.240 -9.557) 12.542 21.145 ( 28.367 2.936 3.887) 28.782 21.864 ( -17.528 -3.572 8.763) 19.919 24.379 ( -0.069 3.972 -1.579) 4.275 24.517 ( -8.389 -1.813 -2.546) 8.952 ======================= Grid point 428 (210/432) ======================= q-point: (-0.36 0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( 2.424 8.070 7.244) 11.112 2.345 ( 0.278 16.501 11.365) 20.038 2.859 ( -1.975 -3.346 0.688) 3.946 3.088 ( 2.043 -4.601 5.900) 7.756 3.308 ( -2.129 -5.729 -1.935) 6.411 3.418 ( -0.501 -8.831 -3.587) 9.545 4.041 ( -4.719 7.013 5.497) 10.083 4.252 ( 11.706 3.026 -3.266) 12.525 4.600 ( -1.762 0.713 7.813) 8.041 5.121 ( -1.267 -9.545 9.469) 13.505 5.331 ( 2.716 -0.741 6.358) 6.953 5.977 ( 0.156 -2.058 -0.157) 2.070 6.306 ( -2.343 -4.648 15.477) 16.328 6.588 ( -12.213 -10.269 25.468) 30.054 7.635 ( -14.161 0.018 -0.008) 14.161 7.993 ( 4.277 -2.282 0.331) 4.859 8.843 ( -18.397 -8.382 11.581) 23.299 9.061 ( -4.726 1.353 8.440) 9.767 9.500 ( 6.678 -10.491 9.777) 15.819 10.545 ( 9.571 4.354 9.743) 14.335 11.743 ( 0.254 31.863 -10.864) 33.665 12.093 ( 3.627 1.829 -9.657) 10.476 12.368 ( -13.657 -1.067 -2.835) 13.989 12.973 ( 4.466 18.240 -10.385) 21.459 13.308 ( -3.682 -6.095 6.468) 9.620 13.923 ( 10.857 3.021 9.708) 14.875 14.398 ( -6.031 3.954 -3.895) 8.196 14.888 ( -0.261 -15.461 -18.073) 23.785 17.823 ( 10.105 -12.479 25.535) 30.165 18.820 ( 3.886 -5.189 -21.269) 22.235 19.606 ( -5.048 4.089 -18.088) 19.219 19.979 ( -3.683 -2.066 -3.808) 5.686 21.494 ( 16.069 6.956 7.965) 19.236 21.788 ( -5.253 -3.042 3.596) 7.055 24.314 ( -3.838 1.844 -3.643) 5.603 24.372 ( -5.939 1.568 -2.777) 6.741 ======================= Grid point 429 (211/432) ======================= q-point: (-0.27 0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 8.299 9.804 7.508) 14.878 2.390 ( 3.892 8.919 12.464) 15.813 2.888 ( 2.148 -2.138 -0.024) 3.031 3.165 ( 0.938 -3.675 -1.800) 4.199 3.311 ( -7.959 -8.989 2.306) 12.225 3.433 ( 0.766 -7.675 -6.822) 10.297 4.019 ( 1.963 7.344 5.668) 9.483 4.330 ( 12.708 4.296 -6.500) 14.906 4.691 ( -0.885 1.355 12.234) 12.340 5.234 ( -3.666 -1.630 7.789) 8.762 5.409 ( -1.634 -3.735 2.131) 4.600 5.981 ( -2.173 -2.558 -0.061) 3.357 6.524 ( -1.864 -9.414 16.250) 18.872 6.873 ( -4.828 -10.599 24.616) 27.232 7.458 ( -14.548 0.231 6.641) 15.994 8.082 ( 1.441 -1.884 5.251) 5.762 8.826 ( -13.270 -9.321 9.752) 18.923 9.120 ( -2.961 -4.419 8.962) 10.422 9.792 ( 6.744 -10.577 8.725) 15.280 10.734 ( 6.798 9.299 12.324) 16.868 11.366 ( -1.066 28.041 -9.199) 29.530 12.009 ( 4.474 2.905 -12.198) 13.314 12.123 ( -14.754 -0.307 -5.253) 15.664 12.752 ( 6.876 20.884 -10.935) 24.556 13.392 ( -2.407 -5.018 6.814) 8.798 14.111 ( 6.191 6.985 7.677) 12.086 14.260 ( -5.729 1.781 -0.333) 6.009 14.799 ( -1.435 -14.762 -16.913) 22.495 18.274 ( 7.567 -10.101 13.567) 18.530 18.683 ( -0.119 -4.316 -14.773) 15.391 19.335 ( -3.478 -2.600 -15.924) 16.506 19.932 ( 0.825 -0.460 -3.337) 3.468 21.478 ( -13.262 6.117 3.727) 15.073 21.996 ( 21.978 2.660 5.317) 22.768 24.144 ( -8.455 2.945 -4.250) 9.910 24.320 ( 0.607 0.325 -1.897) 2.018 ======================= Grid point 430 (212/432) ======================= q-point: (-0.18 0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( 4.363 7.729 8.179) 12.069 2.589 ( 12.885 4.231 10.984) 17.452 2.931 ( 1.186 -1.195 0.200) 1.696 3.178 ( 2.391 -4.684 -4.669) 7.032 3.276 ( -14.100 -8.942 3.884) 17.142 3.416 ( 4.602 -4.556 -10.490) 12.328 4.090 ( 7.307 5.536 4.048) 10.021 4.349 ( 10.818 8.707 -8.173) 16.113 4.821 ( -0.067 -0.526 11.837) 11.848 5.242 ( -5.889 3.356 7.082) 9.803 5.386 ( -7.757 -4.272 -1.411) 8.967 5.969 ( -4.866 -3.724 1.877) 6.409 6.722 ( -4.125 -6.638 7.319) 10.707 7.005 ( -7.966 -6.397 4.646) 11.223 7.599 ( -5.503 -5.045 37.500) 38.236 8.174 ( -1.279 -2.361 7.477) 7.944 8.866 ( -9.897 -10.780 8.567) 16.957 9.277 ( 1.943 -11.042 9.254) 14.538 10.010 ( 2.528 -5.244 4.873) 7.591 10.770 ( -6.447 14.869 7.365) 17.802 11.066 ( 2.875 20.358 -6.012) 21.421 11.820 ( -12.519 -1.145 -8.946) 15.430 12.013 ( 10.802 3.003 -6.144) 12.784 12.593 ( 11.131 16.700 -8.787) 21.909 13.474 ( -2.498 -3.306 6.751) 7.921 14.056 ( -8.926 0.821 -0.935) 9.012 14.276 ( 4.203 7.274 3.719) 9.188 14.746 ( 1.166 -10.475 -9.655) 14.294 18.377 ( -9.401 -3.008 -10.082) 14.110 18.609 ( 10.501 -1.460 -6.948) 12.675 19.242 ( -1.747 -7.477 -3.197) 8.318 19.921 ( 1.499 0.223 -2.533) 2.952 21.262 ( -11.779 3.884 -2.760) 12.706 22.323 ( 19.904 6.694 9.184) 22.919 23.985 ( -4.536 3.039 -3.611) 6.546 24.323 ( 1.148 -1.983 -0.892) 2.458 ======================= Grid point 431 (213/432) ======================= q-point: (-0.09 0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -0.565 0.127 6.669) 6.694 2.843 ( 12.961 4.535 5.932) 14.958 2.964 ( 1.943 -1.640 4.072) 4.801 3.166 ( -8.704 -5.957 -4.026) 11.290 3.197 ( -5.056 -3.619 -0.413) 6.232 3.440 ( 10.936 -2.419 -7.033) 13.226 4.175 ( 6.541 4.546 1.448) 8.096 4.284 ( 8.138 11.430 -9.978) 17.217 4.942 ( -1.133 -0.959 8.449) 8.578 5.204 ( -6.811 0.535 1.840) 7.075 5.253 ( -13.189 -0.791 1.633) 13.313 5.963 ( -5.273 -4.658 2.732) 7.547 6.606 ( -12.598 0.644 -5.540) 13.777 7.105 ( -3.207 -6.936 11.760) 14.025 8.031 ( -6.268 -2.877 39.917) 40.509 8.256 ( -0.559 -3.018 5.956) 6.700 8.932 ( -10.877 -10.814 10.985) 18.866 9.565 ( 6.465 -18.647 8.121) 21.341 9.990 ( -8.054 11.355 0.105) 13.922 10.514 ( -11.884 13.242 -1.734) 17.878 11.020 ( 9.866 3.919 -1.520) 10.724 11.552 ( -11.014 0.939 -8.960) 14.229 12.162 ( 17.581 -0.112 -2.156) 17.713 12.588 ( 15.511 10.220 -2.314) 18.719 13.527 ( -4.047 -1.198 6.420) 7.684 13.929 ( -8.127 -1.133 -1.123) 8.282 14.256 ( -0.375 5.130 -1.938) 5.497 14.787 ( 5.689 -1.551 -1.269) 6.032 18.022 ( -14.141 0.344 -21.551) 25.778 18.736 ( 13.028 -1.804 -2.583) 13.404 19.264 ( -0.743 -1.341 0.877) 1.766 19.883 ( -4.360 1.986 0.315) 4.802 21.087 ( -3.288 -2.130 -7.969) 8.880 22.598 ( 13.307 9.910 12.233) 20.614 23.899 ( 0.996 1.468 -3.921) 4.304 24.363 ( 1.224 -3.680 0.930) 3.988 ======================= Grid point 437 (214/432) ======================= q-point: ( 0.45 -0.55 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -4.486 0.000 3.879) 5.930 2.579 ( 5.834 -0.000 13.829) 15.010 2.816 ( -8.820 0.000 4.976) 10.126 2.823 ( -4.259 0.000 2.056) 4.729 3.258 ( 0.836 -0.000 3.253) 3.358 3.370 ( -1.204 0.000 -8.243) 8.330 4.074 ( 5.277 -0.000 -5.590) 7.687 4.299 ( -0.296 0.000 9.468) 9.472 4.579 ( -2.700 0.000 1.086) 2.910 4.769 ( -1.931 0.000 12.714) 12.860 5.214 ( 3.631 -0.000 9.840) 10.489 5.926 ( -3.196 0.000 5.148) 6.059 6.168 ( -0.566 0.000 7.079) 7.102 6.400 ( -18.671 0.000 18.145) 26.036 7.819 ( -14.702 0.000 0.664) 14.717 7.895 ( 8.827 -0.000 -3.869) 9.638 8.809 ( -19.979 0.000 16.022) 25.610 9.124 ( -8.196 0.000 7.382) 11.030 9.179 ( 3.429 -0.000 7.586) 8.325 10.377 ( 8.896 -0.000 4.618) 10.023 12.196 ( 1.927 -0.000 -9.218) 9.417 12.347 ( 6.153 -0.000 -2.414) 6.610 12.602 ( -12.808 0.000 -12.325) 17.775 12.998 ( 2.489 -0.000 -1.082) 2.714 13.355 ( -9.518 0.000 11.436) 14.879 13.653 ( 16.118 -0.000 5.023) 16.882 14.696 ( -7.398 0.000 -3.454) 8.165 14.733 ( 9.071 -0.000 -20.688) 22.589 17.210 ( 7.900 -0.000 29.551) 30.589 18.937 ( 8.029 -0.000 -24.041) 25.346 20.003 ( -3.234 0.000 -1.708) 3.657 20.010 ( -8.430 0.000 -19.271) 21.034 21.170 ( 30.118 -0.000 2.894) 30.257 21.836 ( -16.693 0.000 9.938) 19.427 24.424 ( -1.566 0.000 -0.707) 1.718 24.489 ( -7.143 0.000 -3.019) 7.755 ======================= Grid point 439 (215/432) ======================= q-point: (-0.45 0.45 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.129 ( 2.614 3.241 4.772) 6.333 2.638 ( 0.450 17.783 7.299) 19.228 2.812 ( -1.393 -1.738 1.949) 2.960 2.922 ( 0.183 -14.698 6.314) 15.998 3.260 ( -2.424 0.775 -2.740) 3.740 3.311 ( -1.769 -4.582 -0.992) 5.011 4.112 ( 7.684 1.611 -2.430) 8.218 4.323 ( 3.422 3.850 -3.707) 6.346 4.615 ( -2.846 0.946 12.804) 13.151 4.949 ( -0.346 -7.678 13.112) 15.198 5.345 ( 1.003 1.004 8.273) 8.394 5.945 ( -0.594 -1.345 1.016) 1.787 6.252 ( -3.448 -1.592 12.046) 12.631 6.469 ( -10.028 -3.660 24.163) 26.416 7.631 ( -13.990 -0.264 -0.403) 13.998 7.984 ( 10.161 0.344 -2.881) 10.567 8.721 ( -23.310 -4.421 16.593) 28.952 9.101 ( -7.170 1.907 7.896) 10.835 9.377 ( 7.702 -3.913 10.352) 13.483 10.589 ( 11.561 1.175 9.405) 14.950 12.116 ( 3.515 0.762 -10.642) 11.233 12.175 ( -4.866 14.759 -20.098) 25.405 12.375 ( -6.792 3.176 1.288) 7.607 13.021 ( -0.753 -7.953 -4.872) 9.357 13.341 ( -6.932 6.839 11.165) 14.815 13.951 ( 16.077 0.459 8.521) 18.201 14.483 ( -7.696 6.117 -6.259) 11.654 14.655 ( 1.000 -11.273 -17.776) 21.073 17.678 ( 9.604 -4.481 27.905) 29.850 18.762 ( 4.901 -1.757 -21.830) 22.442 19.656 ( -9.234 1.628 -20.179) 22.251 19.951 ( -1.612 -1.008 -2.634) 3.248 21.588 ( 25.656 3.556 5.451) 26.468 21.747 ( -10.188 -1.708 5.846) 11.869 24.338 ( -7.169 0.900 -4.493) 8.508 24.384 ( -3.291 0.070 -1.792) 3.748 ======================= Grid point 440 (216/432) ======================= q-point: (-0.36 0.45 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.256 ( 12.478 5.363 5.252) 14.562 2.572 ( -1.321 12.781 6.601) 14.445 2.862 ( 3.283 -1.248 2.462) 4.289 3.077 ( -2.961 -9.615 3.860) 10.775 3.181 ( -2.976 -2.330 -4.729) 6.054 3.316 ( -1.838 -6.486 -2.033) 7.042 4.145 ( 5.725 7.558 -0.500) 9.495 4.349 ( 11.973 -2.180 -7.311) 14.198 4.731 ( -2.884 3.126 15.763) 16.327 5.134 ( -1.828 -7.625 9.183) 12.075 5.406 ( -2.864 1.555 6.305) 7.098 5.943 ( -1.815 -1.864 -1.140) 2.841 6.392 ( -2.909 -5.695 14.763) 16.089 6.718 ( -3.120 -6.956 24.193) 25.365 7.462 ( -13.079 0.196 4.480) 13.826 8.084 ( 8.743 1.561 -0.361) 8.888 8.666 ( -21.187 -8.412 16.442) 28.107 9.093 ( -6.417 0.042 8.533) 10.677 9.655 ( 9.089 -5.640 10.705) 15.133 10.846 ( 10.107 4.219 12.344) 16.503 11.733 ( -8.228 12.569 -19.704) 24.778 12.039 ( 4.801 1.028 -11.896) 12.869 12.215 ( -7.803 12.466 -0.348) 14.711 12.972 ( 1.661 0.733 -10.551) 10.706 13.338 ( -5.783 2.656 11.165) 12.852 14.209 ( 4.979 4.821 5.279) 8.712 14.295 ( -3.741 1.889 2.003) 4.645 14.554 ( 0.055 -13.345 -17.581) 22.072 18.128 ( 7.665 -6.522 20.426) 22.771 18.628 ( 4.201 -2.222 -14.739) 15.486 19.305 ( -7.908 -1.058 -19.226) 20.816 19.924 ( 1.544 -0.358 -3.032) 3.421 21.578 ( -11.709 4.882 1.313) 12.754 22.030 ( 25.656 1.358 6.589) 26.523 24.174 ( -7.659 0.860 -5.116) 9.251 24.326 ( -2.056 0.319 -1.736) 2.709 ======================= Grid point 441 (217/432) ======================= q-point: (-0.27 0.45 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 4.450 10.268 2.518) 11.470 2.638 ( 11.009 1.820 8.740) 14.174 2.942 ( 1.365 2.181 3.525) 4.364 3.091 ( -12.428 -10.092 4.734) 16.695 3.138 ( 2.587 -1.725 -4.309) 5.313 3.335 ( 5.285 -5.653 -7.734) 10.941 4.169 ( 7.514 3.887 -1.740) 8.637 4.445 ( 12.910 2.042 -7.577) 15.108 4.831 ( -3.989 2.026 14.010) 14.708 5.216 ( -4.995 -5.310 3.060) 7.906 5.385 ( -7.594 3.140 5.996) 10.173 5.912 ( -4.872 -3.008 0.540) 5.752 6.591 ( -1.148 -7.762 12.538) 14.791 6.892 ( -6.976 -6.718 3.033) 10.148 7.530 ( -3.743 -2.837 30.247) 30.609 8.174 ( 4.947 1.993 2.890) 6.066 8.680 ( -16.220 -10.757 14.788) 24.443 9.142 ( -3.895 -5.262 9.049) 11.168 9.927 ( 7.907 -4.127 8.982) 12.658 10.978 ( -1.939 9.829 7.340) 12.419 11.327 ( -7.727 7.674 -17.561) 20.664 11.914 ( -3.914 11.989 -3.310) 13.039 12.063 ( 6.780 4.921 -5.921) 10.259 12.842 ( 5.900 9.890 -10.943) 15.886 13.390 ( -5.902 -4.358 9.067) 11.663 14.073 ( -10.671 1.079 -1.188) 10.791 14.350 ( -1.559 -0.913 -3.381) 3.833 14.591 ( 10.201 -5.582 -0.394) 11.635 18.328 ( -5.256 -2.614 -2.841) 6.522 18.589 ( 8.871 -0.841 -6.554) 11.062 19.120 ( -0.903 -6.398 -4.800) 8.049 19.923 ( 2.695 0.078 -2.789) 3.879 21.354 ( -10.762 6.096 -5.480) 13.528 22.418 ( 22.454 4.518 9.716) 24.880 24.021 ( -5.128 1.336 -4.754) 7.119 24.291 ( -1.550 -1.651 -0.933) 2.449 ======================= Grid point 442 (218/432) ======================= q-point: (-0.18 -0.55 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( -5.550 3.205 2.759) 6.978 2.904 ( 4.224 3.625 2.081) 5.943 2.934 ( 6.013 -3.430 5.104) 8.600 3.053 ( -8.335 -6.220 3.224) 10.888 3.180 ( 1.508 1.636 2.010) 2.998 3.397 ( 14.786 -2.968 -9.059) 17.592 4.221 ( 6.424 1.155 -2.838) 7.117 4.449 ( 8.556 7.346 -9.648) 14.842 4.911 ( -4.707 -2.363 9.186) 10.589 5.158 ( -8.933 -3.186 -2.734) 9.870 5.313 ( -9.508 5.190 8.687) 13.885 5.887 ( -6.008 -4.251 2.483) 7.768 6.607 ( -11.060 -0.535 -4.090) 11.804 6.951 ( -0.709 -10.642 9.829) 14.504 7.964 ( -1.088 -4.758 38.663) 38.970 8.247 ( 5.619 1.751 0.721) 5.930 8.741 ( -15.513 -11.192 16.369) 25.176 9.296 ( 0.635 -12.988 8.382) 15.471 10.099 ( 2.928 3.112 5.788) 7.194 10.774 ( -14.883 14.186 -2.319) 20.691 11.018 ( -5.368 -1.306 -15.313) 16.279 11.720 ( -4.114 17.067 1.194) 17.597 12.157 ( 15.818 -0.399 -4.049) 16.332 12.767 ( 11.301 9.932 -5.618) 16.060 13.440 ( -8.298 -7.564 6.840) 13.147 13.939 ( -6.345 1.799 0.171) 6.597 14.268 ( -4.709 -4.146 -5.575) 8.393 14.790 ( 11.680 2.060 5.271) 12.979 18.032 ( -13.430 0.744 -21.249) 25.148 18.706 ( 11.906 -1.638 -1.108) 12.069 19.218 ( 3.353 -3.748 5.584) 7.514 19.914 ( -0.939 1.470 -0.699) 1.880 21.102 ( -5.399 3.448 -11.152) 12.861 22.753 ( 16.685 8.265 12.635) 22.502 23.917 ( -0.725 0.665 -5.173) 5.266 24.296 ( -1.222 -4.023 1.056) 4.335 ======================= Grid point 443 (219/432) ======================= q-point: (-0.09 -0.55 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( -10.452 -3.598 2.189) 11.269 2.836 ( -14.535 -8.113 1.965) 16.761 2.999 ( 0.008 -0.297 -0.796) 0.849 3.157 ( 1.418 1.811 -1.114) 2.556 3.238 ( 15.254 5.925 5.874) 17.387 3.557 ( 15.090 -0.454 -2.308) 15.273 4.226 ( -2.678 -0.461 -1.216) 2.977 4.357 ( 8.330 9.147 -11.532) 16.913 4.895 ( -13.551 -7.053 -2.027) 15.410 5.039 ( -3.441 3.888 1.405) 5.379 5.254 ( -8.199 4.070 8.046) 12.187 5.881 ( -5.020 -5.241 2.171) 7.575 6.367 ( -14.264 0.486 -5.629) 15.342 7.154 ( -0.423 -7.266 11.174) 13.335 8.249 ( 3.310 2.675 0.974) 4.366 8.404 ( -3.624 -2.831 27.077) 27.465 8.833 ( -16.593 -9.949 21.039) 28.582 9.545 ( 3.714 -18.249 4.814) 19.235 10.017 ( -9.718 17.618 2.295) 20.250 10.418 ( -12.265 10.820 -5.638) 17.300 10.902 ( 0.437 -15.776 -10.980) 19.226 11.573 ( 1.346 16.365 2.297) 16.580 12.318 ( 14.476 -2.508 -6.514) 16.071 12.866 ( 14.857 5.726 3.443) 16.290 13.447 ( -11.795 -8.745 5.681) 15.744 13.882 ( -0.184 4.254 1.630) 4.560 14.181 ( -5.116 -2.420 -2.940) 6.378 14.967 ( 12.140 6.462 4.185) 14.375 17.566 ( -15.217 0.351 -24.983) 29.255 18.895 ( 12.642 -1.341 3.485) 13.182 19.320 ( 3.956 3.481 2.456) 5.813 19.850 ( -5.900 3.209 2.000) 7.007 20.937 ( 2.650 -3.105 -14.126) 14.704 22.983 ( 7.101 12.897 14.671) 20.784 23.881 ( 5.373 -1.470 -6.647) 8.672 24.352 ( -0.702 -5.531 3.972) 6.845 ======================= Grid point 450 (220/432) ======================= q-point: (-0.45 0.55 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 12.652 -0.000 5.400) 13.756 2.764 ( -1.786 0.000 -2.476) 3.052 2.815 ( -2.312 0.000 5.369) 5.846 2.943 ( 3.672 -0.000 7.514) 8.364 3.195 ( 1.492 -0.000 -6.172) 6.350 3.236 ( -7.457 0.000 1.311) 7.571 4.259 ( 13.548 -0.000 -0.606) 13.562 4.278 ( 3.974 -0.000 -10.298) 11.038 4.767 ( -2.855 0.000 16.530) 16.775 5.056 ( -0.956 0.000 11.145) 11.186 5.422 ( -3.347 0.000 7.445) 8.163 5.925 ( -1.543 0.000 -1.411) 2.091 6.343 ( -3.006 0.000 13.691) 14.017 6.658 ( -2.773 0.000 23.622) 23.784 7.464 ( -12.456 0.000 4.078) 13.106 8.104 ( 13.209 -0.000 -4.045) 13.814 8.587 ( -25.801 0.000 20.875) 33.189 9.096 ( -8.075 0.000 8.052) 11.404 9.607 ( 9.979 -0.000 11.467) 15.201 10.880 ( 11.544 -0.000 12.337) 16.896 11.817 ( -14.503 0.000 -22.156) 26.481 12.048 ( 5.358 -0.000 -11.665) 12.837 12.393 ( 0.339 -0.000 -1.995) 2.024 12.898 ( -3.776 0.000 -4.349) 5.759 13.404 ( -6.686 0.000 10.353) 12.325 14.272 ( 15.649 -0.000 9.615) 18.367 14.303 ( -14.637 0.000 -3.134) 14.969 14.415 ( 1.811 -0.000 -18.511) 18.600 18.071 ( 7.943 -0.000 22.469) 23.832 18.609 ( 5.435 -0.000 -14.645) 15.621 19.297 ( -9.451 0.000 -20.220) 22.320 19.921 ( 1.929 -0.000 -3.028) 3.591 21.622 ( -11.143 0.000 0.339) 11.148 22.042 ( 26.947 -0.000 7.265) 27.909 24.180 ( -7.355 0.000 -5.410) 9.130 24.329 ( -3.039 0.000 -1.663) 3.464 ======================= Grid point 452 (221/432) ======================= q-point: (-0.36 0.55 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( 10.393 7.628 1.836) 13.022 2.655 ( -0.399 0.317 3.148) 3.189 2.887 ( -4.217 -7.319 6.085) 10.410 3.052 ( -1.056 5.010 4.988) 7.148 3.131 ( 1.170 -0.113 -1.321) 1.768 3.228 ( 7.154 -6.103 -6.988) 11.716 4.221 ( 6.816 2.099 -8.523) 11.113 4.434 ( 12.257 -1.749 -2.818) 12.698 4.877 ( -4.527 2.373 12.760) 13.745 5.135 ( -3.680 -3.202 4.367) 6.548 5.431 ( -7.483 1.701 8.439) 11.407 5.874 ( -4.843 -1.313 -0.610) 5.055 6.494 ( 0.613 -3.132 13.051) 13.436 6.802 ( -6.157 -3.144 4.334) 8.160 7.502 ( -3.358 -0.695 25.135) 25.368 8.222 ( 12.021 2.687 -3.257) 12.742 8.532 ( -23.452 -5.675 22.951) 33.301 9.088 ( -7.647 -1.451 8.531) 11.548 9.879 ( 10.270 -1.440 11.084) 15.179 11.098 ( 1.816 4.083 8.561) 9.657 11.363 ( -14.709 -0.543 -22.234) 26.664 12.020 ( 10.461 1.292 -8.818) 13.742 12.286 ( -2.470 15.223 -1.652) 15.510 12.843 ( 0.650 -7.033 -7.530) 10.324 13.400 ( -7.862 3.701 9.040) 12.539 14.089 ( -11.774 0.757 -1.308) 11.871 14.256 ( -2.942 -5.948 -12.906) 14.512 14.573 ( 14.035 0.801 9.118) 16.756 18.295 ( -2.484 -1.093 2.162) 3.470 18.581 ( 8.212 -0.246 -6.353) 10.386 19.044 ( -1.217 -2.366 -6.894) 7.390 19.924 ( 3.365 0.004 -3.025) 4.525 21.435 ( -9.676 2.783 -6.989) 12.256 22.471 ( 23.897 1.611 10.153) 26.015 24.033 ( -5.278 0.266 -5.223) 7.430 24.271 ( -3.423 -0.630 -1.013) 3.625 ======================= Grid point 453 (222/432) ======================= q-point: (-0.27 -0.45 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -11.847 5.268 1.193) 13.020 2.800 ( -11.973 -9.957 2.214) 15.729 2.994 ( 11.278 5.669 3.183) 13.018 3.013 ( 5.214 0.914 5.697) 7.777 3.213 ( 2.911 0.654 2.720) 4.038 3.341 ( 18.179 -3.004 -8.018) 20.094 4.225 ( 7.385 -0.297 -7.006) 10.183 4.509 ( 5.759 0.074 -7.425) 9.397 4.895 ( -8.062 1.013 7.464) 11.033 5.113 ( -5.240 -2.334 -0.186) 5.739 5.396 ( -9.101 4.166 9.145) 13.558 5.823 ( -6.707 -3.108 2.391) 7.770 6.601 ( -8.151 0.531 -1.577) 8.320 6.774 ( 0.063 -9.601 6.237) 11.450 7.890 ( 2.669 -3.561 34.327) 34.614 8.301 ( 8.634 4.073 -1.247) 9.627 8.576 ( -18.520 -8.027 22.503) 30.229 9.131 ( -5.209 -6.631 8.730) 12.138 10.129 ( 8.339 0.923 9.651) 12.788 10.889 ( -14.539 0.524 -17.913) 23.077 11.065 ( -10.220 5.729 -4.531) 12.562 12.050 ( 0.307 18.720 1.356) 18.772 12.156 ( 11.491 1.408 -5.053) 12.631 12.851 ( 7.751 -2.229 -7.087) 10.736 13.353 ( -11.765 -0.486 8.444) 14.490 13.969 ( -4.968 1.400 1.307) 5.324 14.145 ( -5.574 -8.636 -7.569) 12.765 14.836 ( 12.948 2.581 8.512) 15.709 18.044 ( -13.006 0.615 -21.259) 24.930 18.684 ( 11.202 -0.970 0.036) 11.244 19.156 ( 6.358 -2.995 9.281) 11.642 19.931 ( 1.570 0.612 -1.617) 2.335 21.174 ( -6.383 4.115 -13.992) 15.920 22.865 ( 19.656 4.742 12.915) 23.992 23.923 ( -2.159 0.198 -5.132) 5.571 24.236 ( -3.520 -2.859 0.730) 4.593 ======================= Grid point 454 (223/432) ======================= q-point: (-0.18 -0.45 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( -15.576 0.208 3.309) 15.925 2.670 ( -20.224 -11.049 2.087) 23.140 3.032 ( 4.750 4.263 0.158) 6.385 3.201 ( 3.131 2.768 0.947) 4.285 3.321 ( 16.749 3.432 3.293) 17.411 3.550 ( 18.386 -0.074 -1.874) 18.481 4.217 ( -2.178 -0.175 -4.318) 4.839 4.438 ( 3.814 -0.694 -12.288) 12.885 4.807 ( -13.760 -1.880 1.995) 14.031 5.079 ( -0.878 0.931 0.629) 1.425 5.337 ( -8.158 5.147 7.757) 12.378 5.802 ( -6.277 -4.107 3.142) 8.133 6.373 ( -13.863 0.373 -6.605) 15.361 7.003 ( 4.154 -9.673 9.414) 14.122 8.278 ( -4.195 -2.633 23.998) 24.503 8.361 ( 10.215 1.215 -3.824) 10.975 8.696 ( -16.578 -5.676 30.675) 35.327 9.268 ( -0.534 -13.754 6.787) 15.347 10.246 ( -0.304 9.334 5.144) 10.662 10.517 ( -14.962 -2.380 -14.083) 20.685 10.806 ( -5.693 6.068 -6.959) 10.847 11.871 ( -2.715 18.324 1.872) 18.619 12.276 ( 12.768 -2.218 -7.636) 15.042 12.947 ( 13.127 2.014 -0.381) 13.286 13.303 ( -14.596 -5.952 8.775) 18.040 13.952 ( 1.444 3.564 2.630) 4.659 14.082 ( -6.453 -8.712 -2.445) 11.113 15.065 ( 13.356 4.826 6.770) 15.732 17.572 ( -15.072 0.371 -26.377) 30.381 18.877 ( 12.740 -0.823 4.354) 13.489 19.358 ( 6.338 1.146 7.955) 10.236 19.899 ( -4.223 2.407 0.821) 4.930 20.922 ( 0.987 0.902 -18.554) 18.602 23.181 ( 12.221 10.076 15.378) 22.076 23.859 ( 2.606 -0.872 -6.911) 7.438 24.254 ( -2.964 -5.864 4.071) 7.729 ======================= Grid point 455 (224/432) ======================= q-point: (-0.09 -0.45 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.063 ( -17.577 -4.090 4.744) 18.660 2.520 ( -20.202 -11.674 0.554) 23.339 3.045 ( 2.863 2.779 -1.119) 4.144 3.213 ( 3.278 4.346 1.667) 5.693 3.505 ( 11.430 5.208 -0.016) 12.561 3.737 ( 6.761 1.762 2.533) 7.432 4.067 ( -11.833 -3.599 -1.069) 12.415 4.413 ( 13.033 2.714 -11.878) 17.841 4.639 ( -15.095 -1.630 0.355) 15.187 5.068 ( 0.160 2.512 0.324) 2.538 5.269 ( -5.742 5.575 3.742) 8.835 5.795 ( -4.584 -4.994 1.642) 6.975 6.123 ( -14.037 -0.525 -4.030) 14.613 7.218 ( 0.842 -6.433 9.585) 11.574 8.299 ( 7.259 6.111 -10.592) 14.220 8.506 ( -15.284 -8.825 21.302) 27.663 8.872 ( -12.622 0.326 24.689) 27.730 9.481 ( 3.115 -17.351 2.820) 17.853 10.056 ( -12.694 20.821 1.314) 24.421 10.228 ( -9.012 -2.140 -6.848) 11.519 10.765 ( 5.382 -5.178 -1.947) 7.718 11.736 ( -0.071 12.714 0.873) 12.744 12.355 ( 11.388 -4.894 -10.676) 16.359 13.119 ( 11.456 1.395 1.837) 11.686 13.263 ( -16.408 -6.920 10.938) 20.899 13.993 ( 5.112 5.279 2.703) 7.830 14.071 ( -4.028 -6.511 2.256) 7.982 15.252 ( 14.459 8.419 3.038) 17.006 17.080 ( -15.727 -0.709 -23.177) 28.018 19.122 ( 13.362 -0.577 7.234) 15.206 19.443 ( 2.441 7.641 1.595) 8.179 19.829 ( -4.041 1.306 2.684) 5.023 20.786 ( 7.371 -4.317 -18.431) 20.315 23.321 ( -1.448 17.257 15.227) 23.060 23.870 ( 10.317 -4.059 -9.000) 14.280 24.355 ( -1.048 -7.138 8.463) 11.121 ======================= Grid point 463 (225/432) ======================= q-point: (-0.36 -0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.467 ( -16.470 0.000 1.303) 16.522 2.688 ( -11.218 0.000 1.842) 11.368 3.013 ( 13.619 -0.000 10.039) 16.920 3.084 ( 6.514 -0.000 -2.350) 6.925 3.187 ( 2.765 -0.000 0.575) 2.824 3.322 ( 19.059 -0.000 -3.971) 19.468 4.221 ( 8.314 -0.000 -9.102) 12.328 4.499 ( 2.254 -0.000 -4.882) 5.377 4.915 ( -7.579 0.000 5.919) 9.617 5.088 ( -3.649 0.000 0.228) 3.657 5.435 ( -8.922 0.000 9.596) 13.102 5.794 ( -7.056 0.000 2.283) 7.416 6.638 ( -11.733 0.000 -6.458) 13.393 6.655 ( 4.977 -0.000 10.718) 11.817 7.858 ( 3.580 -0.000 32.246) 32.444 8.351 ( 13.861 -0.000 -7.213) 15.625 8.494 ( -23.206 0.000 30.312) 38.175 9.075 ( -7.869 0.000 8.958) 11.923 10.137 ( 9.990 -0.000 11.008) 14.865 10.886 ( -16.102 0.000 -23.194) 28.236 11.120 ( -8.683 0.000 -0.042) 8.683 12.135 ( 15.370 -0.000 -4.699) 16.072 12.291 ( -4.983 0.000 -1.786) 5.294 12.773 ( 5.523 -0.000 -3.974) 6.804 13.378 ( -11.875 0.000 7.731) 14.170 13.981 ( -4.532 0.000 1.733) 4.852 14.054 ( -5.119 0.000 -8.542) 9.958 14.859 ( 12.817 -0.000 9.233) 15.796 18.050 ( -12.875 0.000 -21.321) 24.907 18.675 ( 10.978 -0.000 0.479) 10.988 19.130 ( 7.453 -0.000 10.575) 12.937 19.936 ( 2.389 -0.000 -1.945) 3.081 21.213 ( -6.511 0.000 -15.067) 16.414 22.906 ( 20.901 -0.000 12.935) 24.580 23.925 ( -2.724 0.000 -4.686) 5.420 24.210 ( -4.534 0.000 0.363) 4.548 ======================= Grid point 464 (226/432) ======================= q-point: (-0.27 -0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( -18.654 2.966 4.946) 19.525 2.498 ( -22.191 -7.610 1.680) 23.520 3.124 ( 6.302 5.738 0.171) 8.525 3.213 ( 2.567 -2.034 -1.423) 3.571 3.356 ( 19.657 1.072 4.224) 20.135 3.558 ( 20.160 0.697 -0.720) 20.184 4.232 ( 4.500 1.929 -6.751) 8.340 4.364 ( -9.415 -5.303 -8.454) 13.720 4.819 ( -10.772 1.518 0.642) 10.898 5.081 ( 1.447 -0.283 0.251) 1.496 5.405 ( -8.180 2.418 7.035) 11.057 5.749 ( -7.060 -1.859 4.420) 8.535 6.381 ( -13.670 0.466 -7.561) 15.629 6.869 ( 7.311 -4.921 8.197) 12.036 8.206 ( -6.457 -3.093 26.048) 27.014 8.418 ( 12.035 2.875 -8.848) 15.211 8.636 ( -11.970 -1.823 34.427) 36.494 9.102 ( -5.910 -5.417 8.563) 11.730 10.355 ( 3.738 4.274 6.233) 8.432 10.443 ( -12.017 -4.052 -17.336) 21.479 10.932 ( -9.481 5.031 -5.238) 11.943 12.138 ( -7.167 10.840 -0.466) 13.003 12.248 ( 11.313 -1.016 -8.216) 14.018 12.895 ( 10.865 -5.262 -0.058) 12.072 13.299 ( -13.120 3.063 11.230) 17.539 13.935 ( -7.068 -6.543 -2.971) 10.079 13.994 ( 2.109 1.286 3.018) 3.899 15.121 ( 13.387 1.736 7.937) 15.660 17.577 ( -14.959 0.157 -27.271) 31.105 18.867 ( 12.889 -0.261 4.814) 13.761 19.367 ( 7.415 0.108 11.648) 13.808 19.927 ( -2.460 0.807 -0.007) 2.589 20.945 ( -0.278 1.123 -21.753) 21.784 23.302 ( 17.197 3.814 14.605) 22.882 23.856 ( -0.155 0.306 -4.083) 4.097 24.172 ( -5.145 -3.124 2.711) 6.602 ======================= Grid point 465 (227/432) ======================= q-point: (-0.18 -0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.039 ( -21.127 1.463 6.791) 22.240 2.311 ( -22.710 -12.292 2.852) 25.980 3.107 ( 0.646 3.800 -3.688) 5.334 3.272 ( 5.331 2.165 2.220) 6.167 3.580 ( 12.887 3.635 -0.416) 13.396 3.782 ( 8.825 3.475 2.135) 9.722 4.017 ( -14.072 -2.299 -2.886) 14.547 4.367 ( 8.207 -6.030 -6.943) 12.326 4.658 ( -8.627 2.532 -1.468) 9.110 5.098 ( 0.359 1.302 0.236) 1.372 5.350 ( -4.590 3.516 2.857) 6.450 5.729 ( -5.774 -2.788 3.196) 7.164 6.116 ( -14.264 -0.152 -5.562) 15.311 7.100 ( 6.545 -6.508 6.914) 11.532 8.347 ( -16.993 -7.132 19.056) 26.509 8.414 ( 8.042 5.590 -6.257) 11.622 8.893 ( -8.718 1.341 27.427) 28.810 9.218 ( 0.798 -12.653 4.373) 13.411 10.093 ( -7.452 -6.639 -14.727) 17.790 10.393 ( -10.874 13.818 5.121) 18.314 10.792 ( 4.971 4.217 -1.577) 6.707 11.949 ( -6.359 11.168 0.018) 12.852 12.282 ( 9.215 -3.604 -11.679) 15.307 13.069 ( 5.478 -5.056 -0.206) 7.457 13.261 ( -9.444 4.864 15.772) 19.016 13.917 ( -6.221 -10.643 2.814) 12.645 14.062 ( 5.459 2.862 2.676) 6.720 15.360 ( 15.032 4.349 5.189) 16.486 17.071 ( -15.683 -0.358 -24.852) 29.389 19.115 ( 13.707 -0.296 7.034) 15.410 19.549 ( 4.603 4.431 7.314) 9.711 19.847 ( -7.918 0.804 0.975) 8.018 20.738 ( 8.374 -1.541 -23.312) 24.818 23.586 ( 7.100 12.862 16.139) 21.825 23.821 ( 5.788 -0.858 -7.906) 9.835 24.218 ( -3.423 -8.697 8.051) 12.336 ======================= Grid point 466 (228/432) ======================= q-point: (-0.09 -0.36 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( -22.166 -3.603 8.227) 23.916 2.142 ( -22.737 -11.522 0.458) 25.494 3.024 ( -5.180 -2.110 -2.247) 6.028 3.352 ( 4.988 4.761 4.321) 8.138 3.594 ( -17.223 1.363 2.644) 17.478 3.633 ( -3.672 3.869 -1.152) 5.456 4.113 ( 12.703 0.232 2.331) 12.917 4.384 ( -5.283 -3.905 -2.247) 6.943 4.584 ( 8.750 6.475 -4.380) 11.733 5.075 ( -2.472 0.781 0.642) 2.671 5.275 ( -1.163 5.845 -3.973) 7.162 5.720 ( -3.254 -4.015 1.436) 5.364 5.913 ( -11.728 -2.015 -0.111) 11.901 7.282 ( 0.939 -4.129 7.363) 8.494 8.283 ( -6.152 2.779 -1.513) 6.918 8.459 ( -9.208 -3.504 12.125) 15.623 8.928 ( -10.331 3.805 6.292) 12.681 9.408 ( 2.165 -15.897 3.502) 16.422 10.030 ( -3.173 2.253 -4.304) 5.802 10.108 ( -8.125 6.639 3.203) 10.970 10.875 ( 7.401 4.802 4.402) 9.860 11.784 ( -5.063 8.195 -2.022) 9.843 12.310 ( 9.697 -6.656 -12.593) 17.231 13.065 ( -10.106 -2.576 1.887) 10.599 13.331 ( -1.302 2.788 11.095) 11.514 14.003 ( -1.581 -9.503 3.370) 10.206 14.145 ( 6.890 2.328 2.555) 7.709 15.544 ( 15.790 8.613 0.117) 17.987 16.662 ( -14.543 -1.580 -10.291) 17.885 19.379 ( 12.330 -0.005 6.194) 13.799 19.503 ( -4.474 8.275 -0.990) 9.459 19.841 ( 1.820 -2.837 3.746) 5.039 20.654 ( 11.295 -3.754 -19.788) 23.091 23.565 ( -9.509 21.762 11.457) 26.368 23.891 ( 13.464 -4.431 -8.473) 16.514 24.407 ( 1.003 -8.950 12.794) 15.646 ======================= Grid point 475 (229/432) ======================= q-point: (-0.27 -0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( -20.776 0.000 9.625) 22.897 2.158 ( -25.482 0.000 1.438) 25.523 3.145 ( -1.885 0.000 -5.627) 5.934 3.287 ( 7.800 -0.000 2.943) 8.337 3.615 ( 13.124 -0.000 0.091) 13.125 3.821 ( 13.939 -0.000 1.645) 14.036 3.998 ( -19.637 0.000 -3.903) 20.021 4.298 ( 7.006 -0.000 -3.561) 7.859 4.683 ( -6.046 0.000 -3.333) 6.903 5.110 ( 0.859 -0.000 0.283) 0.904 5.380 ( -4.652 0.000 2.338) 5.207 5.704 ( -6.211 0.000 4.193) 7.494 6.116 ( -14.266 0.000 -6.333) 15.609 7.038 ( 8.958 -0.000 5.694) 10.615 8.280 ( -19.367 0.000 23.142) 30.176 8.473 ( 10.043 -0.000 -8.809) 13.359 8.905 ( -7.443 0.000 28.321) 29.283 9.101 ( -0.986 0.000 4.819) 4.919 10.033 ( -8.487 0.000 -16.985) 18.987 10.513 ( -6.698 0.000 7.687) 10.196 10.835 ( 3.750 -0.000 -3.589) 5.191 12.056 ( -9.906 0.000 -0.610) 9.925 12.246 ( 8.167 -0.000 -12.136) 14.628 13.022 ( 8.464 -0.000 1.366) 8.574 13.326 ( -10.290 0.000 17.383) 20.201 13.798 ( -7.460 0.000 1.572) 7.623 14.087 ( 5.571 -0.000 2.662) 6.174 15.397 ( 15.137 -0.000 5.961) 16.268 17.068 ( -15.638 0.000 -25.511) 29.922 19.112 ( 13.793 -0.000 6.934) 15.437 19.586 ( 5.933 -0.000 10.449) 12.016 19.854 ( -9.686 0.000 -0.312) 9.691 20.726 ( 8.635 -0.000 -25.636) 27.051 23.690 ( 18.607 -0.000 5.998) 19.550 23.848 ( -1.667 0.000 6.691) 6.895 24.115 ( -6.767 0.000 4.370) 8.056 ======================= Grid point 476 (230/432) ======================= q-point: (-0.18 -0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.827 ( -25.496 1.509 5.863) 26.205 1.964 ( -23.586 -8.129 6.825) 25.865 2.998 ( -12.372 -0.849 -3.384) 12.855 3.413 ( 6.900 2.207 3.106) 7.882 3.618 ( -23.563 1.118 5.126) 24.140 3.691 ( 3.768 1.948 -4.452) 6.149 4.134 ( 17.730 2.491 1.771) 17.991 4.296 ( -7.118 -5.276 0.735) 8.891 4.668 ( 12.299 2.890 -4.884) 13.545 5.084 ( -4.898 0.302 0.660) 4.952 5.340 ( 0.602 1.850 -4.834) 5.210 5.676 ( -3.899 -1.263 1.905) 4.520 5.888 ( -13.026 -0.777 -0.780) 13.072 7.217 ( 7.501 -2.587 3.829) 8.810 8.251 ( -23.236 -2.879 18.938) 30.114 8.495 ( 7.954 3.871 -4.531) 9.939 8.972 ( -13.912 1.026 10.390) 17.394 9.193 ( 3.984 -7.624 0.854) 8.644 9.896 ( 2.595 -5.378 -3.899) 7.132 10.348 ( -13.980 9.149 -0.524) 16.716 10.949 ( 10.278 2.455 3.577) 11.156 11.901 ( -9.270 4.179 -0.735) 10.195 12.221 ( 8.299 -3.230 -12.827) 15.615 13.081 ( -1.034 2.944 0.256) 3.131 13.390 ( -5.865 3.832 14.005) 15.660 13.795 ( -5.611 -11.060 4.956) 13.355 14.187 ( 6.682 1.509 1.360) 6.984 15.642 ( 16.252 2.951 2.077) 16.648 16.643 ( -14.761 -0.620 -10.743) 18.267 19.374 ( 13.358 -0.218 6.386) 14.808 19.636 ( -10.098 6.439 -2.197) 12.176 19.778 ( 1.293 -4.086 5.961) 7.341 20.612 ( 14.243 -1.267 -22.637) 26.775 23.825 ( 9.898 -0.268 -8.519) 13.062 23.929 ( -1.221 18.014 12.160) 21.768 24.212 ( -0.319 -14.397 13.826) 19.964 ======================= Grid point 477 (231/432) ======================= q-point: (-0.09 -0.27 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( -24.339 -5.402 9.350) 26.627 1.740 ( -26.503 -7.747 -0.198) 27.613 2.835 ( -23.019 -7.474 13.541) 27.732 3.382 ( -12.562 4.576 3.457) 13.809 3.534 ( 4.496 2.017 1.473) 5.143 3.620 ( -2.428 3.518 -3.493) 5.520 4.134 ( -10.282 -0.807 1.121) 10.374 4.455 ( 15.825 0.405 4.327) 16.411 4.731 ( 9.437 8.211 -5.300) 13.586 5.032 ( -3.769 -2.096 0.192) 4.317 5.218 ( -0.458 3.768 -11.573) 12.180 5.685 ( 0.945 -3.144 0.819) 3.384 5.807 ( -7.227 -2.206 7.798) 10.858 7.338 ( 1.016 -0.853 3.873) 4.094 8.153 ( -19.847 -2.961 10.629) 22.708 8.513 ( 0.609 7.282 4.536) 8.600 8.833 ( -3.969 1.412 -7.977) 9.021 9.370 ( 1.643 -13.577 8.074) 15.881 9.972 ( -1.060 2.384 -4.996) 5.636 10.102 ( -4.044 1.105 2.101) 4.689 11.086 ( 7.457 5.852 5.030) 10.731 11.702 ( -10.993 6.427 -4.768) 13.597 12.236 ( 9.365 -5.748 -11.987) 16.261 12.956 ( -11.426 5.778 1.177) 12.858 13.407 ( -3.856 -0.170 3.406) 5.148 13.875 ( -3.738 -13.767 -3.754) 14.751 14.268 ( 6.423 1.422 0.633) 6.608 15.800 ( 14.846 7.381 -3.282) 16.902 16.554 ( -4.695 0.137 20.498) 21.030 19.358 ( -6.804 2.296 -10.584) 12.790 19.654 ( 10.092 0.556 8.071) 12.935 19.901 ( 2.797 -3.687 5.003) 6.815 20.580 ( 13.787 -1.335 -18.660) 23.239 23.716 ( -9.609 23.272 5.410) 25.753 23.947 ( 9.928 -1.516 -5.035) 11.235 24.495 ( 2.384 -10.631 10.722) 15.286 ======================= Grid point 487 (232/432) ======================= q-point: (-0.18 -0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( -25.937 0.000 6.940) 26.850 1.670 ( -27.492 0.000 3.016) 27.657 2.772 ( -26.995 0.000 15.628) 31.192 3.434 ( -14.201 0.000 4.523) 14.904 3.540 ( 7.702 -0.000 -0.809) 7.745 3.652 ( -2.574 0.000 -4.574) 5.249 4.129 ( -11.599 0.000 2.159) 11.798 4.454 ( 19.229 -0.000 4.322) 19.708 4.815 ( 12.903 -0.000 -4.985) 13.833 5.002 ( -7.380 0.000 0.097) 7.381 5.250 ( -0.005 0.000 -13.142) 13.142 5.658 ( 0.912 -0.000 0.217) 0.937 5.788 ( -8.115 0.000 9.197) 12.265 7.327 ( 6.538 -0.000 0.276) 6.544 8.119 ( -25.453 0.000 17.074) 30.650 8.602 ( 10.063 -0.000 -0.341) 10.069 8.839 ( -8.527 0.000 -5.666) 10.238 9.234 ( 0.756 -0.000 8.264) 8.298 9.921 ( 6.415 -0.000 -1.820) 6.668 10.188 ( -12.236 0.000 -3.136) 12.632 11.129 ( 8.287 -0.000 3.446) 8.975 11.767 ( -11.937 0.000 -2.660) 12.230 12.187 ( 10.113 -0.000 -11.550) 15.352 13.066 ( -3.952 0.000 -1.847) 4.362 13.382 ( -10.639 0.000 -3.289) 11.136 13.716 ( -6.015 0.000 5.055) 7.858 14.285 ( 6.323 -0.000 -0.395) 6.335 15.863 ( 15.173 -0.000 -2.859) 15.440 16.555 ( -4.018 0.000 22.976) 23.325 19.376 ( -8.363 0.000 -12.521) 15.057 19.664 ( 9.328 -0.000 9.645) 13.418 19.865 ( 1.249 -0.000 5.141) 5.291 20.569 ( 15.522 -0.000 -19.388) 24.836 23.880 ( 11.982 -0.000 -7.638) 14.209 24.043 ( -9.293 0.000 7.710) 12.076 24.336 ( 3.855 -0.000 11.225) 11.869 ======================= Grid point 488 (233/432) ======================= q-point: (-0.09 -0.18 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( -27.387 -3.393 4.743) 28.001 1.359 ( -22.683 -6.647 11.534) 26.301 2.693 ( -32.244 -3.809 34.334) 47.255 3.307 ( -5.400 2.951 -1.151) 6.261 3.512 ( -6.892 1.739 -4.082) 8.197 3.623 ( 6.539 -0.936 -4.587) 8.042 4.050 ( -6.744 0.946 5.837) 8.969 4.712 ( 6.871 1.652 6.929) 9.897 4.798 ( 2.610 8.392 -9.602) 13.017 4.920 ( -0.560 -5.642 -9.032) 10.664 5.149 ( 4.436 0.736 -2.736) 5.264 5.723 ( 7.111 -1.744 0.480) 7.337 5.860 ( -3.457 -0.615 15.013) 15.419 7.374 ( 1.721 1.131 -1.433) 2.509 7.991 ( -20.497 -2.035 12.804) 24.253 8.615 ( -6.569 6.944 -5.459) 11.008 8.762 ( 9.134 1.975 1.208) 9.423 9.419 ( 3.121 -9.336 12.147) 15.634 9.926 ( -2.265 7.095 -5.718) 9.389 10.044 ( -0.454 -7.263 -2.424) 7.670 11.230 ( 2.706 2.960 0.355) 4.026 11.456 ( -21.719 3.099 -10.532) 24.336 12.219 ( 11.456 -1.093 -9.638) 15.011 12.878 ( -11.902 11.436 -0.591) 16.516 13.190 ( -11.320 -16.520 -9.686) 22.246 13.708 ( -5.548 -3.307 2.516) 6.931 14.352 ( 5.267 0.502 -0.770) 5.347 15.958 ( 11.519 3.963 -8.901) 15.087 17.062 ( 19.923 4.354 44.980) 49.387 19.128 ( -4.445 -2.104 -15.131) 15.910 19.847 ( 3.040 4.948 3.740) 6.907 19.950 ( 2.525 -6.989 6.336) 9.766 20.572 ( 16.159 0.216 -16.276) 22.936 23.843 ( -8.058 24.407 2.030) 25.783 24.005 ( 6.966 -1.023 -2.764) 7.564 24.443 ( -5.011 -14.129 -3.482) 15.390 ======================= Grid point 499 (234/432) ======================= q-point: (-0.09 -0.09 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.169 ( -11.231 0.000 20.775) 23.617 1.241 ( -16.692 0.000 18.621) 25.007 2.646 ( -35.485 0.000 37.122) 51.354 3.302 ( 3.944 -0.000 1.608) 4.260 3.360 ( -9.843 0.000 -3.409) 10.416 3.646 ( 10.110 -0.000 -8.759) 13.377 4.085 ( -3.723 0.000 9.692) 10.383 4.593 ( -10.290 0.000 -10.988) 15.054 4.770 ( -0.641 0.000 -11.372) 11.390 4.908 ( 5.127 -0.000 3.992) 6.498 5.299 ( 13.637 -0.000 3.990) 14.209 5.842 ( 9.154 -0.000 1.826) 9.334 6.034 ( -0.844 0.000 20.939) 20.956 7.356 ( 0.644 -0.000 -5.865) 5.900 7.883 ( -15.124 0.000 10.035) 18.150 8.413 ( -13.515 0.000 -5.296) 14.516 9.017 ( 10.132 -0.000 11.920) 15.644 9.542 ( 1.120 -0.000 8.162) 8.239 9.911 ( -2.837 0.000 -1.406) 3.166 9.955 ( 5.913 -0.000 -5.361) 7.981 10.894 ( -38.114 0.000 -10.790) 39.612 11.262 ( 0.763 -0.000 -2.888) 2.987 12.269 ( 11.242 -0.000 -9.640) 14.809 12.822 ( -8.611 0.000 -2.247) 8.899 12.865 ( -11.046 0.000 5.679) 12.420 13.676 ( -3.821 0.000 3.398) 5.113 14.396 ( 3.169 -0.000 -1.817) 3.653 15.959 ( 6.499 -0.000 -14.669) 16.044 18.001 ( 42.076 -0.000 35.853) 55.280 18.898 ( -0.358 0.000 -16.676) 16.680 19.841 ( -5.272 0.000 -3.907) 6.562 20.008 ( -0.906 0.000 3.445) 3.562 20.667 ( 20.641 -0.000 -8.684) 22.394 23.873 ( -24.462 0.000 -19.291) 31.153 23.969 ( -9.971 0.000 8.078) 12.833 24.113 ( 2.597 -0.000 -7.030) 7.494 ======================= Grid point 500 (235/432) ======================= q-point: ( 0.00 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.053 ( 0.204 -0.000 24.419) 24.419 2.082 ( 0.198 -0.000 16.006) 16.007 2.994 ( -1.562 0.000 -4.190) 4.472 3.228 ( 8.061 -0.000 8.177) 11.483 3.551 ( 9.801 -0.000 -10.202) 14.147 3.701 ( -5.759 0.000 -13.029) 14.245 3.820 ( -2.588 0.000 5.647) 6.212 3.975 ( -9.562 0.000 -9.856) 13.733 4.698 ( 5.550 -0.000 10.767) 12.113 5.178 ( -3.589 0.000 7.241) 8.082 5.619 ( 1.167 -0.000 -0.103) 1.171 6.138 ( 3.861 -0.000 1.764) 4.245 7.010 ( -6.500 0.000 -3.918) 7.590 7.242 ( 2.798 -0.000 16.237) 16.476 7.843 ( -1.958 0.000 23.537) 23.618 8.887 ( -22.672 0.000 29.323) 37.065 9.450 ( -5.142 0.000 7.209) 8.855 9.765 ( -12.565 0.000 6.670) 14.226 9.859 ( 11.488 -0.000 8.685) 14.401 9.946 ( 0.140 -0.000 -2.338) 2.343 10.859 ( -6.204 0.000 -9.385) 11.250 11.030 ( 21.085 -0.000 13.290) 24.924 11.824 ( 7.047 -0.000 -18.107) 19.430 12.489 ( -10.530 0.000 -7.681) 13.033 13.296 ( -1.716 0.000 12.851) 12.965 13.751 ( 4.726 -0.000 0.237) 4.732 14.304 ( -2.560 0.000 -1.484) 2.959 15.196 ( -1.368 0.000 -18.348) 18.399 18.335 ( 12.685 -0.000 -14.173) 19.021 18.973 ( -16.044 0.000 -18.270) 24.315 19.522 ( 23.490 -0.000 -0.789) 23.503 19.671 ( -10.075 0.000 -4.796) 11.158 21.421 ( 24.466 -0.000 9.392) 26.207 22.246 ( -40.816 0.000 -2.756) 40.909 23.962 ( -9.150 0.000 3.003) 9.630 24.171 ( 10.597 -0.000 -3.771) 11.248 ======================= Grid point 501 (236/432) ======================= q-point: ( 0.09 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 2.822 2.668 14.956) 15.452 2.356 ( 3.479 -4.547 19.277) 20.110 2.967 ( 3.538 0.970 -2.016) 4.186 3.364 ( 6.112 8.064 -12.076) 15.755 3.432 ( -6.233 0.408 -0.667) 6.282 3.580 ( 7.862 -5.777 -8.855) 13.175 3.754 ( -7.652 -1.676 -7.786) 11.045 3.896 ( 1.901 -2.519 1.872) 3.669 4.892 ( 4.846 0.286 10.246) 11.338 5.221 ( -3.099 -1.232 6.978) 7.734 5.584 ( -5.815 0.691 0.364) 5.868 6.166 ( -0.622 1.432 0.788) 1.749 6.876 ( -8.983 -0.419 -1.862) 9.183 7.336 ( -4.178 0.807 5.603) 7.035 8.171 ( -2.035 2.356 36.244) 36.378 8.878 ( -20.084 6.656 22.599) 30.958 9.361 ( -8.818 9.852 7.156) 15.034 9.837 ( 2.981 7.062 14.079) 16.030 9.880 ( -9.381 -13.215 -5.235) 17.031 10.177 ( 14.835 -12.238 6.616) 20.337 10.646 ( -5.701 4.695 -8.744) 11.446 11.520 ( 23.389 -5.811 12.753) 27.267 11.759 ( 10.372 -1.868 -14.738) 18.118 12.221 ( -7.615 3.964 -13.577) 16.063 13.420 ( -2.410 -3.921 10.314) 11.295 13.838 ( 6.076 -3.077 -0.231) 6.814 14.246 ( -4.401 0.685 -0.200) 4.459 14.969 ( -2.641 2.421 -14.398) 14.837 18.388 ( 15.183 0.303 -8.759) 17.531 18.520 ( -17.540 0.651 -20.453) 26.952 19.477 ( -9.230 1.856 -3.402) 10.010 19.759 ( 13.886 -1.051 -3.711) 14.412 21.706 ( -25.567 6.832 1.147) 26.489 21.878 ( 16.156 -5.370 9.034) 19.273 23.889 ( -6.575 -2.042 0.780) 6.929 24.268 ( 9.219 -0.049 -2.338) 9.511 ======================= Grid point 502 (237/432) ======================= q-point: ( 0.18 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( 3.212 4.585 11.257) 12.572 2.635 ( 6.864 -5.561 10.256) 13.536 3.018 ( 4.151 1.985 2.801) 5.387 3.152 ( -1.442 0.520 -12.382) 12.477 3.350 ( -0.067 8.041 -5.367) 9.668 3.537 ( -6.381 1.921 -1.431) 6.816 3.760 ( 7.844 -12.328 -8.419) 16.864 3.981 ( 5.996 -4.322 0.745) 7.429 5.031 ( 0.684 0.399 7.746) 7.787 5.246 ( -2.804 -1.151 0.062) 3.032 5.478 ( -12.352 0.829 4.778) 13.269 6.127 ( -2.446 2.711 -0.436) 3.677 6.726 ( -12.618 -0.510 -0.649) 12.645 7.320 ( -4.584 0.089 4.515) 6.435 8.459 ( -7.154 6.695 24.070) 25.988 8.775 ( -12.320 14.574 20.582) 28.068 9.316 ( -7.728 3.397 12.624) 15.186 9.729 ( -17.757 -20.206 -5.740) 27.505 10.039 ( 8.851 15.956 15.537) 23.966 10.419 ( -8.920 -1.625 -8.925) 12.722 10.592 ( 16.874 -14.786 5.921) 23.204 11.680 ( -1.689 3.320 -14.602) 15.069 11.936 ( 15.600 4.456 -0.910) 16.249 12.116 ( 20.350 -5.360 0.169) 21.045 13.526 ( -2.891 -5.899 7.447) 9.930 13.938 ( 3.457 -6.201 -1.668) 7.292 14.173 ( -5.622 1.639 1.153) 5.969 14.781 ( -0.891 2.595 -9.561) 9.947 18.049 ( -17.576 0.265 -20.273) 26.833 18.535 ( 16.552 0.108 -2.471) 16.736 19.318 ( -8.125 -0.086 -2.821) 8.602 19.843 ( 4.831 -0.014 -3.211) 5.800 21.323 ( -19.450 5.183 -2.922) 20.340 22.299 ( 17.957 -4.945 12.684) 22.534 23.839 ( -2.899 -1.773 -1.600) 3.756 24.359 ( 7.431 0.684 -0.611) 7.487 ======================= Grid point 503 (238/432) ======================= q-point: ( 0.27 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -3.416 4.997 3.646) 7.066 2.881 ( 9.926 -4.942 5.208) 12.250 2.997 ( -3.071 -3.014 -7.792) 8.901 3.110 ( 2.993 2.798 0.059) 4.098 3.229 ( -1.400 7.468 -0.011) 7.599 3.490 ( 1.404 1.701 4.043) 4.606 3.848 ( 8.623 -11.764 -11.402) 18.514 4.141 ( 7.876 -4.817 2.382) 9.535 5.072 ( -5.757 -0.912 4.651) 7.456 5.112 ( -10.054 0.944 -7.538) 12.601 5.394 ( -11.628 -0.330 7.993) 14.114 6.056 ( -1.968 4.067 -1.798) 4.863 6.537 ( -15.484 0.436 0.276) 15.492 7.334 ( -2.098 -1.473 4.588) 5.256 8.355 ( -7.812 13.626 0.757) 15.725 8.872 ( -6.119 6.676 24.327) 25.958 9.328 ( -13.122 0.528 14.807) 19.792 9.651 ( -15.944 -18.864 2.604) 24.837 10.083 ( -2.992 11.568 2.876) 12.290 10.271 ( -3.346 -2.134 -1.925) 4.411 11.000 ( 16.631 -8.664 6.514) 19.852 11.390 ( -3.951 9.999 -12.711) 16.648 12.058 ( 20.695 2.323 -11.565) 23.821 12.550 ( 22.180 -3.231 10.357) 24.691 13.622 ( -2.202 -6.517 7.012) 9.822 13.935 ( -6.268 -0.206 -1.558) 6.462 14.126 ( -2.772 -3.054 -0.396) 4.144 14.719 ( 4.818 -2.488 -4.920) 7.322 17.595 ( -17.718 0.157 -18.290) 25.465 18.761 ( 16.394 0.311 3.926) 16.860 19.212 ( -4.193 -2.696 -3.185) 5.915 19.838 ( -1.465 -1.353 -1.324) 2.394 21.036 ( -9.064 6.235 -6.673) 12.867 22.704 ( 11.992 -7.685 14.091) 20.036 23.804 ( 1.756 0.188 -4.411) 4.751 24.439 ( 5.317 1.665 1.722) 5.831 ======================= Grid point 504 (239/432) ======================= q-point: (-0.64 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.385 ( -9.675 2.955 3.774) 10.797 2.828 ( -11.072 -3.652 -9.586) 15.094 3.030 ( 3.861 5.243 0.774) 6.557 3.115 ( 3.040 0.109 1.082) 3.229 3.278 ( 8.349 -0.560 4.404) 9.456 3.608 ( 6.328 -1.842 5.243) 8.421 3.955 ( 12.575 -8.858 -9.712) 18.192 4.273 ( 2.442 -0.103 3.109) 3.954 4.840 ( -16.590 -0.085 -5.284) 17.411 5.033 ( -7.638 -2.902 1.498) 8.307 5.322 ( -10.217 -1.135 3.086) 10.733 5.966 ( -1.231 5.331 -3.271) 6.375 6.332 ( -15.900 1.222 2.102) 16.085 7.383 ( -0.543 -1.942 4.112) 4.580 8.164 ( -1.365 9.397 -5.293) 10.871 8.951 ( -9.018 1.522 12.382) 15.394 9.285 ( -17.839 -0.008 14.008) 22.682 9.663 ( -13.857 -13.604 8.304) 21.120 9.944 ( -6.140 1.542 -2.737) 6.897 10.232 ( -5.874 0.573 2.272) 6.324 11.095 ( 9.589 24.105 -5.907) 26.606 11.392 ( 7.686 -11.848 4.729) 14.893 12.154 ( 19.556 3.720 -14.694) 24.742 12.924 ( 16.080 -0.896 6.200) 17.257 13.737 ( -8.419 1.352 14.007) 16.398 13.815 ( -1.685 -2.765 -2.284) 3.963 14.112 ( -1.775 -4.200 -1.894) 4.937 14.827 ( 9.642 -10.029 -3.811) 14.425 17.177 ( -17.731 1.035 -12.553) 21.749 19.036 ( 14.641 1.211 8.578) 17.011 19.184 ( 1.002 -6.822 -5.046) 8.544 19.817 ( -2.578 -2.642 -0.031) 3.692 20.813 ( -2.182 7.976 -9.625) 12.689 23.047 ( 2.615 -12.195 13.781) 18.587 23.783 ( 7.917 4.004 -7.158) 11.399 24.516 ( 3.481 2.188 4.927) 6.417 ======================= Grid point 505 (240/432) ======================= q-point: (-0.55 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.267 ( -15.018 2.686 8.335) 17.384 2.552 ( -16.537 0.871 -8.187) 18.474 3.031 ( 4.782 3.216 -2.386) 6.237 3.207 ( 4.664 -1.810 4.426) 6.680 3.430 ( 4.613 -3.761 1.583) 6.159 3.779 ( 4.648 -5.960 3.232) 8.220 4.075 ( 10.980 -1.614 -6.492) 12.857 4.261 ( -3.886 5.243 4.064) 7.689 4.609 ( -14.701 -3.534 -0.608) 15.132 4.990 ( -3.040 -5.024 -1.378) 6.032 5.218 ( -9.228 -2.533 -1.191) 9.643 5.863 ( -0.401 5.719 -4.638) 7.374 6.161 ( -14.083 2.057 5.667) 15.320 7.435 ( -0.469 -1.300 3.394) 3.664 8.052 ( 2.261 2.139 -6.956) 7.621 8.888 ( -12.291 1.290 3.803) 12.931 9.172 ( -20.295 -0.104 10.671) 22.930 9.676 ( -11.667 -8.877 6.916) 16.210 9.852 ( -4.978 0.084 -0.300) 4.987 10.194 ( -4.908 -3.421 3.670) 7.019 10.998 ( 11.129 22.569 0.177) 25.164 11.597 ( 4.013 -6.392 2.165) 7.852 12.173 ( 17.351 6.389 -17.001) 25.118 13.107 ( 5.930 -0.859 -0.787) 6.043 13.631 ( -13.357 5.886 10.095) 17.747 13.928 ( 0.672 -5.303 2.420) 5.868 14.154 ( 5.506 -1.540 2.150) 6.108 15.026 ( 12.123 -14.365 -4.950) 19.438 16.861 ( -15.726 1.249 -0.455) 15.782 19.188 ( 2.804 -8.166 -7.390) 11.365 19.335 ( 13.058 0.411 8.753) 15.725 19.825 ( 1.222 -1.973 -0.116) 2.324 20.623 ( 1.425 8.862 -10.448) 13.774 23.265 ( -9.104 -17.678 9.482) 22.030 23.796 ( 14.534 8.072 -7.310) 18.161 24.612 ( 2.577 2.114 8.231) 8.881 ======================= Grid point 506 (241/432) ======================= q-point: (-0.45 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( -18.921 5.005 11.219) 22.559 2.210 ( -19.366 4.487 -4.984) 20.494 3.045 ( 4.730 1.863 -2.374) 5.611 3.353 ( 6.537 -2.861 2.612) 7.599 3.508 ( 0.079 -4.878 1.706) 5.168 3.750 ( -19.933 -1.404 5.069) 20.615 4.175 ( 8.568 0.744 -2.692) 9.012 4.290 ( 6.471 -3.095 3.355) 7.919 4.492 ( -7.771 -2.400 1.883) 8.348 5.002 ( 1.608 -4.622 -3.271) 5.887 5.102 ( -7.239 -2.382 -3.580) 8.420 5.763 ( 1.740 5.310 -5.685) 7.972 6.070 ( -10.576 2.455 10.749) 15.279 7.462 ( -1.815 0.208 2.904) 3.430 8.025 ( 2.978 -5.529 -7.059) 9.448 8.712 ( -13.166 2.829 -0.365) 13.472 9.026 ( -18.908 0.546 10.969) 21.866 9.669 ( -9.115 -4.624 6.354) 12.035 9.791 ( -4.662 -1.550 -0.218) 4.918 10.237 ( 1.240 -0.824 2.827) 3.195 11.006 ( 7.572 11.595 4.394) 14.529 11.644 ( -1.483 -1.206 -2.011) 2.775 12.128 ( 15.411 7.770 -17.966) 24.912 13.093 ( -4.258 1.117 -1.733) 4.731 13.560 ( -8.937 2.824 8.895) 12.922 13.940 ( -2.515 -4.298 -4.264) 6.556 14.262 ( 6.570 4.380 2.179) 8.191 15.267 ( 13.941 -15.307 -5.738) 21.484 16.784 ( -8.951 -1.612 17.513) 19.733 19.165 ( 0.940 -7.665 -13.438) 15.499 19.587 ( 11.494 1.763 7.454) 13.813 19.886 ( 7.763 -0.328 -0.757) 7.807 20.469 ( 2.418 7.651 -8.815) 11.920 23.337 ( -14.421 -21.077 3.473) 25.773 23.854 ( 14.340 7.970 -5.141) 17.193 24.723 ( 1.526 2.586 8.710) 9.213 ======================= Grid point 507 (242/432) ======================= q-point: (-0.36 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( -20.772 7.705 2.257) 22.270 1.972 ( -18.119 9.202 12.013) 23.607 3.082 ( 5.196 -0.173 -0.853) 5.269 3.437 ( 2.751 -1.233 -1.825) 3.524 3.527 ( -26.227 -0.367 11.941) 28.820 3.568 ( -1.486 -3.537 0.993) 3.963 4.150 ( -8.218 -6.270 0.838) 10.371 4.466 ( 0.672 -3.577 -5.206) 6.352 4.561 ( 15.258 -2.382 8.865) 17.807 4.955 ( -4.316 -0.771 -7.630) 8.800 5.054 ( 2.759 -0.895 -0.176) 2.906 5.708 ( 5.925 4.297 -4.984) 8.855 6.089 ( -6.402 1.584 15.412) 16.764 7.446 ( -3.591 1.768 2.132) 4.535 8.022 ( 1.051 -7.360 -10.586) 12.935 8.561 ( -10.615 -3.197 4.980) 12.153 8.932 ( -14.459 2.859 14.334) 20.559 9.666 ( -8.817 -6.474 5.417) 12.206 9.758 ( -0.050 2.142 1.159) 2.436 10.257 ( 3.795 7.607 -1.366) 8.610 11.065 ( -2.927 -3.968 2.746) 5.644 11.560 ( -2.547 5.063 -3.239) 6.527 12.055 ( 13.834 6.752 -17.331) 23.180 12.980 ( -8.804 2.491 1.117) 9.217 13.501 ( -6.788 4.734 1.896) 8.490 13.848 ( -5.256 -0.059 -4.079) 6.653 14.311 ( 4.512 3.844 0.879) 5.992 15.483 ( 12.754 -13.167 -10.003) 20.883 17.071 ( 3.342 -7.796 31.660) 32.776 19.033 ( 1.375 -1.538 -18.714) 18.827 19.740 ( 4.356 -0.255 1.275) 4.546 20.041 ( 15.887 1.495 1.868) 16.066 20.352 ( 1.602 5.527 -7.246) 9.253 23.352 ( -15.622 -24.766 0.743) 29.291 23.909 ( 11.138 5.838 -4.487) 13.351 24.767 ( -2.328 5.511 4.198) 7.309 ======================= Grid point 508 (243/432) ======================= q-point: (-0.27 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -13.136 9.092 13.487) 20.907 1.808 ( -15.392 11.924 14.970) 24.560 3.153 ( 4.249 -3.890 -3.772) 6.886 3.327 ( -23.464 -4.593 11.808) 26.666 3.445 ( -10.075 0.320 8.641) 13.277 3.536 ( 4.743 4.192 -7.285) 9.651 4.155 ( -7.009 -8.013 6.684) 12.570 4.417 ( -0.678 -4.770 -9.662) 10.797 4.773 ( -6.795 0.317 -5.811) 8.947 4.884 ( 11.890 1.398 7.529) 14.142 5.142 ( 9.643 -0.659 1.282) 9.750 5.745 ( 10.309 2.276 -2.482) 10.845 6.224 ( -2.521 -0.700 19.623) 19.797 7.388 ( -4.243 3.188 0.531) 5.334 7.914 ( -0.804 -2.267 -13.692) 13.902 8.607 ( -12.235 -11.840 14.445) 22.328 8.951 ( -7.195 0.528 18.728) 20.069 9.660 ( -5.449 -8.834 -0.507) 10.392 9.796 ( 2.960 7.121 7.776) 10.952 10.184 ( 4.403 12.754 -3.909) 14.047 10.964 ( -21.989 -11.307 -4.392) 25.113 11.461 ( 3.095 13.048 -1.974) 13.555 12.012 ( 13.138 1.978 -14.400) 19.593 12.865 ( -9.205 1.295 2.559) 9.641 13.329 ( -7.702 11.615 -0.278) 13.939 13.765 ( -5.070 0.091 1.567) 5.307 14.344 ( 3.361 1.632 -0.351) 3.752 15.581 ( 9.320 -9.983 -15.524) 20.677 17.662 ( 15.714 -13.667 30.707) 37.103 18.831 ( 5.401 4.774 -20.580) 21.806 19.746 ( -3.119 -4.035 -4.356) 6.707 20.226 ( -3.120 7.378 -0.230) 8.014 20.312 ( 23.062 0.642 -2.716) 23.231 23.351 ( -19.953 -29.048 -0.989) 35.255 23.952 ( 10.352 4.224 -5.168) 12.317 24.632 ( -9.499 11.901 -1.583) 15.309 ======================= Grid point 509 (244/432) ======================= q-point: (-0.18 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( -2.931 5.958 20.927) 21.956 1.740 ( -9.395 10.006 19.954) 24.219 3.092 ( -13.991 -3.863 4.730) 15.266 3.258 ( -7.466 -2.819 -4.090) 8.968 3.411 ( -1.467 -1.615 6.208) 6.580 3.553 ( 6.606 5.788 3.167) 9.337 4.184 ( -5.808 -9.883 -5.230) 12.600 4.337 ( -4.804 -0.018 0.780) 4.867 4.573 ( -3.931 3.502 -9.382) 10.759 5.065 ( 1.453 1.336 9.447) 9.651 5.348 ( 14.999 -1.466 2.079) 15.213 5.873 ( 11.463 -0.075 0.243) 11.466 6.488 ( 1.830 -4.218 24.231) 24.663 7.295 ( -4.008 5.107 -1.229) 6.608 7.778 ( 0.053 -0.594 -10.188) 10.205 8.701 ( -20.391 -8.654 25.546) 33.813 9.158 ( -0.818 -10.327 16.444) 19.435 9.680 ( 0.504 -6.240 -1.138) 6.363 9.807 ( -1.490 11.358 3.637) 12.018 10.162 ( 11.069 12.730 2.917) 17.120 10.648 ( -28.507 -9.921 -2.121) 30.259 11.331 ( 1.415 15.747 -5.433) 16.718 12.016 ( 10.506 -1.217 -14.371) 17.843 12.767 ( -9.465 -1.516 1.240) 9.666 13.181 ( -5.004 11.316 8.173) 14.829 13.729 ( -2.860 0.777 1.479) 3.312 14.359 ( 1.715 0.510 -1.500) 2.335 15.547 ( 5.302 -6.543 -19.335) 21.090 18.278 ( 15.542 -15.645 7.704) 23.359 18.710 ( 18.038 8.521 -8.201) 21.569 19.629 ( -9.328 -6.115 -9.448) 14.617 20.071 ( -5.074 6.180 -5.718) 9.830 20.631 ( 24.316 2.090 4.076) 24.744 23.231 ( -31.193 -26.560 -5.354) 41.318 24.003 ( 11.460 2.820 -5.734) 13.121 24.326 ( -13.865 15.820 -0.288) 21.038 ======================= Grid point 510 (245/432) ======================= q-point: (-0.09 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( -3.880 4.420 23.421) 24.149 1.887 ( -0.011 1.795 19.808) 19.889 3.061 ( -5.092 -3.564 5.140) 8.066 3.120 ( -5.100 2.215 -0.364) 5.572 3.503 ( 9.855 -2.833 -6.418) 12.097 3.659 ( 3.367 3.438 9.758) 10.880 4.020 ( -9.179 -4.938 -14.264) 17.667 4.214 ( -9.985 2.110 -6.283) 11.985 4.533 ( 3.599 0.688 6.169) 7.175 5.141 ( -1.994 1.270 7.435) 7.802 5.544 ( 9.042 -1.024 1.050) 9.160 6.028 ( 8.755 -0.879 1.772) 8.976 6.873 ( 4.913 -7.699 24.336) 25.993 7.171 ( -4.031 7.537 -1.253) 8.639 7.724 ( -0.859 -0.795 1.757) 2.111 8.810 ( -22.583 -4.662 32.707) 40.018 9.379 ( -4.668 -15.852 5.866) 17.536 9.706 ( 6.978 16.680 6.884) 19.347 9.788 ( -4.212 -13.413 1.211) 14.111 10.095 ( -7.479 21.581 2.889) 23.022 10.608 ( 4.253 -15.903 8.093) 18.344 11.119 ( -1.850 15.715 -7.132) 17.357 11.949 ( 6.541 -0.101 -17.813) 18.976 12.661 ( -9.657 -2.506 -1.629) 10.109 13.191 ( -2.101 5.647 13.091) 14.411 13.715 ( 0.902 1.234 0.472) 1.600 14.345 ( -0.468 0.048 -1.973) 2.028 15.405 ( 1.524 -3.127 -20.320) 20.616 18.367 ( 9.153 -2.306 -17.175) 19.598 19.076 ( 26.977 -0.343 6.185) 27.679 19.392 ( -11.766 -5.834 -14.222) 19.358 19.872 ( -7.666 4.609 -5.867) 10.697 21.005 ( 24.998 1.154 6.912) 25.961 22.822 ( -42.041 -10.630 -6.779) 43.891 24.076 ( 3.613 3.018 -2.359) 5.265 24.082 ( -3.423 5.206 1.203) 6.346 ======================= Grid point 512 (246/432) ======================= q-point: ( 0.09 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( 8.874 -0.000 10.993) 14.128 2.552 ( 1.144 -0.000 12.391) 12.444 3.040 ( 6.535 -0.000 2.248) 6.911 3.149 ( -7.182 0.000 -12.949) 14.807 3.494 ( 0.681 -0.000 -8.437) 8.464 3.529 ( 4.685 -0.000 -3.617) 5.919 3.607 ( -0.416 0.000 -4.200) 4.221 3.939 ( 5.183 -0.000 0.759) 5.238 5.036 ( 0.855 -0.000 7.351) 7.400 5.236 ( -2.187 0.000 0.705) 2.298 5.485 ( -12.578 0.000 4.390) 13.322 6.151 ( -2.289 0.000 -0.515) 2.347 6.722 ( -12.242 0.000 -0.177) 12.243 7.317 ( -5.538 0.000 3.552) 6.579 8.516 ( -8.449 0.000 30.404) 31.556 8.931 ( -17.024 0.000 26.404) 31.416 9.403 ( -7.190 0.000 12.189) 14.151 9.461 ( -16.937 0.000 -15.035) 22.648 10.272 ( 15.485 -0.000 20.340) 25.563 10.357 ( 9.946 -0.000 2.915) 10.364 10.423 ( -5.987 0.000 -14.070) 15.291 11.708 ( 4.759 -0.000 -14.103) 14.884 11.997 ( 24.992 -0.000 15.917) 29.630 12.059 ( 8.361 -0.000 -14.449) 16.694 13.468 ( -3.135 0.000 7.852) 8.454 13.881 ( 4.456 -0.000 -2.615) 5.166 14.190 ( -5.922 0.000 1.642) 6.146 14.803 ( -2.152 0.000 -10.447) 10.667 18.052 ( -17.766 0.000 -20.609) 27.210 18.536 ( 16.759 -0.000 -2.733) 16.981 19.315 ( -9.263 0.000 -3.014) 9.740 19.842 ( 4.239 -0.000 -2.982) 5.182 21.372 ( -19.317 0.000 -4.112) 19.750 22.253 ( 16.992 -0.000 13.860) 21.928 23.823 ( -2.194 0.000 -1.014) 2.417 24.365 ( 8.030 -0.000 -0.822) 8.072 ======================= Grid point 513 (247/432) ======================= q-point: ( 0.18 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.579 ( -1.536 7.093 1.394) 7.390 2.758 ( 4.600 -8.050 3.422) 9.884 2.971 ( 0.375 -0.442 -5.596) 5.626 3.153 ( 3.974 1.656 2.928) 5.207 3.377 ( -0.816 9.228 -2.214) 9.525 3.495 ( -0.716 -1.832 -1.387) 2.407 3.666 ( 7.847 -8.160 -5.216) 12.465 4.063 ( 8.773 -3.239 1.700) 9.505 5.066 ( -6.419 0.043 4.073) 7.602 5.122 ( -8.658 0.233 -8.139) 11.885 5.393 ( -12.407 0.018 8.491) 15.034 6.106 ( -0.936 1.647 -2.082) 2.815 6.546 ( -15.063 0.485 1.284) 15.125 7.299 ( -3.420 -1.616 3.047) 4.857 8.574 ( -12.709 9.772 12.513) 20.337 8.977 ( -13.444 7.251 13.381) 20.307 9.180 ( -17.993 -15.483 5.676) 24.407 9.486 ( -7.658 -1.406 16.019) 17.811 10.111 ( -12.515 -1.981 -12.614) 17.879 10.440 ( 8.329 14.000 2.116) 16.427 10.790 ( 16.922 -12.697 12.903) 24.779 11.567 ( 5.322 6.686 -13.684) 16.133 12.103 ( 20.052 2.333 -12.322) 23.651 12.508 ( 23.065 -1.612 15.141) 27.638 13.526 ( -2.010 -3.655 6.555) 7.769 13.884 ( -0.124 -3.145 -4.840) 5.773 14.123 ( -7.567 0.948 2.936) 8.172 14.693 ( 1.014 -0.747 -7.465) 7.571 17.598 ( -17.531 0.074 -18.040) 25.155 18.764 ( 16.997 0.089 3.573) 17.368 19.180 ( -6.319 -0.981 -3.156) 7.131 19.821 ( -2.995 -0.602 -1.221) 3.290 21.119 ( -7.831 2.848 -7.639) 11.304 22.608 ( 9.082 -3.167 15.324) 18.093 23.807 ( 3.447 0.102 -3.092) 4.632 24.457 ( 6.283 0.557 0.832) 6.362 ======================= Grid point 514 (248/432) ======================= q-point: (-0.73 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( -6.263 5.439 -1.907) 8.511 2.727 ( -8.295 -7.623 -9.189) 14.538 3.105 ( 11.551 2.615 3.601) 12.378 3.149 ( 0.566 3.934 -0.948) 4.086 3.300 ( -0.527 2.742 1.517) 3.177 3.549 ( 1.043 -4.970 2.830) 5.814 3.830 ( 13.620 -5.202 -0.941) 14.610 4.229 ( 7.457 -4.272 1.445) 8.715 4.851 ( -16.681 1.597 -5.544) 17.650 4.987 ( -10.969 -2.424 0.559) 11.247 5.315 ( -10.629 -0.024 3.638) 11.235 6.049 ( 0.691 3.857 -4.020) 5.614 6.356 ( -15.853 1.508 3.305) 16.264 7.320 ( -1.902 -4.130 2.157) 5.033 8.367 ( -8.056 14.108 -2.765) 16.479 8.880 ( -14.435 -11.264 3.816) 18.703 9.202 ( -19.394 -5.212 17.441) 26.598 9.570 ( -10.543 0.809 18.158) 21.013 9.870 ( -11.040 -7.017 -7.511) 15.084 10.364 ( -1.036 10.530 -4.001) 11.312 11.224 ( 15.164 -7.508 10.289) 19.804 11.471 ( 13.874 17.716 -7.580) 23.744 12.209 ( 20.893 2.863 -14.010) 25.318 12.923 ( 16.067 0.513 8.803) 18.328 13.662 ( 3.262 -5.493 10.521) 12.309 13.811 ( -7.133 -2.181 -3.082) 8.071 14.053 ( -6.326 -1.385 1.367) 6.618 14.687 ( 5.730 -6.059 -6.418) 10.523 17.191 ( -17.256 0.587 -12.210) 21.147 19.053 ( 16.116 0.597 8.739) 18.342 19.098 ( -2.045 -3.227 -4.755) 6.100 19.778 ( -3.015 -1.821 -0.010) 3.522 20.927 ( -1.534 5.111 -10.148) 11.466 22.876 ( -1.386 -7.543 14.198) 16.137 23.843 ( 9.998 2.717 -4.165) 11.166 24.541 ( 4.260 0.859 2.891) 5.220 ======================= Grid point 515 (249/432) ======================= q-point: (-0.64 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( -9.523 3.214 2.563) 10.372 2.530 ( -11.690 -3.079 -9.677) 15.485 3.078 ( 2.889 2.439 -5.157) 6.394 3.237 ( 2.724 4.529 6.751) 8.574 3.363 ( 1.917 -4.018 2.463) 5.088 3.655 ( 3.491 -7.690 0.800) 8.483 4.052 ( 14.315 -0.973 0.973) 14.381 4.318 ( -0.565 -0.806 0.360) 1.048 4.570 ( -17.628 0.975 0.345) 17.658 4.884 ( -7.918 -6.821 -0.887) 10.489 5.197 ( -9.896 -0.426 -0.469) 9.916 5.965 ( 1.450 5.850 -5.881) 8.421 6.196 ( -14.110 2.116 6.695) 15.760 7.357 ( -2.199 -6.386 0.887) 6.812 8.131 ( -4.952 6.018 -7.616) 10.897 8.851 ( -12.189 -6.380 6.993) 15.433 9.110 ( -21.809 -4.109 8.522) 23.772 9.586 ( -11.550 -0.678 11.450) 16.278 9.789 ( -9.422 -9.320 3.334) 13.666 10.205 ( -3.762 5.769 -3.738) 7.837 11.433 ( 15.968 25.282 -2.384) 29.997 11.535 ( 11.526 -1.241 5.798) 12.961 12.270 ( 18.995 4.828 -16.364) 25.532 13.099 ( 5.670 0.324 -0.619) 5.713 13.684 ( -9.003 -1.048 -0.548) 9.080 13.869 ( -6.150 -0.501 13.358) 14.714 14.086 ( 9.301 -5.738 2.690) 11.254 14.791 ( 9.434 -12.614 -7.066) 17.264 16.879 ( -15.821 0.858 -1.776) 15.943 19.065 ( 1.605 -5.707 -7.768) 9.772 19.360 ( 14.422 1.748 10.817) 18.112 19.789 ( 2.366 -2.157 0.029) 3.201 20.752 ( 0.422 6.296 -11.064) 12.737 23.009 ( -11.230 -12.354 9.290) 19.106 23.923 ( 14.056 6.659 -3.382) 15.917 24.628 ( 2.609 0.031 5.496) 6.084 ======================= Grid point 516 (250/432) ======================= q-point: (-0.55 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( -12.985 4.093 9.021) 16.332 2.265 ( -13.951 2.346 -6.964) 15.768 3.063 ( 4.812 -0.442 -5.453) 7.287 3.333 ( 2.800 1.073 8.100) 8.637 3.413 ( -2.424 -5.640 0.989) 6.218 3.706 ( -6.594 -4.071 -1.003) 7.814 4.180 ( -0.470 -0.077 -5.237) 5.259 4.288 ( 3.327 1.633 6.559) 7.533 4.439 ( -7.946 -2.871 4.508) 9.576 4.891 ( -0.477 -7.819 -0.920) 7.887 5.072 ( -7.301 -1.295 -1.631) 7.592 5.865 ( 2.871 6.383 -7.091) 9.963 6.111 ( -10.763 2.366 10.844) 15.460 7.384 ( -4.424 -8.102 0.594) 9.250 7.974 ( -3.128 -1.473 -7.060) 7.861 8.751 ( -17.813 2.084 4.218) 18.424 8.982 ( -12.811 -5.372 6.450) 15.316 9.564 ( -12.828 -3.433 10.084) 16.674 9.793 ( -6.040 -5.697 2.744) 8.745 10.131 ( -3.341 -3.927 1.241) 5.303 11.388 ( 13.429 28.670 -0.350) 31.661 11.683 ( 7.092 4.773 1.558) 8.689 12.257 ( 16.827 7.024 -18.428) 25.924 13.097 ( -1.593 -0.129 -2.926) 3.333 13.594 ( -8.763 -0.159 4.484) 9.845 13.858 ( -7.402 -4.152 2.060) 8.733 14.313 ( 10.122 1.646 3.867) 10.960 14.988 ( 12.709 -17.116 -6.281) 22.225 16.760 ( -10.985 -1.271 13.413) 17.384 19.042 ( 3.368 -6.436 -11.878) 13.923 19.631 ( 12.185 3.058 8.743) 15.306 19.875 ( 9.511 -0.932 -0.912) 9.601 20.583 ( -0.021 5.771 -10.036) 11.577 23.016 ( -16.707 -16.388 4.279) 23.791 24.003 ( 12.875 9.114 -2.949) 16.048 24.732 ( 1.124 -1.131 7.041) 7.220 ======================= Grid point 517 (251/432) ======================= q-point: (-0.45 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( -14.220 8.650 1.276) 16.693 2.105 ( -14.316 6.742 12.263) 20.019 3.081 ( 4.743 -0.786 -3.609) 6.011 3.373 ( -6.785 -4.161 -0.795) 7.999 3.481 ( -4.189 -6.134 3.407) 8.172 3.589 ( -7.388 4.769 7.773) 11.736 4.032 ( -9.419 -6.198 -6.393) 12.962 4.420 ( -5.095 -2.478 2.006) 6.011 4.525 ( 12.697 -1.888 8.553) 15.426 4.913 ( -1.321 -3.679 -3.823) 5.468 5.031 ( 0.025 -1.867 1.942) 2.694 5.791 ( 6.056 5.330 -6.822) 10.565 6.120 ( -7.067 1.906 14.526) 16.266 7.384 ( -8.685 -8.677 2.102) 12.455 7.910 ( -0.047 -5.760 -6.841) 8.943 8.521 ( -18.907 -1.387 3.148) 19.217 8.976 ( -5.795 1.755 9.222) 11.032 9.534 ( -14.618 -5.657 10.157) 18.678 9.796 ( -1.870 -2.380 2.193) 3.738 10.181 ( -3.139 -10.738 1.527) 11.291 11.274 ( 4.937 25.826 -1.812) 26.356 11.711 ( 7.365 11.407 0.615) 13.592 12.185 ( 15.303 8.238 -19.842) 26.377 13.017 ( -6.182 1.588 -0.515) 6.403 13.545 ( -7.016 0.415 4.177) 8.176 13.810 ( -5.601 -3.855 -1.532) 6.970 14.391 ( 4.608 5.040 -0.112) 6.830 15.225 ( 12.179 -16.889 -8.535) 22.504 16.943 ( -1.590 -6.942 27.577) 28.482 18.981 ( 4.829 -4.234 -16.624) 17.821 19.780 ( 5.240 4.369 1.108) 6.912 20.055 ( 18.877 0.264 -0.323) 18.882 20.434 ( -1.773 3.982 -6.688) 7.983 22.964 ( -19.560 -20.339 2.179) 28.302 24.041 ( 10.330 9.098 -3.429) 14.186 24.808 ( -2.162 -0.319 4.860) 5.329 ======================= Grid point 518 (252/432) ======================= q-point: (-0.36 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.813 ( -9.138 12.387 11.797) 19.393 1.999 ( -13.751 10.255 14.908) 22.727 3.106 ( 0.792 -1.649 -2.525) 3.118 3.244 ( -15.029 -5.353 2.124) 16.095 3.434 ( -9.214 -1.746 4.311) 10.321 3.633 ( 5.710 7.604 1.574) 9.639 3.963 ( -6.575 -13.578 -1.062) 15.124 4.372 ( -4.628 -1.616 -0.794) 4.966 4.727 ( -3.804 -4.309 1.223) 5.876 4.925 ( 10.343 2.268 3.507) 11.154 5.118 ( 5.648 -2.312 3.314) 6.945 5.792 ( 9.417 3.085 -4.751) 10.990 6.221 ( -3.803 0.237 17.521) 17.930 7.353 ( -11.420 -7.829 4.002) 14.413 7.868 ( 0.545 -3.202 -9.440) 9.983 8.420 ( -12.673 -9.486 8.669) 18.049 8.995 ( -6.361 4.431 13.429) 15.506 9.518 ( -12.030 -7.445 8.689) 16.603 9.853 ( 0.636 -3.034 5.697) 6.485 10.213 ( -4.519 -7.425 -1.618) 8.841 11.038 ( -4.461 21.314 -4.344) 22.205 11.722 ( 10.027 16.702 1.117) 19.512 12.085 ( 13.981 6.994 -19.752) 25.189 12.903 ( -8.702 2.638 1.035) 9.152 13.467 ( -6.388 4.471 1.052) 7.868 13.758 ( -4.679 -1.192 1.648) 5.102 14.390 ( 1.981 3.795 -0.273) 4.290 15.370 ( 8.627 -14.670 -13.752) 21.880 17.425 ( 8.657 -13.765 30.810) 34.837 18.871 ( 8.006 -0.386 -20.153) 21.689 19.739 ( -1.614 3.292 -5.623) 6.712 20.279 ( 7.751 -0.292 -11.279) 13.688 20.367 ( 12.420 4.815 7.482) 15.278 22.896 ( -22.896 -23.939 1.889) 33.179 24.054 ( 9.296 7.528 -4.183) 12.672 24.760 ( -7.884 3.664 -0.024) 8.694 ======================= Grid point 519 (253/432) ======================= q-point: (-0.27 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( -2.697 10.755 18.195) 21.308 1.928 ( -11.099 11.310 18.456) 24.326 3.036 ( -10.535 -2.207 3.773) 11.406 3.188 ( -4.164 -4.999 -3.085) 7.200 3.394 ( -3.089 -0.951 3.608) 4.844 3.660 ( 5.957 7.068 2.601) 9.602 3.988 ( -3.447 -12.857 -6.650) 14.880 4.328 ( -6.271 -1.122 3.641) 7.337 4.614 ( -5.422 1.235 -5.492) 7.815 5.101 ( 2.922 2.903 10.214) 11.013 5.304 ( 12.849 -3.981 2.067) 13.610 5.873 ( 10.364 0.248 -1.826) 10.527 6.421 ( -0.123 -3.316 20.535) 20.802 7.315 ( -10.195 -4.435 5.513) 12.410 7.774 ( 0.791 0.277 -9.534) 9.571 8.499 ( -13.051 -14.067 15.205) 24.483 9.061 ( -7.494 -0.880 17.164) 18.749 9.544 ( -7.812 -7.955 7.411) 13.388 9.988 ( 3.540 -0.264 8.871) 9.555 10.160 ( -5.059 -4.601 -2.251) 7.199 10.735 ( -7.322 20.479 -2.645) 21.908 11.668 ( 8.571 23.088 -4.564) 25.047 12.010 ( 11.702 1.357 -17.181) 20.832 12.765 ( -10.828 0.937 0.016) 10.869 13.361 ( -5.136 8.668 5.427) 11.444 13.745 ( -1.980 0.985 3.087) 3.797 14.378 ( 0.403 1.825 -0.753) 2.015 15.390 ( 4.757 -11.913 -17.823) 21.959 18.005 ( 12.859 -16.361 17.995) 27.511 18.791 ( 15.146 0.848 -15.948) 22.010 19.573 ( -7.541 0.433 -9.925) 12.472 20.151 ( -4.191 2.838 -7.461) 9.016 20.682 ( 24.177 3.687 5.144) 24.992 22.785 ( -28.684 -24.610 1.114) 37.812 24.072 ( 9.590 5.331 -4.796) 11.975 24.543 ( -13.231 9.236 -2.692) 16.359 ======================= Grid point 520 (254/432) ======================= q-point: (-0.18 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( 0.472 5.588 17.570) 18.444 1.946 ( -7.779 8.720 21.942) 24.860 3.004 ( -4.620 -2.739 2.419) 5.890 3.133 ( -0.751 -0.753 -0.474) 1.164 3.450 ( 3.811 -2.786 0.304) 4.730 3.735 ( 4.908 4.455 5.787) 8.799 3.902 ( -3.582 -7.645 -14.912) 17.136 4.238 ( -11.410 -0.002 -2.937) 11.782 4.559 ( 1.828 2.450 5.670) 6.442 5.182 ( -1.433 3.454 7.826) 8.674 5.507 ( 8.754 -3.448 1.182) 9.482 6.002 ( 8.170 -1.986 0.695) 8.437 6.730 ( 3.416 -7.946 19.733) 21.545 7.280 ( -6.875 2.641 6.360) 9.731 7.705 ( -0.497 -0.961 -1.096) 1.539 8.642 ( -16.868 -14.883 23.332) 32.410 9.172 ( -8.558 -7.007 13.521) 17.469 9.596 ( -8.283 -9.444 6.493) 14.141 10.023 ( 6.826 19.446 4.205) 21.034 10.267 ( -4.054 -20.639 5.939) 21.856 10.486 ( 0.518 22.165 2.855) 22.354 11.472 ( 5.274 24.915 -7.814) 26.639 11.948 ( 9.143 0.185 -18.124) 20.300 12.611 ( -12.053 -2.649 -1.900) 12.486 13.329 ( -2.507 8.870 10.511) 13.980 13.754 ( 1.675 3.285 2.262) 4.326 14.349 ( -1.391 0.577 -1.413) 2.065 15.302 ( 1.255 -8.855 -19.386) 21.349 18.293 ( 9.786 -6.237 -8.930) 14.643 19.010 ( 22.708 -9.364 1.078) 24.586 19.312 ( -11.369 -0.267 -13.492) 17.645 19.965 ( -5.988 4.943 -7.344) 10.688 21.044 ( 24.775 3.350 6.975) 25.955 22.551 ( -35.452 -18.616 -0.519) 40.046 24.113 ( 10.066 2.996 -4.693) 11.503 24.248 ( -13.697 10.581 -0.706) 17.322 ======================= Grid point 521 (255/432) ======================= q-point: (-0.09 0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( -4.113 0.893 19.653) 20.099 2.131 ( 3.535 5.620 18.907) 20.039 2.971 ( -1.237 -2.329 -3.326) 4.244 3.221 ( 8.071 -1.320 3.038) 8.724 3.511 ( 2.777 -2.840 -2.907) 4.922 3.712 ( -3.653 -2.387 -15.751) 16.344 3.827 ( 4.449 3.515 3.874) 6.867 4.007 ( -10.880 2.738 -7.069) 13.261 4.700 ( 4.814 0.385 11.023) 12.035 5.202 ( -3.404 2.847 7.016) 8.302 5.603 ( 1.303 -1.933 0.073) 2.332 6.116 ( 3.754 -2.439 1.505) 4.723 6.961 ( -2.486 -4.887 2.862) 6.185 7.273 ( -2.081 2.494 10.325) 10.824 7.816 ( -1.361 -3.114 21.580) 21.846 8.802 ( -20.149 -11.451 25.810) 34.688 9.269 ( -6.384 -11.302 9.003) 15.797 9.641 ( -6.345 -8.950 7.333) 13.196 10.043 ( 10.969 16.201 5.393) 20.295 10.196 ( -8.712 17.601 3.147) 19.889 10.614 ( 4.752 -13.812 2.300) 14.787 11.309 ( 11.601 20.877 -0.138) 23.884 11.841 ( 8.788 2.207 -18.376) 20.489 12.437 ( -12.011 -5.269 -7.291) 15.006 13.366 ( -1.646 7.001 11.701) 13.735 13.787 ( 5.001 4.242 1.315) 6.688 14.301 ( -3.101 -0.281 -1.388) 3.409 15.147 ( -1.329 -5.656 -17.954) 18.871 18.324 ( 12.574 -1.240 -12.973) 18.109 18.951 ( -16.451 -2.965 -17.906) 24.495 19.408 ( 17.294 -8.954 0.804) 19.491 19.764 ( -3.261 6.826 -6.470) 9.955 21.433 ( 22.969 1.517 9.514) 24.908 22.170 ( -36.343 -8.100 -1.111) 37.251 24.021 ( -10.340 6.270 1.269) 12.159 24.180 ( 9.885 1.054 -3.701) 10.607 ======================= Grid point 524 (256/432) ======================= q-point: ( 0.18 -0.82 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( -3.945 0.000 -6.677) 7.755 2.621 ( -8.276 0.000 -6.277) 10.387 3.121 ( 13.886 -0.000 5.558) 14.957 3.202 ( -0.669 0.000 1.298) 1.460 3.331 ( -2.289 0.000 -11.037) 11.272 3.489 ( -1.489 0.000 8.189) 8.323 3.788 ( 13.566 -0.000 3.835) 14.098 4.182 ( 8.762 -0.000 0.234) 8.765 4.873 ( -14.359 0.000 -6.471) 15.750 4.961 ( -13.776 0.000 1.150) 13.824 5.316 ( -10.779 0.000 3.884) 11.457 6.082 ( 1.292 -0.000 -4.176) 4.371 6.372 ( -15.556 0.000 3.609) 15.970 7.280 ( -2.630 0.000 1.810) 3.193 8.618 ( -15.196 0.000 -18.698) 24.095 8.635 ( -10.733 0.000 15.386) 18.760 9.168 ( -19.404 0.000 23.458) 30.443 9.589 ( -10.527 0.000 21.164) 23.637 9.799 ( -12.083 0.000 -10.568) 16.052 10.469 ( -1.133 0.000 -10.084) 10.147 11.153 ( 18.021 -0.000 14.792) 23.314 11.630 ( 16.849 -0.000 -8.210) 18.743 12.239 ( 21.371 -0.000 -14.154) 25.633 12.929 ( 15.736 -0.000 10.776) 19.073 13.610 ( 4.347 -0.000 11.493) 12.287 13.774 ( -4.172 0.000 -7.077) 8.215 14.050 ( -9.772 0.000 3.796) 10.484 14.634 ( 3.920 -0.000 -7.458) 8.425 17.196 ( -17.076 0.000 -12.108) 20.933 19.053 ( 13.459 -0.000 3.779) 13.980 19.076 ( 0.070 -0.000 0.625) 0.629 19.762 ( -3.158 0.000 -0.085) 3.159 20.972 ( -1.285 0.000 -10.733) 10.810 22.810 ( -2.586 0.000 14.416) 14.646 23.867 ( 10.475 -0.000 -2.741) 10.827 24.548 ( 4.540 -0.000 1.979) 4.953 ======================= Grid point 526 (257/432) ======================= q-point: (-0.73 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( -5.486 3.531 -4.869) 8.140 2.464 ( -8.570 -4.061 -6.924) 11.742 3.140 ( -0.775 5.072 -6.344) 8.159 3.241 ( -2.760 -5.256 -0.609) 5.967 3.354 ( 10.560 2.770 6.080) 12.496 3.557 ( -2.026 -3.250 5.792) 6.943 4.041 ( 14.245 -0.293 6.276) 15.569 4.254 ( 0.806 -3.774 -4.196) 5.700 4.641 ( -12.514 5.372 1.380) 13.689 4.776 ( -13.963 -5.602 -0.993) 15.077 5.194 ( -10.672 0.000 0.042) 10.672 6.037 ( 2.166 2.285 -6.232) 6.982 6.229 ( -13.899 1.387 6.820) 15.544 7.266 ( -3.917 -3.365 0.490) 5.187 8.220 ( -10.032 3.568 -15.365) 18.694 8.723 ( -8.323 -5.788 14.399) 17.610 9.090 ( -23.426 0.433 12.936) 26.764 9.566 ( -10.256 -2.775 -3.503) 11.188 9.672 ( -14.999 -2.166 18.876) 24.207 10.298 ( -2.065 3.496 -10.779) 11.518 11.522 ( 15.213 -0.072 10.171) 18.300 11.764 ( 19.632 11.025 -4.307) 22.924 12.332 ( 20.147 2.343 -16.356) 26.056 13.113 ( 4.514 0.772 0.602) 4.619 13.628 ( -6.615 -3.130 -6.772) 9.971 13.885 ( -6.562 0.817 20.733) 21.762 14.000 ( 8.894 -3.143 1.727) 9.590 14.635 ( 6.960 -5.043 -8.534) 12.112 16.889 ( -15.869 0.303 -2.531) 16.073 19.001 ( 1.266 -1.890 -7.395) 7.737 19.383 ( 14.617 0.822 11.884) 18.857 19.760 ( 2.950 -0.996 -0.071) 3.114 20.827 ( 0.133 2.337 -12.153) 12.376 22.864 ( -12.175 -4.471 9.554) 16.109 24.005 ( 13.650 2.673 -0.191) 13.911 24.623 ( 2.559 -0.337 3.072) 4.013 ======================= Grid point 527 (258/432) ======================= q-point: (-0.64 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -5.525 1.657 -0.728) 5.814 2.300 ( -9.513 1.758 -1.491) 9.788 3.044 ( 1.979 -0.729 -7.544) 7.833 3.271 ( -3.566 -6.907 3.670) 8.596 3.439 ( -1.832 6.588 6.435) 9.390 3.630 ( 0.844 -4.475 0.007) 4.554 4.149 ( -8.040 -3.842 -5.209) 10.322 4.297 ( 10.351 -0.245 5.890) 11.912 4.449 ( -13.043 3.750 3.786) 14.090 4.765 ( 0.707 -6.552 2.178) 6.941 5.055 ( -9.553 -0.735 -0.352) 9.588 5.962 ( 3.218 4.547 -8.022) 9.766 6.147 ( -11.387 1.773 10.880) 15.848 7.242 ( -6.944 -7.446 -0.223) 10.184 7.953 ( -5.403 -1.063 -11.815) 13.035 8.784 ( -18.135 1.433 11.288) 21.409 8.902 ( -12.177 -2.543 7.774) 14.669 9.476 ( -8.608 -9.249 -0.343) 12.639 9.680 ( -18.227 -2.318 17.955) 25.690 10.152 ( 0.368 3.175 -6.940) 7.640 11.765 ( 11.195 5.228 4.064) 13.007 11.842 ( 17.684 21.013 -0.889) 27.479 12.354 ( 17.561 4.516 -18.452) 25.870 13.106 ( -0.107 1.284 -3.600) 3.824 13.528 ( -5.738 -6.710 -3.392) 9.458 13.826 ( -14.622 -0.184 8.622) 16.976 14.330 ( 14.549 0.840 8.018) 16.634 14.725 ( 10.588 -12.988 -7.930) 18.538 16.743 ( -12.270 -0.658 10.691) 16.288 18.958 ( 4.410 -3.402 -11.227) 12.533 19.678 ( 12.052 2.246 10.537) 16.166 19.858 ( 11.088 -1.019 -0.825) 11.165 20.659 ( -1.023 3.152 -12.127) 12.572 22.801 ( -17.570 -8.844 4.989) 20.294 24.141 ( 11.572 6.741 0.579) 13.405 24.698 ( 0.728 -2.459 4.301) 5.008 ======================= Grid point 528 (259/432) ======================= q-point: (-0.55 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( -6.376 6.693 0.224) 9.247 2.212 ( -9.605 6.144 11.195) 15.979 3.034 ( 3.543 -4.581 -5.311) 7.858 3.317 ( -4.548 -5.096 -0.750) 6.872 3.385 ( -10.798 -1.997 6.429) 12.724 3.635 ( -0.390 0.179 1.273) 1.344 3.980 ( -9.682 -0.161 -5.677) 11.225 4.372 ( -7.798 -2.972 4.731) 9.593 4.501 ( 9.503 -0.870 6.524) 11.560 4.850 ( 2.101 -3.425 -0.550) 4.055 4.995 ( -3.646 -2.058 5.313) 6.764 5.879 ( 5.131 4.854 -8.298) 10.897 6.149 ( -8.043 1.371 14.186) 16.365 7.202 ( -11.581 -11.250 1.059) 16.181 7.826 ( -0.659 -4.131 -7.703) 8.766 8.520 ( -22.532 1.281 2.512) 22.707 8.983 ( -2.679 -0.555 12.129) 12.433 9.450 ( -10.920 -7.938 4.271) 14.160 9.657 ( -17.686 -7.667 13.583) 23.581 10.107 ( 2.942 0.715 -2.274) 3.787 11.744 ( 8.150 24.891 -4.658) 26.603 11.922 ( 11.987 14.400 3.704) 19.099 12.312 ( 16.451 6.419 -19.610) 26.389 13.040 ( -1.965 1.445 -3.052) 3.907 13.497 ( -5.120 -6.289 -0.161) 8.111 13.750 ( -10.679 -2.511 5.900) 12.456 14.469 ( 6.307 4.241 -1.187) 7.693 14.938 ( 11.655 -16.479 -6.288) 21.141 16.846 ( -5.047 -4.486 24.210) 25.134 18.909 ( 6.542 -3.788 -15.859) 17.569 19.863 ( 6.293 4.870 3.832) 8.832 20.053 ( 20.068 -0.354 -1.651) 20.139 20.483 ( -3.041 1.897 -9.398) 10.059 22.685 ( -20.368 -12.643 3.414) 24.215 24.200 ( 8.124 9.330 -0.874) 12.402 24.769 ( -1.988 -3.841 3.954) 5.860 ======================= Grid point 529 (260/432) ======================= q-point: (-0.45 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( -4.858 11.739 9.473) 15.847 2.160 ( -10.324 9.596 14.438) 20.177 3.072 ( 1.652 -4.230 -1.767) 4.873 3.171 ( -14.360 -1.430 0.043) 14.431 3.380 ( -4.271 -4.862 0.189) 6.474 3.701 ( -1.447 -10.299 1.931) 10.578 3.819 ( -0.763 7.332 -2.102) 7.666 4.337 ( -7.993 -2.695 3.299) 9.057 4.656 ( -0.813 -3.618 2.413) 4.424 4.935 ( 10.170 -1.930 2.794) 10.722 5.078 ( 0.257 -1.373 8.191) 8.309 5.845 ( 7.811 3.082 -6.600) 10.680 6.228 ( -5.134 0.485 16.357) 17.150 7.158 ( -15.140 -13.649 4.393) 20.853 7.805 ( 2.164 -4.096 -5.905) 7.506 8.305 ( -15.565 -4.200 3.544) 16.506 9.071 ( -2.992 3.537 11.425) 12.328 9.416 ( -14.966 -5.364 11.328) 19.521 9.665 ( -14.217 -14.453 8.672) 22.051 10.151 ( 4.679 0.047 0.932) 4.771 11.508 ( 3.010 30.469 -7.269) 31.469 11.970 ( 8.044 11.962 1.054) 14.454 12.250 ( 18.988 12.027 -18.520) 29.123 12.949 ( -5.288 2.968 -2.234) 6.463 13.477 ( -5.340 -3.267 1.231) 6.380 13.725 ( -5.907 -2.515 5.302) 8.326 14.461 ( 2.082 4.150 -2.252) 5.161 15.107 ( 7.603 -15.847 -10.765) 20.611 17.218 ( 3.355 -10.416 30.513) 32.416 18.832 ( 8.541 -3.399 -20.267) 22.254 19.839 ( -0.168 7.742 -5.177) 9.314 20.261 ( 9.190 -1.545 -11.088) 14.484 20.423 ( 11.818 1.592 4.269) 12.666 22.564 ( -22.301 -15.390 4.020) 27.392 24.195 ( 6.435 8.968 -2.449) 11.306 24.770 ( -6.641 -1.991 0.866) 6.987 ======================= Grid point 530 (261/432) ======================= q-point: (-0.36 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( -5.092 10.657 14.362) 18.595 2.116 ( -8.881 11.868 16.931) 22.503 3.026 ( -8.493 0.900 3.539) 9.244 3.098 ( -2.644 -5.472 -1.974) 6.390 3.366 ( -0.802 -2.498 -0.284) 2.638 3.703 ( -4.423 -10.673 -5.066) 12.615 3.853 ( 8.019 5.484 1.379) 9.812 4.292 ( -9.075 -3.165 3.966) 10.397 4.624 ( -3.911 0.330 -0.520) 3.959 5.157 ( 5.426 3.149 10.574) 12.295 5.209 ( 7.500 -7.014 3.527) 10.858 5.881 ( 8.828 0.629 -3.894) 9.669 6.379 ( -2.278 -1.846 18.223) 18.457 7.151 ( -13.891 -13.606 8.490) 21.217 7.778 ( 1.438 -0.134 -6.696) 6.850 8.270 ( -11.284 -12.291 7.820) 18.427 9.106 ( -6.635 5.023 13.474) 15.837 9.424 ( -14.557 -6.231 15.141) 21.908 9.733 ( -9.224 -18.881 6.884) 22.113 10.233 ( 6.243 4.973 4.117) 8.981 11.184 ( 0.683 30.694 -7.127) 31.518 11.958 ( 5.290 6.429 -5.076) 9.751 12.174 ( 19.779 21.278 -16.637) 33.478 12.789 ( -10.836 2.127 -3.095) 11.468 13.446 ( -4.743 1.200 4.383) 6.569 13.755 ( -1.127 0.054 5.965) 6.070 14.420 ( -0.493 2.992 -1.259) 3.283 15.161 ( 3.682 -14.638 -15.156) 21.390 17.742 ( 8.987 -14.523 25.443) 30.644 18.753 ( 11.376 -4.424 -20.814) 24.129 19.643 ( -5.086 7.083 -10.802) 13.883 20.165 ( -3.709 -0.962 -8.038) 8.904 20.740 ( 25.473 2.806 4.300) 25.985 22.438 ( -24.981 -16.280 4.471) 30.151 24.177 ( 6.450 6.934 -3.564) 10.119 24.638 ( -11.571 2.375 -2.429) 12.059 ======================= Grid point 531 (262/432) ======================= q-point: (-0.27 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( -7.310 4.971 15.054) 17.458 2.131 ( -3.378 11.996 18.632) 22.416 2.970 ( -5.216 -1.582 0.182) 5.454 3.107 ( 2.929 -1.636 0.032) 3.355 3.409 ( 1.990 -2.339 2.231) 3.796 3.684 ( -3.702 -10.709 -6.539) 13.083 3.893 ( 8.436 6.856 -3.087) 11.300 4.211 ( -10.705 -2.946 -0.936) 11.142 4.611 ( 0.147 3.531 7.094) 7.926 5.248 ( -1.096 4.010 8.527) 9.487 5.425 ( 8.101 -6.258 2.197) 10.470 5.968 ( 7.139 -1.919 -0.962) 7.455 6.616 ( 1.258 -5.783 18.381) 19.310 7.217 ( -9.116 -9.758 11.713) 17.763 7.707 ( -0.793 1.098 -4.278) 4.487 8.358 ( -12.210 -17.288 12.745) 24.706 9.138 ( -9.552 1.981 16.011) 18.749 9.454 ( -14.822 -7.517 13.888) 21.658 9.916 ( -0.595 -19.569 7.770) 21.064 10.316 ( 7.866 13.300 7.037) 16.979 10.885 ( 0.897 26.216 -3.497) 26.464 11.868 ( 1.944 11.222 -8.439) 14.175 12.031 ( 18.119 19.710 -19.408) 33.067 12.578 ( -14.389 -1.339 -3.632) 14.901 13.445 ( -3.020 4.104 8.436) 9.856 13.819 ( 3.172 4.017 5.448) 7.475 14.368 ( -2.587 1.696 -0.973) 3.243 15.116 ( 0.528 -12.882 -17.558) 21.783 18.163 ( 9.731 -9.058 4.767) 14.123 18.804 ( 12.232 -12.979 -8.801) 19.888 19.373 ( -5.237 5.906 -13.024) 15.230 20.017 ( -5.176 1.134 -7.414) 9.114 21.110 ( 25.884 4.194 6.065) 26.914 22.264 ( -28.262 -14.416 3.381) 31.906 24.175 ( 7.115 4.331 -3.935) 9.212 24.395 ( -13.669 6.365 -3.022) 15.378 ======================= Grid point 532 (263/432) ======================= q-point: (-0.18 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( -5.014 1.770 15.807) 16.678 2.253 ( 2.749 8.390 17.984) 20.035 2.929 ( -1.162 -2.500 -2.219) 3.539 3.178 ( 5.797 -3.326 -3.217) 7.417 3.479 ( -0.220 -1.329 2.432) 2.780 3.621 ( -1.849 -7.314 -9.075) 11.802 3.921 ( 8.512 6.345 -2.047) 10.812 4.046 ( -8.878 1.770 -5.092) 10.386 4.721 ( 2.934 2.299 11.775) 12.351 5.267 ( -2.983 4.573 6.655) 8.608 5.551 ( 1.497 -4.210 0.942) 4.566 6.063 ( 3.396 -3.545 0.795) 4.973 6.866 ( 0.520 -6.283 9.982) 11.807 7.283 ( -6.513 -2.465 6.958) 9.844 7.745 ( -0.660 -4.673 15.673) 16.368 8.517 ( -12.843 -19.860 15.175) 28.101 9.178 ( -10.179 -0.777 15.249) 18.351 9.498 ( -10.089 -8.035 12.937) 18.268 10.154 ( -1.063 -14.148 5.544) 15.233 10.372 ( 10.447 18.303 6.475) 22.047 10.703 ( 0.013 19.078 2.403) 19.228 11.656 ( 4.830 17.481 -8.387) 19.981 11.927 ( 16.540 10.889 -17.935) 26.717 12.347 ( -15.350 -4.622 -7.077) 17.524 13.480 ( -1.893 5.390 9.962) 11.484 13.887 ( 5.941 7.335 4.166) 10.318 14.300 ( -4.420 0.369 -1.145) 4.581 15.010 ( -1.334 -10.503 -16.879) 19.925 18.296 ( 12.153 -2.084 -9.392) 15.500 18.855 ( -12.098 -8.768 -12.689) 19.602 19.285 ( 11.924 -4.875 -2.582) 13.138 19.855 ( -2.305 3.719 -7.463) 8.651 21.475 ( 19.795 3.519 9.283) 22.145 22.017 ( -25.969 -8.866 0.876) 27.455 24.137 ( -11.802 6.451 -1.389) 13.522 24.207 ( 7.739 2.264 -3.504) 8.792 ======================= Grid point 533 (264/432) ======================= q-point: (-0.09 0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( 0.473 -1.022 14.849) 14.892 2.447 ( 5.726 5.707 15.702) 17.660 2.941 ( 2.959 -1.821 -0.847) 3.576 3.222 ( 4.289 -7.737 -9.728) 13.149 3.415 ( -5.068 -1.938 -6.081) 8.150 3.608 ( -2.040 -2.152 -0.532) 3.012 3.859 ( 2.847 9.566 -8.699) 13.239 3.956 ( 3.802 3.921 -0.237) 5.466 4.889 ( 3.629 0.317 10.985) 11.574 5.261 ( -3.254 3.494 5.957) 7.634 5.559 ( -5.655 -2.271 0.902) 6.161 6.122 ( -0.626 -3.589 0.733) 3.716 6.884 ( -7.924 0.225 -0.645) 7.954 7.303 ( -4.649 -3.347 6.163) 8.414 8.094 ( 0.981 -6.639 31.415) 32.123 8.654 ( -15.405 -18.280 13.128) 27.273 9.239 ( -8.003 -3.600 13.208) 15.857 9.666 ( 0.266 -10.267 16.314) 19.278 10.130 ( -11.555 8.106 -2.315) 14.303 10.444 ( 11.122 17.305 7.313) 21.832 10.592 ( -1.996 4.172 -2.707) 5.359 11.645 ( 16.622 6.239 -0.351) 17.758 11.854 ( 10.087 10.973 -10.583) 18.280 12.118 ( -6.378 -6.851 -13.057) 16.065 13.517 ( -2.169 6.170 9.306) 11.375 13.936 ( 5.968 8.203 1.674) 10.281 14.228 ( -5.206 -1.144 -0.561) 5.360 14.889 ( -1.730 -7.020 -13.476) 15.293 18.379 ( 13.978 -0.767 -7.969) 16.108 18.501 ( -15.887 -1.520 -18.801) 24.662 19.415 ( -2.752 -5.494 -1.403) 6.302 19.787 ( 8.805 2.001 -5.662) 10.658 21.582 ( -23.770 -6.685 3.878) 24.995 21.970 ( 17.668 5.065 6.665) 19.551 23.948 ( -7.848 4.413 -0.678) 9.029 24.270 ( 7.940 0.188 -2.174) 8.234 ======================= Grid point 537 (265/432) ======================= q-point: ( 0.27 -0.73 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( -2.476 0.000 -5.558) 6.085 2.316 ( -7.018 0.000 1.426) 7.161 3.046 ( -0.543 0.000 -9.453) 9.469 3.197 ( -3.721 0.000 3.782) 5.306 3.534 ( -10.201 0.000 6.930) 12.333 3.564 ( 8.940 -0.000 2.660) 9.327 4.101 ( -8.357 0.000 -5.733) 10.134 4.296 ( 11.517 -0.000 7.447) 13.715 4.496 ( -16.351 0.000 -1.174) 16.393 4.700 ( 3.507 -0.000 5.509) 6.531 5.048 ( -10.800 0.000 0.209) 10.802 6.002 ( 3.253 -0.000 -8.014) 8.649 6.164 ( -11.706 0.000 10.447) 15.690 7.173 ( -8.152 0.000 -0.186) 8.154 7.943 ( -5.298 0.000 -14.613) 15.544 8.791 ( -13.690 0.000 17.158) 21.950 8.895 ( -17.494 0.000 7.099) 18.879 9.370 ( -9.284 0.000 -2.634) 9.650 9.675 ( -18.608 0.000 19.558) 26.996 10.183 ( 0.789 -0.000 -9.132) 9.166 11.810 ( 12.998 -0.000 6.587) 14.572 12.031 ( 18.197 -0.000 -2.197) 18.329 12.402 ( 19.406 -0.000 -19.081) 27.216 13.124 ( -0.505 0.000 -2.574) 2.623 13.450 ( -5.900 0.000 -5.847) 8.306 13.827 ( -16.268 0.000 9.201) 18.690 14.342 ( 17.797 -0.000 12.052) 21.493 14.603 ( 8.126 -0.000 -10.569) 13.332 16.738 ( -12.695 0.000 9.750) 16.007 18.930 ( 4.636 -0.000 -11.033) 11.968 19.699 ( 11.754 -0.000 11.417) 16.386 19.848 ( 11.883 -0.000 -0.883) 11.916 20.686 ( -1.266 0.000 -13.141) 13.202 22.726 ( -17.782 0.000 5.359) 18.572 24.204 ( 11.167 -0.000 2.709) 11.491 24.672 ( 0.484 -0.000 2.496) 2.543 ======================= Grid point 539 (266/432) ======================= q-point: (-0.64 0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( -1.489 2.780 0.339) 3.172 2.295 ( -3.966 2.955 9.318) 10.549 2.964 ( 1.084 -2.520 -6.443) 7.003 3.211 ( -2.327 -4.592 2.313) 5.643 3.408 ( -17.206 1.886 4.921) 17.995 3.620 ( -1.590 -1.009 -2.970) 3.517 3.985 ( -2.738 0.066 -1.917) 3.343 4.336 ( -8.960 -1.015 3.407) 9.639 4.496 ( 7.103 0.137 5.963) 9.275 4.805 ( 3.151 -1.638 -0.339) 3.567 4.971 ( -5.767 -0.718 9.135) 10.827 5.942 ( 4.296 2.144 -9.314) 10.479 6.164 ( -9.013 0.461 14.158) 16.790 7.056 ( -12.922 -5.033 0.800) 13.891 7.777 ( 0.383 -1.539 -9.933) 10.059 8.552 ( -24.955 1.735 2.864) 25.179 8.974 ( -3.611 -0.268 16.192) 16.592 9.279 ( -7.733 -7.630 0.246) 10.866 9.621 ( -21.582 0.335 18.442) 28.391 10.129 ( 3.865 0.994 -4.767) 6.217 11.988 ( 10.325 6.294 0.865) 12.124 12.162 ( 10.258 7.766 -2.836) 13.175 12.426 ( 21.472 7.478 -17.364) 28.609 13.057 ( -2.132 0.044 -4.541) 5.017 13.374 ( -2.707 -5.814 -2.355) 6.832 13.724 ( -14.817 -0.782 9.076) 17.394 14.546 ( 8.281 5.399 -5.088) 11.118 14.700 ( 10.792 -10.890 -1.144) 15.374 16.795 ( -6.755 -1.521 22.318) 23.367 18.864 ( 7.078 -1.433 -15.675) 17.258 19.925 ( 7.040 2.069 6.824) 10.020 20.047 ( 20.510 -0.240 -2.328) 20.643 20.502 ( -3.502 0.440 -12.596) 13.081 22.542 ( -20.287 -4.232 4.396) 21.185 24.331 ( 6.533 5.086 2.118) 8.546 24.701 ( -1.763 -3.202 1.872) 4.106 ======================= Grid point 540 (267/432) ======================= q-point: (-0.55 0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( -3.316 6.449 6.846) 9.973 2.333 ( -3.000 10.125 13.754) 17.341 2.971 ( 0.514 -6.023 -1.808) 6.309 3.194 ( -13.977 2.411 1.517) 14.265 3.268 ( -2.396 -7.722 1.476) 8.219 3.532 ( -7.123 -6.959 -5.584) 11.417 3.955 ( 4.164 5.356 -0.963) 6.852 4.305 ( -7.666 -0.005 6.332) 9.943 4.613 ( 1.189 -1.454 3.064) 3.593 4.858 ( 3.490 -5.950 2.104) 7.212 5.084 ( 1.058 1.324 12.385) 12.500 5.889 ( 5.922 2.026 -7.862) 10.049 6.234 ( -6.309 0.175 16.004) 17.203 6.950 ( -15.964 -9.705 4.152) 19.138 7.744 ( 4.223 -2.815 -5.631) 7.581 8.269 ( -18.749 -0.570 0.461) 18.764 9.102 ( -4.617 0.509 15.580) 16.258 9.280 ( -6.582 -9.729 2.940) 12.109 9.533 ( -23.386 -1.415 18.317) 29.739 10.163 ( 6.585 0.712 -0.163) 6.625 11.957 ( 7.056 19.884 -7.467) 22.381 12.127 ( 5.030 6.501 -8.582) 11.883 12.464 ( 18.528 13.898 -6.834) 24.149 12.988 ( 0.407 -0.419 -7.141) 7.165 13.387 ( -2.957 -5.319 1.756) 6.334 13.676 ( -9.615 -3.215 8.772) 13.407 14.519 ( 4.692 2.657 -7.469) 9.212 14.870 ( 5.230 -11.210 -4.759) 13.254 17.083 ( 0.134 -5.495 29.810) 30.312 18.778 ( 8.457 -2.568 -20.464) 22.291 19.971 ( 0.689 7.140 -2.223) 7.509 20.231 ( 6.142 -1.973 -12.425) 14.000 20.425 ( 15.572 -0.907 0.389) 15.603 22.376 ( -20.795 -7.098 5.785) 22.722 24.344 ( 3.352 8.161 -0.323) 8.828 24.708 ( -5.192 -4.760 0.486) 7.060 ======================= Grid point 541 (268/432) ======================= q-point: (-0.45 0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( -8.034 6.665 10.355) 14.704 2.345 ( -3.057 14.778 14.093) 20.648 2.992 ( -4.908 -5.248 0.236) 7.190 3.071 ( -5.468 1.886 4.834) 7.538 3.311 ( 0.916 -4.069 -1.561) 4.453 3.472 ( -4.103 -13.090 -5.906) 14.935 3.980 ( 8.800 4.645 -3.019) 10.399 4.255 ( -10.041 1.077 6.006) 11.750 4.632 ( -2.136 0.618 3.514) 4.158 5.051 ( 6.711 -10.260 4.902) 13.203 5.224 ( 1.923 3.526 12.142) 12.789 5.891 ( 7.069 0.449 -5.272) 8.830 6.354 ( -4.418 -1.178 17.071) 17.672 6.916 ( -14.298 -12.813 9.075) 21.235 7.768 ( 4.002 -0.890 -4.557) 6.130 8.103 ( -13.193 -7.344 2.192) 15.258 9.184 ( -5.666 3.007 12.938) 14.441 9.330 ( -11.274 -5.777 13.636) 18.612 9.479 ( -16.391 -9.239 13.695) 23.272 10.282 ( 8.746 1.226 4.312) 9.828 11.707 ( 4.042 29.409 -10.737) 31.568 12.025 ( 4.713 3.373 -12.432) 13.717 12.502 ( 12.522 13.823 -3.207) 18.925 12.861 ( -1.817 6.609 -10.603) 12.626 13.417 ( -4.349 -3.089 5.950) 7.991 13.734 ( -0.820 -3.135 8.355) 8.961 14.465 ( 1.006 1.942 -5.088) 5.538 14.925 ( 0.966 -12.399 -9.897) 15.894 17.532 ( 5.543 -9.988 29.421) 31.561 18.674 ( 9.361 -4.331 -22.949) 25.161 19.782 ( -4.867 8.738 -11.861) 15.515 20.126 ( -4.092 -3.488 -7.730) 9.416 20.768 ( 28.412 0.562 1.933) 28.484 22.237 ( -21.130 -7.869 6.573) 23.486 24.299 ( 2.712 7.385 -2.239) 8.180 24.635 ( -9.457 -2.303 -1.946) 9.926 ======================= Grid point 542 (269/432) ======================= q-point: (-0.36 0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( -8.428 4.758 11.147) 14.762 2.347 ( -2.451 13.578 14.832) 20.257 2.936 ( -6.033 -2.777 -1.387) 6.785 3.101 ( 2.251 0.862 2.866) 3.745 3.363 ( 2.293 -3.307 2.734) 4.866 3.477 ( -2.224 -12.535 -6.670) 14.372 4.020 ( 10.992 5.531 -6.179) 13.770 4.157 ( -10.701 -1.592 1.267) 10.893 4.673 ( -0.385 3.639 10.065) 10.709 5.253 ( 2.443 -7.267 4.602) 8.942 5.354 ( 3.232 1.739 9.316) 10.013 5.939 ( 5.872 -1.482 -2.470) 6.540 6.531 ( -1.898 -4.433 17.349) 18.006 7.004 ( -8.679 -13.706 13.258) 20.951 7.730 ( -1.378 1.555 -4.256) 4.736 8.095 ( -8.545 -13.458 5.510) 16.867 9.205 ( -8.989 5.055 14.505) 17.798 9.343 ( -21.589 -5.641 20.723) 30.452 9.628 ( 1.823 -14.314 9.203) 17.114 10.459 ( 10.144 4.443 8.447) 13.928 11.371 ( 2.306 30.219 -9.855) 31.869 11.921 ( 5.374 1.230 -14.467) 15.482 12.463 ( 9.046 17.344 -6.582) 20.639 12.590 ( -8.558 9.190 -11.726) 17.182 13.462 ( -4.046 -1.361 8.598) 9.599 13.872 ( 5.706 1.692 8.166) 10.105 14.399 ( -2.396 1.613 -2.371) 3.737 14.889 ( -1.698 -13.246 -14.039) 19.376 18.001 ( 8.277 -9.674 18.500) 22.458 18.613 ( 9.236 -9.177 -17.093) 21.487 19.482 ( -5.998 6.552 -15.183) 17.591 20.009 ( -4.840 -1.746 -6.400) 8.211 21.171 ( 29.146 2.684 3.893) 29.527 22.083 ( -22.349 -7.073 5.064) 23.983 24.254 ( 3.243 4.920 -3.165) 6.689 24.461 ( -12.041 1.667 -3.388) 12.619 ======================= Grid point 543 (270/432) ======================= q-point: (-0.27 0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -3.068 3.104 11.792) 12.573 2.404 ( 0.325 9.563 15.208) 17.967 2.890 ( -0.908 -2.145 -1.320) 2.677 3.130 ( 1.794 -1.962 -3.499) 4.395 3.437 ( -0.974 -5.638 -6.546) 8.694 3.488 ( -1.052 -6.649 4.411) 8.048 4.019 ( 2.323 4.753 -2.322) 5.778 4.069 ( 3.434 1.305 -6.861) 7.783 4.777 ( 0.868 4.195 13.070) 13.754 5.330 ( -1.701 1.116 4.921) 5.324 5.475 ( 0.650 -3.279 4.625) 5.706 6.005 ( 2.788 -3.294 -0.125) 4.317 6.751 ( -0.471 -7.233 13.596) 15.407 7.171 ( -5.274 -10.306 9.522) 14.990 7.685 ( -3.153 -2.159 8.221) 9.066 8.205 ( -5.186 -16.016 6.536) 18.059 9.199 ( -14.654 2.409 18.049) 23.374 9.374 ( -14.173 -6.364 18.453) 24.122 9.901 ( 3.897 -13.968 8.448) 16.783 10.638 ( 9.848 11.314 9.798) 17.916 11.074 ( 1.614 24.652 -5.279) 25.262 11.803 ( 4.421 3.067 -14.951) 15.890 12.261 ( 2.698 15.271 -15.334) 21.809 12.311 ( -4.980 9.665 -6.855) 12.853 13.525 ( -3.163 -0.016 9.571) 10.080 14.017 ( 7.923 7.362 7.157) 12.969 14.316 ( -5.412 1.402 -1.077) 5.693 14.804 ( -2.099 -13.440 -15.194) 20.394 18.257 ( 11.108 -2.418 -2.949) 11.745 18.672 ( -2.439 -12.000 -5.506) 13.426 19.243 ( 1.253 -0.640 -10.675) 10.768 19.890 ( -2.045 0.634 -6.809) 7.138 21.548 ( 18.962 4.909 7.791) 21.079 21.894 ( -15.945 -5.516 1.131) 16.910 24.210 ( -6.538 2.464 -2.932) 7.577 24.264 ( -0.887 4.051 -3.034) 5.138 ======================= Grid point 544 (271/432) ======================= q-point: (-0.18 0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( 1.179 1.674 11.947) 12.121 2.538 ( 5.043 4.985 12.470) 14.345 2.919 ( 2.793 -0.469 1.655) 3.280 3.115 ( 2.035 -4.804 -7.668) 9.275 3.359 ( -1.815 -4.861 -9.529) 10.850 3.544 ( -8.697 -5.093 5.258) 11.367 3.998 ( 3.304 3.984 0.230) 5.181 4.037 ( 11.524 7.642 -11.094) 17.728 4.911 ( 1.402 2.289 12.094) 12.388 5.324 ( -3.123 3.098 3.420) 5.572 5.513 ( -5.777 -2.645 3.519) 7.264 6.055 ( -0.746 -4.151 0.656) 4.268 6.868 ( -5.703 -2.562 2.874) 6.881 7.215 ( -6.323 -7.239 5.364) 11.007 7.961 ( 4.456 -8.695 25.573) 27.375 8.340 ( -6.428 -17.228 5.045) 19.068 9.207 ( -13.873 -1.194 18.016) 22.770 9.509 ( -6.570 -8.029 19.535) 22.119 10.093 ( -1.302 -7.871 3.476) 8.702 10.723 ( 8.069 15.479 5.791) 18.392 10.844 ( -4.980 20.761 -1.802) 21.426 11.712 ( 11.375 2.606 -10.372) 15.613 11.995 ( -16.194 -2.318 -10.021) 19.185 12.152 ( 18.785 18.292 -11.077) 28.463 13.588 ( -2.825 1.710 9.333) 9.900 14.090 ( 3.066 8.904 3.273) 9.970 14.224 ( -3.908 1.441 -0.504) 4.196 14.737 ( -0.023 -10.843 -11.675) 15.934 18.364 ( 11.705 -0.851 -6.423) 13.379 18.472 ( -12.312 -1.798 -15.734) 20.059 19.297 ( 1.786 -8.244 0.224) 8.438 19.817 ( 5.085 1.322 -6.740) 8.546 21.506 ( -23.850 -1.990 2.779) 24.094 22.046 ( 23.809 3.993 6.011) 24.879 24.021 ( -9.062 3.936 -2.151) 10.111 24.275 ( 5.427 0.421 -1.832) 5.743 ======================= Grid point 545 (272/432) ======================= q-point: (-0.09 0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( 1.077 -1.661 9.762) 9.961 2.715 ( 8.939 3.825 7.864) 12.505 2.994 ( 1.964 -0.569 4.939) 5.345 3.104 ( 4.955 -4.535 -9.838) 11.912 3.270 ( -2.621 -2.151 -6.291) 7.147 3.483 ( -9.841 -4.623 2.098) 11.073 3.964 ( 10.073 11.306 -11.744) 19.163 4.056 ( 7.529 4.110 1.009) 8.636 5.031 ( -0.107 0.549 8.732) 8.750 5.270 ( -4.522 1.153 -2.174) 5.148 5.462 ( -11.579 -0.597 6.698) 13.390 6.067 ( -2.843 -4.084 -0.143) 4.978 6.737 ( -12.891 0.584 -1.563) 12.999 7.289 ( -2.945 -4.392 6.904) 8.696 8.309 ( -3.675 -9.973 8.709) 13.741 8.523 ( -1.787 -14.751 22.316) 26.810 9.264 ( -11.107 -3.364 17.197) 20.746 9.782 ( -0.079 -13.980 18.613) 23.279 10.016 ( -11.311 10.860 -1.582) 15.760 10.526 ( -10.718 13.116 -5.369) 17.769 10.812 ( 13.855 10.430 3.669) 17.726 11.621 ( -11.955 -1.842 -13.320) 17.993 11.886 ( 17.500 -1.484 -6.783) 18.827 12.239 ( 21.761 9.460 0.033) 23.729 13.624 ( -3.091 4.450 8.082) 9.730 14.029 ( -5.119 1.990 -0.606) 5.525 14.181 ( 0.263 4.662 -0.423) 4.689 14.721 ( 2.992 -4.321 -6.594) 8.432 18.046 ( -17.150 -0.082 -19.601) 26.044 18.532 ( 15.966 -0.233 -1.765) 16.065 19.309 ( -4.805 -1.448 -1.175) 5.154 19.841 ( 6.113 -0.177 -3.982) 7.298 21.233 ( -19.974 -4.513 -2.142) 20.589 22.400 ( 20.929 6.521 10.611) 24.355 23.876 ( -4.594 2.487 -2.673) 5.868 24.342 ( 5.693 -1.260 -0.056) 5.831 ======================= Grid point 550 (273/432) ======================= q-point: ( 0.36 -0.64 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.236 ( -2.646 0.000 5.590) 6.184 2.435 ( 1.604 -0.000 13.597) 13.691 2.913 ( 0.402 -0.000 -1.531) 1.583 3.179 ( -11.154 0.000 3.997) 11.848 3.224 ( -7.584 0.000 0.324) 7.591 3.476 ( -6.971 0.000 -7.192) 10.016 3.990 ( 2.331 -0.000 -2.398) 3.344 4.321 ( -3.116 0.000 7.760) 8.362 4.603 ( 1.171 -0.000 3.650) 3.834 4.793 ( -0.629 0.000 1.911) 2.012 5.099 ( 1.828 -0.000 13.466) 13.590 5.907 ( 4.939 -0.000 -8.372) 9.720 6.235 ( -6.733 0.000 15.945) 17.309 6.864 ( -15.944 0.000 4.103) 16.464 7.719 ( 5.124 -0.000 -6.012) 7.900 8.267 ( -20.420 0.000 -0.581) 20.428 9.105 ( -6.242 0.000 17.644) 18.715 9.185 ( -4.458 0.000 3.282) 5.536 9.532 ( -23.445 0.000 18.149) 29.648 10.169 ( 6.608 -0.000 -0.826) 6.659 12.140 ( 9.696 -0.000 -3.809) 10.418 12.160 ( 4.187 -0.000 -13.153) 13.803 12.663 ( 23.920 -0.000 -7.227) 24.987 12.917 ( -8.636 0.000 -5.565) 10.274 13.352 ( 4.134 -0.000 0.703) 4.194 13.639 ( -13.550 0.000 10.108) 16.904 14.544 ( 7.892 -0.000 -13.829) 15.922 14.768 ( 2.258 -0.000 2.001) 3.017 17.036 ( -0.939 0.000 29.447) 29.462 18.756 ( 8.373 -0.000 -20.538) 22.179 20.042 ( 1.477 -0.000 1.739) 2.282 20.207 ( 3.056 -0.000 -15.275) 15.578 20.413 ( 18.385 -0.000 -1.657) 18.459 22.318 ( -20.080 0.000 6.532) 21.116 24.430 ( 1.771 -0.000 1.410) 2.264 24.651 ( -4.267 0.000 -0.645) 4.315 ======================= Grid point 552 (274/432) ======================= q-point: (-0.55 0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( -7.322 2.785 6.863) 10.415 2.573 ( 1.952 10.040 11.452) 15.354 2.924 ( -4.022 -1.930 3.335) 5.570 3.044 ( -12.138 -5.566 5.789) 14.554 3.250 ( 3.434 -1.269 -0.001) 3.660 3.335 ( -2.357 -3.114 -6.918) 7.944 3.977 ( 3.083 -2.084 -5.985) 7.048 4.341 ( -3.497 5.596 4.145) 7.793 4.643 ( -1.329 0.611 6.464) 6.627 4.891 ( 2.865 -6.901 7.061) 10.280 5.271 ( 2.064 1.670 12.815) 13.087 5.895 ( 5.600 0.004 -5.932) 8.158 6.340 ( -5.766 -0.423 16.585) 17.563 6.759 ( -13.745 -5.061 9.141) 17.266 7.754 ( 6.870 -0.548 -3.604) 7.777 8.024 ( -15.544 -2.225 -1.359) 15.761 9.201 ( -10.451 -0.149 18.361) 21.128 9.232 ( 0.023 -3.890 6.888) 7.910 9.426 ( -23.356 0.096 18.386) 29.724 10.289 ( 9.574 0.054 3.444) 10.175 12.035 ( 5.470 4.389 -15.233) 16.769 12.128 ( 6.942 10.650 -11.898) 17.412 12.664 ( -6.153 7.989 -1.347) 10.174 12.901 ( 10.611 -4.536 -8.564) 14.370 13.437 ( 4.074 6.649 5.441) 9.509 13.640 ( -4.557 -7.502 9.234) 12.740 14.478 ( 5.123 -0.109 -12.464) 13.476 14.779 ( -3.818 -4.353 -1.492) 5.979 17.416 ( 3.607 -3.551 30.867) 31.280 18.621 ( 8.659 -1.666 -23.628) 25.220 19.918 ( -6.493 6.805 -14.188) 17.023 20.053 ( -3.903 -4.771 -5.633) 8.350 20.768 ( 31.025 -0.222 -0.007) 31.026 22.157 ( -18.717 -2.117 7.809) 20.391 24.412 ( -0.567 5.249 -0.862) 5.350 24.577 ( -7.240 -3.637 -2.250) 8.408 ======================= Grid point 553 (275/432) ======================= q-point: (-0.45 0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.178 ( -6.946 3.531 7.101) 10.542 2.583 ( -1.216 14.170 10.248) 17.530 2.887 ( -5.818 -2.371 -0.138) 6.284 3.081 ( -2.949 -6.501 4.569) 8.475 3.281 ( -0.683 -3.921 -0.236) 3.987 3.340 ( 2.861 -3.091 -0.351) 4.227 3.999 ( 6.953 -4.517 -6.363) 10.451 4.228 ( -4.187 6.578 -3.717) 8.638 4.731 ( -0.169 3.208 12.797) 13.194 5.093 ( 3.533 -9.466 6.708) 12.128 5.407 ( 0.554 3.001 11.400) 11.801 5.916 ( 4.699 -1.239 -3.439) 5.954 6.468 ( -4.977 -2.792 16.470) 17.431 6.806 ( -7.475 -8.772 13.372) 17.653 7.760 ( -2.205 2.191 -3.436) 4.633 7.914 ( -4.268 -8.148 0.646) 9.221 9.252 ( -16.483 -1.991 20.667) 26.510 9.301 ( -17.347 2.893 17.354) 24.707 9.442 ( 2.117 -7.787 10.596) 13.319 10.497 ( 12.462 0.813 7.752) 14.699 11.837 ( 3.914 21.987 -15.904) 27.417 11.945 ( 4.520 2.548 -15.946) 16.769 12.509 ( -11.533 -0.730 -1.475) 11.650 12.883 ( 8.794 11.720 -12.294) 19.127 13.462 ( -4.307 4.430 10.369) 12.071 13.849 ( 9.996 -5.211 7.808) 13.713 14.406 ( 1.060 -0.956 -8.055) 8.181 14.710 ( -7.224 -7.006 -6.107) 11.771 17.861 ( 6.527 -6.293 26.423) 27.936 18.499 ( 8.874 -4.407 -21.333) 23.522 19.579 ( -8.852 4.654 -17.561) 20.209 19.971 ( -3.965 -2.331 -4.912) 6.729 21.198 ( 32.659 0.760 1.620) 32.708 22.012 ( -18.562 -1.923 5.970) 19.593 24.336 ( -0.912 4.725 -2.625) 5.482 24.458 ( -9.479 -1.701 -3.134) 10.128 ======================= Grid point 554 (276/432) ======================= q-point: (-0.36 0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( 0.189 3.731 7.922) 8.758 2.573 ( -2.099 10.386 10.564) 14.962 2.856 ( 0.395 -1.659 -0.129) 1.710 3.111 ( -0.844 -1.295 -1.516) 2.165 3.284 ( -3.568 -9.397 -4.597) 11.053 3.419 ( -1.665 -3.383 6.315) 7.355 4.054 ( 0.844 0.219 -2.183) 2.351 4.112 ( 10.182 2.954 -10.004) 14.577 4.851 ( -0.240 4.314 13.840) 14.499 5.259 ( 1.155 -7.511 3.486) 8.361 5.490 ( -1.994 3.362 9.545) 10.315 5.954 ( 2.118 -2.668 -0.954) 3.538 6.631 ( -3.615 -6.665 14.730) 16.567 6.982 ( -2.425 -10.644 11.302) 15.714 7.665 ( -7.353 -0.649 4.804) 8.808 7.999 ( 3.602 -8.393 -0.019) 9.134 9.220 ( -25.774 -1.326 23.578) 34.957 9.310 ( -10.501 -0.118 17.740) 20.616 9.705 ( 6.545 -9.132 10.288) 15.234 10.759 ( 13.043 4.007 10.707) 17.344 11.483 ( -0.574 21.801 -14.306) 26.082 11.832 ( 6.890 0.931 -16.202) 17.631 12.296 ( -15.040 2.918 -4.192) 15.883 12.696 ( 8.419 19.625 -14.902) 26.040 13.506 ( -5.141 -0.511 11.042) 12.191 14.107 ( 11.927 2.266 8.195) 14.647 14.335 ( -3.419 0.230 -2.881) 4.477 14.587 ( -6.637 -10.918 -11.063) 16.901 18.217 ( 8.837 -2.323 7.949) 12.111 18.486 ( 4.845 -9.208 -6.751) 12.404 19.247 ( -6.603 0.655 -15.964) 17.288 19.887 ( -1.314 -0.721 -5.720) 5.913 21.626 ( 24.698 3.864 5.174) 25.528 21.833 ( -13.218 -1.894 1.041) 13.394 24.240 ( -6.849 1.215 -3.333) 7.713 24.320 ( -3.197 2.399 -2.605) 4.771 ======================= Grid point 555 (277/432) ======================= q-point: (-0.27 0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 4.599 4.389 8.165) 10.348 2.614 ( 2.083 4.064 8.756) 9.875 2.928 ( 5.225 1.257 4.347) 6.912 3.063 ( -0.930 -1.295 -5.157) 5.398 3.251 ( -1.486 -7.859 -7.589) 11.025 3.450 ( -11.144 -5.773 6.323) 14.054 4.031 ( 5.715 0.925 -4.385) 7.263 4.157 ( 13.799 5.588 -8.769) 17.279 4.959 ( -1.028 3.138 12.159) 12.599 5.319 ( -2.496 -4.090 -0.060) 4.792 5.513 ( -5.907 3.055 8.483) 10.779 5.988 ( -1.017 -3.638 0.663) 3.836 6.789 ( -3.856 -6.635 8.603) 11.529 7.072 ( -7.154 -9.048 2.287) 11.759 7.818 ( 3.763 -7.669 21.231) 22.885 8.117 ( 3.588 -8.926 -1.632) 9.758 9.180 ( -21.631 -2.239 22.252) 31.114 9.406 ( -10.655 -4.118 21.089) 23.984 9.960 ( 5.066 -7.034 7.698) 11.593 10.940 ( 4.954 10.107 6.086) 12.796 11.172 ( -2.953 15.680 -8.788) 18.216 11.749 ( 9.868 1.890 -13.348) 16.706 12.005 ( -12.525 5.781 -5.998) 15.042 12.490 ( 11.390 19.113 -13.440) 25.993 13.576 ( -4.859 -2.302 10.458) 11.759 14.187 ( -8.226 2.824 0.826) 8.736 14.300 ( 4.534 6.079 1.742) 7.781 14.536 ( 3.358 -12.185 -7.850) 14.878 18.353 ( 8.496 -0.467 -4.192) 9.486 18.440 ( -6.519 -1.988 -11.529) 13.392 19.155 ( 1.944 -8.095 -0.058) 8.326 19.830 ( 3.678 0.334 -6.635) 7.594 21.511 ( -21.553 2.065 -0.451) 21.656 22.104 ( 28.857 2.854 5.203) 29.461 24.073 ( -9.299 2.132 -2.670) 9.907 24.284 ( 1.985 0.618 -1.489) 2.557 ======================= Grid point 556 (278/432) ======================= q-point: (-0.18 0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( 0.353 2.369 7.690) 8.054 2.766 ( 10.136 2.249 6.774) 12.397 2.990 ( -2.146 -0.742 2.484) 3.366 3.054 ( 6.564 0.102 -3.835) 7.603 3.231 ( 3.321 -3.633 -6.661) 8.282 3.384 ( -13.874 -6.608 5.181) 16.217 4.066 ( 9.684 0.582 -9.027) 13.252 4.170 ( 10.476 9.353 -4.746) 14.824 5.044 ( -2.159 0.651 8.973) 9.252 5.263 ( -6.696 -2.152 -3.565) 7.886 5.480 ( -9.588 3.036 8.673) 13.280 5.999 ( -3.253 -3.874 0.516) 5.085 6.738 ( -12.149 -0.579 -1.795) 12.295 7.156 ( -2.351 -11.239 8.267) 14.148 8.169 ( 2.450 -5.818 -2.557) 6.811 8.284 ( 7.216 -13.470 22.745) 27.401 9.198 ( -16.766 -4.332 20.618) 26.925 9.582 ( -8.484 -9.610 21.684) 25.190 10.098 ( 0.860 1.210 4.054) 4.317 10.814 ( -13.819 16.532 -3.251) 21.791 10.929 ( 1.346 4.638 -7.540) 8.954 11.679 ( -7.802 9.411 -4.535) 13.038 11.877 ( 17.082 0.388 -8.787) 19.214 12.429 ( 17.360 12.501 -5.147) 22.003 13.646 ( -5.232 -2.010 9.971) 11.438 14.035 ( -9.999 0.671 -1.295) 10.105 14.271 ( -0.330 2.506 -3.418) 4.251 14.661 ( 10.188 -1.483 -0.131) 10.297 18.048 ( -16.765 0.347 -19.147) 25.451 18.527 ( 15.117 -0.302 -0.862) 15.145 19.264 ( -0.050 -3.815 3.062) 4.892 19.837 ( 6.967 -0.344 -5.188) 8.694 21.191 ( -19.975 -0.285 -4.330) 20.441 22.504 ( 25.052 5.576 8.380) 26.998 23.918 ( -6.385 2.387 -2.853) 7.389 24.317 ( 3.062 -1.694 0.538) 3.541 ======================= Grid point 557 (279/432) ======================= q-point: (-0.09 -0.64 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.419 ( -5.904 -1.270 5.939) 8.470 2.920 ( 5.699 0.624 2.986) 6.465 3.035 ( 3.151 0.665 -6.569) 7.316 3.093 ( 5.109 -0.900 5.146) 7.307 3.144 ( -6.209 -1.024 -3.924) 7.416 3.444 ( 4.922 -3.616 5.926) 8.510 4.027 ( 10.910 8.184 -14.025) 19.563 4.207 ( 5.406 3.539 1.748) 6.694 5.070 ( -7.595 -2.540 0.190) 8.011 5.109 ( -9.008 1.495 -0.922) 9.177 5.414 ( -10.535 2.366 7.210) 12.983 5.983 ( -3.392 -4.170 -1.069) 5.481 6.532 ( -15.464 -0.248 -1.194) 15.512 7.308 ( -0.468 -5.636 7.354) 9.277 8.170 ( -0.366 -7.266 -6.296) 9.621 8.733 ( 2.911 -9.950 22.156) 24.462 9.265 ( -14.192 -5.424 18.660) 24.063 9.790 ( -8.190 -11.450 13.126) 19.248 10.026 ( -7.732 14.122 4.174) 16.633 10.421 ( -11.460 13.377 -6.391) 18.738 10.924 ( 3.713 -13.854 -7.400) 16.139 11.452 ( -2.509 15.301 -0.659) 15.519 12.026 ( 19.901 -1.721 -12.193) 23.403 12.620 ( 20.375 5.088 5.555) 21.723 13.694 ( -6.104 -0.060 10.227) 11.910 13.905 ( -7.242 -0.666 -1.449) 7.415 14.196 ( -1.740 2.743 -3.236) 4.585 14.782 ( 10.422 5.173 -0.492) 11.646 17.593 ( -18.080 -0.144 -18.918) 26.169 18.754 ( 15.424 -0.494 4.436) 16.057 19.266 ( -0.423 3.502 -1.402) 3.796 19.860 ( 1.535 1.034 -1.890) 2.646 20.934 ( -11.334 -5.266 -7.373) 14.510 22.845 ( 17.349 8.437 11.828) 22.628 23.805 ( -1.485 0.536 -5.101) 5.339 24.401 ( 3.535 -2.799 2.973) 5.401 ======================= Grid point 563 (280/432) ======================= q-point: ( 0.45 -0.55 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( -6.010 0.000 5.265) 7.990 2.757 ( 2.698 -0.000 4.154) 4.954 2.895 ( -5.677 0.000 4.619) 7.319 2.923 ( -7.944 0.000 4.636) 9.197 3.271 ( -0.580 0.000 -1.556) 1.660 3.316 ( 2.133 -0.000 3.540) 4.133 3.953 ( 7.830 -0.000 -6.079) 9.913 4.292 ( -3.729 0.000 -7.369) 8.259 4.767 ( -0.009 0.000 14.004) 14.004 4.996 ( 3.431 -0.000 8.750) 9.398 5.435 ( 0.174 -0.000 11.887) 11.889 5.904 ( 4.189 -0.000 -3.791) 5.650 6.444 ( -6.281 0.000 16.023) 17.210 6.730 ( -6.851 0.000 13.387) 15.038 7.805 ( -13.465 0.000 -0.939) 13.497 7.820 ( 8.618 -0.000 -3.316) 9.234 9.228 ( -22.714 0.000 24.799) 33.629 9.351 ( -16.278 0.000 15.320) 22.353 9.359 ( 6.075 -0.000 10.012) 11.710 10.502 ( 13.397 -0.000 7.328) 15.271 11.939 ( 6.513 -0.000 -16.729) 17.952 12.075 ( 1.821 -0.000 -20.562) 20.643 12.502 ( -11.099 0.000 -0.816) 11.129 12.944 ( 3.995 -0.000 -4.706) 6.173 13.584 ( -9.090 0.000 10.749) 14.077 13.739 ( 20.037 -0.000 3.249) 20.299 14.390 ( 3.284 -0.000 -11.618) 12.073 14.656 ( -10.591 0.000 -0.594) 10.607 17.805 ( 5.821 -0.000 28.661) 29.246 18.463 ( 8.916 -0.000 -22.338) 24.051 19.622 ( -10.665 0.000 -18.935) 21.732 19.948 ( -3.050 0.000 -3.863) 4.922 21.203 ( 34.082 -0.000 0.701) 34.089 21.999 ( -17.214 0.000 6.287) 18.326 24.402 ( -2.295 0.000 -1.628) 2.814 24.418 ( -8.692 0.000 -3.786) 9.481 ======================= Grid point 565 (281/432) ======================= q-point: (-0.45 0.45 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 2.407 1.811 5.709) 6.455 2.729 ( -2.440 5.955 0.893) 6.497 2.859 ( -0.083 3.749 4.087) 5.547 3.017 ( 0.677 -9.383 3.239) 9.950 3.206 ( -6.475 -0.244 -1.932) 6.762 3.368 ( -4.139 -2.103 5.794) 7.425 4.054 ( 12.633 -0.056 -3.109) 13.010 4.144 ( 1.203 0.919 -11.371) 11.471 4.913 ( -0.507 2.557 13.496) 13.745 5.144 ( 2.005 -4.672 5.816) 7.725 5.540 ( -2.600 1.907 10.780) 11.252 5.919 ( 1.782 -1.315 -1.575) 2.718 6.546 ( -5.883 -2.806 14.661) 16.044 6.852 ( -1.112 -4.140 11.559) 12.328 7.657 ( -10.034 -0.262 4.261) 10.904 7.913 ( 9.868 -2.257 -3.790) 10.809 9.184 ( -29.283 -1.555 28.112) 40.623 9.335 ( -11.982 1.451 15.538) 19.675 9.598 ( 8.473 -3.392 11.275) 14.506 10.797 ( 15.546 0.923 10.480) 18.772 11.738 ( -7.341 7.479 -22.074) 24.435 11.842 ( 7.700 0.298 -16.726) 18.416 12.380 ( -6.021 5.254 -0.761) 8.027 12.873 ( 0.054 2.265 -9.972) 10.226 13.563 ( -6.709 5.949 10.360) 13.702 14.062 ( 18.201 -5.796 0.725) 19.116 14.327 ( 1.305 -0.284 -3.547) 3.790 14.484 ( -13.882 -1.860 -2.363) 14.204 18.184 ( 5.923 -1.215 20.278) 21.160 18.381 ( 9.653 -3.130 -14.419) 17.632 19.257 ( -10.551 0.386 -18.300) 21.127 19.875 ( -0.482 -0.450 -5.081) 5.124 21.668 ( 33.017 1.134 2.715) 33.148 21.821 ( -16.563 0.011 1.603) 16.641 24.253 ( -9.008 0.389 -3.568) 9.697 24.345 ( -2.531 0.722 -2.088) 3.360 ======================= Grid point 566 (282/432) ======================= q-point: (-0.36 0.45 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.364 ( 9.604 4.537 5.669) 12.041 2.679 ( -0.849 3.727 3.435) 5.139 2.939 ( 6.864 -0.689 3.875) 7.912 3.074 ( -3.847 2.220 -1.591) 4.718 3.119 ( -2.015 -6.520 -1.271) 6.942 3.357 ( -11.875 -4.951 5.475) 13.982 4.040 ( 6.002 0.337 -9.683) 11.397 4.216 ( 15.020 1.594 -4.982) 15.905 5.008 ( -2.421 2.589 10.513) 11.094 5.231 ( -1.785 -5.109 1.314) 5.569 5.578 ( -5.622 3.655 9.567) 11.683 5.935 ( -1.281 -2.606 0.711) 2.990 6.673 ( -3.873 -6.003 11.978) 13.947 6.937 ( -5.628 -6.184 0.837) 8.403 7.720 ( 1.402 -3.773 16.565) 17.047 8.025 ( 10.557 -2.786 -4.670) 11.876 9.137 ( -27.187 -2.351 26.836) 38.273 9.366 ( -13.208 -0.990 19.961) 23.956 9.869 ( 8.702 -3.658 10.373) 14.025 11.067 ( 8.168 5.134 7.761) 12.382 11.330 ( -9.596 3.862 -18.579) 21.264 11.772 ( 10.945 0.815 -14.671) 18.322 12.199 ( -6.540 14.997 -0.908) 16.387 12.720 ( 4.334 6.434 -13.618) 15.672 13.560 ( -6.775 1.748 10.582) 12.686 14.198 ( -3.337 -3.687 -2.903) 5.758 14.289 ( -9.574 -5.736 -6.916) 13.130 14.447 ( 13.651 2.619 7.495) 15.791 18.351 ( 3.214 0.264 -1.514) 3.563 18.406 ( 2.072 -1.956 -7.586) 8.103 19.043 ( -0.413 -4.713 -2.297) 5.259 19.831 ( 3.466 -0.084 -6.284) 7.178 21.554 ( -18.771 2.501 -3.361) 19.233 22.140 ( 32.036 1.478 4.213) 32.346 24.095 ( -8.945 0.698 -2.354) 9.276 24.294 ( -1.093 0.464 -1.354) 1.801 ======================= Grid point 567 (283/432) ======================= q-point: (-0.27 -0.55 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 0.414 6.459 5.516) 8.504 2.784 ( 10.567 -0.528 5.989) 12.158 2.982 ( -1.782 0.578 -3.259) 3.759 3.097 ( 3.074 3.664 2.554) 5.422 3.132 ( 4.686 -7.524 -1.475) 8.986 3.285 ( -11.877 -4.739 4.480) 13.550 4.047 ( 9.626 -2.076 -9.742) 13.852 4.302 ( 11.456 5.867 -5.660) 14.060 5.047 ( -5.091 -0.086 6.985) 8.643 5.211 ( -6.128 -3.572 -1.664) 7.285 5.551 ( -8.344 4.685 8.376) 12.717 5.940 ( -3.705 -3.067 1.608) 5.071 6.718 ( -9.930 -1.489 -0.251) 10.044 6.946 ( -3.050 -12.327 6.336) 14.191 8.082 ( 10.133 -8.828 13.558) 19.090 8.117 ( 9.775 -1.935 -0.163) 9.966 9.126 ( -22.235 -3.951 24.237) 33.128 9.460 ( -13.674 -5.020 23.258) 27.443 10.103 ( 7.248 -0.175 8.405) 11.100 10.910 ( -11.125 -0.292 -15.086) 18.747 11.090 ( -9.383 9.948 -4.588) 14.424 11.836 ( 16.971 2.743 -6.276) 18.301 11.980 ( -2.420 16.669 -1.229) 16.889 12.619 ( 11.436 8.336 -9.127) 16.839 13.587 ( -8.381 -3.218 10.309) 13.670 14.061 ( -10.139 1.921 -0.335) 10.325 14.216 ( -2.892 -8.022 -6.021) 10.439 14.690 ( 14.513 3.845 5.783) 16.089 18.056 ( -16.587 0.523 -19.122) 25.319 18.523 ( 14.229 -0.252 -0.078) 14.232 19.192 ( 4.405 -4.247 8.206) 10.236 19.831 ( 7.094 -0.300 -6.213) 9.435 21.214 ( -18.836 2.422 -8.149) 20.666 22.580 ( 28.835 3.384 5.871) 29.620 23.955 ( -7.418 1.989 -1.437) 7.814 24.287 ( 0.094 -1.763 0.694) 1.897 ======================= Grid point 568 (284/432) ======================= q-point: (-0.18 -0.55 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( -9.175 2.248 7.281) 11.927 2.928 ( 1.917 1.051 -0.478) 2.238 3.004 ( -9.299 -7.052 1.153) 11.727 3.078 ( 13.736 3.510 1.687) 14.278 3.173 ( 1.171 1.273 -4.126) 4.474 3.385 ( 9.323 -2.745 7.352) 12.186 4.083 ( 11.196 -0.913 -11.245) 15.894 4.294 ( 3.791 6.285 -3.641) 8.194 5.013 ( -10.990 -3.535 0.636) 11.562 5.125 ( -5.698 -0.175 0.212) 5.704 5.476 ( -9.636 4.601 6.371) 12.434 5.922 ( -4.549 -3.049 0.367) 5.489 6.525 ( -15.027 -0.514 -2.419) 15.229 7.143 ( 1.533 -12.766 8.001) 15.144 8.119 ( 6.402 0.565 -9.222) 11.241 8.548 ( 10.092 -11.291 17.509) 23.150 9.167 ( -17.278 -5.839 21.083) 27.877 9.604 ( -12.534 -8.906 21.095) 26.104 10.216 ( 0.836 7.711 5.232) 9.356 10.617 ( -14.772 -1.098 -11.057) 18.485 10.767 ( -7.415 5.889 -9.464) 13.388 11.768 ( -2.551 20.853 3.694) 21.331 11.999 ( 18.072 -1.467 -12.878) 22.240 12.712 ( 17.579 5.153 1.051) 18.349 13.617 ( -11.561 -6.632 10.477) 16.953 13.945 ( -3.316 3.855 0.113) 5.086 14.179 ( -3.074 -4.785 -3.173) 6.513 14.884 ( 13.479 6.358 3.191) 15.241 17.591 ( -18.514 -0.112 -19.866) 27.155 18.745 ( 14.550 -0.482 4.915) 15.366 19.322 ( 3.668 2.978 3.472) 5.864 19.869 ( 5.162 0.005 -3.193) 6.069 20.874 ( -13.791 -1.808 -11.139) 17.819 22.967 ( 23.615 5.680 7.657) 25.467 23.831 ( -5.033 2.681 -2.612) 6.272 24.345 ( 1.158 -3.857 3.792) 5.531 ======================= Grid point 569 (285/432) ======================= q-point: (-0.09 -0.55 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( -14.007 -0.848 8.061) 16.183 2.829 ( -16.950 -4.323 -4.170) 17.983 2.965 ( 4.809 -0.997 -1.594) 5.164 3.147 ( 3.550 3.560 0.655) 5.070 3.309 ( 13.913 2.555 2.454) 14.357 3.618 ( 11.422 -0.292 6.173) 12.987 4.088 ( 13.361 5.593 -13.405) 19.736 4.247 ( -5.486 -1.792 2.642) 6.347 4.839 ( -14.660 -0.464 -2.339) 14.853 5.070 ( -4.314 1.017 0.502) 4.461 5.364 ( -9.659 3.890 2.629) 10.740 5.887 ( -3.412 -3.869 -2.016) 5.538 6.313 ( -15.853 -1.109 0.650) 15.905 7.341 ( 1.554 -7.578 6.685) 10.224 8.081 ( 5.263 -0.002 -9.540) 10.896 8.870 ( -1.409 -7.587 11.911) 14.192 9.221 ( -15.836 -5.599 16.724) 23.703 9.721 ( -9.850 -8.485 10.881) 16.953 10.073 ( -12.351 17.998 2.211) 21.940 10.290 ( -9.153 3.144 -5.527) 11.145 10.747 ( 5.433 -13.816 -3.371) 15.224 11.633 ( 0.487 16.642 3.604) 17.035 12.087 ( 17.298 -4.033 -15.822) 23.787 12.951 ( 15.558 1.909 3.946) 16.164 13.631 ( -14.331 -7.883 11.451) 19.967 13.910 ( 2.932 6.016 1.446) 6.847 14.145 ( -1.800 -1.047 -1.262) 2.435 15.002 ( 12.612 10.147 -0.870) 16.210 17.157 ( -18.325 -1.202 -13.158) 22.592 19.016 ( 14.147 -1.079 7.875) 16.227 19.320 ( 3.712 9.044 -2.948) 10.211 19.860 ( -1.599 2.308 -0.484) 2.850 20.673 ( -3.302 -8.196 -11.489) 14.494 23.254 ( 11.700 11.003 11.468) 19.736 23.731 ( 1.611 -1.027 -7.571) 7.808 24.464 ( 2.233 -4.135 6.842) 8.300 ======================= Grid point 576 (286/432) ======================= q-point: (-0.45 0.55 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( 12.405 -0.000 5.378) 13.521 2.722 ( -0.270 0.000 -1.851) 1.870 2.915 ( -0.112 0.000 4.463) 4.465 3.061 ( -0.312 0.000 0.056) 0.317 3.107 ( -0.292 0.000 2.211) 2.230 3.307 ( -13.469 0.000 5.718) 14.633 4.044 ( 5.655 -0.000 -12.499) 13.719 4.226 ( 15.276 -0.000 -2.626) 15.500 5.035 ( -2.730 0.000 9.419) 9.807 5.180 ( -1.223 0.000 2.219) 2.534 5.612 ( -5.646 0.000 10.001) 11.485 5.910 ( -1.311 0.000 0.638) 1.458 6.619 ( -4.109 0.000 12.526) 13.183 6.883 ( -4.774 0.000 0.886) 4.855 7.690 ( 0.636 -0.000 14.593) 14.607 8.004 ( 12.699 -0.000 -5.484) 13.832 9.116 ( -28.890 0.000 28.701) 40.723 9.360 ( -14.422 0.000 19.255) 24.057 9.838 ( 9.962 -0.000 11.325) 15.084 11.111 ( 11.082 -0.000 9.351) 14.500 11.353 ( -14.248 0.000 -22.394) 26.542 11.778 ( 11.276 -0.000 -15.037) 18.796 12.368 ( -1.280 0.000 -0.666) 1.443 12.739 ( -1.483 0.000 -10.870) 10.970 13.602 ( -7.649 0.000 9.031) 11.835 14.112 ( 4.124 -0.000 -8.848) 9.762 14.264 ( -15.093 0.000 -0.880) 15.118 14.478 ( 13.130 -0.000 8.213) 15.487 18.357 ( -5.388 0.000 1.200) 5.520 18.385 ( 12.318 -0.000 -7.322) 14.330 19.003 ( -1.827 0.000 -3.716) 4.141 19.830 ( 3.510 -0.000 -6.146) 7.078 21.578 ( -17.590 0.000 -4.441) 18.142 22.153 ( 33.125 -0.000 3.729) 33.334 24.101 ( -8.768 0.000 -2.082) 9.012 24.298 ( -2.287 0.000 -1.340) 2.650 ======================= Grid point 578 (287/432) ======================= q-point: (-0.36 -0.45 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( 2.033 8.853 3.816) 9.852 2.728 ( 5.097 -6.425 3.750) 9.018 3.002 ( 2.346 0.688 -0.784) 2.568 3.031 ( 7.073 -2.708 -1.004) 7.640 3.145 ( -10.524 1.315 3.135) 11.060 3.228 ( -0.198 -1.726 5.968) 6.216 4.015 ( 9.309 -1.299 -11.234) 14.647 4.363 ( 11.115 1.546 -4.121) 11.954 5.053 ( -6.210 0.728 4.824) 7.897 5.156 ( -4.928 -2.394 -0.607) 5.512 5.615 ( -7.950 2.353 8.055) 11.560 5.900 ( -4.051 -1.443 2.623) 5.037 6.707 ( -5.281 0.770 4.177) 6.777 6.779 ( -6.512 -6.801 1.439) 9.525 7.976 ( 11.608 -3.204 16.145) 20.142 8.108 ( 12.767 -0.038 -6.296) 14.235 9.077 ( -25.482 -1.601 26.702) 36.944 9.406 ( -16.073 -1.507 23.695) 28.672 10.100 ( 10.098 -0.091 10.695) 14.709 10.899 ( -16.175 -0.480 -21.030) 26.535 11.196 ( -5.079 2.917 -1.397) 6.021 11.848 ( 19.174 0.075 -9.008) 21.185 12.280 ( -3.139 14.241 1.390) 14.649 12.660 ( 6.040 -2.900 -8.803) 11.063 13.579 ( -9.317 1.646 8.591) 12.780 14.071 ( -2.018 -6.653 -5.126) 8.638 14.086 ( -10.232 0.802 0.494) 10.275 14.745 ( 14.379 1.957 7.135) 16.171 18.063 ( -16.570 0.245 -19.294) 25.434 18.520 ( 13.632 -0.097 0.355) 13.637 19.137 ( 7.013 -1.817 11.497) 13.589 19.827 ( 7.027 -0.118 -6.688) 9.702 21.251 ( -17.649 1.415 -10.843) 20.762 22.617 ( 31.014 1.060 3.968) 31.285 23.981 ( -7.496 0.896 0.462) 7.564 24.264 ( -2.145 -0.855 0.335) 2.333 ======================= Grid point 579 (288/432) ======================= q-point: (-0.27 -0.45 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( -12.814 4.894 7.219) 15.501 2.856 ( -14.297 -9.207 3.027) 17.272 2.975 ( 6.338 4.214 -2.570) 8.033 3.133 ( 12.970 -0.298 -1.799) 13.098 3.167 ( 6.112 0.550 2.230) 6.529 3.368 ( 10.355 0.541 6.397) 12.184 4.045 ( 10.858 -2.614 -10.230) 15.146 4.376 ( 1.348 2.962 -5.020) 5.983 4.974 ( -10.764 -0.672 1.410) 10.877 5.102 ( -4.045 -2.262 -0.910) 4.723 5.551 ( -9.229 3.740 5.383) 11.319 5.881 ( -5.389 -1.819 2.305) 6.137 6.519 ( -14.525 -0.140 -3.397) 14.917 6.934 ( 3.155 -10.468 7.168) 13.074 8.157 ( 10.886 3.175 -8.344) 14.079 8.379 ( 13.437 -8.214 12.789) 20.287 9.081 ( -20.314 -3.901 23.271) 31.135 9.497 ( -16.167 -3.984 25.138) 30.152 10.312 ( 4.797 4.310 5.347) 8.377 10.500 ( -12.043 -6.792 -14.651) 20.145 10.959 ( -12.221 9.600 -7.544) 17.275 11.978 ( 16.594 -0.839 -12.933) 21.055 12.115 ( -4.906 18.860 4.314) 19.959 12.753 ( 13.846 -1.345 -1.549) 13.998 13.542 ( -11.434 -1.009 10.116) 15.300 14.001 ( -2.521 2.295 1.366) 3.672 14.057 ( -3.897 -8.370 -1.696) 9.387 14.976 ( 13.849 4.021 4.940) 15.243 17.589 ( -18.847 -0.074 -20.750) 28.032 18.739 ( 14.040 -0.283 5.249) 14.992 19.361 ( 6.632 1.578 9.516) 11.705 19.864 ( 7.747 -0.459 -5.026) 9.246 20.866 ( -15.158 0.392 -15.883) 21.958 23.031 ( 27.766 2.071 2.600) 27.964 23.891 ( -6.222 3.957 2.680) 7.846 24.277 ( -1.522 -3.847 3.414) 5.364 ======================= Grid point 580 (289/432) ======================= q-point: (-0.18 -0.45 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( -17.508 1.483 9.596) 20.021 2.703 ( -20.147 -9.308 0.701) 22.204 2.996 ( 5.827 3.667 -3.912) 7.918 3.207 ( 4.310 2.464 1.189) 5.105 3.358 ( 16.071 3.512 0.986) 16.479 3.609 ( 14.862 -0.623 4.935) 15.673 4.113 ( 12.904 -1.627 -8.342) 15.451 4.248 ( -10.246 1.159 -2.715) 10.663 4.827 ( -13.624 -0.683 0.564) 13.653 5.070 ( -0.792 -0.618 -1.788) 2.051 5.437 ( -9.139 4.061 1.712) 10.147 5.839 ( -5.163 -1.919 -0.117) 5.509 6.295 ( -15.853 -0.929 -0.523) 15.889 7.161 ( 4.875 -11.919 5.900) 14.165 8.142 ( 8.970 6.078 -9.749) 14.575 8.716 ( 4.572 -9.833 9.450) 14.384 9.125 ( -15.048 -5.464 17.454) 23.684 9.592 ( -15.671 -5.571 20.005) 26.016 10.126 ( -7.904 -8.211 -13.758) 17.865 10.470 ( -11.139 14.948 6.499) 19.742 10.675 ( 3.159 2.925 -5.141) 6.705 11.928 ( -5.111 16.369 2.602) 17.345 12.030 ( 13.953 -1.530 -15.109) 20.623 12.963 ( 13.728 -1.279 1.531) 13.872 13.529 ( -12.251 -2.762 12.258) 17.549 13.996 ( 2.813 3.985 1.531) 5.112 14.071 ( -2.943 -7.278 0.555) 7.870 15.150 ( 13.866 7.037 1.430) 15.615 17.138 ( -18.829 -0.971 -13.876) 23.410 19.001 ( 13.963 -0.687 7.302) 15.772 19.473 ( 5.782 8.480 2.455) 10.553 19.890 ( 0.565 1.190 -1.401) 1.923 20.549 ( -5.244 -6.207 -17.056) 18.893 23.366 ( 22.806 2.034 0.736) 22.909 23.792 ( -5.971 8.427 2.397) 10.603 24.375 ( 0.282 -6.390 7.669) 9.986 ======================= Grid point 581 (290/432) ======================= q-point: (-0.09 -0.45 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -19.568 -1.902 10.682) 22.375 2.491 ( -20.353 -6.292 -3.492) 21.588 3.001 ( 4.164 0.183 -2.557) 4.889 3.269 ( 6.217 4.470 2.575) 8.078 3.489 ( 7.431 3.313 -0.196) 8.138 3.841 ( 7.334 1.982 6.089) 9.736 4.076 ( -8.029 -2.311 -1.408) 8.473 4.217 ( 11.640 0.883 -3.595) 12.215 4.649 ( -14.218 0.827 0.898) 14.271 5.042 ( 1.059 1.611 -2.842) 3.434 5.280 ( -8.621 4.077 -2.589) 9.882 5.786 ( -2.778 -3.272 -3.105) 5.298 6.127 ( -14.403 -1.903 4.855) 15.318 7.368 ( 2.908 -8.662 4.888) 10.362 8.090 ( 7.611 6.453 -8.931) 13.392 8.825 ( -8.961 -5.995 2.892) 11.162 9.127 ( -17.842 -3.878 12.774) 22.283 9.640 ( -8.814 -8.033 9.295) 15.120 10.025 ( -7.482 5.581 -4.411) 10.324 10.178 ( -5.719 2.903 0.843) 6.468 10.798 ( 8.114 -1.303 5.162) 9.705 11.759 ( -4.617 12.453 0.965) 13.317 12.068 ( 14.968 -5.657 -17.095) 23.415 13.107 ( 4.611 -1.374 -1.069) 4.929 13.542 ( -11.181 -3.388 12.413) 17.046 14.012 ( 2.137 3.921 -1.101) 4.599 14.127 ( 2.607 -4.321 2.608) 5.681 15.247 ( 13.961 11.404 -2.931) 18.263 16.839 ( -15.648 -1.313 1.040) 15.738 19.261 ( 12.161 -0.011 2.733) 12.464 19.422 ( 2.599 10.986 -1.750) 11.424 19.851 ( -0.491 0.983 -0.320) 1.145 20.461 ( 3.778 -10.147 -12.168) 16.288 23.580 ( -0.421 17.309 10.344) 20.168 23.671 ( 9.532 -4.581 -10.257) 14.733 24.549 ( 2.199 -5.550 10.099) 11.732 ======================= Grid point 589 (291/432) ======================= q-point: (-0.36 -0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( -15.059 0.000 6.655) 16.464 2.751 ( -14.205 0.000 4.148) 14.798 3.059 ( 10.302 -0.000 -8.470) 13.337 3.065 ( 6.064 -0.000 0.478) 6.083 3.191 ( 12.153 -0.000 7.210) 14.131 3.378 ( 9.865 -0.000 4.839) 10.988 4.019 ( 10.994 -0.000 -10.302) 15.066 4.398 ( -0.696 0.000 -4.237) 4.294 4.977 ( -10.345 0.000 0.938) 10.388 5.074 ( -2.825 0.000 -1.300) 3.109 5.585 ( -9.176 0.000 4.737) 10.327 5.865 ( -5.705 0.000 3.373) 6.627 6.519 ( -14.535 0.000 -4.149) 15.116 6.838 ( 3.864 -0.000 7.183) 8.156 8.197 ( 12.237 -0.000 -7.296) 14.247 8.297 ( 14.679 -0.000 10.333) 17.951 9.047 ( -21.837 0.000 24.325) 32.689 9.464 ( -17.218 0.000 26.376) 31.498 10.362 ( 10.352 -0.000 11.025) 15.123 10.428 ( -17.102 0.000 -21.174) 27.218 11.042 ( -11.179 0.000 -6.973) 13.176 11.971 ( 15.891 -0.000 -12.882) 20.457 12.311 ( -7.584 0.000 3.589) 8.391 12.707 ( 12.844 -0.000 -1.157) 12.896 13.555 ( -9.626 0.000 9.462) 13.498 13.961 ( -4.282 0.000 -1.470) 4.527 14.023 ( -2.652 0.000 2.114) 3.392 15.010 ( 13.741 -0.000 5.434) 14.777 17.588 ( -18.968 0.000 -21.110) 28.380 18.736 ( 13.885 -0.000 5.367) 14.886 19.374 ( 7.686 -0.000 12.325) 14.525 19.859 ( 8.578 -0.000 -6.006) 10.472 20.871 ( -15.456 0.000 -17.991) 23.718 23.047 ( 28.910 -0.000 0.362) 28.912 23.933 ( -5.627 0.000 5.963) 8.199 24.238 ( -3.148 0.000 2.421) 3.971 ======================= Grid point 590 (292/432) ======================= q-point: (-0.27 -0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( -18.625 4.201 9.067) 21.136 2.550 ( -22.674 -7.814 3.089) 24.181 3.061 ( 5.336 3.153 -5.706) 8.424 3.212 ( 7.958 -1.141 2.363) 8.379 3.422 ( 14.921 3.024 1.491) 15.297 3.599 ( 16.766 -0.466 2.874) 17.017 4.084 ( 13.828 -1.122 -7.423) 15.734 4.256 ( -14.765 -0.118 -0.885) 14.792 4.819 ( -13.271 -0.232 -0.351) 13.278 5.060 ( 2.517 -0.310 -2.343) 3.452 5.486 ( -9.193 1.554 0.597) 9.343 5.819 ( -6.111 -0.544 1.594) 6.339 6.285 ( -15.849 -0.316 -1.340) 15.909 7.001 ( 6.725 -5.564 4.787) 9.955 8.245 ( 10.523 4.772 -7.278) 13.655 8.572 ( 8.574 -5.960 5.183) 11.657 9.054 ( -16.880 -2.467 19.766) 26.109 9.535 ( -18.287 -1.484 24.331) 30.473 10.012 ( -11.152 -3.785 -18.311) 21.771 10.610 ( 6.957 2.640 12.690) 14.711 10.773 ( -10.038 5.347 -9.942) 15.106 11.984 ( 12.461 -0.887 -16.886) 21.005 12.183 ( -10.649 8.808 3.818) 14.337 12.910 ( 12.479 -3.384 1.395) 13.005 13.550 ( -7.833 3.500 11.805) 14.593 13.932 ( -4.650 -6.934 1.607) 8.502 14.044 ( 2.599 1.398 1.812) 3.463 15.231 ( 14.226 2.468 2.666) 14.682 17.127 ( -19.104 -0.374 -14.376) 23.912 18.993 ( 13.892 -0.231 6.981) 15.549 19.582 ( 6.363 3.755 9.244) 11.834 19.900 ( 3.577 0.143 -2.685) 4.475 20.475 ( -7.447 -2.369 -23.570) 24.831 23.366 ( 24.184 -0.637 -6.511) 25.053 23.954 ( -3.032 8.150 11.636) 14.526 24.260 ( -2.986 -6.075 6.063) 9.087 ======================= Grid point 591 (293/432) ======================= q-point: (-0.18 -0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( -22.838 -0.273 8.809) 24.480 2.367 ( -21.514 -7.322 2.012) 22.815 3.026 ( 1.481 2.051 -3.076) 3.983 3.328 ( 6.665 2.068 1.753) 7.195 3.544 ( 8.637 3.060 -2.266) 9.439 3.869 ( 16.367 1.375 4.151) 16.941 4.032 ( -20.326 -1.661 5.505) 21.124 4.239 ( 16.697 0.346 -4.493) 17.294 4.643 ( -13.105 -1.004 -0.261) 13.146 5.064 ( 3.240 1.209 -3.526) 4.939 5.333 ( -8.119 2.028 -4.760) 9.627 5.751 ( -4.874 -1.051 -1.425) 5.186 6.100 ( -14.792 -1.208 4.417) 15.484 7.202 ( 6.862 -9.030 3.148) 11.771 8.234 ( 9.261 9.496 -6.824) 14.916 8.701 ( -4.688 -8.156 1.220) 9.486 9.065 ( -15.245 -3.196 13.109) 20.359 9.520 ( -17.048 -5.478 13.451) 22.395 9.883 ( 2.288 -9.251 -5.365) 10.936 10.422 ( -14.340 13.749 -4.128) 20.290 10.834 ( 9.833 3.235 7.438) 12.747 11.940 ( 2.298 3.665 -9.477) 10.418 12.022 ( -0.136 3.721 -5.768) 6.865 13.065 ( 4.493 -2.787 -0.216) 5.292 13.542 ( -7.630 3.185 9.652) 12.709 13.972 ( -3.160 -8.733 0.709) 9.314 14.100 ( 5.231 1.846 1.504) 5.748 15.397 ( 15.075 6.145 -1.458) 16.344 16.820 ( -15.657 -0.874 2.205) 15.835 19.250 ( 13.562 -0.707 4.146) 14.199 19.627 ( -0.865 12.145 -0.333) 12.181 19.854 ( -3.610 -0.778 0.116) 3.695 20.293 ( 8.501 -9.142 -17.851) 21.783 23.561 ( 17.907 -4.124 -10.430) 21.129 23.921 ( -4.431 18.617 10.234) 21.702 24.420 ( 0.877 -10.015 10.771) 14.734 ======================= Grid point 592 (294/432) ======================= q-point: (-0.09 -0.36 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.041 ( -22.420 -5.379 10.508) 25.338 2.117 ( -23.413 -5.768 -2.270) 24.219 3.027 ( 2.102 -0.032 0.826) 2.258 3.394 ( 6.326 1.588 -1.889) 6.790 3.575 ( 2.113 3.170 0.581) 3.853 3.781 ( -26.097 2.531 11.467) 28.618 4.162 ( 13.657 -0.119 2.146) 13.825 4.359 ( 6.364 2.580 0.606) 6.893 4.519 ( -1.629 1.847 -1.810) 3.056 5.049 ( 2.806 1.640 -3.522) 4.792 5.138 ( -7.451 1.325 -7.975) 10.994 5.694 ( -0.593 -2.809 -4.043) 4.959 6.032 ( -10.685 -1.865 11.078) 15.504 7.378 ( 3.175 -8.189 2.131) 9.038 8.168 ( 5.671 10.877 -7.941) 14.613 8.646 ( -7.906 -5.147 -2.182) 9.683 8.996 ( -21.295 -2.052 15.162) 26.222 9.582 ( -4.970 -9.154 10.037) 14.465 9.925 ( -2.275 1.377 -6.407) 6.937 10.154 ( -3.249 0.705 0.432) 3.352 10.999 ( 7.108 4.894 7.563) 11.475 11.743 ( -9.806 9.619 -2.935) 14.046 12.012 ( 12.893 -5.716 -16.221) 21.495 13.063 ( -5.459 -1.507 -0.655) 5.701 13.523 ( -6.930 -1.659 5.235) 8.842 13.956 ( -3.652 -3.634 -5.347) 7.426 14.196 ( 5.789 -1.976 2.220) 6.507 15.486 ( 14.906 10.262 -5.673) 18.965 16.810 ( -6.688 1.384 22.007) 23.042 19.273 ( -1.224 4.384 -15.963) 16.600 19.592 ( 8.121 2.757 7.862) 11.634 19.888 ( 5.744 0.060 0.493) 5.765 20.332 ( 7.183 -8.235 -10.182) 14.936 23.642 ( 2.325 6.380 -6.240) 9.222 23.808 ( 2.572 10.872 3.440) 11.690 24.636 ( 1.591 -7.934 9.047) 12.138 ======================= Grid point 601 (295/432) ======================= q-point: (-0.27 -0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( -25.422 0.000 3.882) 25.717 2.291 ( -20.512 0.000 7.808) 21.948 3.047 ( -0.188 0.000 -2.942) 2.948 3.343 ( 7.447 -0.000 1.159) 7.536 3.574 ( 8.382 -0.000 -3.353) 9.028 3.879 ( 21.630 -0.000 1.958) 21.718 4.027 ( -24.295 0.000 8.545) 25.753 4.233 ( 15.660 -0.000 -2.056) 15.794 4.632 ( -11.226 0.000 -1.998) 11.402 5.076 ( 3.797 -0.000 -3.596) 5.229 5.349 ( -8.091 0.000 -5.760) 9.932 5.743 ( -5.651 0.000 -0.689) 5.693 6.090 ( -14.960 0.000 4.254) 15.553 7.119 ( 8.196 -0.000 2.261) 8.503 8.343 ( 10.048 -0.000 -3.354) 10.593 8.604 ( -2.171 0.000 -2.824) 3.562 9.035 ( -15.338 0.000 15.077) 21.508 9.471 ( -20.581 0.000 12.371) 24.013 9.805 ( 1.930 -0.000 -3.569) 4.057 10.541 ( -12.319 0.000 -7.836) 14.600 10.868 ( 9.227 -0.000 9.849) 13.497 11.939 ( 11.922 -0.000 -17.646) 21.296 12.089 ( -13.382 0.000 2.896) 13.691 13.040 ( 6.777 -0.000 0.479) 6.794 13.596 ( -6.465 0.000 6.054) 8.857 13.863 ( -5.407 0.000 3.881) 6.656 14.119 ( 5.389 -0.000 0.582) 5.420 15.449 ( 15.471 -0.000 -0.911) 15.498 16.812 ( -15.687 0.000 2.640) 15.907 19.243 ( 13.640 -0.000 4.014) 14.218 19.776 ( 4.239 -0.000 8.338) 9.354 19.819 ( -14.011 0.000 -3.122) 14.354 20.201 ( 13.525 -0.000 -24.202) 27.725 23.525 ( 17.794 -0.000 -11.143) 20.995 24.185 ( 3.714 -0.000 15.095) 15.545 24.231 ( -5.874 0.000 6.888) 9.053 ======================= Grid point 602 (296/432) ======================= q-point: (-0.18 -0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -24.292 -3.546 7.103) 25.557 2.050 ( -25.393 -1.946 1.351) 25.503 3.035 ( -1.433 0.560 4.455) 4.713 3.407 ( 6.725 0.221 -5.863) 8.925 3.614 ( 2.927 1.327 -0.702) 3.290 3.818 ( -27.492 1.297 15.001) 31.345 4.190 ( 19.356 3.089 3.523) 19.915 4.336 ( -4.565 -3.754 3.514) 6.876 4.567 ( 11.028 2.488 -5.458) 12.554 5.067 ( 0.636 0.439 -2.517) 2.633 5.146 ( -6.266 -0.025 -12.564) 14.040 5.666 ( -2.604 -0.719 -2.842) 3.921 6.010 ( -10.789 -0.697 11.537) 15.811 7.254 ( 6.840 -4.720 -0.065) 8.311 8.361 ( 2.166 11.219 -7.536) 13.687 8.535 ( -0.045 -8.157 -2.493) 8.530 8.971 ( -20.868 -0.747 15.919) 26.257 9.440 ( -7.704 -5.761 12.243) 15.570 9.850 ( 3.900 -3.612 -1.903) 5.647 10.271 ( -10.787 5.641 -7.446) 14.269 11.067 ( 6.605 2.453 8.222) 10.827 11.887 ( -3.020 5.349 -6.532) 8.966 11.944 ( 2.560 -2.296 -9.543) 10.143 13.071 ( -1.459 1.915 -0.838) 2.549 13.493 ( -9.514 -1.812 -3.741) 10.382 13.859 ( -5.646 -4.827 2.219) 7.752 14.194 ( 6.101 0.526 0.013) 6.123 15.604 ( 15.535 3.597 -5.820) 16.975 16.827 ( -5.146 0.548 25.127) 25.654 19.310 ( -0.546 0.634 -16.575) 16.596 19.657 ( 1.510 3.289 7.542) 8.365 19.892 ( 2.594 0.360 4.248) 4.990 20.214 ( 14.313 -4.669 -14.758) 21.082 23.625 ( 15.090 -1.735 -10.124) 18.254 24.122 ( -6.115 18.603 7.707) 21.044 24.454 ( 1.325 -13.040 8.296) 15.512 ======================= Grid point 603 (297/432) ======================= q-point: (-0.09 -0.27 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( -24.997 -4.526 2.735) 25.550 1.811 ( -20.867 -8.778 11.083) 25.206 3.098 ( 2.679 1.531 5.378) 6.201 3.418 ( 4.688 -1.670 -4.841) 6.942 3.577 ( -18.199 3.465 6.488) 19.629 3.614 ( -14.311 1.890 7.328) 16.189 4.215 ( -9.773 1.732 6.941) 12.112 4.530 ( 14.216 2.672 -2.924) 14.757 4.619 ( 11.644 5.135 -0.326) 12.730 4.932 ( -6.288 -3.254 -10.141) 12.368 5.064 ( 3.703 0.464 -1.938) 4.205 5.652 ( 4.597 -2.276 -3.201) 6.047 6.070 ( -5.917 -0.702 16.603) 17.640 7.360 ( 2.484 -6.469 -1.144) 7.023 8.132 ( -2.837 4.859 -14.606) 15.652 8.631 ( 2.605 5.070 7.643) 9.535 8.892 ( -20.799 -1.906 19.339) 28.464 9.594 ( -1.200 -8.213 12.242) 14.791 9.842 ( -1.392 3.327 -7.510) 8.331 10.088 ( -1.497 -5.409 -3.379) 6.551 11.184 ( 2.940 4.044 4.308) 6.600 11.595 ( -17.290 8.251 -6.068) 20.096 11.968 ( 13.771 -3.518 -14.084) 20.010 12.966 ( -8.810 2.115 0.534) 9.076 13.371 ( -8.881 -10.721 -4.514) 14.635 13.823 ( -6.149 -1.978 0.615) 6.489 14.274 ( 5.529 -0.749 0.138) 5.581 15.655 ( 13.340 7.103 -11.055) 18.725 17.188 ( 8.406 5.526 35.295) 36.701 19.032 ( -2.633 -1.090 -21.449) 21.637 19.792 ( 4.116 5.372 4.593) 8.179 20.000 ( 8.803 -3.583 4.585) 10.553 20.262 ( 8.820 -4.564 -11.528) 15.216 23.687 ( 6.072 7.884 -6.355) 11.808 23.932 ( -4.304 14.769 1.847) 15.494 24.612 ( -3.358 -13.017 2.056) 13.599 ======================= Grid point 613 (298/432) ======================= q-point: (-0.18 -0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( -26.639 0.000 3.031) 26.811 1.727 ( -21.968 0.000 10.550) 24.369 3.116 ( 0.322 -0.000 10.036) 10.041 3.402 ( 8.065 -0.000 -10.585) 13.307 3.609 ( -3.842 0.000 -1.596) 4.161 3.630 ( -32.153 0.000 18.701) 37.196 4.227 ( -10.164 0.000 7.118) 12.409 4.548 ( 21.165 -0.000 3.530) 21.457 4.686 ( 11.163 -0.000 -7.811) 13.625 4.886 ( -9.042 0.000 -11.059) 14.285 5.069 ( 3.683 -0.000 -2.688) 4.560 5.633 ( 3.755 -0.000 -2.467) 4.493 6.065 ( -5.698 0.000 17.236) 18.153 7.295 ( 4.806 -0.000 -3.028) 5.680 8.173 ( -5.789 0.000 -15.971) 16.987 8.691 ( 12.195 -0.000 8.884) 15.088 8.871 ( -24.598 0.000 20.160) 31.804 9.505 ( -1.906 0.000 14.185) 14.312 9.843 ( 3.038 -0.000 -5.213) 6.034 10.076 ( -7.874 0.000 -8.054) 11.264 11.207 ( 2.615 -0.000 3.911) 4.705 11.691 ( -20.219 0.000 -5.503) 20.954 11.938 ( 15.223 -0.000 -12.648) 19.792 13.031 ( -5.174 0.000 -1.564) 5.405 13.221 ( -14.197 0.000 -6.425) 15.583 13.805 ( -5.999 0.000 3.548) 6.970 14.271 ( 5.885 -0.000 -0.737) 5.931 15.716 ( 13.596 -0.000 -11.466) 17.786 17.238 ( 10.733 -0.000 36.842) 38.374 19.019 ( -4.453 0.000 -22.692) 23.124 19.875 ( 8.948 -0.000 11.045) 14.214 19.937 ( -1.718 0.000 1.776) 2.471 20.220 ( 14.423 -0.000 -14.531) 20.473 23.713 ( 15.015 -0.000 -8.556) 17.282 24.214 ( -9.364 0.000 8.847) 12.883 24.392 ( -4.723 0.000 -4.056) 6.226 ======================= Grid point 614 (299/432) ======================= q-point: (-0.09 -0.18 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -15.359 -3.348 14.587) 21.445 1.641 ( -16.739 -6.167 15.338) 23.526 3.225 ( 5.879 3.681 -0.985) 7.006 3.397 ( -32.758 3.110 22.651) 39.948 3.415 ( 4.852 -2.675 -3.756) 6.694 3.488 ( -7.111 -1.632 -5.224) 8.973 4.226 ( -5.471 1.388 10.257) 11.708 4.537 ( -1.890 8.023 -14.556) 16.727 4.702 ( -1.338 -6.466 -11.304) 13.091 4.889 ( 8.502 0.760 10.359) 13.423 5.146 ( 11.137 0.005 0.536) 11.150 5.719 ( 10.587 -0.845 -0.747) 10.647 6.239 ( -1.515 0.707 21.812) 21.876 7.309 ( 1.020 -3.845 -4.109) 5.719 7.940 ( -1.808 0.758 -15.071) 15.198 8.768 ( -22.354 5.494 22.834) 32.424 8.973 ( 7.190 2.271 15.784) 17.492 9.673 ( -2.309 -5.598 11.797) 13.261 9.790 ( 2.191 5.844 -6.204) 8.800 9.964 ( 1.344 -9.543 -5.163) 10.933 11.180 ( -18.973 10.001 -5.544) 22.152 11.301 ( -10.783 -6.253 -4.170) 13.144 12.004 ( 14.151 0.338 -11.461) 18.213 12.891 ( -8.726 4.668 1.039) 9.950 13.112 ( -9.065 -12.072 2.086) 15.240 13.763 ( -5.354 -0.103 2.240) 5.804 14.330 ( 4.412 -0.274 -1.216) 4.585 15.696 ( 9.767 3.512 -16.460) 19.459 17.845 ( 22.754 6.637 31.497) 39.419 18.746 ( 0.934 -3.796 -22.168) 22.510 19.848 ( -4.723 6.441 -3.145) 8.584 20.088 ( -1.168 -7.386 3.694) 8.341 20.309 ( 22.061 -0.014 -6.659) 23.044 23.767 ( 2.256 11.908 -6.799) 13.897 23.982 ( -6.546 14.899 -3.478) 16.641 24.353 ( -12.261 -21.092 -1.783) 24.462 ======================= Grid point 625 (300/432) ======================= q-point: (-0.09 -0.09 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -1.454 0.000 22.594) 22.641 1.637 ( -10.244 0.000 20.351) 22.783 3.133 ( -16.709 0.000 6.096) 17.786 3.277 ( -10.362 0.000 -4.869) 11.449 3.456 ( 12.645 -0.000 -9.538) 15.838 3.473 ( -3.851 0.000 19.319) 19.699 4.290 ( -4.888 0.000 9.034) 10.271 4.327 ( -8.290 0.000 -14.202) 16.444 4.530 ( -0.535 0.000 -10.616) 10.629 5.054 ( 0.643 -0.000 9.030) 9.053 5.360 ( 15.660 -0.000 2.252) 15.821 5.874 ( 11.873 -0.000 1.129) 11.926 6.532 ( 2.796 -0.000 27.130) 27.274 7.233 ( -1.414 0.000 -5.644) 5.818 7.784 ( -0.216 0.000 -9.967) 9.969 8.773 ( -24.955 0.000 31.068) 39.850 9.306 ( 10.830 -0.000 15.339) 18.777 9.606 ( -7.834 0.000 -1.913) 8.064 9.860 ( 2.753 -0.000 -3.452) 4.415 9.952 ( 6.435 -0.000 6.408) 9.082 10.783 ( -27.641 0.000 -1.285) 27.671 11.178 ( -2.567 0.000 -5.686) 6.239 12.029 ( 10.024 -0.000 -14.097) 17.298 12.797 ( -8.871 0.000 -0.279) 8.876 13.058 ( -4.408 0.000 11.769) 12.567 13.722 ( -3.223 0.000 0.959) 3.362 14.355 ( 2.246 -0.000 -1.933) 2.963 15.603 ( 5.497 -0.000 -19.861) 20.608 18.510 ( 4.683 -0.000 -21.122) 21.635 18.535 ( 30.523 -0.000 19.314) 36.121 19.706 ( -9.813 0.000 -9.589) 13.720 19.997 ( -5.156 0.000 -4.223) 6.665 20.613 ( 24.497 -0.000 3.258) 24.713 23.527 ( -34.012 0.000 -14.019) 36.788 23.981 ( 11.222 -0.000 -6.702) 13.071 24.124 ( -11.091 0.000 6.957) 13.092 ======================= Grid point 626 (301/432) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( -0.647 0.000 12.414) 12.431 2.484 ( 1.194 -0.000 16.513) 16.556 2.946 ( -0.814 0.000 0.236) 0.848 3.210 ( 7.634 -0.000 -8.494) 11.421 3.353 ( 8.417 -0.000 -8.051) 11.648 3.507 ( -7.037 0.000 -4.127) 8.158 3.800 ( -9.119 0.000 -6.876) 11.420 3.875 ( 0.398 -0.000 -1.953) 1.993 4.919 ( 4.770 -0.000 10.321) 11.370 5.276 ( -1.196 0.000 0.892) 1.492 5.687 ( -3.533 0.000 7.704) 8.475 6.136 ( 5.284 -0.000 -2.133) 5.698 6.990 ( -8.211 0.000 1.997) 8.450 7.342 ( 5.714 -0.000 -2.433) 6.211 8.465 ( 6.185 -0.000 33.065) 33.639 9.341 ( -17.559 0.000 16.357) 23.997 9.666 ( -11.318 0.000 12.946) 17.196 9.792 ( 3.401 -0.000 -10.231) 10.781 9.964 ( 6.528 -0.000 -1.295) 6.655 10.086 ( -11.181 0.000 24.511) 26.940 10.657 ( -5.352 0.000 -11.741) 12.903 11.329 ( 21.122 -0.000 16.280) 26.668 11.443 ( 12.023 -0.000 -18.959) 22.450 12.298 ( -17.079 0.000 -11.521) 20.602 13.518 ( -2.060 0.000 8.914) 9.149 13.738 ( 5.686 -0.000 -1.196) 5.811 14.304 ( -3.066 0.000 1.883) 3.598 14.859 ( 1.108 -0.000 -14.962) 15.003 18.108 ( 16.412 -0.000 -7.364) 17.988 18.587 ( -18.728 0.000 -18.948) 26.641 19.518 ( 17.592 -0.000 0.255) 17.594 19.594 ( -10.389 0.000 -2.864) 10.777 21.625 ( 26.476 -0.000 10.564) 28.505 22.168 ( -35.784 0.000 -5.229) 36.164 24.006 ( -10.580 0.000 1.460) 10.681 24.099 ( 12.290 -0.000 -3.155) 12.688 ======================= Grid point 627 (302/432) ======================= q-point: ( 0.09 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( 2.871 1.919 9.910) 10.494 2.635 ( 1.140 -1.812 6.310) 6.664 2.999 ( 4.322 0.619 3.983) 5.910 3.091 ( -2.341 1.856 -11.201) 11.593 3.353 ( 2.715 4.703 -2.977) 6.193 3.503 ( 4.126 -7.048 -3.221) 8.779 3.638 ( -6.928 -0.771 -3.018) 7.596 3.876 ( 4.543 -2.099 -2.862) 5.765 5.077 ( 2.785 -0.157 7.831) 8.313 5.247 ( -1.772 -0.769 -3.706) 4.180 5.694 ( -9.363 0.608 9.113) 13.080 6.135 ( 1.039 1.295 -3.989) 4.320 6.898 ( -11.450 -0.288 3.920) 12.106 7.349 ( 1.425 0.009 -3.364) 3.653 8.821 ( -3.053 8.286 25.767) 27.238 9.207 ( -11.476 20.709 8.645) 25.205 9.557 ( -10.510 -3.024 6.771) 12.863 9.761 ( -15.525 -18.095 4.882) 24.337 10.132 ( 12.739 0.401 3.287) 13.162 10.353 ( 5.230 -4.195 14.277) 15.773 10.428 ( -4.958 -1.873 -9.441) 10.827 11.438 ( 15.962 -0.288 -16.617) 23.043 11.825 ( 22.053 -0.835 15.572) 27.009 11.929 ( -9.681 2.879 -14.711) 17.845 13.582 ( -2.993 -3.628 5.671) 7.368 13.813 ( 5.219 -4.260 -2.045) 7.040 14.283 ( -4.954 1.193 4.263) 6.644 14.709 ( 0.565 1.686 -11.584) 11.720 18.127 ( -19.160 0.118 -17.288) 25.806 18.295 ( 17.959 -0.123 0.109) 17.960 19.420 ( -10.435 0.581 -2.481) 10.741 19.704 ( 11.810 0.343 -1.770) 11.947 21.660 ( -30.014 2.533 -4.785) 30.499 22.101 ( 24.692 -1.432 12.045) 27.511 23.893 ( -8.432 -1.205 -0.316) 8.524 24.226 ( 11.023 -0.248 -1.681) 11.153 ======================= Grid point 628 (303/432) ======================= q-point: ( 0.18 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -1.233 4.128 2.209) 4.841 2.764 ( 6.692 -5.226 3.378) 9.138 2.941 ( -2.094 -0.267 -6.623) 6.951 3.084 ( 3.958 2.021 -0.168) 4.448 3.315 ( -0.790 5.877 2.243) 6.340 3.546 ( 0.372 -5.435 -3.162) 6.299 3.586 ( 2.533 -1.524 -1.459) 3.297 3.997 ( 9.186 -5.636 1.096) 10.833 5.139 ( -4.039 -0.285 -4.407) 5.985 5.167 ( -3.164 -0.969 2.279) 4.018 5.637 ( -13.114 0.882 7.967) 15.370 6.065 ( -0.489 2.301 -5.801) 6.260 6.768 ( -15.232 0.816 4.484) 15.899 7.335 ( 1.073 -1.795 -2.381) 3.169 8.663 ( -14.064 21.874 -0.429) 26.008 9.131 ( -2.056 8.644 10.047) 13.413 9.577 ( -13.790 -13.176 9.630) 21.366 9.807 ( -11.271 -4.448 16.676) 20.613 10.152 ( -7.991 -4.219 -13.902) 16.581 10.317 ( 3.411 2.440 8.917) 9.854 10.765 ( 16.279 -7.950 10.778) 21.080 11.381 ( -0.679 2.622 -14.280) 14.535 11.688 ( 15.211 4.640 -17.822) 23.886 12.340 ( 23.890 -0.505 14.472) 27.936 13.637 ( -2.288 -6.414 3.445) 7.632 13.883 ( 1.922 -7.817 -3.734) 8.874 14.244 ( -7.238 3.440 6.345) 10.222 14.604 ( 2.515 -0.031 -8.105) 8.486 17.701 ( -19.004 0.043 -12.927) 22.984 18.577 ( 18.291 -0.160 6.665) 19.468 19.256 ( -8.815 -0.333 -3.528) 9.501 19.793 ( 5.443 0.369 -1.499) 5.658 21.232 ( -21.829 3.358 -5.935) 22.870 22.567 ( 21.184 -2.328 13.559) 25.259 23.793 ( -5.531 -0.857 -2.641) 6.189 24.354 ( 9.446 -0.200 0.141) 9.449 ======================= Grid point 629 (304/432) ======================= q-point: (-0.73 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.517 ( -5.034 -0.945 1.142) 5.248 2.788 ( -4.463 -5.258 -9.567) 11.794 3.000 ( 6.828 -0.521 4.357) 8.116 3.070 ( 2.696 2.758 -2.449) 4.568 3.294 ( 0.787 4.098 3.731) 5.598 3.577 ( 3.174 -4.669 -3.069) 6.426 3.687 ( 9.972 0.914 3.016) 10.458 4.190 ( 8.252 -5.772 2.607) 10.402 4.971 ( -9.959 -0.780 -6.231) 11.773 5.141 ( -8.110 -1.249 2.220) 8.501 5.516 ( -14.423 0.802 4.242) 15.055 5.960 ( 0.019 3.269 -7.666) 8.334 6.596 ( -16.646 2.073 5.138) 17.544 7.356 ( 1.687 -3.707 -1.688) 4.409 8.298 ( -7.738 17.099 -6.696) 19.927 9.112 ( -5.220 3.264 3.804) 7.237 9.586 ( -16.749 -10.109 8.817) 21.458 9.852 ( -9.071 -2.651 5.916) 11.149 9.996 ( -8.083 -2.493 3.349) 9.098 10.361 ( -6.195 1.042 4.570) 7.768 11.068 ( 12.963 12.325 -2.744) 18.096 11.253 ( 4.522 -7.156 2.692) 8.883 11.732 ( 24.388 2.528 -20.483) 31.949 12.761 ( 19.001 1.405 8.824) 20.997 13.720 ( 1.616 -6.815 1.125) 7.093 13.909 ( -1.888 -7.878 -0.937) 8.155 14.181 ( -8.869 4.546 7.278) 12.341 14.611 ( 5.934 -6.427 -5.441) 10.302 17.345 ( -18.434 0.542 -5.325) 19.196 18.914 ( 17.263 0.309 10.687) 20.306 19.120 ( -4.937 -2.177 -6.099) 8.143 19.820 ( -0.069 -1.242 -0.180) 1.257 20.893 ( -12.770 5.130 -7.439) 15.644 22.992 ( 14.543 -4.453 14.057) 20.711 23.699 ( -1.347 1.313 -5.636) 5.942 24.484 ( 7.630 -0.379 2.637) 8.082 ======================= Grid point 630 (305/432) ======================= q-point: (-0.64 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.492 ( -8.511 -5.602 4.420) 11.106 2.622 ( -10.361 -3.557 -8.249) 13.713 2.970 ( 0.945 1.856 -5.499) 5.880 3.184 ( 7.487 3.209 4.390) 9.253 3.379 ( 4.548 -0.857 5.361) 7.082 3.645 ( 6.069 -6.887 -3.687) 9.892 3.857 ( 13.912 4.532 1.928) 14.758 4.341 ( 2.864 -2.594 3.708) 5.355 4.780 ( -13.074 -1.329 -0.909) 13.172 5.039 ( -10.045 -2.932 -0.805) 10.495 5.349 ( -13.610 0.336 0.136) 13.615 5.839 ( 0.803 3.959 -9.287) 10.128 6.433 ( -15.030 2.593 7.304) 16.911 7.395 ( 1.758 -4.788 -1.870) 5.433 8.046 ( -1.306 9.634 -7.366) 12.197 9.024 ( -5.783 5.005 -0.613) 7.673 9.497 ( -21.156 -9.958 5.158) 23.944 9.794 ( -5.563 -5.380 -1.439) 7.872 9.991 ( -12.445 0.857 13.487) 18.372 10.290 ( -7.243 -0.395 2.338) 7.622 11.019 ( 12.228 20.019 -1.849) 23.531 11.499 ( 6.538 -7.960 5.340) 11.603 11.778 ( 23.138 4.252 -22.131) 32.299 13.000 ( 10.108 0.300 1.502) 10.223 13.740 ( -1.711 -3.923 -4.957) 6.549 14.040 ( 6.779 -6.071 5.591) 10.681 14.102 ( -10.542 5.133 9.425) 15.044 14.730 ( 8.147 -12.730 -4.766) 15.847 17.108 ( -16.444 0.535 6.205) 17.584 19.023 ( -0.294 -5.016 -10.738) 11.856 19.248 ( 14.959 1.648 11.230) 18.777 19.819 ( -2.485 -2.432 0.556) 3.521 20.639 ( -5.220 6.983 -7.465) 11.478 23.313 ( -0.606 -11.135 12.253) 16.568 23.624 ( 9.480 7.814 -8.120) 14.727 24.625 ( 5.920 -0.787 5.510) 8.125 ======================= Grid point 631 (306/432) ======================= q-point: (-0.55 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( -12.604 -2.819 -9.202) 15.858 2.486 ( -15.843 -0.235 12.266) 20.038 2.944 ( 5.698 -0.855 -5.812) 8.184 3.290 ( 6.668 4.186 3.484) 8.610 3.488 ( 0.937 -4.118 3.256) 5.332 3.754 ( 5.410 -9.560 -5.123) 12.121 4.017 ( 14.498 5.517 1.093) 15.551 4.369 ( -6.471 1.297 5.700) 8.720 4.657 ( -11.837 -3.096 4.708) 13.110 4.950 ( -3.386 -3.097 -2.326) 5.145 5.171 ( -10.498 -0.209 -2.476) 10.789 5.709 ( 1.746 3.866 -10.240) 11.084 6.335 ( -11.567 2.599 10.475) 15.821 7.439 ( 1.538 -4.921 -1.479) 5.364 7.919 ( 2.222 3.041 -7.892) 8.744 8.869 ( -5.908 9.029 -1.388) 10.879 9.342 ( -22.491 -11.830 3.685) 25.678 9.777 ( -1.829 -2.098 0.856) 2.912 9.938 ( -15.457 -0.429 11.168) 19.074 10.267 ( -2.739 0.216 4.286) 5.091 11.031 ( 11.133 15.041 2.278) 18.851 11.621 ( 1.313 -2.490 -1.195) 3.058 11.772 ( 19.723 5.080 -20.979) 29.239 13.083 ( 2.636 -1.035 -1.229) 3.087 13.681 ( -3.169 -2.161 -3.674) 5.311 14.012 ( -8.379 1.749 3.508) 9.250 14.231 ( 5.976 2.377 6.602) 9.217 14.922 ( 10.652 -15.285 -4.839) 19.248 17.070 ( -11.475 -1.606 19.690) 22.846 18.933 ( 2.690 -6.067 -17.236) 18.470 19.520 ( 11.769 2.312 8.390) 14.637 19.816 ( 0.043 -1.294 -0.400) 1.355 20.472 ( -1.085 6.736 -4.580) 8.217 23.391 ( -14.007 -15.681 2.195) 21.140 23.684 ( 17.767 10.317 -2.489) 20.695 24.769 ( 3.840 -0.355 6.829) 7.842 ======================= Grid point 632 (307/432) ======================= q-point: (-0.45 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.119 ( -13.534 2.279 -2.872) 14.022 2.382 ( -17.653 5.790 12.475) 22.378 2.987 ( 5.980 -1.451 -2.910) 6.807 3.359 ( 6.103 3.513 -0.735) 7.080 3.547 ( -1.217 -4.122 0.407) 4.317 3.798 ( -6.048 -10.620 -1.117) 12.273 4.103 ( -0.571 -1.735 -1.993) 2.704 4.426 ( 9.264 -0.430 6.552) 11.356 4.592 ( -11.056 0.316 8.245) 13.795 4.926 ( -0.839 -1.294 -4.370) 4.634 5.051 ( -2.976 0.970 0.194) 3.136 5.605 ( 4.701 2.974 -9.650) 11.138 6.326 ( -7.344 1.803 13.339) 15.334 7.476 ( 0.197 -2.062 0.144) 2.077 7.843 ( 3.281 -1.204 -11.844) 12.349 8.731 ( -6.338 5.611 4.685) 9.675 9.220 ( -17.069 -10.621 5.217) 20.769 9.785 ( 0.598 2.778 1.290) 3.121 9.873 ( -14.500 -1.890 12.252) 19.077 10.277 ( -0.721 4.304 3.430) 5.551 11.090 ( 3.823 3.881 3.054) 6.246 11.573 ( 1.890 3.207 -8.322) 9.117 11.744 ( 13.566 3.644 -16.110) 21.374 13.070 ( -3.019 0.315 -0.726) 3.121 13.604 ( -3.422 1.610 -3.103) 4.891 13.932 ( -7.999 0.911 3.615) 8.825 14.312 ( 3.416 4.741 3.224) 6.674 15.120 ( 11.374 -13.504 -8.791) 19.723 17.283 ( -3.393 -5.618 28.902) 29.638 18.785 ( 3.792 -3.200 -23.406) 23.927 19.697 ( 6.050 1.286 3.235) 6.980 19.855 ( 8.489 -0.260 -1.798) 8.681 20.383 ( -0.783 5.432 -0.635) 5.525 23.355 ( -11.514 -16.199 -0.851) 19.893 23.783 ( 11.017 6.242 -2.145) 12.843 24.858 ( -0.096 2.176 4.600) 5.089 ======================= Grid point 633 (308/432) ======================= q-point: (-0.36 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( -9.791 6.355 7.284) 13.759 2.230 ( -15.592 10.585 12.953) 22.868 3.045 ( 5.212 -0.734 -1.769) 5.553 3.374 ( 3.676 2.554 -3.493) 5.678 3.504 ( -5.091 -1.402 -5.156) 7.380 3.766 ( -16.048 -9.605 7.872) 20.292 4.079 ( -1.508 -11.580 -8.382) 14.375 4.495 ( -9.031 1.748 7.822) 12.075 4.747 ( 16.795 3.220 4.438) 17.667 4.816 ( -4.455 -1.171 -2.155) 5.085 5.088 ( 3.360 1.800 4.973) 6.266 5.586 ( 9.975 1.506 -6.823) 12.179 6.415 ( -2.857 -0.317 15.278) 15.546 7.469 ( -1.928 3.592 1.566) 4.368 7.741 ( 3.208 -1.165 -14.903) 15.289 8.755 ( -6.266 -7.637 12.721) 16.106 9.202 ( -8.845 -6.992 8.619) 14.192 9.743 ( -4.493 5.272 3.806) 7.904 9.915 ( -4.630 -1.721 13.481) 14.357 10.228 ( -1.246 11.076 1.074) 11.198 11.079 ( -10.998 -7.036 -1.145) 13.106 11.466 ( 5.638 8.109 -10.290) 14.262 11.726 ( 11.390 1.770 -11.009) 15.940 12.995 ( -6.345 1.593 0.317) 6.550 13.493 ( -4.406 6.890 -0.389) 8.188 13.870 ( -7.173 0.799 3.978) 8.241 14.337 ( 2.127 4.139 1.756) 4.974 15.230 ( 9.719 -10.560 -14.414) 20.341 17.691 ( 5.021 -9.250 27.510) 29.454 18.577 ( 6.323 1.403 -24.599) 25.437 19.720 ( -2.126 -2.188 -2.978) 4.264 20.004 ( 16.026 0.076 -4.156) 16.556 20.338 ( -0.498 5.689 3.475) 6.685 23.349 ( -12.422 -20.347 -0.152) 23.839 23.822 ( 8.169 4.865 -4.649) 10.583 24.810 ( -6.105 6.839 0.422) 9.177 ======================= Grid point 634 (309/432) ======================= q-point: (-0.27 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( -3.562 6.979 15.502) 17.370 2.122 ( -10.246 11.535 15.860) 22.126 3.092 ( 3.008 -1.474 -1.709) 3.760 3.322 ( -8.493 -3.169 -2.983) 9.543 3.360 ( 2.175 4.657 -9.304) 10.629 3.749 ( -12.865 -6.713 11.268) 18.373 4.038 ( -2.150 -12.395 -13.385) 18.369 4.480 ( -6.922 1.712 9.042) 11.516 4.600 ( -4.536 6.062 -7.465) 10.632 5.115 ( 15.559 -1.989 10.214) 18.718 5.179 ( 3.290 1.998 5.210) 6.477 5.687 ( 14.052 -0.472 -3.066) 14.390 6.606 ( 2.178 -4.175 15.833) 16.519 7.402 ( -2.214 8.747 0.754) 9.054 7.649 ( 3.056 -1.617 -8.399) 9.083 8.948 ( -8.064 -18.252 16.713) 26.029 9.288 ( -2.705 -5.417 9.651) 11.393 9.713 ( -0.509 6.958 7.376) 10.153 10.016 ( -11.811 4.969 14.603) 19.428 10.135 ( 8.391 9.475 1.478) 12.743 10.895 ( -22.319 -8.464 -2.291) 23.980 11.343 ( 6.078 11.272 -11.240) 17.040 11.747 ( 8.908 -0.943 -10.531) 13.826 12.892 ( -8.519 0.369 0.548) 8.545 13.395 ( -3.628 9.522 5.954) 11.802 13.810 ( -5.900 1.827 2.260) 6.577 14.344 ( 1.444 2.723 0.537) 3.129 15.230 ( 7.402 -7.716 -18.561) 21.421 18.074 ( 7.744 -8.517 1.097) 11.563 18.477 ( 14.455 2.147 -4.017) 15.156 19.621 ( -8.370 -5.043 -7.930) 12.585 20.064 ( 3.896 2.855 -8.375) 9.668 20.442 ( 14.276 3.884 7.782) 16.717 23.329 ( -20.604 -23.763 -0.561) 31.456 23.828 ( 10.783 5.541 -7.221) 14.111 24.604 ( -11.630 11.135 -1.152) 16.142 ======================= Grid point 635 (310/432) ======================= q-point: (-0.18 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( -0.451 3.449 17.010) 17.362 2.143 ( -4.341 8.672 19.414) 21.701 3.100 ( -1.911 -2.310 -0.625) 3.062 3.160 ( -8.207 -1.903 -5.402) 10.008 3.319 ( 9.591 4.073 -7.405) 12.783 3.784 ( -6.385 -3.250 8.094) 10.810 3.927 ( -5.370 -9.981 -13.142) 17.354 4.309 ( -9.556 5.106 -8.706) 13.899 4.592 ( 1.161 2.867 10.538) 10.982 5.243 ( -0.378 1.924 5.698) 6.026 5.415 ( 11.607 -1.913 7.042) 13.710 5.868 ( 14.097 -1.657 -0.735) 14.213 6.880 ( 5.974 -8.520 11.256) 15.329 7.295 ( -0.901 10.547 -0.485) 10.597 7.705 ( 4.614 -2.564 7.885) 9.489 9.195 ( -11.712 -21.389 19.544) 31.252 9.399 ( -2.030 -6.305 5.501) 8.610 9.775 ( 8.683 14.336 3.365) 17.095 9.889 ( -13.088 6.059 14.952) 20.774 10.311 ( 7.752 8.713 11.506) 16.382 10.643 ( -21.852 -11.324 0.931) 24.629 11.178 ( 2.827 13.462 -9.518) 16.728 11.697 ( 5.314 -1.086 -16.740) 17.597 12.776 ( -11.094 -2.106 -0.164) 11.293 13.382 ( -1.708 7.915 10.546) 13.296 13.740 ( -2.615 3.065 -0.229) 4.035 14.340 ( 0.211 1.395 -0.150) 1.419 15.145 ( 5.063 -5.064 -19.849) 21.101 18.066 ( 9.984 -1.290 -18.864) 21.382 18.818 ( 20.403 -3.025 10.924) 23.340 19.398 ( -13.849 -5.303 -13.396) 19.985 19.936 ( -4.069 4.038 -6.480) 8.652 20.762 ( 22.940 2.000 7.841) 24.325 23.131 ( -31.923 -17.065 -4.646) 36.495 23.874 ( 13.987 3.617 -6.501) 15.843 24.343 ( -13.084 9.544 1.239) 16.242 ======================= Grid point 636 (311/432) ======================= q-point: (-0.09 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -0.359 0.082 14.978) 14.982 2.275 ( -1.482 3.844 20.350) 20.763 3.009 ( -6.173 -1.042 -3.131) 7.000 3.141 ( 5.690 -1.682 -1.768) 6.191 3.341 ( 10.857 3.358 -8.297) 14.071 3.702 ( -9.021 -4.105 -10.080) 14.137 3.868 ( -2.085 -3.041 1.502) 3.981 4.038 ( -9.476 4.792 -8.423) 13.554 4.738 ( 3.919 0.986 11.346) 12.044 5.270 ( -1.467 1.056 3.790) 4.199 5.604 ( 3.761 -0.939 6.489) 7.558 6.041 ( 10.530 -1.282 -0.690) 10.630 7.052 ( -3.139 -4.396 1.127) 5.518 7.259 ( 7.510 4.523 1.221) 8.852 8.006 ( 7.252 -3.211 25.877) 27.065 9.368 ( -17.834 -10.536 15.365) 25.791 9.514 ( -3.524 -13.042 11.932) 18.025 9.743 ( 9.637 10.258 -1.217) 14.127 9.970 ( -3.566 3.460 14.347) 15.183 10.197 ( -17.578 16.034 7.770) 25.029 10.732 ( 1.011 -17.543 0.296) 17.574 11.032 ( 7.790 15.756 2.228) 17.717 11.554 ( 6.173 -0.312 -20.644) 21.549 12.600 ( -15.359 -2.445 -4.938) 16.317 13.440 ( -1.199 4.138 11.148) 11.952 13.705 ( 2.660 2.676 -1.175) 3.951 14.324 ( -1.444 0.324 0.195) 1.492 15.011 ( 2.880 -2.524 -18.170) 18.569 18.033 ( 13.682 -0.146 -14.475) 19.918 19.022 ( -14.284 -0.257 -15.784) 21.289 19.231 ( 17.641 -4.536 3.035) 18.466 19.767 ( -7.940 2.403 -4.254) 9.323 21.170 ( 25.931 0.874 8.975) 27.454 22.698 ( -37.008 -5.875 -6.174) 37.977 23.976 ( 13.449 0.979 -4.626) 14.255 24.145 ( -11.994 3.724 2.454) 12.796 ======================= Grid point 638 (312/432) ======================= q-point: ( 0.09 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( -2.147 0.000 -1.657) 2.712 2.681 ( 5.853 -0.000 5.189) 7.822 2.935 ( -3.120 0.000 -6.042) 6.800 3.108 ( 6.332 -0.000 0.493) 6.352 3.403 ( -1.091 0.000 -8.894) 8.960 3.451 ( 3.639 -0.000 4.394) 5.705 3.584 ( -0.503 0.000 3.668) 3.702 3.939 ( 8.765 -0.000 -0.057) 8.765 5.138 ( -4.728 0.000 -7.434) 8.810 5.158 ( -1.769 0.000 4.793) 5.109 5.645 ( -13.458 0.000 8.277) 15.799 6.085 ( -0.245 0.000 -6.009) 6.014 6.776 ( -14.852 0.000 5.187) 15.732 7.317 ( 0.141 -0.000 -3.032) 3.035 8.959 ( -15.430 0.000 16.520) 22.605 9.103 ( -17.017 0.000 -20.074) 26.317 9.437 ( -6.499 0.000 20.585) 21.587 9.795 ( -9.521 0.000 25.737) 27.441 10.101 ( -6.118 0.000 -16.879) 17.954 10.350 ( 11.835 -0.000 -3.872) 12.453 10.688 ( 11.658 -0.000 19.565) 22.775 11.407 ( 5.778 -0.000 -15.213) 16.273 11.738 ( 12.092 -0.000 -18.221) 21.869 12.337 ( 23.949 -0.000 16.883) 29.302 13.578 ( -2.124 0.000 3.290) 3.917 13.810 ( 2.313 -0.000 -4.370) 4.944 14.275 ( -7.232 0.000 7.060) 10.106 14.604 ( 0.867 -0.000 -9.350) 9.390 17.702 ( -18.895 0.000 -12.895) 22.876 18.576 ( 18.382 -0.000 6.715) 19.570 19.254 ( -9.580 0.000 -3.302) 10.133 19.796 ( 4.572 -0.000 -1.509) 4.814 21.262 ( -21.219 0.000 -6.764) 22.271 22.545 ( 19.598 -0.000 14.908) 24.624 23.787 ( -4.545 0.000 -2.326) 5.105 24.352 ( 9.927 -0.000 -0.457) 9.938 ======================= Grid point 639 (313/432) ======================= q-point: ( 0.18 0.09 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.530 ( -5.012 2.018 -4.890) 7.288 2.685 ( -5.399 -5.324 -7.059) 10.360 2.999 ( 9.706 0.092 4.789) 10.824 3.147 ( 3.470 5.316 -2.592) 6.857 3.291 ( -0.447 -4.086 -6.835) 7.976 3.547 ( 2.672 1.174 4.535) 5.393 3.706 ( 6.756 0.738 9.565) 11.734 4.089 ( 9.019 -4.503 1.425) 10.181 4.961 ( -8.671 -0.353 -7.604) 11.539 5.129 ( -8.954 -0.239 2.170) 9.217 5.530 ( -15.059 0.519 5.101) 15.908 6.003 ( 1.092 1.442 -8.141) 8.339 6.625 ( -16.662 1.136 6.132) 17.791 7.300 ( 0.673 -2.134 -2.380) 3.267 8.575 ( -13.859 14.099 -14.653) 24.608 8.998 ( -14.555 -12.238 8.608) 20.874 9.516 ( -11.444 0.651 13.030) 17.354 9.837 ( -8.137 -0.540 -8.545) 11.812 9.969 ( -10.690 -0.726 22.552) 24.967 10.373 ( 0.751 0.337 -7.337) 7.384 11.078 ( 15.567 -2.627 13.915) 21.044 11.330 ( 10.439 6.066 -9.469) 15.344 11.770 ( 24.336 1.614 -20.954) 32.155 12.790 ( 19.101 1.446 11.097) 22.138 13.632 ( 3.219 -2.936 3.973) 5.897 13.776 ( -1.281 -5.545 -5.757) 8.095 14.244 ( -10.421 2.248 9.607) 14.351 14.537 ( 2.567 -2.290 -7.545) 8.292 17.351 ( -18.111 0.185 -5.308) 18.874 18.915 ( 16.911 -0.059 10.356) 19.830 19.103 ( -6.068 -0.300 -4.240) 7.408 19.802 ( -1.616 -0.643 -0.376) 1.780 20.954 ( -11.218 1.912 -8.654) 14.296 22.930 ( 9.027 -2.215 16.376) 18.830 23.727 ( 2.826 1.246 -4.581) 5.525 24.476 ( 8.256 -0.395 0.822) 8.306 ======================= Grid point 640 (314/432) ======================= q-point: (-0.73 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.411 ( -5.564 -3.399 -4.174) 7.741 2.554 ( -8.281 -4.139 -5.752) 10.899 3.016 ( 0.633 3.738 -7.858) 8.725 3.229 ( 10.029 1.319 4.517) 11.078 3.321 ( 2.228 -5.599 0.303) 6.033 3.610 ( 1.782 2.594 4.689) 5.647 3.923 ( 11.767 2.943 8.065) 14.566 4.252 ( 4.622 -6.778 1.489) 8.338 4.771 ( -10.309 -0.113 -2.768) 10.675 4.988 ( -14.152 -2.292 -0.563) 14.348 5.364 ( -14.465 1.083 1.777) 14.614 5.905 ( 2.642 3.277 -10.211) 11.045 6.476 ( -15.327 2.243 8.042) 17.453 7.309 ( 0.405 -4.450 -2.413) 5.078 8.177 ( -8.378 5.316 -14.537) 17.601 9.011 ( -10.608 -5.148 9.664) 15.246 9.414 ( -17.354 0.983 4.042) 17.846 9.691 ( -6.615 -6.251 -3.965) 9.927 10.046 ( -12.205 3.653 18.055) 22.097 10.253 ( -7.077 -2.435 -3.883) 8.432 11.347 ( 18.385 16.104 -5.249) 24.998 11.427 ( 12.694 -1.510 9.097) 15.690 11.836 ( 24.979 2.533 -22.549) 33.747 13.022 ( 8.550 2.165 1.331) 8.920 13.666 ( -2.376 -4.152 -6.069) 7.728 13.900 ( 11.275 -8.637 4.267) 14.830 14.191 ( -12.591 4.350 14.400) 19.617 14.549 ( 4.661 -8.070 -6.259) 11.226 17.115 ( -16.616 0.286 5.261) 17.431 18.957 ( -2.614 -2.590 -8.969) 9.694 19.284 ( 15.466 2.011 12.844) 20.204 19.779 ( -2.817 -2.004 0.447) 3.486 20.728 ( -4.381 3.566 -9.529) 11.077 23.147 ( -7.719 -7.311 12.152) 16.146 23.761 ( 14.456 6.830 -3.240) 16.313 24.599 ( 6.263 -1.833 2.612) 7.029 ======================= Grid point 641 (315/432) ======================= q-point: (-0.64 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( -6.629 -3.956 -7.940) 11.075 2.461 ( -9.807 -2.452 7.230) 12.428 2.927 ( 3.644 -0.534 -8.879) 9.612 3.366 ( 3.038 -4.608 2.519) 6.067 3.402 ( 3.725 2.669 2.798) 5.369 3.665 ( 1.082 -0.684 2.256) 2.594 4.113 ( 10.927 5.474 3.668) 12.760 4.331 ( -4.040 -6.061 2.487) 7.697 4.635 ( -11.596 1.042 3.988) 12.307 4.858 ( -6.186 -6.859 -1.552) 9.366 5.188 ( -11.582 1.680 0.450) 11.712 5.786 ( 3.639 4.690 -11.751) 13.165 6.380 ( -11.933 2.605 10.640) 16.198 7.328 ( -0.352 -6.821 -2.472) 7.264 7.935 ( -4.055 -1.668 -11.690) 12.485 9.005 ( -7.865 6.130 8.247) 12.940 9.182 ( -19.610 -5.167 -0.063) 20.280 9.667 ( -5.340 -9.795 0.842) 11.188 9.989 ( -9.498 4.915 6.030) 12.277 10.200 ( -10.948 -5.132 8.876) 15.000 11.382 ( 18.592 22.514 -3.393) 29.395 11.634 ( 8.632 3.112 3.035) 9.665 11.859 ( 22.116 4.530 -23.071) 32.278 13.069 ( 2.106 -0.126 -1.811) 2.780 13.604 ( -3.084 -6.417 -5.314) 8.885 14.023 ( -4.777 -1.031 0.749) 4.944 14.274 ( 3.564 2.975 13.175) 13.969 14.666 ( 7.880 -14.216 -3.541) 16.635 17.048 ( -13.142 -1.069 17.645) 22.027 18.846 ( 0.963 -4.046 -14.023) 14.627 19.577 ( 12.609 3.852 9.657) 16.343 19.788 ( 1.188 -1.971 0.340) 2.327 20.557 ( -1.759 3.514 -8.220) 9.111 23.152 ( -16.072 -11.556 5.052) 20.430 23.880 ( 16.506 11.534 -0.615) 20.146 24.732 ( 4.057 -3.616 4.461) 7.032 ======================= Grid point 642 (316/432) ======================= q-point: (-0.55 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( -6.186 2.070 -3.132) 7.236 2.444 ( -13.181 1.778 13.453) 18.918 2.938 ( 7.752 -4.488 -6.479) 11.055 3.397 ( -2.774 -4.168 -2.117) 5.436 3.488 ( 3.606 2.633 5.612) 7.171 3.669 ( -3.421 -4.336 -1.711) 5.782 4.103 ( -10.457 0.703 -2.347) 10.741 4.416 ( 8.481 -0.298 5.930) 10.353 4.571 ( -8.325 -2.678 7.579) 11.572 4.868 ( -0.962 -4.831 -2.117) 5.362 5.080 ( -4.089 2.274 3.879) 6.078 5.671 ( 6.033 4.571 -11.879) 14.085 6.361 ( -7.924 2.203 12.685) 15.118 7.363 ( -1.700 -9.196 -1.070) 9.412 7.810 ( -1.056 -4.085 -9.565) 10.454 8.803 ( -19.086 2.381 0.928) 19.257 9.117 ( -4.663 -0.614 7.770) 9.082 9.715 ( -6.616 -11.647 4.946) 14.278 9.899 ( -6.300 5.426 4.994) 9.699 10.220 ( -11.162 -7.118 10.533) 16.917 11.359 ( 11.965 23.952 -3.295) 26.976 11.686 ( 9.968 9.275 -4.335) 14.289 11.825 ( 16.967 5.293 -20.459) 27.101 13.060 ( -1.863 -1.187 -0.937) 2.400 13.572 ( -2.078 -5.144 -3.549) 6.586 13.949 ( -9.427 0.768 4.724) 10.572 14.382 ( 3.369 3.263 3.015) 5.576 14.878 ( 9.896 -14.391 -4.128) 17.946 17.197 ( -6.900 -4.406 27.671) 28.857 18.721 ( 3.742 -3.924 -19.704) 20.436 19.759 ( 7.997 5.203 3.367) 10.118 19.847 ( 8.253 -0.614 -1.570) 8.423 20.441 ( -1.664 1.573 -4.273) 4.848 23.078 ( -17.510 -14.728 2.593) 23.028 23.958 ( 12.549 12.548 -1.645) 17.822 24.846 ( 0.519 -3.281 4.029) 5.222 ======================= Grid point 643 (317/432) ======================= q-point: (-0.45 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( -3.437 7.644 6.412) 10.553 2.381 ( -13.495 7.273 14.070) 20.808 3.026 ( 6.648 -2.747 -1.870) 7.432 3.343 ( -7.597 -4.565 -1.982) 9.082 3.498 ( -4.798 -1.319 -1.615) 5.232 3.674 ( 1.337 -1.138 0.622) 1.862 3.916 ( -11.231 -6.498 -5.046) 13.922 4.500 ( -6.903 -0.796 6.487) 9.506 4.723 ( 6.518 -4.812 8.688) 11.880 4.826 ( 2.361 1.401 -4.031) 4.877 5.126 ( 1.844 2.551 7.902) 8.506 5.623 ( 10.359 2.810 -9.463) 14.310 6.420 ( -3.926 0.851 13.674) 14.252 7.404 ( -4.994 -9.635 1.551) 10.962 7.735 ( 2.174 -1.308 -10.245) 10.554 8.611 ( -16.411 -8.223 5.034) 19.034 9.174 ( -1.389 3.289 10.554) 11.141 9.773 ( -13.926 -9.493 11.041) 20.148 9.874 ( 2.162 3.999 5.235) 6.933 10.250 ( -10.201 -6.478 8.463) 14.753 11.200 ( 0.480 20.410 -5.494) 21.142 11.663 ( 19.132 13.462 -17.493) 29.210 11.784 ( 9.261 5.870 -7.409) 13.233 13.012 ( -5.501 0.179 -0.148) 5.505 13.542 ( -2.408 -0.934 -1.010) 2.774 13.886 ( -8.359 0.863 6.073) 10.368 14.404 ( 1.301 3.215 0.986) 3.606 15.032 ( 7.968 -12.190 -9.758) 17.530 17.542 ( 0.373 -8.138 29.468) 30.573 18.567 ( 6.585 -2.224 -23.116) 24.138 19.746 ( -0.741 4.935 -4.049) 6.426 20.000 ( 15.939 -0.586 -4.064) 16.459 20.394 ( -0.338 0.869 0.840) 1.255 23.010 ( -18.641 -18.131 2.983) 26.175 23.972 ( 9.916 11.432 -3.647) 15.567 24.865 ( -4.839 -0.144 0.823) 4.911 ======================= Grid point 644 (318/432) ======================= q-point: (-0.36 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( -1.557 9.803 13.604) 16.840 2.312 ( -10.289 10.335 15.684) 21.417 3.088 ( 1.626 0.408 0.552) 1.765 3.236 ( -11.443 -6.006 -1.832) 13.052 3.402 ( -2.783 -1.084 -5.608) 6.354 3.701 ( 1.376 2.426 3.174) 4.225 3.824 ( -4.093 -12.825 -10.382) 17.000 4.486 ( -8.942 -1.236 6.521) 11.136 4.671 ( -5.407 2.489 -1.834) 6.229 5.074 ( 16.448 -2.919 6.735) 18.012 5.224 ( 1.455 3.223 8.799) 9.483 5.685 ( 13.519 0.290 -5.397) 14.559 6.555 ( 0.259 -1.900 13.638) 13.772 7.427 ( -7.235 -6.916 4.850) 11.122 7.649 ( 3.981 1.975 -10.444) 11.350 8.638 ( -10.923 -17.538 10.796) 23.312 9.257 ( -2.139 2.054 12.020) 12.380 9.787 ( -11.028 -1.021 15.673) 19.191 10.000 ( 2.244 -5.324 8.504) 10.281 10.228 ( -9.295 1.065 5.779) 10.996 10.943 ( -5.804 15.828 -4.816) 17.533 11.573 ( 19.308 13.449 -22.284) 32.408 11.780 ( 6.124 7.227 -3.950) 10.263 12.905 ( -9.391 0.706 -0.563) 9.434 13.511 ( -2.500 3.661 3.853) 5.874 13.846 ( -5.925 2.181 5.340) 8.270 14.395 ( 0.093 2.877 0.587) 2.938 15.074 ( 5.559 -10.269 -14.836) 18.881 17.932 ( 5.442 -8.229 13.996) 17.124 18.468 ( 11.540 -2.993 -13.354) 17.901 19.594 ( -6.595 2.053 -8.661) 11.078 20.090 ( 5.497 0.434 -7.761) 9.521 20.494 ( 13.698 1.689 5.076) 14.706 22.945 ( -22.275 -20.537 3.341) 30.481 23.959 ( 9.832 9.484 -5.412) 14.694 24.736 ( -10.373 4.390 -2.209) 11.478 ======================= Grid point 645 (319/432) ======================= q-point: (-0.27 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( -1.717 6.960 14.455) 16.135 2.309 ( -6.889 10.110 18.622) 22.281 3.078 ( -5.570 -0.457 1.860) 5.890 3.110 ( -5.697 -3.367 -4.381) 7.936 3.371 ( 6.263 1.140 -4.142) 7.595 3.726 ( -0.581 -6.955 -12.042) 13.918 3.766 ( -1.290 -4.343 1.436) 4.752 4.357 ( -11.296 0.360 -5.140) 12.415 4.657 ( -0.354 4.523 10.351) 11.302 5.285 ( 2.298 2.194 3.204) 4.512 5.373 ( 9.202 -2.355 9.394) 13.359 5.835 ( 13.420 -2.052 -1.894) 13.708 6.762 ( 4.223 -5.491 11.178) 13.150 7.419 ( -4.286 1.994 1.386) 4.926 7.641 ( 4.196 -3.834 2.493) 6.207 8.812 ( -10.346 -22.927 12.821) 28.232 9.345 ( -3.719 0.081 11.369) 11.962 9.875 ( -11.788 -0.010 23.801) 26.560 10.125 ( 0.766 17.078 2.421) 17.266 10.193 ( -2.423 -16.692 7.993) 18.665 10.710 ( -5.418 14.419 0.326) 15.407 11.447 ( 15.931 17.317 -18.018) 29.637 11.701 ( 2.568 3.887 -11.870) 12.752 12.748 ( -12.810 -1.252 -1.588) 12.969 13.511 ( -1.720 6.183 8.310) 10.500 13.811 ( -2.119 4.934 3.304) 6.305 14.373 ( -1.138 2.263 0.369) 2.560 15.026 ( 3.574 -8.670 -17.607) 19.949 18.038 ( 9.353 -1.814 -13.854) 16.814 18.713 ( 15.765 -9.678 8.965) 20.556 19.346 ( -11.308 0.151 -12.510) 16.864 19.994 ( -3.313 2.394 -7.485) 8.528 20.800 ( 23.718 2.094 6.089) 24.576 22.812 ( -28.563 -18.977 1.515) 34.326 23.963 ( 11.269 6.725 -5.876) 14.379 24.495 ( -13.451 7.402 -2.244) 15.517 ======================= Grid point 646 (320/432) ======================= q-point: (-0.18 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -1.457 1.847 13.035) 13.246 2.374 ( -4.241 7.345 19.226) 21.013 2.978 ( -6.092 -2.432 -2.387) 6.980 3.110 ( 3.333 -1.344 -1.479) 3.886 3.419 ( 10.805 4.768 -4.234) 12.546 3.590 ( -5.452 -8.125 -13.256) 16.476 3.822 ( 1.148 -1.981 0.788) 2.421 4.121 ( -10.758 3.793 -6.494) 13.126 4.771 ( 2.495 2.949 11.937) 12.546 5.305 ( -0.619 2.880 2.828) 4.083 5.575 ( 3.629 -2.459 7.129) 8.369 6.002 ( 10.125 -3.044 -0.880) 10.609 6.962 ( 2.313 -5.453 5.251) 7.916 7.343 ( 0.195 4.119 -2.255) 4.700 7.901 ( 6.579 -8.953 20.052) 22.925 9.012 ( -12.129 -26.048 10.785) 30.690 9.416 ( -5.454 -0.443 12.047) 13.231 9.914 ( -19.658 3.014 22.162) 29.777 10.091 ( 10.386 17.098 4.686) 20.547 10.371 ( -6.532 -14.635 3.270) 16.357 10.584 ( 2.013 15.166 5.620) 16.299 11.317 ( 12.077 19.385 -6.644) 23.786 11.547 ( 6.399 -0.218 -20.561) 21.535 12.540 ( -16.582 -3.800 -5.372) 17.840 13.543 ( -1.419 6.693 10.053) 12.160 13.790 ( 2.813 7.112 1.462) 7.787 14.336 ( -2.657 1.149 0.323) 2.913 14.929 ( 2.141 -7.043 -17.199) 18.708 18.029 ( 13.512 -0.289 -13.661) 19.217 18.982 ( -14.869 -6.534 -13.879) 21.363 19.137 ( 16.217 -3.478 4.469) 17.177 19.823 ( -6.328 3.399 -6.397) 9.619 21.196 ( 26.524 2.048 7.882) 27.746 22.531 ( -33.732 -12.508 -1.737) 36.019 24.014 ( 12.018 3.509 -4.709) 13.376 24.241 ( -13.107 6.523 -0.334) 14.645 ======================= Grid point 647 (321/432) ======================= q-point: (-0.09 0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.361 ( -1.449 -0.669 11.976) 12.082 2.512 ( 0.968 3.138 15.084) 15.437 2.936 ( -0.672 -1.127 0.662) 1.469 3.148 ( 3.983 -4.630 -6.326) 8.793 3.405 ( 2.448 0.329 -12.614) 12.853 3.502 ( 3.289 2.833 -0.227) 4.347 3.798 ( -5.432 -0.045 -5.098) 7.450 3.915 ( -3.028 3.677 -3.591) 5.965 4.928 ( 4.005 1.216 10.620) 11.415 5.292 ( -1.067 1.935 0.486) 2.262 5.675 ( -3.387 -1.411 7.811) 8.630 6.113 ( 5.200 -2.555 -2.010) 6.133 6.990 ( -6.878 -0.121 2.511) 7.323 7.340 ( 4.167 -0.428 -2.514) 4.885 8.369 ( 7.517 -10.669 28.417) 31.271 9.136 ( -15.794 -23.356 6.815) 29.007 9.499 ( -6.859 -3.179 14.082) 15.983 9.939 ( -2.541 4.072 15.802) 16.515 10.132 ( -6.645 11.100 7.148) 14.780 10.229 ( -1.246 17.658 1.396) 17.757 10.593 ( -2.287 -3.418 -5.248) 6.668 11.399 ( 15.127 5.331 3.979) 16.525 11.458 ( 17.933 3.993 -14.013) 23.106 12.250 ( -18.048 -4.844 -11.250) 21.812 13.576 ( -2.194 5.979 8.849) 10.903 13.797 ( 5.770 6.833 -0.154) 8.945 14.299 ( -3.788 -0.512 1.544) 4.122 14.819 ( 1.136 -4.655 -14.519) 15.289 18.108 ( 16.386 0.015 -7.190) 17.894 18.578 ( -18.514 -1.031 -18.301) 26.053 19.442 ( 10.782 -6.576 2.303) 12.837 19.648 ( -3.393 3.968 -4.953) 7.197 21.633 ( 25.736 0.998 10.126) 27.674 22.120 ( -33.492 -5.268 -3.943) 34.132 24.039 ( -10.805 3.634 0.498) 11.411 24.109 ( 11.424 1.221 -3.074) 11.894 ======================= Grid point 650 (322/432) ======================= q-point: ( 0.18 0.18 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( -5.227 0.000 -8.233) 9.752 2.512 ( -6.798 0.000 -4.152) 7.966 3.066 ( 0.939 -0.000 -10.984) 11.024 3.219 ( 2.501 -0.000 -0.161) 2.506 3.270 ( 10.122 -0.000 5.240) 11.398 3.651 ( -0.924 0.000 8.862) 8.910 3.948 ( 11.116 -0.000 10.471) 15.272 4.179 ( 4.912 -0.000 0.274) 4.919 4.770 ( -8.038 0.000 -4.380) 9.154 4.969 ( -16.267 0.000 -0.280) 16.270 5.375 ( -14.790 0.000 2.447) 14.991 5.934 ( 3.343 -0.000 -10.476) 10.997 6.497 ( -15.497 0.000 8.336) 17.597 7.268 ( -0.128 0.000 -2.334) 2.338 8.221 ( -12.149 0.000 -20.315) 23.671 8.953 ( -9.350 0.000 15.740) 18.308 9.446 ( -17.818 0.000 6.980) 19.136 9.622 ( -8.120 0.000 -6.504) 10.404 10.081 ( -15.295 0.000 24.248) 28.669 10.231 ( -1.942 0.000 -12.816) 12.962 11.417 ( 14.758 -0.000 11.102) 18.468 11.494 ( 20.559 -0.000 -5.984) 21.412 11.859 ( 25.689 -0.000 -23.133) 34.570 13.048 ( 7.921 -0.000 1.416) 8.047 13.626 ( -4.676 0.000 -7.716) 9.022 13.814 ( 14.512 -0.000 6.369) 15.849 14.231 ( -13.269 0.000 15.502) 20.405 14.477 ( 3.334 -0.000 -7.474) 8.183 17.118 ( -16.673 0.000 4.933) 17.388 18.936 ( -3.285 0.000 -8.347) 8.970 19.302 ( 15.520 -0.000 13.699) 20.701 19.761 ( -2.981 0.000 0.238) 2.990 20.758 ( -4.056 0.000 -10.477) 11.235 23.084 ( -9.057 0.000 12.182) 15.180 23.823 ( 15.076 -0.000 -0.803) 15.097 24.580 ( 6.325 -0.000 0.970) 6.399 ======================= Grid point 651 (323/432) ======================= q-point: (-0.73 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( -2.718 -1.731 -6.275) 7.054 2.420 ( -5.491 -1.742 1.967) 6.087 2.934 ( 0.979 0.897 -10.907) 10.987 3.251 ( 0.259 -4.704 -1.362) 4.904 3.467 ( 9.742 1.883 4.954) 11.090 3.705 ( -5.183 3.484 9.687) 11.526 4.174 ( -0.519 -0.152 1.343) 1.448 4.226 ( 6.608 -2.808 6.706) 9.825 4.674 ( -7.982 3.106 0.768) 8.600 4.750 ( -10.088 -5.438 -1.665) 11.580 5.212 ( -12.577 0.886 2.303) 12.817 5.848 ( 4.606 2.116 -12.519) 13.506 6.415 ( -12.480 1.273 10.848) 16.585 7.239 ( -2.219 -3.095 -2.375) 4.489 7.893 ( -6.439 -2.027 -16.062) 17.424 9.041 ( -5.448 -0.295 15.422) 16.359 9.198 ( -22.239 4.176 0.336) 22.630 9.502 ( -8.329 -7.622 -1.326) 11.368 10.066 ( -4.080 3.623 -1.964) 5.799 10.134 ( -14.266 -2.843 14.345) 20.429 11.675 ( 19.352 8.358 -2.976) 21.289 11.690 ( 16.312 4.020 2.140) 16.936 11.913 ( 22.793 1.639 -22.868) 32.329 13.086 ( 1.755 1.555 -2.410) 3.362 13.495 ( -4.891 -4.926 -6.322) 9.390 13.993 ( 1.433 -1.573 -0.465) 2.178 14.329 ( 0.426 3.249 18.304) 18.595 14.476 ( 4.661 -7.471 -4.656) 9.961 17.035 ( -14.031 -0.367 16.559) 21.708 18.801 ( -0.026 -1.319 -12.592) 12.661 19.633 ( 12.669 2.232 11.775) 17.439 19.756 ( 2.016 -1.435 0.126) 2.478 20.594 ( -2.000 1.042 -10.918) 11.149 23.019 ( -16.752 -4.081 5.962) 18.244 24.034 ( 15.538 5.576 3.265) 16.828 24.670 ( 4.008 -2.701 1.327) 5.012 ======================= Grid point 652 (324/432) ======================= q-point: (-0.64 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( -0.202 2.073 -1.294) 2.452 2.445 ( -5.977 -1.409 11.323) 12.881 2.864 ( 5.588 -3.235 -9.358) 11.370 3.270 ( -0.780 -7.309 -3.707) 8.232 3.589 ( 3.928 4.252 5.236) 7.806 3.649 ( -11.429 2.965 4.325) 12.574 4.087 ( -12.188 -2.965 -1.190) 12.600 4.433 ( 8.818 2.275 6.945) 11.453 4.517 ( -9.863 -2.999 3.584) 10.914 4.785 ( 2.309 -4.483 -0.797) 5.105 5.117 ( -6.334 1.829 6.842) 9.502 5.744 ( 6.313 3.566 -13.496) 15.320 6.395 ( -8.792 1.649 12.541) 15.404 7.214 ( -4.601 -7.394 -1.517) 8.839 7.723 ( -1.486 -4.924 -10.339) 11.548 8.839 ( -22.669 2.718 -3.742) 23.136 9.155 ( -2.916 3.183 15.710) 16.292 9.486 ( -8.612 -13.280 1.975) 15.950 9.987 ( -1.075 4.283 0.267) 4.424 10.130 ( -16.594 -3.326 16.332) 23.519 11.738 ( 14.615 16.923 -7.758) 23.667 11.848 ( 21.595 8.358 -10.334) 25.358 11.913 ( 14.273 6.065 -12.455) 19.890 13.049 ( -1.462 0.421 -1.838) 2.386 13.451 ( -2.440 -8.309 -3.297) 9.266 13.951 ( -8.698 -0.426 3.693) 9.459 14.413 ( 3.661 0.170 -2.398) 4.380 14.675 ( 7.564 -8.448 5.807) 12.739 17.139 ( -9.256 -2.343 26.864) 28.510 18.667 ( 3.152 -2.337 -17.707) 18.137 19.823 ( 11.079 0.329 -0.324) 11.088 19.861 ( 6.704 3.672 4.776) 9.013 20.445 ( -2.478 -0.631 -9.016) 9.372 22.886 ( -18.701 -7.796 4.108) 20.674 24.167 ( 10.682 11.243 1.711) 15.603 24.762 ( 1.107 -5.967 1.920) 6.365 ======================= Grid point 653 (325/432) ======================= q-point: (-0.55 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( 1.630 6.929 6.440) 9.599 2.481 ( -9.255 4.848 14.389) 17.782 2.936 ( 8.662 -7.213 -3.982) 11.955 3.260 ( -2.547 -5.356 -4.568) 7.486 3.475 ( -15.459 0.080 2.442) 15.650 3.641 ( -0.697 -3.723 -0.817) 3.875 3.903 ( -8.920 3.830 -2.104) 9.933 4.476 ( -7.147 -2.074 5.809) 9.441 4.641 ( 4.548 -3.729 6.489) 8.758 4.826 ( 4.590 -1.601 -0.865) 4.938 5.170 ( 0.110 2.583 10.958) 11.259 5.674 ( 9.786 2.913 -11.717) 15.541 6.438 ( -4.942 1.134 12.926) 13.885 7.211 ( -7.615 -11.709 0.816) 13.991 7.681 ( 2.367 -4.193 -6.237) 7.879 8.520 ( -18.764 -2.360 -1.754) 18.993 9.259 ( -2.345 5.408 14.820) 15.950 9.530 ( -9.310 -15.813 4.726) 18.949 9.963 ( -5.878 4.874 9.798) 12.422 10.142 ( -10.158 -4.976 11.746) 16.307 11.600 ( 6.843 22.923 -10.710) 26.210 11.813 ( 18.878 5.186 -27.044) 33.386 11.991 ( 16.355 16.725 1.949) 23.474 13.003 ( -4.252 -0.970 -0.870) 4.448 13.474 ( -1.276 -6.631 -0.200) 6.756 13.890 ( -9.139 -0.460 6.340) 11.133 14.421 ( 2.485 -1.557 -3.999) 4.959 14.857 ( 4.865 -7.526 -0.716) 8.991 17.426 ( -3.358 -5.441 31.315) 31.961 18.520 ( 5.875 -2.855 -22.197) 23.139 19.865 ( 0.572 8.481 -3.709) 9.274 19.987 ( 15.852 -0.857 -3.983) 16.368 20.368 ( -0.217 -3.718 -2.964) 4.760 22.764 ( -19.423 -10.908 4.883) 22.805 24.180 ( 7.213 12.751 -1.317) 14.709 24.815 ( -3.481 -5.328 0.552) 6.388 ======================= Grid point 654 (326/432) ======================= q-point: (-0.45 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( -0.368 9.066 11.688) 14.797 2.466 ( -9.030 8.388 15.190) 19.561 3.058 ( 2.942 -5.173 0.117) 5.952 3.173 ( -8.256 0.118 -0.241) 8.260 3.347 ( -6.079 -4.256 -2.626) 7.872 3.605 ( -6.370 -12.473 -7.535) 15.904 3.807 ( 3.991 7.595 -1.572) 8.723 4.445 ( -9.919 -2.836 3.779) 10.986 4.695 ( -3.006 0.757 4.167) 5.194 5.012 ( 13.160 -4.717 4.051) 14.555 5.284 ( 1.114 3.796 11.489) 12.151 5.697 ( 12.510 0.964 -7.427) 14.580 6.537 ( -1.296 -0.358 12.414) 12.487 7.233 ( -9.220 -13.991 4.139) 17.259 7.672 ( 3.591 0.370 -6.467) 7.406 8.388 ( -12.536 -11.740 4.659) 17.795 9.335 ( -3.980 5.943 14.543) 16.207 9.618 ( -7.692 -15.254 8.271) 18.980 9.961 ( -15.904 0.346 18.650) 24.513 10.221 ( 1.194 -1.330 7.710) 7.915 11.325 ( 2.706 25.925 -11.078) 28.322 11.701 ( 17.311 4.046 -27.061) 32.378 12.051 ( 15.054 21.357 -0.923) 26.146 12.908 ( -9.270 -0.342 -1.703) 9.431 13.517 ( -1.115 -2.552 3.795) 4.708 13.869 ( -6.005 0.135 7.160) 9.346 14.415 ( 1.003 -1.246 -3.113) 3.500 14.917 ( 1.780 -7.267 -6.973) 10.227 17.804 ( 1.955 -6.742 24.307) 25.300 18.395 ( 8.926 -4.937 -19.657) 22.146 19.680 ( -5.255 7.520 -10.031) 13.593 20.084 ( 4.975 -0.996 -6.768) 8.458 20.487 ( 15.848 -2.568 1.892) 16.166 22.661 ( -21.217 -12.999 5.782) 25.546 24.136 ( 6.365 11.254 -3.597) 13.420 24.756 ( -8.679 -1.690 -2.151) 9.100 ======================= Grid point 655 (327/432) ======================= q-point: (-0.36 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( -5.294 6.875 11.573) 14.465 2.468 ( -7.585 8.886 17.460) 21.008 3.037 ( -8.289 -3.534 -3.169) 9.552 3.108 ( -2.154 2.476 3.525) 4.817 3.350 ( 4.737 -3.099 -0.805) 5.718 3.546 ( -2.950 -11.710 -10.878) 16.253 3.798 ( 6.499 4.544 -3.871) 8.824 4.330 ( -11.857 -2.913 -2.367) 12.437 4.734 ( -0.295 4.446 10.579) 11.479 5.250 ( 9.306 -5.773 1.197) 11.016 5.394 ( 1.407 4.079 11.924) 12.680 5.806 ( 12.256 -1.300 -3.138) 12.718 6.692 ( 2.276 -3.031 10.930) 11.569 7.306 ( -7.187 -13.290 7.001) 16.652 7.635 ( 4.249 2.216 -4.906) 6.858 8.451 ( -11.184 -19.471 8.426) 23.983 9.393 ( -5.562 4.931 15.214) 16.933 9.788 ( -4.190 -12.590 14.578) 19.712 9.955 ( -21.281 -6.041 19.747) 29.653 10.353 ( 8.231 7.157 7.452) 13.210 11.024 ( 1.881 23.327 -8.647) 24.949 11.600 ( 17.527 2.378 -26.221) 31.629 11.976 ( 8.777 25.862 -5.736) 27.906 12.730 ( -14.194 -0.973 -2.923) 14.525 13.572 ( -1.263 1.111 7.477) 7.663 13.886 ( -1.038 3.297 6.319) 7.202 14.398 ( -0.810 -0.121 -1.341) 1.571 14.878 ( -0.221 -7.783 -12.126) 14.410 18.010 ( 8.004 -1.312 -6.531) 10.413 18.514 ( 9.846 -12.961 5.941) 17.327 19.399 ( -8.493 5.491 -12.961) 16.440 20.012 ( -3.134 -0.166 -7.167) 7.824 20.818 ( 26.136 -0.225 3.461) 26.365 22.534 ( -25.101 -13.401 5.023) 28.894 24.093 ( 7.375 8.509 -4.718) 12.209 24.577 ( -12.339 2.384 -3.507) 13.048 ======================= Grid point 656 (328/432) ======================= q-point: (-0.27 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.282 ( -5.394 2.042 10.887) 12.320 2.507 ( -5.398 8.190 17.143) 19.751 2.931 ( -4.927 -2.986 -2.818) 6.413 3.108 ( -0.263 1.183 0.986) 1.563 3.439 ( -0.767 -6.997 -6.590) 9.642 3.484 ( 7.774 -0.044 -4.554) 9.009 3.810 ( 6.002 0.778 -5.106) 7.918 4.150 ( -11.026 -0.198 -4.351) 11.855 4.836 ( 1.518 4.627 12.142) 13.082 5.345 ( 1.820 0.603 0.458) 1.971 5.537 ( 1.888 -0.987 9.711) 9.942 5.948 ( 9.284 -3.126 -1.130) 9.861 6.876 ( 3.417 -4.744 7.565) 9.561 7.355 ( -4.495 -4.289 -0.386) 6.225 7.743 ( 6.908 -7.744 10.609) 14.841 8.579 ( -11.744 -24.518 7.360) 28.164 9.452 ( -6.856 4.063 16.158) 18.017 9.908 ( -25.501 -1.672 28.623) 38.371 10.073 ( 1.041 -17.061 7.442) 18.642 10.440 ( 10.426 19.235 4.177) 22.274 10.840 ( 3.521 14.454 -0.863) 14.902 11.526 ( 15.394 0.226 -24.024) 28.534 11.742 ( 6.427 28.123 -8.898) 30.189 12.487 ( -17.658 -2.411 -5.824) 18.750 13.632 ( -1.648 3.391 9.537) 10.255 13.922 ( 3.916 7.801 4.629) 9.880 14.359 ( -3.497 1.187 0.089) 3.694 14.787 ( -0.351 -9.125 -14.765) 17.361 18.025 ( 13.204 -0.041 -12.479) 18.168 18.802 ( -2.521 -12.937 1.153) 13.231 19.139 ( 1.117 2.285 -6.793) 7.254 19.865 ( -5.168 1.449 -7.501) 9.224 21.229 ( 28.559 1.545 5.730) 29.169 22.322 ( -29.408 -11.327 2.190) 31.590 24.089 ( 8.868 5.270 -4.335) 11.189 24.338 ( -13.184 4.663 -2.615) 14.227 ======================= Grid point 657 (329/432) ======================= q-point: (-0.18 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( -2.651 -0.813 10.860) 11.209 2.579 ( -0.316 4.486 11.631) 12.470 2.912 ( 0.559 -1.513 1.206) 2.014 3.092 ( -1.145 -1.715 -2.619) 3.333 3.342 ( -1.709 -5.339 -10.602) 11.993 3.595 ( 9.595 5.296 1.303) 11.037 3.798 ( 1.192 0.169 -7.099) 7.201 3.969 ( -5.316 2.372 -4.181) 7.167 4.964 ( 2.538 3.071 11.024) 11.722 5.334 ( -0.656 2.541 -0.737) 2.726 5.646 ( -3.267 -1.711 8.646) 9.400 6.058 ( 4.882 -3.710 -1.638) 6.347 6.978 ( -3.808 -1.528 3.890) 5.654 7.318 ( 0.090 -2.617 -2.481) 3.607 8.143 ( 9.830 -14.866 20.047) 26.823 8.701 ( -11.957 -26.287 3.209) 29.056 9.512 ( -8.667 2.992 17.914) 20.124 9.938 ( -18.612 -2.301 27.173) 33.016 10.235 ( -5.205 -8.464 2.361) 10.213 10.445 ( 13.038 19.496 1.791) 23.523 10.754 ( -2.757 17.199 0.755) 17.435 11.428 ( 11.209 0.467 -18.154) 21.341 11.649 ( 21.364 16.822 -3.899) 27.470 12.170 ( -19.844 -3.691 -10.449) 22.728 13.679 ( -2.454 5.316 9.517) 11.174 13.951 ( 6.167 10.727 1.954) 12.527 14.294 ( -5.550 0.104 0.685) 5.593 14.706 ( 0.989 -8.654 -13.242) 15.850 18.109 ( 16.327 0.125 -6.773) 17.677 18.555 ( -17.594 -1.646 -16.198) 23.972 19.320 ( 9.206 -7.674 4.588) 12.833 19.705 ( -2.137 2.616 -7.281) 8.027 21.657 ( 24.256 1.789 8.682) 25.825 22.011 ( -27.657 -7.077 -1.665) 28.597 24.111 ( -11.706 4.249 -1.159) 12.507 24.140 ( 9.680 2.661 -2.881) 10.444 ======================= Grid point 658 (330/432) ======================= q-point: (-0.09 0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.464 ( 0.539 -2.409 8.981) 9.314 2.674 ( 3.679 2.323 5.634) 7.118 2.980 ( 4.199 -1.544 0.686) 4.526 3.051 ( -1.557 -1.927 -3.434) 4.235 3.279 ( -0.983 -3.961 -3.254) 5.220 3.627 ( -0.185 4.718 -1.134) 4.856 3.667 ( -0.486 4.275 -8.229) 9.286 3.929 ( 6.380 3.448 -1.662) 7.440 5.087 ( 1.728 1.267 8.218) 8.493 5.271 ( -2.205 1.925 -3.914) 4.887 5.677 ( -8.909 -1.252 8.987) 12.716 6.095 ( 0.935 -3.156 -3.558) 4.847 6.905 ( -11.818 0.369 3.160) 12.239 7.340 ( 2.462 -1.494 -2.097) 3.563 8.582 ( -3.095 -18.299 13.707) 23.072 8.827 ( -1.756 -22.849 7.179) 24.014 9.584 ( -10.200 1.258 19.647) 22.173 10.046 ( -10.263 5.754 5.254) 12.886 10.128 ( -10.524 2.635 15.594) 18.996 10.445 ( -0.944 11.307 -9.428) 14.753 10.572 ( 9.198 13.352 4.099) 16.724 11.447 ( 17.559 0.780 -16.369) 24.018 11.814 ( -11.882 -3.827 -10.081) 16.045 11.907 ( 21.137 3.855 5.698) 22.229 13.681 ( -3.341 7.123 6.663) 10.310 13.941 ( 4.904 10.112 -1.185) 11.301 14.248 ( -5.860 -2.662 2.966) 7.087 14.654 ( 2.158 -4.751 -10.009) 11.287 18.124 ( -18.880 -0.139 -16.679) 25.192 18.299 ( 17.822 0.324 0.196) 17.826 19.398 ( -7.729 -2.184 -0.973) 8.090 19.694 ( 10.764 -0.767 -3.250) 11.270 21.591 ( -29.315 -4.945 -2.523) 29.836 22.138 ( 26.065 2.579 9.459) 27.848 23.929 ( -9.284 2.938 -1.052) 9.794 24.235 ( 9.899 0.724 -1.184) 9.996 ======================= Grid point 662 (331/432) ======================= q-point: ( 0.27 -0.73 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( 2.202 -0.000 0.300) 2.223 2.424 ( -1.708 0.000 8.712) 8.878 2.840 ( 3.315 -0.000 -10.010) 10.545 3.201 ( -0.534 0.000 -3.175) 3.219 3.607 ( 2.887 -0.000 1.391) 3.205 3.710 ( -15.458 0.000 9.905) 18.359 4.044 ( -8.402 0.000 -0.079) 8.402 4.461 ( 6.417 -0.000 7.586) 9.936 4.491 ( -10.400 0.000 1.828) 10.559 4.741 ( 4.280 -0.000 -1.263) 4.462 5.134 ( -7.200 0.000 7.914) 10.699 5.776 ( 6.334 -0.000 -14.130) 15.485 6.410 ( -9.333 0.000 12.593) 15.674 7.147 ( -5.882 0.000 -1.806) 6.153 7.678 ( -0.773 0.000 -10.784) 10.812 8.874 ( -22.804 0.000 -5.090) 23.366 9.188 ( -5.100 0.000 19.088) 19.757 9.353 ( -7.868 0.000 0.843) 7.913 10.027 ( 4.718 -0.000 -6.187) 7.781 10.100 ( -22.125 0.000 22.253) 31.380 11.874 ( 10.619 -0.000 -0.964) 10.663 11.901 ( 26.578 -0.000 -30.017) 40.092 12.011 ( 17.833 -0.000 0.135) 17.834 13.065 ( -1.741 0.000 -2.604) 3.132 13.357 ( -3.009 0.000 -3.210) 4.400 13.945 ( -8.044 0.000 3.094) 8.619 14.405 ( 4.541 -0.000 -8.579) 9.706 14.609 ( 5.549 -0.000 13.983) 15.043 17.119 ( -10.076 0.000 26.579) 28.425 18.647 ( 2.841 -0.000 -17.109) 17.344 19.820 ( 10.310 -0.000 -1.545) 10.425 19.901 ( 8.217 -0.000 7.977) 11.452 20.437 ( -2.963 0.000 -11.710) 12.079 22.820 ( -18.886 0.000 4.652) 19.451 24.280 ( 9.834 -0.000 4.593) 10.854 24.695 ( 1.314 -0.000 -0.421) 1.380 ======================= Grid point 664 (332/432) ======================= q-point: (-0.64 0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 2.851 3.286 7.030) 8.267 2.541 ( -2.049 1.940 14.054) 14.334 2.832 ( 8.448 -3.767 -6.001) 11.026 3.175 ( 1.351 -3.552 -4.694) 6.039 3.508 ( -19.292 3.173 2.728) 19.741 3.574 ( -11.475 -3.847 -0.563) 12.116 3.968 ( -3.294 2.466 -0.116) 4.117 4.436 ( -4.874 -1.931 5.978) 7.951 4.622 ( 3.294 0.864 6.641) 7.464 4.783 ( 3.918 -2.594 -0.804) 4.767 5.205 ( -0.333 1.237 12.548) 12.613 5.711 ( 9.042 1.268 -13.229) 16.074 6.453 ( -5.812 0.513 12.833) 14.097 7.059 ( -8.639 -5.172 -0.034) 10.068 7.624 ( 3.329 -1.973 -4.105) 5.641 8.512 ( -20.638 0.484 -5.405) 21.340 9.306 ( -5.142 -4.034 5.394) 8.474 9.341 ( -6.077 -1.086 16.574) 17.686 10.029 ( -13.253 3.000 14.325) 19.745 10.080 ( -4.072 -2.751 7.127) 8.657 11.833 ( 17.318 3.586 -27.637) 32.811 11.922 ( 10.140 7.301 -10.213) 16.138 12.243 ( 21.744 10.290 0.140) 24.057 12.987 ( -5.436 -0.688 -2.153) 5.887 13.356 ( 0.361 -5.418 0.885) 5.502 13.876 ( -9.832 -0.745 5.759) 11.419 14.375 ( 4.181 -2.406 -8.612) 9.871 14.786 ( 1.928 -1.511 7.072) 7.485 17.363 ( -5.454 -1.904 32.287) 32.800 18.484 ( 5.270 -1.164 -21.799) 22.458 19.970 ( 13.801 0.124 -5.051) 14.697 20.005 ( 3.668 5.518 0.844) 6.680 20.289 ( -0.638 -4.332 -8.389) 9.463 22.644 ( -19.082 -3.512 5.948) 20.293 24.372 ( 4.376 8.451 1.666) 9.662 24.709 ( -1.910 -5.858 -1.156) 6.269 ======================= Grid point 665 (333/432) ======================= q-point: (-0.55 0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( -2.660 4.317 10.214) 11.404 2.607 ( -3.623 7.945 12.426) 15.187 2.964 ( 5.993 -4.447 1.453) 7.604 3.188 ( 3.221 -0.821 -2.977) 4.462 3.286 ( -13.033 -1.755 1.456) 13.231 3.423 ( -12.401 -8.240 -4.852) 15.659 3.904 ( 0.718 3.130 -3.600) 4.824 4.422 ( -7.806 0.535 2.941) 8.359 4.707 ( -0.129 0.987 7.409) 7.475 4.917 ( 8.353 -6.091 3.421) 10.889 5.345 ( 1.475 3.092 12.771) 13.222 5.711 ( 11.385 0.557 -9.015) 14.533 6.536 ( -2.606 0.105 12.001) 12.281 7.019 ( -9.149 -10.002 3.020) 13.887 7.667 ( 4.024 -0.649 -1.146) 4.234 8.246 ( -15.323 -5.296 -1.691) 16.301 9.361 ( -3.484 -7.997 6.265) 10.739 9.454 ( -6.353 1.960 17.801) 19.002 9.970 ( -25.105 0.440 23.959) 34.706 10.194 ( 8.326 -1.597 3.553) 9.193 11.683 ( 12.016 10.016 -23.032) 27.842 11.799 ( 10.038 11.930 -18.673) 24.326 12.394 ( 19.067 17.716 -0.960) 26.045 12.887 ( -8.279 -2.529 -2.959) 9.148 13.448 ( 1.537 -4.604 4.654) 6.725 13.846 ( -7.413 -2.479 7.290) 10.688 14.358 ( 3.186 -4.230 -7.853) 9.472 14.846 ( -2.432 -1.633 1.907) 3.495 17.713 ( -1.173 -3.905 30.939) 31.206 18.323 ( 7.631 -3.187 -23.339) 24.760 19.820 ( -5.654 8.180 -11.562) 15.250 20.060 ( 1.978 -1.834 -5.201) 5.859 20.420 ( 20.785 -4.513 -0.990) 21.292 22.506 ( -19.432 -5.699 7.103) 21.460 24.325 ( 2.273 10.671 -1.820) 11.061 24.690 ( -6.390 -5.776 -2.290) 8.913 ======================= Grid point 666 (334/432) ======================= q-point: (-0.45 0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( -9.770 2.915 9.361) 13.841 2.622 ( -4.333 9.562 13.612) 17.190 2.989 ( -6.855 -1.858 -1.129) 7.191 3.169 ( -2.535 4.196 3.530) 6.041 3.291 ( 5.610 -3.248 0.016) 6.482 3.346 ( -2.559 -11.761 -5.473) 13.222 3.860 ( 5.136 1.479 -7.379) 9.112 4.293 ( -11.102 -0.386 -1.896) 11.270 4.801 ( 1.058 3.422 11.153) 11.714 5.131 ( 7.982 -7.832 2.984) 11.574 5.469 ( 1.102 4.387 11.525) 12.381 5.789 ( 10.830 -0.942 -4.045) 11.599 6.654 ( -0.033 -1.579 10.737) 10.853 7.066 ( -6.273 -13.283 6.079) 15.898 7.678 ( 2.865 2.708 -2.996) 4.952 8.168 ( -12.168 -14.005 4.008) 18.981 9.466 ( -4.777 0.624 13.784) 14.602 9.582 ( -1.669 -6.764 13.536) 15.224 9.913 ( -27.592 -1.115 26.797) 38.479 10.395 ( 11.541 -0.555 6.588) 13.300 11.440 ( 5.946 22.689 -15.804) 28.283 11.633 ( 13.339 3.118 -25.041) 28.543 12.407 ( 13.636 22.577 -5.472) 26.937 12.718 ( -13.273 -0.078 -4.197) 13.921 13.561 ( 0.142 -1.655 8.040) 8.210 13.899 ( -0.342 -2.362 7.337) 7.716 14.351 ( 1.924 -4.803 -6.224) 8.094 14.798 ( -6.075 -1.762 -2.827) 6.928 18.000 ( 5.644 0.153 3.818) 6.816 18.306 ( 7.239 -11.066 0.062) 13.224 19.507 ( -8.962 6.637 -14.334) 18.162 19.993 ( -3.569 -1.913 -6.274) 7.467 20.794 ( 29.798 -2.346 0.918) 29.904 22.369 ( -21.650 -6.456 6.414) 23.485 24.241 ( 2.834 8.789 -3.607) 9.914 24.578 ( -10.202 -2.113 -3.623) 11.030 ======================= Grid point 667 (335/432) ======================= q-point: (-0.36 0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( -8.339 1.141 8.991) 12.315 2.645 ( -4.984 8.235 13.633) 16.689 2.886 ( -4.382 -2.114 -2.647) 5.539 3.140 ( -3.302 1.809 1.970) 4.249 3.312 ( -0.240 -6.736 -8.444) 10.804 3.467 ( 7.353 -2.302 5.756) 9.618 3.842 ( 9.242 2.269 -10.211) 13.958 4.127 ( -10.380 -1.903 -3.264) 11.047 4.916 ( 1.601 4.541 11.565) 12.527 5.295 ( 4.377 -5.863 0.538) 7.336 5.565 ( -0.324 3.670 10.694) 11.311 5.902 ( 7.996 -2.371 -1.126) 8.416 6.802 ( 1.650 -4.079 8.700) 9.749 7.190 ( -3.599 -13.171 4.597) 14.407 7.684 ( 4.459 0.061 1.759) 4.794 8.210 ( -10.820 -18.887 4.753) 22.280 9.531 ( -8.199 4.746 17.583) 19.973 9.823 ( 2.814 -12.067 10.114) 15.995 9.877 ( -27.450 -1.899 30.071) 40.760 10.634 ( 12.958 4.277 8.351) 15.998 11.153 ( 4.700 22.055 -11.342) 25.242 11.524 ( 13.815 -0.041 -24.201) 27.867 12.240 ( 8.487 28.737 -10.890) 31.882 12.461 ( -17.193 -0.544 -5.130) 17.951 13.656 ( -2.274 -0.064 10.079) 10.333 14.024 ( 6.794 3.276 6.563) 9.998 14.344 ( -0.327 -3.860 -3.670) 5.336 14.665 ( -7.445 -3.895 -7.811) 11.472 18.030 ( 12.898 0.672 -11.872) 17.543 18.585 ( 0.955 -12.233 10.186) 15.947 19.190 ( -6.238 3.397 -11.806) 13.778 19.871 ( -4.311 -0.569 -7.446) 8.623 21.240 ( 31.978 -0.342 3.197) 32.139 22.173 ( -25.278 -6.144 3.791) 26.288 24.184 ( 4.396 5.727 -3.689) 8.108 24.391 ( -11.681 1.524 -3.508) 12.291 ======================= Grid point 668 (336/432) ======================= q-point: (-0.27 0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.339 ( -2.680 -0.189 9.438) 9.813 2.652 ( -2.260 3.818 6.466) 7.842 2.891 ( 2.497 -0.680 2.323) 3.478 3.091 ( -4.658 1.371 1.416) 5.058 3.252 ( -1.148 -5.165 -8.257) 9.807 3.628 ( 1.643 -1.639 6.852) 7.234 3.824 ( 10.613 3.156 -12.438) 16.653 3.991 ( -3.728 0.293 -4.277) 5.681 5.025 ( 1.412 3.850 10.408) 11.187 5.349 ( 0.169 -1.566 -1.667) 2.293 5.638 ( -3.485 1.361 9.873) 10.558 5.998 ( 4.219 -3.280 -0.945) 5.427 6.933 ( -1.486 -3.892 5.654) 7.023 7.235 ( -3.809 -7.617 -1.249) 8.607 7.916 ( 10.808 -10.865 12.311) 19.657 8.293 ( -8.425 -21.334 1.775) 23.006 9.573 ( -11.515 3.886 19.109) 22.646 9.890 ( -21.096 -3.053 28.036) 35.219 10.060 ( -0.344 -10.142 8.053) 12.955 10.775 ( 9.045 16.512 3.027) 19.069 11.000 ( 4.302 12.439 -1.647) 13.264 11.435 ( 13.019 0.285 -21.419) 25.067 11.994 ( 9.110 21.836 -9.272) 25.412 12.158 ( -14.934 3.815 -8.545) 17.624 13.733 ( -3.387 0.972 10.760) 11.323 14.133 ( 7.739 10.180 3.797) 13.340 14.303 ( -5.848 0.305 -0.236) 5.861 14.542 ( -1.339 -9.969 -10.909) 14.838 18.113 ( 16.281 0.346 -6.409) 17.501 18.524 ( -15.377 -2.006 -12.112) 19.677 19.192 ( 6.115 -7.178 5.280) 10.807 19.735 ( -1.413 1.011 -8.435) 8.612 21.689 ( 24.867 1.820 6.200) 25.692 21.902 ( -22.007 -5.495 -0.474) 22.688 24.160 ( -5.329 2.063 -1.880) 6.016 24.205 ( 0.213 4.207 -2.757) 5.034 ======================= Grid point 669 (337/432) ======================= q-point: (-0.18 0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.436 ( 0.392 -0.779 8.409) 8.454 2.706 ( 5.349 1.279 3.602) 6.574 2.951 ( 2.705 -1.483 -2.509) 3.976 3.050 ( -2.213 1.903 3.398) 4.479 3.213 ( -0.730 -4.090 -2.084) 4.648 3.630 ( -11.746 -2.344 2.893) 12.322 3.777 ( 10.755 5.826 -14.092) 18.660 3.981 ( 8.760 3.132 -0.855) 9.342 5.119 ( 0.279 2.217 8.177) 8.477 5.298 ( -3.063 0.737 -4.044) 5.126 5.664 ( -8.068 0.131 8.953) 12.053 6.038 ( 0.682 -3.338 -2.629) 4.304 6.903 ( -11.539 -0.777 2.227) 11.777 7.280 ( 2.302 -6.227 0.251) 6.643 8.267 ( -2.364 -17.389 3.303) 17.857 8.456 ( 7.599 -20.711 8.809) 23.755 9.605 ( -13.957 1.220 20.745) 25.033 10.010 ( -12.541 -4.574 25.865) 29.107 10.137 ( -4.429 -2.281 1.130) 5.109 10.753 ( 1.453 18.278 -2.657) 18.527 10.798 ( -3.908 13.742 -2.595) 14.521 11.459 ( 20.944 0.509 -15.545) 26.088 11.777 ( -15.994 1.713 -10.462) 19.189 12.043 ( 21.379 11.763 1.100) 24.427 13.785 ( -3.940 4.086 9.696) 11.235 14.110 ( -0.966 8.014 -1.411) 8.194 14.218 ( -3.910 0.428 -0.059) 3.934 14.559 ( 6.099 -5.993 -6.153) 10.535 18.124 ( -18.597 0.167 -16.026) 24.550 18.306 ( 17.657 0.440 0.466) 17.668 19.344 ( -3.008 -4.208 2.795) 5.880 19.681 ( 8.499 -0.663 -5.966) 10.405 21.514 ( -28.604 -3.828 -1.772) 28.913 22.177 ( 29.147 1.820 6.535) 29.926 23.985 ( -10.031 3.461 -1.350) 10.696 24.250 ( 7.625 0.980 -0.557) 7.708 ======================= Grid point 670 (338/432) ======================= q-point: (-0.09 0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -1.174 -0.985 5.150) 5.373 2.835 ( 9.966 3.221 3.040) 10.905 2.928 ( -0.300 -1.726 -5.129) 5.420 3.069 ( 1.948 0.253 -0.250) 1.980 3.235 ( -3.394 -3.402 3.182) 5.763 3.544 ( -5.685 -2.510 4.611) 7.738 3.693 ( 9.694 7.536 -14.041) 18.653 4.087 ( 9.643 4.460 1.987) 10.808 5.149 ( -4.744 0.693 -2.184) 5.268 5.189 ( -4.318 1.447 1.155) 4.698 5.623 ( -12.163 -0.399 7.216) 14.148 6.016 ( -1.085 -3.095 -5.080) 6.047 6.752 ( -15.621 -1.084 2.924) 15.929 7.352 ( 2.887 -0.876 -0.330) 3.035 8.307 ( -9.072 -19.431 -3.770) 21.774 8.893 ( 9.695 -17.387 10.374) 22.447 9.661 ( -14.192 -0.506 21.162) 25.486 10.006 ( -10.180 11.760 0.651) 15.568 10.155 ( -10.396 -3.064 10.936) 15.397 10.384 ( -7.584 12.421 -3.094) 14.878 10.866 ( 10.672 0.490 1.284) 10.760 11.390 ( -7.124 7.356 -8.294) 13.178 11.626 ( 20.088 -2.267 -17.658) 26.842 12.363 ( 23.384 2.587 9.738) 25.462 13.767 ( -2.961 8.118 4.833) 9.901 14.010 ( -3.235 4.216 -1.451) 5.509 14.183 ( -4.414 -2.007 2.241) 5.342 14.613 ( 7.298 1.461 -4.494) 8.694 17.700 ( -19.341 -0.060 -13.107) 23.364 18.581 ( 17.961 0.261 6.559) 19.123 19.268 ( -6.430 1.120 -3.439) 7.377 19.780 ( 7.594 -1.316 -1.623) 7.876 21.161 ( -23.306 -4.626 -4.821) 24.245 22.612 ( 25.045 2.569 9.856) 27.037 23.820 ( -7.676 2.508 -2.483) 8.449 24.356 ( 8.028 -0.083 1.422) 8.153 ======================= Grid point 675 (339/432) ======================= q-point: ( 0.36 -0.64 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( -4.248 0.000 9.325) 10.247 2.685 ( -0.099 0.000 9.628) 9.628 2.931 ( 10.014 -0.000 4.467) 10.965 3.151 ( 4.292 -0.000 -4.547) 6.253 3.289 ( -17.953 0.000 4.299) 18.461 3.351 ( -11.740 0.000 -5.409) 12.926 3.923 ( -2.782 0.000 -3.916) 4.804 4.438 ( -5.001 0.000 2.451) 5.569 4.724 ( 0.579 -0.000 8.918) 8.937 4.848 ( 6.245 -0.000 3.078) 6.963 5.374 ( 1.673 -0.000 13.316) 13.420 5.715 ( 10.866 -0.000 -9.875) 14.683 6.538 ( -3.197 0.000 11.981) 12.400 6.930 ( -8.684 0.000 2.555) 9.052 7.660 ( 4.262 -0.000 1.386) 4.482 8.203 ( -16.833 0.000 -4.740) 17.487 9.278 ( -1.756 0.000 5.889) 6.146 9.486 ( -7.259 0.000 19.817) 21.105 9.974 ( -27.422 0.000 25.175) 37.225 10.178 ( 10.406 -0.000 1.322) 10.490 11.734 ( 15.037 -0.000 -28.302) 32.048 11.947 ( 8.715 -0.000 -14.709) 17.097 12.577 ( 21.686 -0.000 -1.597) 21.745 12.840 ( -11.267 0.000 -2.265) 11.493 13.403 ( 5.006 -0.000 4.383) 6.654 13.816 ( -9.506 0.000 7.115) 11.874 14.317 ( 3.719 -0.000 -8.495) 9.274 14.836 ( -3.744 0.000 4.723) 6.027 17.679 ( -2.420 0.000 33.152) 33.240 18.296 ( 7.286 -0.000 -24.497) 25.558 19.907 ( -6.095 0.000 -14.129) 15.387 20.034 ( -1.658 0.000 -2.362) 2.886 20.373 ( 25.260 -0.000 -2.320) 25.366 22.460 ( -18.593 0.000 7.519) 20.056 24.447 ( -0.387 0.000 -0.024) 0.388 24.609 ( -4.468 0.000 -3.458) 5.650 ======================= Grid point 677 (340/432) ======================= q-point: (-0.55 0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -10.712 0.515 7.467) 13.068 2.762 ( -0.145 5.344 8.287) 9.862 2.997 ( -8.373 3.987 1.976) 9.482 3.134 ( -10.011 -9.933 0.110) 14.103 3.229 ( 6.040 -0.913 -1.238) 6.233 3.276 ( 5.677 1.714 3.522) 6.897 3.844 ( 0.992 -1.870 -6.852) 7.171 4.317 ( -9.436 1.859 -4.030) 10.428 4.852 ( 2.205 2.472 11.284) 11.760 5.011 ( 6.879 -5.297 4.664) 9.856 5.529 ( 0.967 2.281 12.174) 12.424 5.772 ( 10.019 -0.801 -5.131) 11.285 6.636 ( -1.867 -0.545 10.793) 10.966 6.904 ( -5.013 -5.138 5.151) 8.835 7.722 ( 2.491 2.070 1.188) 3.450 7.992 ( -12.819 -6.125 -1.047) 14.246 9.395 ( 3.359 -3.683 9.328) 10.577 9.589 ( -9.572 1.934 19.713) 21.999 9.901 ( -29.054 -0.331 27.688) 40.136 10.375 ( 13.867 -0.996 4.503) 14.614 11.608 ( 14.496 1.398 -26.626) 30.349 11.802 ( 5.414 10.437 -18.933) 22.286 12.637 ( -7.801 3.751 -1.800) 8.841 12.761 ( 8.480 4.758 -5.409) 11.127 13.554 ( 7.344 1.392 6.429) 9.859 13.813 ( -5.123 -5.876 7.273) 10.661 14.285 ( 2.891 -2.109 -6.425) 7.354 14.792 ( -8.747 0.258 2.127) 9.005 18.016 ( 1.670 1.525 21.733) 21.851 18.160 ( 8.693 -5.551 -15.116) 18.299 19.598 ( -10.997 3.364 -15.693) 19.455 19.960 ( -3.662 -1.482 -5.241) 6.563 20.757 ( 32.866 -1.394 -0.594) 32.900 22.304 ( -19.381 -1.688 6.729) 20.585 24.377 ( -1.336 6.847 -2.734) 7.492 24.516 ( -7.485 -4.608 -3.684) 9.530 ======================= Grid point 678 (341/432) ======================= q-point: (-0.45 0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( -8.035 0.465 7.111) 10.740 2.767 ( -5.694 4.857 5.585) 9.339 2.878 ( -3.757 2.535 1.522) 4.781 3.108 ( -2.808 -6.209 -0.508) 6.834 3.262 ( -2.082 0.814 -1.210) 2.541 3.429 ( 6.232 -1.632 6.894) 9.436 3.855 ( 10.585 -1.060 -8.028) 13.328 4.112 ( -9.926 0.458 -5.870) 11.541 4.981 ( 2.068 3.177 10.328) 11.002 5.184 ( 4.763 -6.338 2.652) 8.360 5.633 ( -0.620 3.860 10.442) 11.150 5.865 ( 6.908 -2.076 -1.052) 7.289 6.743 ( -1.363 -2.704 9.433) 9.907 6.989 ( -1.276 -9.180 4.953) 10.509 7.714 ( 1.313 3.181 -0.076) 3.442 7.950 ( -7.979 -12.056 2.504) 14.672 9.586 ( -1.949 0.766 14.614) 14.763 9.683 ( -3.317 -3.759 15.136) 15.945 9.850 ( -29.285 -1.171 30.728) 42.464 10.655 ( 16.826 -0.367 7.239) 18.321 11.474 ( 8.477 10.590 -20.361) 24.466 11.542 ( 7.045 5.373 -21.973) 23.692 12.462 ( -11.669 1.160 -3.184) 12.151 12.653 ( 4.143 17.975 -10.254) 21.105 13.664 ( -1.274 2.581 9.528) 9.953 13.981 ( 8.681 -9.130 4.791) 13.479 14.278 ( 2.321 -1.775 -4.103) 5.037 14.652 ( -12.656 0.927 -0.695) 12.709 18.048 ( 13.015 1.361 -13.486) 18.792 18.410 ( 1.299 -8.085 17.675) 19.480 19.243 ( -11.025 2.564 -14.306) 18.243 19.854 ( -3.321 -1.177 -6.992) 7.830 21.224 ( 35.072 -1.118 1.332) 35.115 22.109 ( -22.019 -1.874 3.740) 22.413 24.276 ( -0.671 5.048 -3.252) 6.042 24.391 ( -8.749 -1.328 -3.482) 9.510 ======================= Grid point 679 (342/432) ======================= q-point: (-0.36 0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( -0.742 0.767 7.758) 7.831 2.695 ( -2.889 1.052 -0.101) 3.077 2.901 ( 1.998 2.005 4.752) 5.532 3.118 ( -1.912 0.544 2.405) 3.120 3.181 ( -5.240 -2.208 -3.131) 6.491 3.572 ( -2.265 -4.032 7.563) 8.865 3.878 ( 7.434 2.575 -12.374) 14.663 3.988 ( 4.043 -0.403 -4.237) 5.871 5.081 ( 0.653 2.610 8.443) 8.861 5.286 ( 0.871 -5.058 -0.225) 5.137 5.687 ( -3.289 3.884 9.394) 10.684 5.950 ( 3.335 -2.500 0.145) 4.170 6.854 ( -1.843 -4.920 7.318) 9.009 7.077 ( -3.805 -9.797 0.460) 10.520 7.795 ( 7.663 -3.844 6.450) 10.728 8.003 ( -3.280 -12.926 0.332) 13.340 9.633 ( -14.695 3.047 19.250) 24.409 9.844 ( -18.994 -2.318 26.527) 32.708 9.917 ( -0.583 -6.701 13.557) 15.134 10.943 ( 13.383 4.574 6.610) 15.611 11.206 ( -0.611 10.925 -11.757) 16.061 11.436 ( 14.637 -0.029 -22.682) 26.994 12.212 ( -13.989 8.815 -3.706) 16.945 12.413 ( 6.144 19.500 -12.296) 23.858 13.728 ( -4.563 -0.585 10.673) 11.622 14.219 ( 6.207 -9.511 -0.722) 11.380 14.287 ( 6.862 5.870 1.310) 9.124 14.446 ( -12.508 -0.216 -3.451) 12.977 18.120 ( 16.306 0.520 -6.483) 17.555 18.489 ( -11.897 -2.111 -6.000) 13.491 19.089 ( 0.808 -4.808 3.712) 6.127 19.742 ( -0.496 -0.043 -8.637) 8.651 21.710 ( 31.312 0.511 3.381) 31.498 21.836 ( -22.167 -2.146 -0.591) 22.278 24.189 ( -6.744 1.290 -1.545) 7.038 24.265 ( -0.997 2.857 -2.763) 4.097 ======================= Grid point 680 (343/432) ======================= q-point: (-0.27 0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.442 ( 2.690 1.599 7.473) 8.102 2.715 ( 6.539 -0.281 0.771) 6.590 2.941 ( 0.396 0.322 -1.190) 1.295 3.104 ( -0.712 3.104 0.571) 3.235 3.144 ( -2.507 -2.947 4.416) 5.871 3.567 ( -14.045 -4.760 4.780) 15.581 3.825 ( 10.052 0.013 -13.659) 16.959 4.051 ( 12.385 4.991 -2.920) 13.669 5.147 ( -1.470 0.814 6.546) 6.758 5.283 ( -3.417 -2.503 -2.781) 5.067 5.691 ( -6.948 3.045 8.186) 11.161 5.990 ( 0.268 -2.369 -1.086) 2.620 6.875 ( -9.916 -2.525 1.926) 10.412 7.128 ( -0.819 -11.200 2.345) 11.472 8.036 ( 1.890 -9.774 -2.650) 10.302 8.150 ( 11.996 -15.089 8.498) 21.066 9.622 ( -18.253 0.721 21.143) 27.941 9.933 ( -17.785 -4.227 26.952) 32.567 10.094 ( 4.344 -2.319 5.208) 7.167 10.910 ( -4.727 4.705 -5.730) 8.792 11.053 ( -5.607 11.271 -6.316) 14.084 11.463 ( 22.883 0.070 -15.148) 27.443 11.913 ( -9.872 14.248 -2.254) 17.480 12.278 ( 14.105 14.812 -6.104) 21.344 13.799 ( -5.383 -1.951 11.398) 12.755 14.186 ( -12.501 3.194 -1.847) 13.034 14.234 ( -0.161 -3.217 -5.555) 6.421 14.506 ( 14.056 1.674 2.065) 14.306 18.130 ( -18.529 0.461 -15.757) 24.327 18.314 ( 17.493 0.459 0.866) 17.520 19.263 ( 1.436 -5.032 7.810) 9.401 19.673 ( 6.354 -0.401 -8.524) 10.639 21.470 ( -27.179 -1.487 -3.303) 27.419 22.196 ( 32.259 0.516 3.676) 32.472 24.041 ( -9.715 3.110 -0.402) 10.208 24.265 ( 4.452 0.770 -0.287) 4.528 ======================= Grid point 681 (344/432) ======================= q-point: (-0.18 -0.64 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( 0.080 1.919 7.092) 7.347 2.864 ( 12.470 -0.217 -3.916) 13.072 2.913 ( -0.633 0.678 3.751) 3.864 3.081 ( 1.801 1.189 -0.930) 2.350 3.195 ( -4.818 -1.758 2.806) 5.847 3.483 ( -7.537 -4.504 4.870) 10.040 3.795 ( 11.548 3.870 -14.679) 19.074 4.151 ( 9.802 3.714 0.766) 10.510 5.149 ( -6.829 -0.987 -1.061) 6.981 5.205 ( -4.539 0.042 0.881) 4.624 5.635 ( -10.648 2.024 6.059) 12.417 5.971 ( -1.699 -2.064 -3.607) 4.490 6.731 ( -15.244 -1.558 1.359) 15.383 7.271 ( 2.894 -9.301 2.880) 10.158 8.049 ( -2.019 -10.170 -6.698) 12.344 8.590 ( 15.781 -17.660 7.231) 24.763 9.638 ( -17.326 -1.726 22.392) 28.365 10.016 ( -14.499 -5.444 15.148) 21.664 10.190 ( 1.851 4.352 6.551) 8.079 10.671 ( -14.864 17.843 -9.367) 25.041 10.780 ( -5.736 -7.356 -5.900) 11.037 11.583 ( 20.917 2.879 -15.337) 26.097 11.670 ( -2.199 17.464 -1.311) 17.651 12.432 ( 21.241 5.504 4.510) 22.402 13.867 ( -5.014 1.146 11.173) 12.300 13.995 ( -9.795 -1.054 -2.570) 10.181 14.189 ( -0.711 -0.403 -3.915) 4.000 14.671 ( 12.912 5.517 0.183) 14.042 17.699 ( -19.889 -0.085 -13.531) 24.055 18.585 ( 17.341 0.268 6.466) 18.510 19.296 ( -2.482 2.238 -1.345) 3.603 19.747 ( 9.828 -2.618 -2.484) 10.469 21.089 ( -24.809 -3.667 -5.564) 25.689 22.642 ( 28.930 0.870 4.777) 29.335 23.881 ( -8.942 4.663 -0.446) 10.095 24.348 ( 5.797 -0.977 2.492) 6.385 ======================= Grid point 682 (345/432) ======================= q-point: (-0.09 -0.64 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.557 ( -5.834 3.349 7.429) 10.022 2.834 ( -0.529 0.677 -8.591) 8.634 3.023 ( -0.778 1.531 2.342) 2.904 3.064 ( 1.906 1.842 -2.759) 3.826 3.207 ( 5.156 -5.028 5.771) 9.229 3.591 ( 4.197 -3.139 7.517) 9.164 3.741 ( 12.751 6.415 -13.720) 19.798 4.256 ( 6.384 2.177 3.083) 7.416 4.985 ( -11.089 0.689 -4.241) 11.893 5.159 ( -6.967 0.203 1.706) 7.176 5.515 ( -13.175 1.031 2.911) 13.532 5.908 ( -1.549 -2.534 -6.511) 7.156 6.561 ( -16.419 -1.978 3.807) 16.971 7.385 ( 3.212 -1.790 0.749) 3.753 8.037 ( -1.710 -12.293 -6.675) 14.092 8.945 ( 7.554 -13.880 1.420) 15.866 9.675 ( -18.823 -0.719 20.388) 27.758 9.948 ( -9.967 2.763 0.696) 10.366 10.124 ( -13.272 15.657 3.881) 20.888 10.340 ( -6.424 -0.550 -0.356) 6.457 10.798 ( 1.982 -15.576 -2.989) 15.983 11.500 ( 2.099 19.546 4.599) 20.189 11.688 ( 22.769 -2.622 -20.667) 30.862 12.755 ( 19.095 0.694 6.360) 20.138 13.835 ( -0.907 5.895 -2.527) 6.478 13.955 ( -8.049 -3.141 11.183) 14.132 14.138 ( -2.168 0.136 -1.661) 2.734 14.748 ( 10.387 9.465 -2.723) 14.314 17.333 ( -18.998 -0.824 -5.370) 19.760 18.903 ( 16.209 -0.989 9.588) 18.858 19.186 ( -1.024 5.740 -6.733) 8.906 19.836 ( 2.785 0.409 0.011) 2.815 20.790 ( -15.642 -6.889 -6.740) 18.373 23.048 ( 23.138 1.346 7.300) 24.300 23.715 ( -7.536 4.009 -2.921) 9.022 24.480 ( 6.386 -0.998 4.704) 7.994 ======================= Grid point 688 (346/432) ======================= q-point: ( 0.45 -0.55 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( -7.181 0.000 6.176) 9.472 2.795 ( -7.221 0.000 -0.452) 7.235 2.976 ( -4.919 0.000 0.660) 4.963 2.987 ( 0.457 -0.000 5.636) 5.654 3.276 ( -2.943 0.000 0.810) 3.053 3.417 ( 4.556 -0.000 5.829) 7.398 3.836 ( 11.435 -0.000 -5.346) 12.623 4.122 ( -9.847 0.000 -8.067) 12.730 5.015 ( 2.109 -0.000 9.466) 9.699 5.119 ( 5.081 -0.000 3.848) 6.373 5.672 ( -1.006 0.000 10.929) 10.975 5.842 ( 6.854 -0.000 -1.506) 7.018 6.719 ( -2.920 0.000 9.829) 10.254 6.909 ( -0.382 0.000 4.536) 4.552 7.783 ( 3.127 -0.000 0.286) 3.140 7.808 ( -9.317 0.000 1.151) 9.388 9.576 ( 7.461 -0.000 11.235) 13.487 9.670 ( -12.956 0.000 19.111) 23.089 9.840 ( -29.906 0.000 30.998) 43.072 10.649 ( 18.483 -0.000 6.579) 19.619 11.511 ( 14.980 -0.000 -25.359) 29.453 11.646 ( -1.881 0.000 -20.387) 20.474 12.477 ( -9.027 0.000 -1.990) 9.244 12.807 ( 1.681 -0.000 -8.334) 8.501 13.772 ( -6.962 0.000 7.670) 10.359 13.797 ( 15.554 -0.000 3.031) 15.846 14.271 ( 3.726 -0.000 -1.580) 4.047 14.663 ( -13.647 0.000 1.065) 13.689 18.064 ( 13.559 -0.000 -16.349) 21.240 18.336 ( 0.717 -0.000 22.591) 22.603 19.266 ( -12.996 0.000 -15.129) 19.945 19.842 ( -2.713 0.000 -6.752) 7.277 21.213 ( 36.291 -0.000 0.673) 36.297 22.096 ( -20.741 0.000 3.490) 21.033 24.344 ( -8.347 0.000 -3.312) 8.980 24.354 ( -1.860 0.000 -3.152) 3.660 ======================= Grid point 690 (347/432) ======================= q-point: (-0.45 0.45 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( 1.749 0.631 6.396) 6.661 2.697 ( -2.204 -0.279 -3.281) 3.963 2.943 ( -0.504 2.070 3.245) 3.882 3.091 ( 0.809 -1.901 2.494) 3.238 3.187 ( -7.819 1.074 2.551) 8.295 3.517 ( -3.728 -1.962 7.817) 8.880 3.904 ( -2.847 0.606 -11.749) 12.104 3.983 ( 15.003 -0.103 -4.092) 15.551 5.114 ( 0.275 1.345 6.393) 6.538 5.209 ( 1.394 -3.168 1.340) 3.711 5.746 ( -3.279 2.380 8.932) 9.808 5.914 ( 3.012 -1.484 1.021) 3.510 6.789 ( -3.569 -2.308 8.598) 9.591 6.951 ( -2.270 -4.249 0.511) 4.844 7.768 ( 1.523 0.072 4.722) 4.962 7.854 ( 3.816 -4.873 -1.389) 6.343 9.671 ( -18.188 1.292 19.329) 26.573 9.816 ( -1.690 -0.916 16.810) 16.919 9.839 ( -15.371 -2.383 25.075) 29.508 10.981 ( 18.327 0.794 6.985) 19.629 11.328 ( -9.592 3.444 -17.291) 20.071 11.436 ( 15.626 -0.040 -23.218) 27.987 12.355 ( -4.389 6.059 -1.286) 7.591 12.645 ( -1.901 6.853 -11.489) 13.512 13.751 ( -5.428 3.366 8.165) 10.366 14.024 ( 7.504 -9.897 -2.222) 12.617 14.365 ( 10.466 2.463 3.967) 11.460 14.465 ( -15.933 1.013 -0.171) 15.966 18.128 ( 16.401 0.294 -6.979) 17.826 18.460 ( -9.075 -1.035 -0.681) 9.159 19.035 ( -3.609 -1.594 1.522) 4.229 19.739 ( 0.253 -0.171 -8.522) 8.527 21.710 ( 36.125 -0.242 1.671) 36.164 21.821 ( -23.055 -0.141 -1.247) 23.089 24.203 ( -8.335 0.435 -1.220) 8.435 24.298 ( -0.902 0.995 -2.592) 2.919 ======================= Grid point 691 (348/432) ======================= q-point: (-0.36 -0.55 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 7.154 3.096 6.146) 9.927 2.696 ( 6.439 -1.753 -1.866) 6.929 2.960 ( -1.682 1.808 0.129) 2.473 3.058 ( -1.462 -4.085 -0.441) 4.361 3.201 ( -1.747 4.871 8.373) 9.843 3.486 ( -16.567 -4.368 6.242) 18.235 3.804 ( 8.543 -1.701 -12.526) 15.257 4.126 ( 15.028 3.303 -4.400) 16.003 5.150 ( -2.937 -0.094 4.019) 4.979 5.229 ( -2.892 -3.354 -1.010) 4.542 5.750 ( -6.191 3.271 6.942) 9.860 5.958 ( -0.151 -1.464 0.815) 1.683 6.831 ( -7.150 -2.055 2.932) 7.996 6.944 ( -4.507 -9.333 2.122) 10.579 7.928 ( 6.163 -3.647 -4.262) 8.333 7.962 ( 12.483 -7.211 6.633) 15.869 9.630 ( -21.532 0.224 21.790) 30.635 9.877 ( -19.755 -2.301 26.246) 32.931 10.065 ( 8.811 -1.130 8.627) 12.383 10.954 ( -14.658 1.140 -12.547) 19.328 11.166 ( 1.674 3.299 -4.971) 6.197 11.464 ( 23.401 0.017 -14.364) 27.458 12.197 ( -4.157 16.982 1.311) 17.533 12.482 ( 6.532 7.581 -8.511) 13.137 13.761 ( -6.719 -1.218 9.237) 11.487 14.108 ( 0.517 -9.149 -4.902) 10.392 14.237 ( -14.207 2.524 -0.341) 14.433 14.574 ( 15.474 4.185 4.762) 16.723 18.138 ( -18.651 0.399 -15.834) 24.469 18.320 ( 17.327 0.317 1.206) 17.372 19.188 ( 4.140 -3.435 11.931) 13.087 19.667 ( 5.286 -0.211 -9.933) 11.254 21.459 ( -25.532 -0.046 -5.619) 26.143 22.197 ( 34.293 -0.210 1.432) 34.323 24.085 ( -8.410 1.968 1.265) 8.730 24.274 ( 1.281 0.293 -0.521) 1.414 ======================= Grid point 692 (349/432) ======================= q-point: (-0.27 -0.55 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.586 ( 2.026 4.538 6.637) 8.292 2.850 ( 12.336 -1.162 -4.409) 13.151 2.912 ( 0.643 -1.588 3.890) 4.250 3.109 ( 3.370 1.367 -0.127) 3.639 3.178 ( -9.930 0.565 3.262) 10.467 3.407 ( -6.209 -4.127 5.853) 9.478 3.817 ( 11.153 -0.759 -11.829) 16.275 4.221 ( 10.540 4.375 -2.468) 11.675 5.120 ( -7.791 -1.960 0.490) 8.049 5.183 ( -4.983 -2.480 -0.565) 5.595 5.685 ( -9.272 3.338 4.457) 10.816 5.948 ( -2.264 -0.756 -1.371) 2.753 6.702 ( -14.139 -1.652 0.173) 14.237 7.067 ( 0.952 -12.939 4.415) 13.704 7.963 ( 5.427 -1.085 -6.990) 8.915 8.323 ( 17.640 -13.578 4.287) 22.670 9.611 ( -20.564 -1.337 23.425) 31.199 9.930 ( -15.746 -4.314 18.893) 24.970 10.250 ( 6.715 3.046 4.741) 8.767 10.639 ( -15.874 -7.044 -8.403) 19.292 10.946 ( -10.268 12.025 -9.163) 18.275 11.595 ( 21.270 0.580 -17.273) 27.407 12.031 ( -2.422 21.787 5.329) 22.559 12.530 ( 16.308 5.104 0.126) 17.089 13.796 ( -9.102 -5.717 9.702) 14.480 14.040 ( -6.609 3.061 -2.022) 7.559 14.133 ( -1.899 -5.195 -2.274) 5.980 14.776 ( 14.786 6.082 2.560) 16.192 17.697 ( -20.497 -0.110 -14.082) 24.868 18.589 ( 16.594 0.190 6.407) 17.789 19.341 ( 2.229 2.895 4.028) 5.438 19.696 ( 10.912 -3.265 -5.389) 12.600 21.043 ( -25.641 -1.859 -8.295) 27.014 22.642 ( 31.111 -0.646 0.184) 31.118 23.970 ( -7.956 5.598 2.851) 10.137 24.322 ( 3.007 -2.055 2.768) 4.575 ======================= Grid point 693 (350/432) ======================= q-point: (-0.18 -0.55 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.615 ( -8.080 3.302 10.846) 13.922 2.844 ( 4.087 1.148 -6.823) 8.036 3.007 ( -16.341 -4.262 -0.497) 16.895 3.122 ( 5.906 5.149 -0.828) 7.879 3.152 ( 13.848 -1.635 4.354) 14.608 3.527 ( 7.089 -3.811 5.342) 9.660 3.829 ( 12.719 3.230 -12.022) 17.797 4.283 ( 3.822 1.793 1.721) 4.559 4.992 ( -10.891 0.098 -1.559) 11.002 5.132 ( -6.473 -3.302 -0.239) 7.270 5.552 ( -11.505 2.981 1.158) 11.941 5.883 ( -3.021 -0.439 -4.455) 5.401 6.529 ( -15.967 -1.808 2.740) 16.301 7.257 ( 3.733 -12.658 3.340) 13.613 7.937 ( 4.348 0.383 -8.408) 9.473 8.693 ( 14.410 -15.319 -0.803) 21.047 9.637 ( -20.350 -2.733 24.593) 32.037 9.942 ( -12.522 -2.209 9.436) 15.835 10.199 ( -8.228 -5.042 -7.278) 12.087 10.539 ( -15.385 19.846 -1.357) 25.147 10.606 ( 2.107 -6.973 0.540) 7.304 11.647 ( 20.294 -1.964 -21.197) 29.411 11.867 ( -3.170 22.859 5.639) 23.757 12.775 ( 18.110 1.144 3.819) 18.544 13.814 ( -10.183 -6.935 5.140) 13.350 13.963 ( -1.224 4.393 4.522) 6.422 14.125 ( -0.559 -2.787 -2.511) 3.793 14.908 ( 12.847 8.906 -0.690) 15.647 17.318 ( -19.629 -0.881 -5.432) 20.386 18.885 ( 14.941 -1.024 7.739) 16.857 19.311 ( 3.886 8.944 -5.128) 11.018 19.826 ( 6.625 -1.846 0.011) 6.877 20.672 ( -19.592 -6.737 -8.275) 22.310 23.032 ( 27.106 -2.653 -1.329) 27.268 23.836 ( -8.347 9.662 3.142) 13.149 24.446 ( 4.491 -3.209 5.985) 8.141 ======================= Grid point 694 (351/432) ======================= q-point: (-0.09 -0.55 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( -15.123 2.211 12.284) 19.608 2.678 ( -11.631 3.041 -9.689) 15.440 2.931 ( 1.417 -3.042 -2.540) 4.209 3.164 ( 6.886 1.627 0.392) 7.086 3.382 ( 9.617 0.042 5.121) 10.895 3.739 ( 10.242 -1.690 5.137) 11.583 3.826 ( 14.651 5.682 -12.067) 19.813 4.338 ( -2.212 -2.079 5.789) 6.537 4.818 ( -12.031 2.667 0.265) 12.326 5.053 ( -6.763 -1.560 -1.881) 7.191 5.365 ( -12.267 2.224 -1.969) 12.621 5.789 ( -1.639 -1.658 -7.597) 7.947 6.392 ( -14.882 -2.240 6.631) 16.446 7.415 ( 3.508 -4.770 1.132) 6.028 7.913 ( 4.825 -3.196 -7.496) 9.470 8.879 ( 2.397 -11.038 -6.235) 12.902 9.616 ( -24.428 2.283 18.618) 30.799 9.841 ( -8.367 0.915 0.649) 8.442 10.084 ( -12.796 3.946 0.803) 13.415 10.231 ( -3.875 -0.764 -0.232) 3.957 10.781 ( 6.771 -6.369 5.848) 10.982 11.685 ( 10.798 2.221 -13.289) 17.266 11.724 ( 7.440 9.629 -5.395) 13.311 13.003 ( 11.196 0.176 1.243) 11.266 13.766 ( -5.433 -1.650 -0.951) 5.757 14.018 ( -4.261 -2.028 9.846) 10.918 14.115 ( 2.794 0.870 -1.154) 3.146 14.948 ( 11.069 12.489 -3.690) 17.091 17.098 ( -16.186 -0.665 7.593) 17.891 19.094 ( 7.219 1.778 -8.716) 11.456 19.271 ( 10.018 6.107 5.616) 13.007 19.854 ( -1.893 1.634 0.269) 2.515 20.494 ( -6.513 -10.151 -5.938) 13.443 23.375 ( 22.495 -6.015 -2.010) 23.372 23.649 ( -10.368 13.097 2.277) 16.859 24.614 ( 5.131 -2.223 7.623) 9.454 ======================= Grid point 701 (352/432) ======================= q-point: (-0.45 -0.45 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( 11.079 -0.000 5.805) 12.508 2.674 ( 4.623 -0.000 -3.340) 5.703 2.995 ( -7.873 0.000 -2.802) 8.357 3.003 ( 2.770 -0.000 4.418) 5.214 3.250 ( 0.732 -0.000 8.335) 8.367 3.442 ( -19.127 0.000 6.696) 20.265 3.787 ( 7.912 -0.000 -12.371) 14.684 4.154 ( 15.817 -0.000 -4.425) 16.424 5.152 ( -3.176 0.000 2.834) 4.257 5.192 ( -2.774 0.000 -0.357) 2.797 5.781 ( -6.051 0.000 6.247) 8.697 5.944 ( -0.224 0.000 1.860) 1.874 6.822 ( -3.081 0.000 7.327) 7.948 6.850 ( -8.598 0.000 -2.140) 8.860 7.898 ( 10.274 -0.000 5.157) 11.495 7.904 ( 9.536 -0.000 -3.889) 10.298 9.631 ( -22.765 0.000 22.165) 31.773 9.857 ( -20.176 0.000 25.859) 32.799 10.056 ( 10.191 -0.000 9.784) 14.128 10.962 ( -18.021 0.000 -15.063) 23.488 11.191 ( 4.606 -0.000 -4.170) 6.213 11.464 ( 23.554 -0.000 -13.945) 27.373 12.380 ( 0.630 -0.000 2.301) 2.386 12.522 ( 0.294 -0.000 -8.911) 8.916 13.762 ( -7.048 0.000 6.682) 9.712 14.009 ( 1.548 -0.000 -2.666) 3.083 14.260 ( -14.720 0.000 0.209) 14.722 14.612 ( 15.338 -0.000 4.987) 16.128 18.142 ( -18.739 0.000 -15.924) 24.591 18.323 ( 17.245 -0.000 1.332) 17.297 19.158 ( 5.025 -0.000 13.515) 14.419 19.666 ( 5.017 -0.000 -10.332) 11.485 21.460 ( -24.811 0.000 -6.696) 25.699 22.195 ( 34.976 -0.000 0.577) 34.981 24.102 ( -7.570 0.000 2.153) 7.870 24.276 ( -0.183 0.000 -0.777) 0.798 ======================= Grid point 702 (353/432) ======================= q-point: (-0.36 -0.45 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( 4.162 6.262 3.970) 8.503 2.798 ( 13.332 -5.443 2.163) 14.562 2.887 ( -2.357 -0.470 -2.940) 3.797 3.109 ( 2.943 -0.496 3.365) 4.498 3.215 ( -15.391 2.250 2.962) 15.834 3.356 ( 0.361 -1.739 5.647) 5.920 3.795 ( 10.134 -1.100 -9.676) 14.055 4.279 ( 11.126 1.957 -3.827) 11.928 5.101 ( -7.431 -0.136 0.654) 7.461 5.136 ( -5.496 -2.407 -1.221) 6.123 5.730 ( -8.672 1.575 3.065) 9.331 5.941 ( -2.653 -0.174 0.572) 2.720 6.683 ( -13.244 -0.466 -0.958) 13.287 6.897 ( -0.092 -5.940 5.103) 7.832 7.980 ( 9.991 2.065 -5.050) 11.383 8.148 ( 16.971 -6.598 1.332) 18.257 9.595 ( -22.592 -0.494 24.351) 33.220 9.880 ( -15.899 -1.536 18.710) 24.601 10.292 ( 10.579 1.653 6.931) 12.754 10.550 ( -21.460 -3.085 -11.383) 24.487 11.076 ( -5.541 3.662 -8.688) 10.936 11.605 ( 19.463 0.473 -15.610) 24.954 12.350 ( -1.371 14.416 5.304) 15.422 12.557 ( 10.648 -2.783 -0.986) 11.050 13.738 ( -8.009 -1.048 6.436) 10.327 14.006 ( -0.964 -4.414 -2.032) 4.954 14.108 ( -8.315 1.029 1.469) 8.506 14.851 ( 14.848 2.405 3.262) 15.392 17.696 ( -20.903 -0.057 -14.468) 25.422 18.591 ( 16.079 0.067 6.377) 17.297 19.383 ( 5.947 1.638 11.265) 12.843 19.649 ( 10.636 -1.784 -10.555) 15.091 21.024 ( -25.842 -0.482 -10.823) 28.021 22.630 ( 31.801 -0.519 -2.314) 31.889 24.050 ( -5.747 3.103 5.853) 8.770 24.287 ( 0.343 -1.636 1.995) 2.603 ======================= Grid point 703 (354/432) ======================= q-point: (-0.27 -0.45 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.669 ( -11.015 3.279 10.004) 15.237 2.875 ( 8.439 2.181 -6.468) 10.854 2.908 ( -18.144 -6.278 1.751) 19.279 3.118 ( 11.580 -2.380 1.517) 11.919 3.227 ( 8.775 6.190 1.242) 10.810 3.474 ( 7.942 -2.411 3.113) 8.865 3.847 ( 12.282 -0.575 -8.128) 14.739 4.325 ( 2.344 2.728 -0.039) 3.597 4.987 ( -10.693 -0.653 0.378) 10.720 5.068 ( -5.139 -3.407 -2.417) 6.623 5.599 ( -10.651 2.200 -0.674) 10.897 5.886 ( -4.068 0.477 -2.211) 4.654 6.503 ( -15.439 -1.185 2.049) 15.619 7.040 ( 3.711 -10.833 3.318) 11.922 8.004 ( 8.804 6.096 -6.564) 12.560 8.452 ( 16.794 -12.636 -3.311) 21.276 9.598 ( -21.987 -1.662 25.926) 34.034 9.889 ( -10.429 -3.427 10.055) 14.887 10.130 ( -20.627 -2.274 -7.964) 22.228 10.531 ( 9.093 -2.533 0.839) 9.477 10.824 ( -12.304 12.304 -0.082) 17.401 11.626 ( 17.198 -0.512 -21.012) 27.158 12.226 ( -6.386 18.485 6.036) 20.467 12.770 ( 15.272 -2.327 2.109) 15.591 13.722 ( -7.536 -2.811 5.848) 9.944 14.007 ( -0.532 -1.566 -0.384) 1.698 14.062 ( -2.510 -1.849 1.802) 3.601 15.029 ( 13.595 5.105 0.365) 14.527 17.305 ( -20.114 -0.583 -5.476) 20.854 18.871 ( 14.277 -0.582 6.439) 15.673 19.475 ( 7.650 10.054 -1.136) 12.684 19.768 ( 10.611 -5.139 -1.329) 11.864 20.576 ( -23.709 -4.298 -11.595) 26.740 22.983 ( 27.085 -2.575 -6.100) 27.882 24.009 ( -4.634 9.962 7.570) 13.342 24.373 ( 1.788 -5.210 5.956) 8.113 ======================= Grid point 704 (355/432) ======================= q-point: (-0.18 -0.45 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.576 ( -18.572 -0.243 10.900) 21.536 2.682 ( -18.992 -3.227 -3.122) 19.516 2.912 ( 6.809 1.704 -3.096) 7.671 3.220 ( 6.493 3.574 -2.025) 7.683 3.385 ( 12.635 0.665 2.677) 12.933 3.675 ( 15.343 -3.670 0.638) 15.789 3.938 ( 15.055 4.932 -6.234) 17.025 4.311 ( -7.268 -0.144 6.657) 9.857 4.846 ( -12.834 -0.162 1.606) 12.935 5.007 ( -2.204 -2.642 -4.225) 5.449 5.405 ( -11.396 1.962 -4.336) 12.350 5.783 ( -3.902 0.596 -5.403) 6.692 6.359 ( -14.836 -1.627 6.375) 16.230 7.239 ( 5.610 -13.151 2.071) 14.447 7.970 ( 8.236 8.382 -7.594) 13.992 8.671 ( 8.433 -13.327 -8.798) 18.059 9.607 ( -24.401 -2.064 25.015) 35.006 9.858 ( -16.430 -0.189 5.550) 17.343 9.910 ( -2.203 -11.632 -4.450) 12.648 10.414 ( -9.775 9.894 -9.039) 16.587 10.792 ( 4.298 6.877 13.769) 15.980 11.625 ( 17.634 -3.433 -22.105) 28.485 12.021 ( -8.472 18.368 3.327) 20.499 12.988 ( 10.802 -2.203 0.786) 11.052 13.707 ( -6.782 -3.566 2.925) 8.201 14.013 ( -0.712 -0.444 0.646) 1.059 14.091 ( 0.989 -2.450 1.845) 3.223 15.129 ( 12.717 8.532 -3.141) 15.632 17.087 ( -15.926 -0.565 9.044) 18.324 19.090 ( 12.454 -1.104 -3.765) 13.057 19.445 ( 7.703 13.205 -1.703) 15.382 19.870 ( -0.056 0.183 0.059) 0.200 20.303 ( -9.416 -12.329 -6.290) 16.740 23.256 ( 21.868 -6.440 -8.940) 24.487 23.916 ( -5.806 16.611 7.411) 19.093 24.545 ( 3.612 -6.127 8.521) 11.099 ======================= Grid point 705 (356/432) ======================= q-point: (-0.09 -0.45 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( -18.387 -0.202 -6.133) 19.384 2.459 ( -20.101 -3.771 11.194) 23.315 2.953 ( 5.236 0.974 -2.000) 5.689 3.264 ( 8.029 0.309 -2.971) 8.566 3.529 ( 4.433 1.392 3.505) 5.821 3.940 ( 18.143 -0.573 -4.756) 18.765 3.949 ( 5.401 9.803 0.814) 11.222 4.325 ( -6.106 -2.991 9.242) 11.474 4.697 ( -13.963 0.549 4.282) 14.615 4.961 ( 1.016 -0.700 -4.811) 4.967 5.188 ( -10.062 1.021 -5.323) 11.429 5.669 ( -1.091 -0.906 -8.154) 8.276 6.296 ( -11.540 -1.965 10.673) 15.841 7.419 ( 3.748 -8.468 0.858) 9.300 7.919 ( 7.443 5.524 -9.466) 13.248 8.710 ( -0.966 -9.988 -6.473) 11.941 9.503 ( -27.356 5.459 16.660) 32.492 9.777 ( -5.229 -0.191 3.618) 6.361 9.931 ( -5.328 -6.989 -1.768) 8.964 10.201 ( -4.097 -0.522 2.619) 4.890 10.953 ( 6.003 3.684 9.315) 11.678 11.640 ( 14.465 -3.731 -19.896) 24.880 11.798 ( -4.566 11.389 -2.502) 12.523 13.086 ( 2.413 -0.975 -1.039) 2.802 13.666 ( -5.306 -3.477 -1.179) 6.453 13.989 ( -4.938 -0.971 0.750) 5.089 14.183 ( 4.259 -3.287 3.500) 6.418 15.155 ( 12.418 11.847 -6.133) 18.226 17.099 ( -9.390 1.717 22.296) 24.254 19.030 ( 5.225 4.617 -21.629) 22.726 19.525 ( 8.660 3.680 8.122) 12.430 19.831 ( -0.614 0.476 -1.190) 1.421 20.328 ( 0.352 -10.295 -1.590) 10.423 23.459 ( 13.915 -7.698 -10.115) 18.847 23.755 ( -5.747 18.603 6.874) 20.648 24.735 ( 3.231 -4.587 7.756) 9.573 ======================= Grid point 713 (357/432) ======================= q-point: (-0.36 -0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.710 ( -12.010 0.000 8.225) 14.557 2.838 ( -19.190 0.000 3.873) 19.577 2.900 ( 11.340 -0.000 -7.244) 13.456 3.090 ( 10.837 -0.000 1.646) 10.961 3.291 ( 8.957 -0.000 2.139) 9.209 3.450 ( 7.987 -0.000 1.784) 8.184 3.837 ( 11.866 -0.000 -6.707) 13.630 4.352 ( 1.958 -0.000 -0.030) 1.958 4.976 ( -11.210 0.000 -0.694) 11.231 5.040 ( -3.759 0.000 -1.915) 4.219 5.618 ( -10.513 0.000 -1.430) 10.610 5.891 ( -4.429 0.000 -1.286) 4.612 6.493 ( -15.200 0.000 1.731) 15.298 6.942 ( 3.589 -0.000 3.250) 4.842 8.082 ( 10.389 -0.000 -3.713) 11.032 8.319 ( 17.209 -0.000 -6.194) 18.289 9.584 ( -22.557 0.000 26.215) 34.584 9.856 ( -9.885 0.000 7.687) 12.522 10.114 ( -25.508 0.000 -4.093) 25.834 10.510 ( 12.087 -0.000 -1.048) 12.133 10.929 ( -9.882 0.000 0.846) 9.918 11.624 ( 15.551 -0.000 -20.474) 25.710 12.413 ( -9.656 0.000 5.736) 11.231 12.724 ( 15.114 -0.000 2.045) 15.252 13.711 ( -4.351 0.000 4.073) 5.960 13.958 ( -2.007 0.000 0.447) 2.056 14.066 ( -2.673 0.000 2.389) 3.585 15.072 ( 13.730 -0.000 0.680) 13.746 17.300 ( -20.293 0.000 -5.489) 21.022 18.866 ( 14.085 -0.000 5.998) 15.309 19.609 ( 6.169 -0.000 10.817) 12.453 19.677 ( 15.338 -0.000 -11.877) 19.399 20.539 ( -25.601 0.000 -13.436) 28.913 22.960 ( 26.783 -0.000 -7.392) 27.785 24.118 ( -1.204 0.000 10.512) 10.581 24.307 ( -0.963 0.000 4.310) 4.416 ======================= Grid point 714 (358/432) ======================= q-point: (-0.27 -0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.572 ( -22.092 -0.046 5.858) 22.856 2.617 ( -18.820 -2.912 3.515) 19.365 2.954 ( 7.745 2.013 -4.152) 9.015 3.246 ( 7.063 -0.112 -1.335) 7.189 3.414 ( 11.921 1.940 -0.861) 12.109 3.632 ( 17.077 -1.327 0.307) 17.131 3.976 ( 17.046 0.381 -2.534) 17.238 4.336 ( -9.431 2.005 7.949) 12.497 4.810 ( -13.885 -2.511 -0.442) 14.117 4.990 ( 1.085 0.081 -4.315) 4.450 5.426 ( -11.547 0.635 -5.840) 12.955 5.795 ( -5.081 0.520 -4.015) 6.497 6.340 ( -14.800 -0.621 6.400) 16.136 7.062 ( 6.405 -6.094 1.433) 8.956 8.139 ( 10.170 9.762 -3.755) 14.588 8.452 ( 11.188 -11.208 -12.365) 20.092 9.572 ( -21.415 -1.494 20.322) 29.560 9.743 ( -13.942 -4.602 -0.577) 14.693 9.892 ( -14.085 0.864 12.190) 18.647 10.490 ( 0.171 1.143 -15.500) 15.543 10.932 ( -1.662 6.092 16.873) 18.016 11.586 ( 15.653 -1.086 -22.038) 27.054 12.266 ( -13.201 8.731 3.547) 16.219 12.938 ( 11.099 -2.667 1.159) 11.473 13.681 ( -4.247 0.208 -0.429) 4.274 13.961 ( -2.077 -3.721 1.028) 4.383 14.080 ( 1.046 0.401 2.305) 2.563 15.227 ( 13.471 2.974 -2.957) 14.109 17.080 ( -15.769 -0.222 9.997) 18.672 19.075 ( 13.318 -0.521 -3.181) 13.702 19.679 ( 10.741 13.511 -2.632) 17.460 19.844 ( 6.706 -4.530 1.129) 8.171 20.110 ( -18.927 -8.386 -9.118) 22.620 23.179 ( 21.263 -2.375 -10.424) 23.800 24.177 ( -0.618 13.591 9.174) 16.409 24.409 ( 0.548 -9.624 8.040) 12.552 ======================= Grid point 715 (359/432) ======================= q-point: (-0.18 -0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -22.039 -4.361 2.637) 22.620 2.390 ( -22.097 -2.043 3.473) 22.462 2.990 ( 5.136 2.950 -0.843) 5.983 3.264 ( 6.366 -0.776 -7.927) 10.196 3.547 ( 6.884 0.911 2.347) 7.330 3.914 ( 22.260 -0.388 1.135) 22.292 4.139 ( 8.642 9.311 -0.686) 12.722 4.290 ( -8.420 -0.632 12.214) 14.848 4.659 ( -14.993 -4.558 2.574) 15.880 4.958 ( 3.704 0.436 -6.901) 7.845 5.193 ( -10.807 -0.295 -7.389) 13.095 5.670 ( -3.521 0.557 -6.397) 7.323 6.271 ( -11.611 -1.004 11.205) 16.167 7.231 ( 6.429 -10.606 0.129) 12.403 8.083 ( 7.851 12.323 -11.101) 18.350 8.529 ( 4.476 -11.589 -7.001) 14.260 9.520 ( -22.160 -2.489 18.329) 28.865 9.687 ( -10.240 -8.764 8.954) 16.182 9.864 ( -4.700 2.068 3.589) 6.265 10.259 ( -6.921 3.520 -9.106) 11.967 11.065 ( 2.357 7.708 13.829) 16.007 11.574 ( 17.155 -3.077 -21.041) 27.322 12.024 ( -13.189 12.128 -0.054) 17.918 13.057 ( 3.133 -1.766 -0.527) 3.635 13.593 ( -6.518 -4.387 -4.236) 8.926 13.961 ( -3.628 -2.476 0.414) 4.412 14.141 ( 3.443 -1.251 2.451) 4.407 15.309 ( 13.491 6.277 -7.119) 16.495 17.124 ( -7.580 1.151 24.617) 25.783 19.075 ( 7.597 1.051 -23.336) 24.564 19.652 ( 2.793 10.647 6.052) 12.561 19.836 ( 0.364 0.451 -1.858) 1.947 20.130 ( 2.839 -13.073 0.416) 13.384 23.344 ( 17.593 -4.965 -10.604) 21.134 24.087 ( -4.713 19.553 6.376) 21.099 24.610 ( 1.773 -10.297 7.553) 12.892 ======================= Grid point 716 (360/432) ======================= q-point: (-0.09 -0.36 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( -19.720 -2.018 -0.824) 19.840 2.252 ( -20.210 -8.924 10.267) 24.362 3.015 ( 4.887 2.606 -1.943) 5.870 3.299 ( 7.954 -4.170 -5.993) 10.797 3.597 ( -0.488 2.192 0.313) 2.267 3.998 ( -14.322 12.398 6.124) 19.908 4.169 ( 12.366 5.509 -1.347) 13.604 4.426 ( 11.337 -0.248 5.672) 12.679 4.558 ( -13.141 -3.869 6.565) 15.191 4.911 ( 0.509 -2.397 -8.215) 8.572 5.042 ( -3.055 -0.423 -1.139) 3.287 5.575 ( 2.149 -0.678 -7.406) 7.741 6.304 ( -6.951 -0.828 14.481) 16.084 7.389 ( 3.236 -10.436 -0.137) 10.927 7.911 ( 3.857 6.353 -16.677) 18.258 8.646 ( 4.034 -3.880 5.842) 8.091 9.388 ( -25.036 6.811 15.914) 30.438 9.776 ( -2.612 3.123 -0.723) 4.135 9.806 ( -2.586 -10.545 5.663) 12.246 10.147 ( -4.852 -6.028 2.465) 8.121 11.158 ( 2.146 6.566 6.803) 9.695 11.577 ( 8.447 1.724 -15.783) 17.984 11.747 ( -5.069 5.691 -6.552) 10.050 13.051 ( -3.756 -1.316 -0.540) 4.016 13.518 ( -5.784 -8.166 -3.585) 10.630 13.920 ( -6.043 -0.670 1.906) 6.372 14.239 ( 3.800 -3.461 2.334) 5.645 15.312 ( 12.486 8.993 -11.273) 19.075 17.376 ( 0.433 5.064 30.391) 30.813 18.816 ( 2.723 0.426 -27.693) 27.830 19.732 ( 4.639 5.355 5.231) 8.806 19.857 ( 8.272 0.164 -2.536) 8.653 20.259 ( 0.480 -9.182 1.291) 9.284 23.475 ( 11.793 -2.095 -8.382) 14.619 23.887 ( -6.928 18.379 2.906) 19.855 24.766 ( -1.181 -8.939 4.072) 9.894 ======================= Grid point 725 (361/432) ======================= q-point: (-0.27 -0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( -23.107 0.000 5.411) 23.732 2.377 ( -22.922 0.000 1.034) 22.946 3.022 ( 5.463 -0.000 -0.215) 5.467 3.251 ( 5.200 -0.000 -10.192) 11.442 3.557 ( 7.495 -0.000 1.783) 7.704 3.914 ( 23.466 -0.000 1.827) 23.537 4.214 ( 19.366 -0.000 -0.662) 19.378 4.307 ( -18.360 0.000 17.143) 25.119 4.600 ( -13.970 0.000 -0.877) 13.998 4.964 ( 3.775 -0.000 -7.478) 8.377 5.189 ( -11.557 0.000 -8.063) 14.092 5.676 ( -4.351 0.000 -5.802) 7.253 6.262 ( -11.641 0.000 11.540) 16.392 7.133 ( 7.106 -0.000 -0.480) 7.122 8.268 ( 2.930 -0.000 -22.588) 22.777 8.354 ( 11.830 -0.000 4.353) 12.605 9.478 ( -12.866 0.000 8.659) 15.508 9.619 ( -18.333 0.000 16.824) 24.882 9.890 ( -9.259 0.000 11.893) 15.073 10.286 ( -3.917 0.000 -15.635) 16.118 11.143 ( -0.348 0.000 15.384) 15.388 11.547 ( 17.316 -0.000 -20.770) 27.042 12.134 ( -15.252 0.000 0.779) 15.272 13.043 ( 5.130 -0.000 -0.119) 5.132 13.549 ( -8.051 0.000 -8.093) 11.416 13.933 ( -3.552 0.000 2.811) 4.529 14.133 ( 3.513 -0.000 1.304) 3.748 15.362 ( 13.868 -0.000 -7.498) 15.765 17.135 ( -6.851 0.000 25.569) 26.471 19.081 ( 8.255 -0.000 -23.315) 24.734 19.787 ( -10.718 0.000 2.999) 11.130 19.895 ( 13.845 -0.000 -5.356) 14.845 19.921 ( 2.153 -0.000 5.903) 6.284 23.302 ( 18.082 -0.000 -10.774) 21.048 24.383 ( -4.612 0.000 7.930) 9.174 24.395 ( 2.489 -0.000 5.796) 6.308 ======================= Grid point 726 (362/432) ======================= q-point: (-0.18 -0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( -23.386 -0.106 1.304) 23.423 2.121 ( -21.425 -5.424 8.540) 23.693 3.078 ( 5.220 4.101 -1.009) 6.715 3.219 ( 7.283 -4.599 -10.385) 13.492 3.624 ( 0.290 0.888 0.306) 0.983 4.186 ( -21.764 8.247 16.455) 28.503 4.252 ( 20.958 3.510 1.450) 21.299 4.425 ( 9.439 0.024 2.344) 9.726 4.470 ( -7.045 -5.380 0.521) 8.879 4.868 ( -2.228 -1.981 -11.864) 12.233 5.036 ( -1.806 -0.191 -0.624) 1.920 5.572 ( 0.201 0.061 -6.119) 6.122 6.297 ( -6.665 -0.087 15.636) 16.997 7.230 ( 5.272 -6.053 -1.787) 8.223 8.003 ( 0.533 3.272 -21.553) 21.806 8.608 ( 12.296 -0.811 9.319) 15.450 9.427 ( -21.557 -0.662 18.903) 28.678 9.636 ( -1.012 -5.974 5.700) 8.319 9.871 ( -9.788 5.695 8.464) 14.138 10.077 ( -5.996 -3.258 -8.249) 10.705 11.235 ( -0.914 2.358 4.768) 5.397 11.595 ( 17.990 0.658 -12.903) 22.148 11.879 ( -17.590 5.992 -3.661) 18.940 13.053 ( -2.015 1.558 -0.904) 2.702 13.367 ( -9.194 -7.489 -5.373) 13.018 13.910 ( -5.207 -0.431 2.458) 5.775 14.203 ( 4.398 -0.963 0.950) 4.601 15.415 ( 13.139 3.106 -12.466) 18.376 17.439 ( 3.118 2.115 31.599) 31.823 18.811 ( 1.386 -0.480 -30.284) 30.320 19.825 ( 6.835 2.075 5.706) 9.143 19.903 ( 4.097 8.153 -1.724) 9.286 20.084 ( 2.508 -11.173 1.456) 11.544 23.426 ( 16.982 -1.973 -9.406) 19.513 24.239 ( -6.939 20.993 3.148) 22.333 24.556 ( -3.402 -15.945 3.034) 16.584 ======================= Grid point 727 (363/432) ======================= q-point: (-0.09 -0.27 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.860 ( -14.889 -3.545 8.476) 17.495 2.050 ( -16.746 -9.443 12.411) 22.883 3.080 ( 6.182 3.766 -4.062) 8.300 3.284 ( 8.048 -6.774 -6.647) 12.444 3.541 ( -7.800 2.017 -3.589) 8.820 3.949 ( -24.471 10.784 13.581) 29.993 4.282 ( 3.078 12.124 -10.123) 16.091 4.440 ( -8.409 -4.489 7.644) 12.219 4.650 ( 9.299 -7.853 -5.581) 13.390 4.829 ( 8.136 0.155 4.329) 9.217 5.070 ( 2.654 -0.393 3.985) 4.804 5.571 ( 8.891 -0.385 -4.570) 10.004 6.430 ( -1.664 1.358 17.598) 17.729 7.327 ( 1.731 -9.974 -1.386) 10.218 7.775 ( 1.709 1.856 -16.620) 16.811 8.869 ( 7.909 6.175 14.530) 17.657 9.335 ( -19.707 5.688 17.780) 27.145 9.692 ( -0.697 -0.583 -5.685) 5.758 9.868 ( 2.216 -5.398 11.210) 12.637 10.023 ( -9.233 -9.479 3.984) 13.819 11.215 ( -2.533 2.830 -3.456) 5.135 11.460 ( -15.992 8.062 -7.333) 19.353 11.716 ( 11.844 0.290 -8.399) 14.523 12.978 ( -6.188 0.457 0.475) 6.223 13.329 ( -6.245 -11.363 1.034) 13.008 13.861 ( -6.426 -0.331 2.244) 6.814 14.281 ( 3.610 -2.266 0.734) 4.325 15.370 ( 10.760 5.800 -16.639) 20.647 17.836 ( 9.796 7.281 27.239) 29.849 18.527 ( 4.257 -3.743 -26.877) 27.469 19.812 ( -3.107 7.972 -2.475) 8.907 19.999 ( 15.485 -0.604 -4.869) 16.244 20.213 ( 0.354 -8.521 6.029) 10.444 23.549 ( 12.070 1.681 -6.475) 13.800 23.934 ( -11.302 19.090 -2.323) 22.306 24.630 ( -7.942 -14.500 0.561) 16.542 ======================= Grid point 737 (364/432) ======================= q-point: (-0.18 -0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -17.108 0.000 9.016) 19.339 1.962 ( -16.960 0.000 12.435) 21.030 3.168 ( 4.719 -0.000 -0.970) 4.818 3.170 ( 10.291 -0.000 -11.638) 15.535 3.559 ( -7.776 0.000 -3.370) 8.474 4.062 ( -30.823 0.000 17.556) 35.472 4.383 ( -4.907 0.000 6.902) 8.469 4.453 ( 5.976 -0.000 -12.445) 13.806 4.516 ( 6.022 -0.000 -7.726) 9.796 4.828 ( 12.707 -0.000 5.251) 13.749 5.068 ( 1.994 -0.000 4.038) 4.504 5.569 ( 8.328 -0.000 -3.678) 9.104 6.446 ( -1.000 0.000 19.140) 19.166 7.228 ( 2.624 -0.000 -2.956) 3.952 7.791 ( 1.090 -0.000 -17.380) 17.414 8.933 ( 14.460 -0.000 14.112) 20.205 9.370 ( -22.809 0.000 23.019) 32.406 9.676 ( 7.362 -0.000 -3.904) 8.333 9.872 ( -1.701 0.000 -11.679) 11.802 9.904 ( -15.539 0.000 21.268) 26.340 11.222 ( 0.184 -0.000 -5.273) 5.276 11.563 ( -25.004 0.000 -6.093) 25.736 11.720 ( 14.302 -0.000 -6.964) 15.907 13.004 ( -5.465 0.000 -0.969) 5.550 13.196 ( -7.294 0.000 3.165) 7.951 13.858 ( -6.237 0.000 1.762) 6.481 14.262 ( 4.273 -0.000 0.068) 4.274 15.419 ( 11.131 -0.000 -17.332) 20.598 17.905 ( 12.458 -0.000 28.447) 31.056 18.487 ( 2.443 -0.000 -28.970) 29.073 19.927 ( -5.551 0.000 -3.008) 6.314 19.980 ( 13.514 -0.000 -8.404) 15.914 20.109 ( 4.658 -0.000 10.834) 11.793 23.546 ( 16.781 -0.000 -7.709) 18.467 24.239 ( -13.377 0.000 -9.771) 16.565 24.384 ( -9.197 0.000 7.665) 11.973 ======================= Grid point 738 (365/432) ======================= q-point: (-0.09 -0.18 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( -4.357 -2.411 16.801) 17.524 1.965 ( -10.698 -5.623 16.512) 20.463 3.145 ( 4.744 4.754 -4.620) 8.152 3.246 ( 7.879 -6.562 -8.083) 13.056 3.373 ( -11.184 1.295 -4.779) 12.231 3.858 ( -21.610 4.392 14.739) 26.524 4.232 ( -3.172 9.659 -14.366) 17.599 4.442 ( -5.430 -2.375 6.982) 9.158 4.477 ( -0.085 -7.040 -7.876) 10.564 5.139 ( 12.091 0.779 12.793) 17.620 5.158 ( 6.497 -0.610 2.428) 6.962 5.696 ( 14.225 0.342 -1.476) 14.305 6.681 ( 4.382 3.660 19.234) 20.063 7.240 ( -0.490 -7.305 -2.277) 7.668 7.668 ( 3.263 0.531 -7.976) 8.634 9.217 ( 2.343 12.322 17.901) 21.858 9.371 ( -10.923 0.749 19.673) 22.514 9.639 ( 0.928 1.089 -4.958) 5.161 9.836 ( -1.586 -12.419 -2.640) 12.795 10.031 ( -2.070 -2.760 19.830) 20.128 11.073 ( -20.714 9.638 -4.927) 23.371 11.200 ( -7.061 -6.652 -6.965) 11.943 11.773 ( 9.213 1.310 -10.916) 14.344 12.904 ( -7.792 1.442 0.683) 7.954 13.237 ( -3.477 -7.062 8.791) 11.800 13.789 ( -5.984 -0.631 0.294) 6.025 14.312 ( 2.757 -0.955 -0.290) 2.932 15.320 ( 8.203 2.768 -20.102) 21.887 18.205 ( 7.291 5.961 -17.282) 19.681 18.413 ( 17.282 -4.181 12.351) 21.649 19.728 ( -9.618 5.682 -8.659) 14.134 19.999 ( 1.807 -3.917 -7.474) 8.630 20.388 ( 16.556 -1.920 9.048) 18.965 23.642 ( 0.413 7.706 -4.743) 9.058 23.822 ( -9.097 7.227 -11.073) 16.050 24.389 ( -11.620 -11.847 3.638) 16.988 ======================= Grid point 749 (366/432) ======================= q-point: (-0.09 -0.09 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.039 ( 1.268 -0.000 17.874) 17.919 2.050 ( -4.606 0.000 20.135) 20.655 3.136 ( -1.187 0.000 -1.992) 2.319 3.167 ( -8.445 0.000 -5.563) 10.113 3.275 ( 11.057 -0.000 -8.236) 13.788 3.817 ( -10.068 0.000 10.623) 14.636 4.038 ( -7.165 0.000 -13.789) 15.539 4.237 ( -7.674 0.000 -10.000) 12.606 4.567 ( 2.353 -0.000 10.242) 10.509 5.227 ( -0.876 0.000 5.982) 6.045 5.432 ( 11.780 -0.000 6.982) 13.694 5.883 ( 14.320 -0.000 -0.284) 14.323 7.003 ( 10.004 -0.000 14.088) 17.278 7.150 ( -3.434 0.000 -2.199) 4.078 7.725 ( 5.628 -0.000 8.536) 10.224 9.429 ( -19.662 0.000 30.670) 36.432 9.543 ( 10.338 -0.000 4.447) 11.254 9.552 ( -6.651 0.000 -1.414) 6.800 9.815 ( 8.689 -0.000 1.374) 8.797 10.191 ( -7.622 0.000 17.283) 18.889 10.819 ( -16.331 0.000 4.634) 16.976 11.018 ( -2.403 0.000 -10.460) 10.732 11.708 ( 5.026 -0.000 -17.238) 17.956 12.801 ( -10.406 0.000 0.208) 10.408 13.302 ( -1.260 0.000 11.867) 11.934 13.714 ( -2.803 0.000 -1.626) 3.240 14.328 ( 0.883 -0.000 -0.508) 1.019 15.189 ( 5.476 -0.000 -20.506) 21.225 18.077 ( 10.155 -0.000 -20.753) 23.104 18.839 ( 21.060 -0.000 11.534) 24.012 19.458 ( -13.849 0.000 -14.541) 20.081 19.892 ( -4.445 0.000 -5.044) 6.723 20.744 ( 22.906 -0.000 8.390) 24.394 23.297 ( -34.280 0.000 -9.585) 35.595 23.844 ( 15.054 -0.000 -6.408) 16.361 24.242 ( -11.851 0.000 4.662) 12.735 ======================= Grid point 750 (367/432) ======================= q-point: ( 0.00 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.579 ( -0.335 0.000 8.115) 8.122 2.657 ( -0.178 0.000 1.310) 1.322 2.975 ( 3.247 -0.000 0.457) 3.279 3.031 ( -0.890 0.000 -6.672) 6.731 3.321 ( 4.568 -0.000 5.895) 7.458 3.447 ( -1.972 0.000 -3.944) 4.409 3.713 ( -8.051 0.000 -1.174) 8.136 3.772 ( 3.756 -0.000 -6.242) 7.285 5.102 ( 3.408 -0.000 7.703) 8.423 5.228 ( -1.706 0.000 -4.693) 4.993 5.880 ( -5.419 0.000 9.815) 11.211 6.049 ( 5.771 -0.000 -6.479) 8.677 7.082 ( -9.025 0.000 6.625) 11.196 7.231 ( 8.444 -0.000 -7.394) 11.224 9.070 ( 7.692 -0.000 25.894) 27.012 9.508 ( -4.525 0.000 -17.799) 18.365 9.635 ( -14.801 0.000 13.208) 19.837 9.858 ( 13.615 -0.000 -8.526) 16.064 9.966 ( -6.944 0.000 17.328) 18.667 10.347 ( -2.076 0.000 -18.659) 18.774 10.616 ( -12.953 0.000 25.151) 28.291 11.062 ( 14.005 -0.000 -19.498) 24.006 11.677 ( 21.141 -0.000 17.772) 27.618 12.021 ( -20.345 0.000 -15.717) 25.709 13.651 ( -3.372 0.000 4.417) 5.557 13.709 ( 4.946 -0.000 -1.780) 5.256 14.394 ( -3.439 0.000 7.179) 7.960 14.589 ( 2.975 -0.000 -11.756) 12.127 18.067 ( 19.012 -0.000 3.607) 19.351 18.248 ( -19.764 0.000 -13.736) 24.068 19.529 ( 13.641 -0.000 0.789) 13.664 19.551 ( -11.405 0.000 -1.490) 11.502 21.838 ( 29.020 -0.000 10.335) 30.806 22.030 ( -32.184 0.000 -8.372) 33.255 24.027 ( -11.813 0.000 0.868) 11.844 24.050 ( 12.603 -0.000 -1.648) 12.710 ======================= Grid point 751 (368/432) ======================= q-point: ( 0.09 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.620 ( -1.175 2.867 -1.496) 3.441 2.678 ( 3.653 -2.178 0.564) 4.290 2.941 ( -3.165 -0.213 -1.902) 3.699 3.034 ( 3.768 -0.409 0.475) 3.820 3.347 ( -2.244 -0.107 -7.485) 7.815 3.436 ( 3.574 1.463 3.293) 5.075 3.667 ( -3.732 -0.409 6.237) 7.280 3.839 ( 8.990 -3.945 0.331) 9.823 5.127 ( -3.513 -0.710 -7.368) 8.193 5.207 ( 0.921 -0.538 4.909) 5.024 5.873 ( -10.391 0.891 7.711) 12.971 6.006 ( 1.822 1.023 -8.631) 8.880 7.016 ( -13.062 0.621 7.103) 14.881 7.241 ( 5.304 -0.950 -6.209) 8.222 9.010 ( -15.597 21.438 -13.761) 29.870 9.301 ( -2.575 6.191 11.151) 13.012 9.686 ( -8.831 -10.644 8.728) 16.354 9.960 ( 4.344 -4.439 -12.481) 13.940 10.136 ( -5.574 -1.773 15.458) 16.528 10.215 ( 7.142 -11.111 -1.308) 13.273 10.774 ( -0.474 2.122 18.968) 19.092 11.062 ( 20.283 -0.536 -20.920) 29.144 11.587 ( -13.762 2.690 -17.561) 22.472 12.166 ( 23.487 1.110 16.007) 28.445 13.653 ( -3.727 -3.888 1.763) 5.667 13.754 ( 3.486 -4.700 -4.026) 7.103 14.427 ( -5.453 2.054 9.719) 11.332 14.501 ( 2.336 0.456 -8.520) 8.846 17.863 ( -19.426 -0.048 -7.920) 20.978 18.401 ( 19.383 -0.063 10.087) 21.851 19.369 ( -12.151 0.507 -2.676) 12.452 19.686 ( 9.957 0.545 -0.020) 9.972 21.530 ( -28.655 0.976 -7.842) 29.725 22.343 ( 28.544 0.475 11.503) 30.778 23.886 ( -10.934 -0.811 -0.020) 10.964 24.201 ( 12.037 -0.788 -0.958) 12.101 ======================= Grid point 752 (369/432) ======================= q-point: ( 0.18 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.533 ( -2.365 0.020 -5.664) 6.138 2.705 ( 0.106 -4.685 -6.793) 8.252 2.965 ( 4.101 0.014 5.110) 6.553 3.073 ( -1.260 0.479 1.354) 1.910 3.251 ( 1.780 -4.206 -8.622) 9.757 3.493 ( 4.578 5.906 4.092) 8.520 3.733 ( 1.119 3.069 8.977) 9.553 4.041 ( 9.538 -6.967 3.555) 12.335 4.988 ( -5.205 -1.867 -8.317) 9.988 5.238 ( -3.884 -0.673 2.705) 4.780 5.767 ( -14.725 1.638 4.863) 15.594 5.895 ( 0.284 1.779 -10.785) 10.935 6.883 ( -15.669 2.806 5.994) 17.009 7.265 ( 3.613 -3.630 -3.431) 6.165 8.481 ( -12.154 16.838 -16.342) 26.425 9.271 ( -6.287 7.385 5.915) 11.360 9.725 ( -9.054 -7.295 3.339) 12.098 9.826 ( -1.696 -4.326 -11.955) 12.826 10.243 ( -5.553 0.062 16.007) 16.943 10.423 ( -3.066 -10.262 4.040) 11.446 10.973 ( 10.725 5.544 4.956) 13.051 11.146 ( 16.626 -3.477 -8.031) 18.788 11.273 ( 4.963 2.839 -19.035) 19.875 12.602 ( 20.889 2.924 10.425) 23.528 13.667 ( -1.253 -5.199 -0.509) 5.372 13.789 ( 1.678 -9.435 -5.131) 10.870 14.412 ( -4.018 3.698 4.050) 6.799 14.489 ( -0.714 -1.694 3.063) 3.573 17.569 ( -18.268 0.126 0.485) 18.274 18.788 ( 18.329 0.305 13.505) 22.769 19.166 ( -10.481 0.881 -5.529) 11.883 19.786 ( 4.889 -0.206 0.856) 4.968 21.091 ( -22.472 1.696 -7.764) 23.836 22.828 ( 26.028 1.937 11.744) 28.620 23.749 ( -10.187 -1.086 -1.218) 10.317 24.361 ( 11.111 -2.011 0.335) 11.297 ======================= Grid point 753 (370/432) ======================= q-point: ( 0.27 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.453 ( -1.623 -5.820 -8.632) 10.536 2.639 ( -4.112 -7.387 -6.417) 10.614 3.000 ( -8.140 0.770 0.218) 8.179 3.115 ( 10.101 1.428 4.066) 10.982 3.303 ( 7.016 -6.531 -3.334) 10.148 3.558 ( 5.400 8.251 6.153) 11.623 3.828 ( 5.903 6.427 6.232) 10.723 4.260 ( 7.477 -6.480 4.722) 10.963 4.852 ( -5.648 -3.141 -6.022) 8.834 5.167 ( -10.661 -0.842 0.518) 10.707 5.580 ( -16.892 2.131 2.438) 17.200 5.750 ( 1.069 2.217 -12.916) 13.148 6.718 ( -14.645 3.686 6.013) 16.255 7.311 ( 1.768 -5.209 -1.525) 5.709 8.073 ( -5.040 9.605 -15.002) 18.513 9.165 ( -4.498 11.465 2.134) 12.499 9.626 ( -9.040 -5.617 -6.366) 12.401 9.771 ( -6.772 -10.556 -1.641) 12.648 10.305 ( -13.878 -6.294 8.163) 17.287 10.415 ( -5.045 4.508 8.195) 10.627 10.981 ( 8.262 11.723 -4.399) 15.001 11.253 ( 27.361 1.796 -24.915) 37.049 11.399 ( 8.244 -6.683 8.890) 13.844 12.877 ( 13.145 2.470 2.886) 13.683 13.666 ( -0.612 -4.660 -5.363) 7.131 13.883 ( 5.799 -9.979 -1.672) 11.662 14.378 ( -4.761 4.186 6.065) 8.774 14.562 ( -0.211 -5.666 5.681) 8.027 17.404 ( -16.088 0.108 10.926) 19.448 18.952 ( -7.096 -0.684 -10.346) 12.564 19.168 ( 16.273 2.718 13.246) 21.158 19.841 ( -0.783 -1.930 2.398) 3.176 20.742 ( -14.162 2.905 -7.474) 16.274 23.243 ( 22.013 4.508 9.552) 24.416 23.608 ( -10.181 -1.834 -2.031) 10.543 24.538 ( 9.772 -3.543 2.478) 10.686 ======================= Grid point 754 (371/432) ======================= q-point: ( 0.36 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( -5.459 -6.591 -11.485) 14.323 2.646 ( 0.774 -10.482 -1.015) 10.560 2.885 ( -8.846 1.285 1.072) 9.003 3.275 ( 9.592 4.454 4.638) 11.548 3.410 ( 4.254 -8.815 -3.601) 10.429 3.634 ( 5.009 6.514 5.737) 10.022 3.923 ( 11.316 8.598 2.568) 14.442 4.438 ( 1.978 -4.511 6.300) 7.997 4.766 ( -4.733 -2.909 -1.663) 5.799 5.005 ( -12.101 -2.114 -2.487) 12.534 5.361 ( -16.256 2.451 1.930) 16.553 5.600 ( 2.129 2.030 -13.973) 14.279 6.589 ( -11.006 3.338 6.716) 13.318 7.365 ( 0.416 -6.327 0.215) 6.344 7.842 ( 0.987 3.967 -12.304) 12.965 9.017 ( -1.782 15.799 0.182) 15.900 9.464 ( -13.414 -10.383 -7.292) 18.464 9.773 ( -4.502 -8.186 1.072) 9.404 10.182 ( -12.752 -4.367 -1.147) 13.528 10.463 ( -7.543 4.827 18.071) 20.168 10.980 ( 12.092 9.177 -4.009) 15.700 11.299 ( 23.484 5.681 -21.423) 32.291 11.598 ( 2.973 -4.535 3.622) 6.521 13.005 ( 6.721 -0.379 -0.421) 6.745 13.626 ( -1.127 -4.654 -5.838) 7.551 14.009 ( 5.523 -4.589 -2.611) 7.641 14.360 ( -3.429 4.594 7.304) 9.286 14.702 ( 2.365 -9.002 4.805) 10.475 17.402 ( -12.398 -0.991 21.329) 24.691 18.741 ( -2.371 -0.946 -17.035) 17.226 19.466 ( 12.228 3.219 9.730) 15.955 19.849 ( -4.842 -2.086 2.520) 5.844 20.513 ( -5.466 3.160 -5.159) 8.153 23.466 ( -0.182 4.726 -5.610) 7.338 23.542 ( 6.822 -1.865 8.875) 11.349 24.726 ( 7.588 -3.909 4.317) 9.565 ======================= Grid point 755 (372/432) ======================= q-point: (-0.55 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( -6.192 -3.024 -7.053) 9.861 2.733 ( -12.948 -0.883 10.889) 16.941 2.805 ( 7.878 -4.606 -7.695) 11.937 3.366 ( 4.695 8.972 4.397) 11.039 3.489 ( 1.422 -10.936 -3.753) 11.650 3.690 ( 3.064 1.074 0.467) 3.280 4.055 ( 12.280 5.291 1.901) 13.506 4.485 ( -8.270 -1.351 5.222) 9.873 4.735 ( -3.719 -3.258 1.987) 5.329 4.892 ( -1.733 -1.469 -3.971) 4.575 5.187 ( -11.486 2.704 5.501) 13.019 5.464 ( 3.423 1.074 -13.456) 13.927 6.528 ( -6.334 2.110 6.885) 9.590 7.440 ( -0.029 -6.629 2.882) 7.228 7.713 ( 2.651 2.831 -11.323) 11.969 8.886 ( -0.167 13.227 1.931) 13.368 9.309 ( -12.341 -11.486 -4.991) 17.583 9.804 ( -1.218 -2.940 2.107) 3.816 10.065 ( -7.086 -1.929 -0.528) 7.363 10.516 ( -11.738 3.623 19.589) 23.122 11.036 ( 10.984 2.751 -5.312) 12.507 11.289 ( 16.520 6.977 -17.071) 24.759 11.647 ( -0.762 -1.824 -0.592) 2.064 13.064 ( 2.065 -1.068 -0.585) 2.397 13.588 ( -0.839 -2.393 -3.980) 4.719 14.036 ( -0.960 -0.306 -0.408) 1.088 14.373 ( -0.402 3.898 5.045) 6.388 14.855 ( 4.772 -8.464 -0.537) 9.731 17.570 ( -7.177 -2.923 27.265) 28.345 18.514 ( 1.728 -0.398 -23.224) 23.292 19.655 ( 7.442 1.854 4.829) 9.063 19.816 ( -3.118 -0.121 0.332) 3.138 20.419 ( -0.936 2.013 -1.316) 2.581 23.370 ( -4.806 -2.840 -2.470) 6.104 23.699 ( 6.997 2.634 2.500) 7.883 24.875 ( 3.566 -1.767 3.554) 5.336 ======================= Grid point 756 (373/432) ======================= q-point: (-0.45 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( -3.200 1.885 1.796) 4.126 2.616 ( -14.633 7.872 10.499) 19.655 2.910 ( 10.121 -3.308 -5.756) 12.104 3.374 ( 1.875 8.146 2.830) 8.825 3.498 ( -3.908 -4.996 -4.660) 7.870 3.737 ( 1.921 -8.942 -3.457) 9.778 4.083 ( -9.434 -3.499 -0.823) 10.096 4.524 ( 9.292 -0.025 2.298) 9.572 4.739 ( -2.910 1.658 3.819) 5.079 4.837 ( -2.278 -0.123 -2.090) 3.094 5.172 ( -2.150 2.521 11.033) 11.520 5.393 ( 7.707 -0.361 -10.347) 12.907 6.542 ( -1.375 0.051 6.120) 6.273 7.524 ( -1.235 -2.102 5.177) 5.723 7.591 ( 2.532 3.031 -10.757) 11.459 8.861 ( -2.085 -1.446 5.562) 6.114 9.245 ( -3.148 -5.073 0.138) 5.971 9.821 ( 0.649 3.243 1.153) 3.503 10.027 ( -1.150 -0.423 2.457) 2.746 10.531 ( -15.026 4.561 19.839) 25.302 11.065 ( 7.257 -1.056 -10.860) 13.104 11.239 ( 4.559 -0.217 -11.028) 11.935 11.639 ( 1.407 1.654 -0.254) 2.187 13.061 ( -2.215 0.555 -0.203) 2.293 13.552 ( -0.935 1.666 -0.718) 2.041 14.006 ( -4.524 1.458 2.704) 5.468 14.385 ( -0.021 3.753 3.020) 4.818 14.938 ( 5.502 -6.375 -8.038) 11.642 17.833 ( -1.052 -4.049 18.991) 19.446 18.295 ( 4.932 0.707 -18.806) 19.454 19.716 ( -1.544 -0.208 -1.214) 1.975 19.828 ( 6.783 -0.306 -0.889) 6.848 20.397 ( -0.258 2.008 1.151) 2.329 23.341 ( -4.329 -7.570 0.125) 8.721 23.746 ( 3.157 2.280 -1.948) 4.355 24.908 ( -2.147 2.250 0.380) 3.133 ======================= Grid point 757 (374/432) ======================= q-point: (-0.36 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( 0.403 5.673 10.180) 11.661 2.483 ( -11.337 11.196 11.698) 19.767 2.990 ( 10.129 0.701 -4.931) 11.288 3.334 ( -0.926 9.333 0.363) 9.386 3.389 ( -8.875 -5.593 -5.227) 11.720 3.787 ( -0.738 -12.777 -6.568) 14.385 3.951 ( -12.816 -8.251 -1.642) 15.330 4.586 ( -1.198 2.487 -6.379) 6.951 4.689 ( -3.157 4.760 4.598) 7.332 4.933 ( 13.738 -0.231 4.983) 14.616 5.294 ( -0.221 1.267 14.184) 14.242 5.451 ( 13.615 -1.676 -5.786) 14.888 6.630 ( 3.837 -2.780 4.338) 6.424 7.445 ( 1.962 7.612 -7.418) 10.808 7.613 ( -1.625 -1.967 7.637) 8.052 8.977 ( -3.534 -17.142 6.600) 18.706 9.307 ( 4.584 2.084 5.653) 7.571 9.798 ( 3.264 8.663 0.185) 9.260 10.101 ( 6.482 2.431 4.872) 8.465 10.491 ( -19.990 3.791 20.882) 29.155 10.999 ( 0.150 -0.959 -10.413) 10.459 11.162 ( -2.971 -6.261 -8.855) 11.244 11.645 ( 2.282 3.006 -1.347) 4.007 12.998 ( -5.872 1.117 0.173) 5.980 13.526 ( -0.704 5.277 3.638) 6.448 13.950 ( -6.694 3.211 3.472) 8.196 14.380 ( -0.211 3.631 2.175) 4.238 14.928 ( 5.829 -4.723 -14.669) 16.476 17.872 ( 6.635 -0.609 -19.632) 20.732 18.372 ( 6.726 -2.324 15.329) 16.900 19.627 ( -7.433 -3.199 -6.231) 10.213 19.918 ( 9.096 0.889 -4.089) 10.012 20.421 ( 3.435 1.823 4.266) 5.773 23.373 ( -8.735 -14.329 2.870) 17.025 23.707 ( 3.752 4.721 -6.879) 9.148 24.792 ( -7.814 6.245 -2.132) 10.228 ======================= Grid point 758 (375/432) ======================= q-point: (-0.27 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( 0.927 5.655 13.101) 14.299 2.430 ( -4.027 10.505 13.896) 17.879 3.062 ( 9.086 1.764 -2.938) 9.710 3.195 ( -6.649 0.982 -5.448) 8.652 3.270 ( -6.990 1.791 -1.328) 7.337 3.757 ( -3.777 -12.205 -11.804) 17.394 3.885 ( -7.547 -8.024 0.800) 11.044 4.391 ( -7.147 5.881 -8.181) 12.353 4.710 ( 0.144 4.525 8.432) 9.571 5.167 ( 13.524 0.091 0.484) 13.533 5.454 ( -0.249 -0.554 15.702) 15.714 5.629 ( 16.751 -2.353 -2.577) 17.110 6.782 ( 8.677 -5.423 1.419) 10.331 7.336 ( 1.159 7.600 -4.393) 8.855 7.747 ( 1.573 -2.747 14.884) 15.217 9.173 ( -1.802 -22.278 3.405) 22.609 9.431 ( 3.131 1.959 9.551) 10.240 9.784 ( 8.986 13.467 -0.779) 16.209 10.225 ( 8.211 12.120 7.751) 16.565 10.469 ( -18.248 -7.567 20.749) 28.649 10.856 ( -12.430 -0.831 -1.310) 12.526 11.073 ( 0.051 -1.940 -9.409) 9.607 11.573 ( -2.166 2.950 -8.080) 8.870 12.899 ( -9.399 -1.090 0.075) 9.462 13.534 ( 0.141 6.455 7.199) 9.670 13.849 ( -6.945 5.853 1.706) 9.241 14.371 ( -0.582 3.090 2.067) 3.763 14.855 ( 6.336 -4.043 -18.114) 19.612 17.744 ( 11.397 0.182 -21.033) 23.923 18.696 ( 11.047 -2.885 14.597) 18.532 19.425 ( -13.117 -4.354 -11.511) 17.986 19.921 ( 2.350 2.794 -5.613) 6.696 20.593 ( 14.234 0.504 7.306) 16.007 23.330 ( -24.738 -17.905 -0.167) 30.538 23.671 ( 14.191 7.870 -7.378) 17.825 24.579 ( -11.287 7.479 -1.567) 13.630 ======================= Grid point 759 (376/432) ======================= q-point: (-0.18 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( 1.046 1.450 12.037) 12.169 2.498 ( -0.509 7.379 14.612) 16.377 3.055 ( -6.491 -2.352 -4.591) 8.292 3.118 ( -1.200 1.643 3.095) 3.704 3.171 ( 6.755 4.475 -6.807) 10.583 3.650 ( -6.355 -9.581 -10.729) 15.726 3.864 ( -3.013 -4.764 -2.783) 6.287 4.144 ( -8.926 6.830 -6.732) 13.101 4.806 ( 3.249 3.013 9.850) 10.801 5.274 ( 4.496 0.825 -0.803) 4.641 5.644 ( 1.675 -1.401 13.293) 13.471 5.838 ( 15.329 -2.106 -2.356) 15.651 6.964 ( 10.241 -6.239 -0.915) 12.027 7.244 ( -0.081 7.053 -2.028) 7.340 8.069 ( 8.490 -7.321 22.595) 25.223 9.354 ( 1.699 -17.297 -1.206) 17.422 9.571 ( -1.903 -5.021 11.233) 12.451 9.771 ( 7.732 14.393 -0.197) 16.340 10.262 ( 0.047 18.249 11.793) 21.728 10.594 ( -1.139 -14.097 -1.962) 14.278 10.679 ( -25.253 2.686 19.097) 31.775 11.015 ( 6.430 3.101 -3.048) 7.762 11.369 ( -3.919 2.137 -14.757) 15.418 12.743 ( -15.410 -3.306 -3.770) 16.205 13.578 ( 0.382 5.251 8.235) 9.774 13.733 ( -2.490 7.399 0.168) 7.808 14.361 ( -1.438 1.740 2.424) 3.313 14.766 ( 6.061 -3.543 -17.357) 18.723 17.719 ( 14.952 0.016 -13.573) 20.193 19.010 ( 11.481 -0.072 5.763) 12.846 19.107 ( -14.191 -4.932 -12.931) 19.823 19.831 ( -4.169 1.874 -3.719) 5.893 20.927 ( 22.547 0.191 8.313) 24.032 23.020 ( -30.899 -8.884 -7.105) 32.926 23.767 ( 14.489 2.760 -3.372) 15.130 24.361 ( -12.304 4.986 0.418) 13.283 ======================= Grid point 760 (377/432) ======================= q-point: (-0.09 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( -0.521 -0.736 10.236) 10.276 2.598 ( 0.094 2.134 10.034) 10.258 2.968 ( -2.400 -0.992 -1.963) 3.256 3.087 ( 1.112 1.412 -3.059) 3.547 3.217 ( 7.294 1.751 -0.482) 7.517 3.528 ( -5.314 -3.906 -6.045) 8.946 3.815 ( -1.474 -2.934 -6.220) 7.033 3.903 ( -8.295 5.869 -5.431) 11.522 4.954 ( 4.225 1.086 9.751) 10.682 5.279 ( 0.203 0.619 -2.078) 2.178 5.799 ( -1.017 -0.838 11.177) 11.254 5.993 ( 11.036 -1.196 -4.116) 11.839 7.098 ( -0.632 -3.577 2.665) 4.505 7.191 ( 7.120 3.848 -4.784) 9.402 8.571 ( 12.393 -9.127 26.745) 30.858 9.485 ( 1.498 -15.487 -3.483) 15.944 9.680 ( -1.064 5.149 8.760) 10.217 9.790 ( 2.806 -2.937 2.225) 4.631 10.119 ( -7.082 24.069 1.723) 25.149 10.534 ( -9.542 -5.340 1.004) 10.980 10.594 ( -15.599 1.889 9.112) 18.164 11.143 ( 5.850 -2.551 -16.703) 17.881 11.248 ( 13.490 2.545 13.555) 19.292 12.443 ( -20.805 -2.369 -10.847) 23.582 13.630 ( -0.994 3.157 7.161) 7.888 13.683 ( 2.961 4.789 -0.426) 5.646 14.366 ( -2.290 0.073 4.225) 4.807 14.680 ( 4.621 -2.053 -14.580) 15.432 17.830 ( 17.508 0.023 -4.684) 18.124 18.678 ( -18.942 -0.356 -16.432) 25.079 19.307 ( 15.079 -1.685 3.548) 15.583 19.705 ( -8.642 0.489 -1.929) 8.868 21.355 ( 27.132 0.063 9.160) 28.637 22.550 ( -32.888 -2.761 -8.777) 34.151 23.905 ( 13.211 0.816 -2.183) 13.415 24.181 ( -12.316 1.853 1.205) 12.513 ======================= Grid point 762 (378/432) ======================= q-point: ( 0.09 0.09 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( -3.786 0.000 -7.364) 8.280 2.649 ( -1.657 0.000 -6.865) 7.062 2.964 ( 3.390 -0.000 6.297) 7.151 3.088 ( 5.069 -0.000 -0.648) 5.110 3.202 ( -2.490 0.000 -9.323) 9.650 3.559 ( 4.945 -0.000 6.764) 8.379 3.764 ( 1.318 -0.000 10.648) 10.729 3.962 ( 9.573 -0.000 2.769) 9.966 4.972 ( -5.146 0.000 -8.941) 10.316 5.233 ( -3.626 0.000 2.665) 4.500 5.782 ( -14.930 0.000 5.183) 15.804 5.911 ( 0.520 -0.000 -10.995) 11.008 6.911 ( -16.118 0.000 7.509) 17.782 7.228 ( 3.695 -0.000 -4.841) 6.090 8.654 ( -15.598 0.000 -24.408) 28.967 9.251 ( -15.629 0.000 12.748) 20.168 9.757 ( -6.798 0.000 11.325) 13.209 9.783 ( -1.478 0.000 -13.510) 13.590 10.205 ( 9.883 -0.000 -10.331) 14.297 10.325 ( -7.709 0.000 24.453) 25.640 11.040 ( 8.624 -0.000 15.709) 17.920 11.101 ( 18.728 -0.000 -15.901) 24.568 11.311 ( 6.350 -0.000 -22.857) 23.722 12.632 ( 20.969 -0.000 11.333) 23.836 13.623 ( -0.235 0.000 1.804) 1.819 13.697 ( 0.578 -0.000 -6.995) 7.019 14.438 ( 1.615 -0.000 -6.654) 6.847 14.480 ( -7.927 0.000 13.195) 15.393 17.571 ( -18.137 0.000 0.467) 18.143 18.791 ( 18.235 -0.000 13.744) 22.834 19.175 ( -10.982 0.000 -4.506) 11.871 19.784 ( 4.283 -0.000 0.340) 4.297 21.105 ( -21.741 0.000 -8.556) 23.364 22.843 ( 24.227 -0.000 14.145) 28.054 23.743 ( -8.847 0.000 -1.522) 8.977 24.342 ( 11.291 -0.000 -0.790) 11.318 ======================= Grid point 763 (379/432) ======================= q-point: ( 0.18 0.09 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.388 ( -5.019 -1.770 -9.234) 10.658 2.537 ( -2.794 -3.790 -8.755) 9.941 3.015 ( -5.279 0.786 -2.544) 5.913 3.140 ( 8.271 1.653 2.060) 8.682 3.202 ( 7.279 -4.519 -0.256) 8.571 3.695 ( 3.647 6.110 10.318) 12.534 3.911 ( 6.570 2.907 8.541) 11.161 4.143 ( 7.212 -5.676 4.241) 10.110 4.808 ( -5.325 -1.600 -7.739) 9.529 5.158 ( -11.287 -0.253 0.729) 11.313 5.609 ( -16.996 1.055 3.036) 17.298 5.782 ( 2.014 1.131 -13.576) 13.771 6.772 ( -15.876 2.127 7.629) 17.742 7.237 ( 2.357 -2.805 -2.978) 4.722 8.179 ( -11.422 3.002 -22.042) 25.007 9.224 ( -11.243 -1.445 11.397) 16.075 9.647 ( -7.549 0.009 -3.174) 8.189 9.676 ( -6.954 3.501 -1.866) 8.006 10.164 ( -2.977 -7.740 -10.204) 13.149 10.460 ( -10.546 1.253 21.132) 23.651 11.150 ( 14.087 6.303 -11.380) 19.175 11.275 ( 28.921 0.899 -23.175) 37.072 11.346 ( 11.521 -1.150 11.192) 16.104 12.923 ( 12.091 2.161 2.397) 12.514 13.605 ( -1.386 -2.063 -7.537) 7.937 13.732 ( 7.686 -6.011 2.285) 10.022 14.395 ( 0.957 -0.744 -4.276) 4.444 14.529 ( -9.270 0.308 16.239) 18.701 17.405 ( -16.151 0.038 10.508) 19.269 18.940 ( -8.035 -0.433 -8.085) 11.407 19.213 ( 15.851 1.753 14.277) 21.405 19.813 ( -1.719 -1.029 1.611) 2.571 20.772 ( -12.836 0.829 -9.324) 15.887 23.259 ( 8.959 -0.716 15.982) 18.336 23.638 ( 1.785 2.724 -3.769) 4.981 24.482 ( 9.884 -2.228 -0.356) 10.138 ======================= Grid point 764 (380/432) ======================= q-point: ( 0.27 0.09 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( -3.357 -4.270 -9.685) 11.105 2.487 ( 1.564 -7.562 -5.010) 9.205 2.896 ( -7.356 0.322 -1.296) 7.476 3.243 ( 4.842 -5.722 -2.705) 7.969 3.363 ( 9.570 1.625 4.360) 10.641 3.775 ( 0.052 9.171 10.862) 14.216 4.068 ( 10.955 7.703 5.065) 14.318 4.319 ( 1.333 -8.622 5.729) 10.437 4.714 ( -1.812 -3.361 -3.468) 5.158 4.965 ( -16.849 -1.808 -1.634) 17.025 5.405 ( -15.697 2.354 2.562) 16.078 5.642 ( 3.965 2.321 -15.543) 16.208 6.647 ( -12.255 3.253 7.575) 14.770 7.263 ( 0.130 -5.105 -1.145) 5.233 7.847 ( -4.883 -2.157 -16.529) 17.369 9.223 ( -5.564 5.060 10.379) 12.817 9.386 ( -16.177 4.027 -6.542) 17.908 9.642 ( -2.106 -7.017 -0.353) 7.335 10.054 ( -7.554 -8.163 -7.311) 13.310 10.525 ( -12.883 2.156 20.604) 24.396 11.146 ( 23.568 7.494 -21.844) 32.997 11.413 ( 23.455 7.607 -10.723) 26.889 11.580 ( 8.650 1.016 5.231) 10.159 13.012 ( 5.155 1.293 -1.446) 5.508 13.530 ( -2.060 -6.162 -6.910) 9.484 13.921 ( 9.216 -4.918 -0.572) 10.462 14.377 ( 0.464 -2.015 -2.638) 3.351 14.619 ( -6.300 -0.994 17.697) 18.811 17.389 ( -13.306 -0.507 20.724) 24.633 18.726 ( -5.147 -0.706 -14.123) 15.048 19.537 ( 13.061 4.418 11.352) 17.860 19.808 ( -4.301 -2.555 2.690) 5.680 20.542 ( -5.359 0.715 -8.862) 10.381 23.341 ( -16.382 -6.822 6.650) 18.951 23.748 ( 20.562 12.495 2.580) 24.199 24.638 ( 7.925 -5.808 1.099) 9.887 ======================= Grid point 765 (381/432) ======================= q-point: ( 0.36 0.09 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.159 ( -0.443 -1.225 -5.553) 5.704 2.599 ( 6.681 -10.532 0.063) 12.473 2.796 ( -7.082 0.196 0.999) 7.154 3.298 ( 0.737 -9.478 -5.412) 10.939 3.500 ( 7.808 5.311 4.606) 10.507 3.774 ( -5.645 8.335 7.610) 12.620 4.168 ( 6.362 6.892 1.808) 9.552 4.432 ( -4.409 -4.677 6.363) 9.044 4.683 ( -5.539 -2.505 0.744) 6.125 4.818 ( -3.460 -6.384 -2.544) 7.694 5.247 ( -9.790 3.777 5.537) 11.864 5.499 ( 5.408 2.663 -16.104) 17.195 6.571 ( -7.215 2.799 6.209) 9.922 7.310 ( -1.537 -7.918 1.950) 8.298 7.692 ( -0.798 -4.483 -10.762) 11.686 9.041 ( -16.662 3.280 -7.172) 18.434 9.251 ( -1.364 5.714 9.318) 11.015 9.705 ( -1.873 -9.530 3.296) 10.257 9.958 ( -5.605 -6.176 -4.650) 9.549 10.559 ( -15.389 1.292 21.178) 26.210 11.147 ( 25.048 6.578 -24.544) 35.681 11.474 ( 14.036 14.770 -7.184) 21.605 11.680 ( 7.426 4.503 -0.225) 8.688 13.042 ( 1.795 -1.027 -0.669) 2.173 13.506 ( -0.885 -6.949 -3.726) 7.934 14.011 ( 2.001 -2.325 -1.267) 3.319 14.380 ( 0.966 -3.041 -2.484) 4.044 14.763 ( -1.289 -1.957 12.597) 12.813 17.530 ( -9.304 -1.786 28.184) 29.733 18.499 ( -0.901 -1.041 -19.987) 20.034 19.714 ( 7.004 4.052 3.796) 8.938 19.817 ( -0.574 0.701 2.258) 2.433 20.418 ( -1.718 -1.717 -5.668) 6.166 23.233 ( -17.029 -8.910 3.728) 19.578 23.893 ( 15.054 15.523 1.415) 21.670 24.799 ( 4.537 -6.988 2.046) 8.579 ======================= Grid point 766 (382/432) ======================= q-point: (-0.55 0.09 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 3.310 3.617 2.802) 5.647 2.710 ( -11.641 3.332 11.359) 16.602 2.810 ( 13.417 -8.421 -5.712) 16.839 3.304 ( -1.991 -9.832 -6.146) 11.764 3.581 ( 4.909 6.887 3.055) 8.992 3.669 ( -10.629 2.321 2.597) 11.185 4.065 ( -14.880 0.772 -1.949) 15.027 4.520 ( 7.787 0.177 3.212) 8.425 4.719 ( -1.100 -4.645 7.100) 8.555 4.805 ( -2.097 -2.352 -2.914) 4.292 5.236 ( -0.810 4.357 10.201) 11.122 5.402 ( 9.338 1.339 -13.744) 16.670 6.553 ( -1.928 1.138 4.251) 4.805 7.398 ( -3.680 -10.533 5.121) 12.276 7.622 ( 1.213 -0.712 -7.111) 7.248 8.765 ( -15.310 -6.405 -4.320) 17.149 9.317 ( 2.759 9.536 11.676) 15.326 9.820 ( -1.923 -11.153 5.787) 12.712 9.907 ( -1.336 -2.588 -2.760) 4.013 10.582 ( -16.879 0.438 21.600) 27.416 11.123 ( 20.536 5.958 -23.997) 32.142 11.363 ( 4.533 14.210 -10.668) 18.338 11.735 ( 9.691 9.498 0.722) 13.588 13.054 ( -1.648 -1.210 0.265) 2.062 13.528 ( -0.207 -4.329 -0.007) 4.334 14.013 ( -2.982 -0.605 1.671) 3.471 14.390 ( 1.123 -3.395 -3.182) 4.787 14.870 ( 0.428 -1.190 4.063) 4.256 17.780 ( -4.296 -2.259 25.533) 25.991 18.284 ( 2.843 -1.755 -19.934) 20.212 19.766 ( 0.966 5.628 -2.384) 6.188 19.821 ( 5.934 -0.360 -0.923) 6.016 20.385 ( -0.618 -3.294 -1.988) 3.897 23.147 ( -16.423 -11.908 4.652) 20.813 23.924 ( 10.464 15.204 -2.052) 18.570 24.889 ( -0.823 -4.324 0.173) 4.405 ======================= Grid point 767 (383/432) ======================= q-point: (-0.45 0.09 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.238 ( 4.597 7.411 10.225) 13.439 2.647 ( -9.847 7.777 11.781) 17.212 2.976 ( 12.159 -2.845 -4.201) 13.175 3.267 ( -5.508 -8.331 -5.814) 11.556 3.490 ( -10.851 6.747 2.871) 13.096 3.623 ( -0.075 -5.218 -4.990) 7.220 3.850 ( -12.867 -2.850 -1.621) 13.278 4.580 ( -3.128 -2.110 -2.438) 4.493 4.755 ( -2.409 2.378 2.605) 4.271 4.906 ( 11.626 -2.706 6.523) 13.603 5.341 ( 0.770 3.707 12.440) 13.003 5.432 ( 15.165 -0.282 -8.462) 17.368 6.598 ( 3.008 -1.012 2.643) 4.130 7.479 ( -5.203 -9.640 2.213) 11.176 7.569 ( 0.901 3.073 -0.817) 3.305 8.686 ( -9.091 -15.590 2.544) 18.225 9.416 ( 2.263 9.156 13.148) 16.181 9.898 ( -2.311 -5.927 0.904) 6.425 9.983 ( 5.217 -3.896 6.695) 9.339 10.589 ( -17.278 2.670 20.867) 27.223 11.024 ( 5.720 7.464 -14.717) 17.464 11.180 ( 8.887 6.599 -18.680) 21.713 11.773 ( 7.997 12.381 0.271) 14.742 13.010 ( -6.322 0.059 0.027) 6.322 13.568 ( 0.029 -0.322 3.640) 3.654 13.990 ( -5.100 1.197 3.994) 6.588 14.393 ( 1.042 -2.876 -3.295) 4.496 14.881 ( 0.494 -0.088 -3.905) 3.937 17.872 ( 4.591 0.811 -13.353) 14.143 18.305 ( 2.923 -5.598 14.159) 15.503 19.628 ( -5.975 3.380 -7.454) 10.134 19.925 ( 10.113 0.009 -3.138) 10.589 20.413 ( 3.246 -3.008 0.621) 4.469 23.099 ( -18.058 -15.342 5.962) 24.434 23.885 ( 9.018 13.827 -5.086) 17.274 24.844 ( -6.498 -0.127 -2.815) 7.083 ======================= Grid point 768 (384/432) ======================= q-point: (-0.36 0.09 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.342 ( 0.306 7.900 12.355) 14.668 2.610 ( -4.604 10.159 13.062) 17.176 3.086 ( 9.824 0.817 -3.019) 10.310 3.155 ( -9.388 -4.440 -5.677) 11.836 3.342 ( -7.999 4.214 2.234) 9.313 3.565 ( -3.895 -9.748 -10.912) 15.141 3.771 ( -3.667 -4.452 -0.006) 5.768 4.444 ( -8.811 0.442 -6.116) 10.735 4.783 ( 0.599 4.097 7.936) 8.952 5.150 ( 12.649 -2.534 1.871) 13.035 5.465 ( 0.253 1.918 13.262) 13.403 5.593 ( 16.793 -1.458 -3.180) 17.153 6.709 ( 7.324 -3.285 1.502) 8.166 7.435 ( -0.317 2.676 -5.051) 5.725 7.646 ( -2.507 -8.030 11.037) 13.877 8.804 ( -5.672 -20.748 5.842) 22.289 9.512 ( -0.107 7.144 13.386) 15.173 9.971 ( 7.242 1.573 2.994) 7.992 10.172 ( 3.315 -6.728 7.838) 10.848 10.534 ( -16.434 9.364 17.593) 25.832 10.860 ( -7.749 3.105 -1.030) 8.411 11.077 ( 15.420 1.954 -22.333) 27.210 11.712 ( 2.170 14.296 -4.168) 15.049 12.889 ( -11.243 -0.418 -1.101) 11.304 13.616 ( 0.532 2.997 6.158) 6.870 13.945 ( -5.212 4.695 4.330) 8.244 14.395 ( 0.616 -1.579 -1.742) 2.431 14.807 ( 0.877 -0.419 -10.426) 10.471 17.750 ( 10.666 0.632 -20.363) 22.996 18.617 ( 6.030 -6.448 17.788) 19.858 19.392 ( -10.931 1.000 -11.148) 15.645 19.957 ( 2.401 1.363 -5.524) 6.175 20.582 ( 15.542 -2.253 3.981) 16.201 23.031 ( -23.589 -16.588 4.750) 29.226 23.837 ( 10.826 11.533 -6.398) 17.063 24.673 ( -10.579 3.338 -3.925) 11.768 ======================= Grid point 769 (385/432) ======================= q-point: (-0.27 0.09 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.399 ( -2.311 4.174 10.636) 11.657 2.639 ( -2.660 8.882 12.502) 15.565 3.009 ( -7.158 -3.089 -4.282) 8.895 3.151 ( -0.169 1.985 4.232) 4.677 3.261 ( 5.460 5.928 -5.962) 10.025 3.476 ( -4.080 -10.298 -8.787) 14.138 3.776 ( -0.496 -5.145 -2.836) 5.896 4.234 ( -10.033 3.346 -5.667) 11.999 4.868 ( 2.683 4.167 9.258) 10.501 5.287 ( 5.897 0.161 -1.029) 5.988 5.623 ( 1.183 -0.692 12.987) 13.059 5.795 ( 14.886 -2.632 -2.186) 15.274 6.871 ( 9.566 -4.733 0.839) 10.705 7.345 ( -0.974 4.294 -3.935) 5.905 7.893 ( 4.003 -12.902 16.014) 20.951 8.971 ( -6.948 -24.286 3.686) 25.528 9.603 ( -1.468 5.699 14.351) 15.511 10.073 ( 13.908 16.434 -0.639) 21.539 10.331 ( -3.164 -13.278 3.847) 14.182 10.463 ( -13.517 6.706 20.403) 25.376 10.760 ( -8.767 4.789 7.352) 12.403 11.046 ( 16.856 0.740 -17.538) 24.336 11.496 ( -3.326 14.915 -8.972) 17.720 12.691 ( -16.556 -2.623 -4.466) 17.347 13.670 ( 1.275 5.021 7.023) 8.727 13.880 ( -2.423 8.792 3.690) 9.837 14.390 ( -1.487 0.554 0.754) 1.757 14.698 ( 2.291 -3.354 -14.230) 14.798 17.720 ( 14.874 0.099 -13.696) 20.219 18.934 ( 5.150 -8.602 8.623) 13.224 19.083 ( -9.998 2.498 -11.345) 15.327 19.863 ( -4.366 1.486 -5.338) 7.054 20.923 ( 24.300 -0.937 6.145) 25.083 22.830 ( -29.661 -12.573 -0.344) 32.217 23.851 ( 12.713 7.024 -4.650) 15.251 24.447 ( -12.309 4.512 -2.486) 13.344 ======================= Grid point 770 (386/432) ======================= q-point: (-0.18 0.09 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( -1.250 -0.239 9.242) 9.329 2.652 ( -3.245 3.764 6.564) 8.233 2.944 ( -1.658 -1.555 -0.465) 2.320 3.127 ( -4.359 2.970 1.194) 5.408 3.252 ( 7.003 0.955 -5.363) 8.872 3.452 ( 1.685 -2.884 -3.140) 4.585 3.767 ( 0.690 -3.156 -5.003) 5.956 4.004 ( -9.807 5.154 -5.087) 12.191 4.988 ( 3.616 2.940 9.396) 10.488 5.299 ( 0.868 1.662 -2.386) 3.035 5.776 ( -0.948 -1.698 11.065) 11.235 5.958 ( 10.710 -2.769 -3.714) 11.669 7.034 ( 5.782 -3.744 2.092) 7.199 7.256 ( -0.058 3.202 -4.128) 5.225 8.325 ( 10.671 -18.051 18.956) 28.268 9.094 ( -9.921 -26.736 -1.158) 28.541 9.709 ( -2.822 3.834 16.461) 17.135 10.053 ( 12.343 22.054 -0.713) 25.283 10.353 ( -5.465 -4.673 -5.689) 9.169 10.505 ( -11.262 4.815 21.431) 24.684 10.657 ( -10.349 10.097 4.095) 15.028 11.089 ( 11.080 -3.291 -18.017) 21.406 11.333 ( 11.387 8.963 3.840) 14.992 12.384 ( -21.287 -3.732 -10.103) 23.857 13.717 ( 1.079 6.480 6.586) 9.302 13.822 ( 0.931 10.447 2.001) 10.678 14.369 ( -3.566 0.329 3.038) 4.696 14.615 ( 3.581 -5.365 -13.766) 15.202 17.831 ( 17.659 0.075 -4.657) 18.263 18.666 ( -18.704 -0.945 -15.388) 24.239 19.258 ( 13.368 -3.763 5.837) 15.064 19.716 ( -7.982 0.695 -3.985) 8.949 21.355 ( 28.128 -0.220 7.714) 29.168 22.466 ( -32.425 -6.815 -5.045) 33.515 23.938 ( 12.655 3.202 -2.519) 13.294 24.231 ( -12.424 3.648 -0.528) 12.959 ======================= Grid point 771 (387/432) ======================= q-point: (-0.09 0.09 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( -1.188 -1.558 7.940) 8.179 2.657 ( 0.809 -0.125 -0.089) 0.824 2.966 ( 1.774 -0.743 1.297) 2.320 3.041 ( -1.479 0.998 -5.339) 5.629 3.309 ( 1.275 -1.513 5.233) 5.595 3.452 ( 2.994 1.299 -5.459) 6.360 3.737 ( -4.363 2.224 0.274) 4.905 3.810 ( 0.304 3.676 -5.851) 6.917 5.114 ( 2.995 1.458 7.713) 8.401 5.240 ( -1.543 1.445 -4.747) 5.196 5.867 ( -5.297 -1.500 9.621) 11.085 6.030 ( 5.688 -2.057 -6.227) 8.682 7.084 ( -8.252 0.126 6.525) 10.521 7.231 ( 7.666 -0.202 -7.244) 10.549 8.859 ( 9.829 -20.427 19.139) 29.668 9.127 ( -11.303 -27.011 -7.158) 30.142 9.819 ( -5.379 5.417 15.823) 17.568 10.044 ( 11.567 16.303 -4.562) 20.503 10.147 ( -9.883 17.220 4.586) 20.378 10.385 ( -2.891 7.848 -14.322) 16.585 10.603 ( -13.348 -1.468 24.345) 27.803 11.047 ( 15.659 -1.681 -19.931) 25.402 11.676 ( 21.996 0.304 15.132) 26.701 11.985 ( -21.267 -3.577 -14.739) 26.121 13.716 ( -3.259 7.005 4.984) 9.194 13.781 ( 4.788 8.059 -1.706) 9.528 14.378 ( -4.164 -1.876 6.473) 7.922 14.559 ( 3.338 -3.493 -11.199) 12.197 18.068 ( 19.052 0.202 3.625) 19.395 18.247 ( -19.687 0.009 -13.499) 23.870 19.496 ( 6.738 -3.100 2.976) 7.992 19.562 ( -4.442 0.505 -3.687) 5.795 21.834 ( 28.483 -0.514 9.526) 30.038 22.007 ( -31.142 -2.699 -7.286) 32.097 24.046 ( -11.066 2.154 0.398) 11.281 24.063 ( 11.497 1.481 -1.476) 11.685 ======================= Grid point 774 (388/432) ======================= q-point: ( 0.18 0.18 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( -2.556 0.000 -8.578) 8.950 2.419 ( 1.571 -0.000 -6.807) 6.986 2.899 ( -6.424 0.000 -3.166) 7.162 3.190 ( 2.798 -0.000 -2.198) 3.558 3.379 ( 11.107 -0.000 5.202) 12.265 3.877 ( -1.145 0.000 13.155) 13.204 4.147 ( 12.159 -0.000 8.253) 14.695 4.215 ( -0.224 0.000 3.596) 3.603 4.677 ( -0.939 0.000 -5.060) 5.147 4.951 ( -18.474 0.000 -1.492) 18.534 5.427 ( -15.513 0.000 2.878) 15.778 5.663 ( 4.691 -0.000 -16.141) 16.808 6.679 ( -13.243 0.000 8.451) 15.710 7.215 ( 0.519 -0.000 -2.310) 2.368 7.820 ( -7.229 0.000 -18.188) 19.573 9.237 ( -7.405 0.000 10.378) 12.749 9.497 ( -17.938 0.000 -0.069) 17.938 9.546 ( -5.321 0.000 -0.927) 5.401 9.973 ( 0.748 -0.000 -12.489) 12.512 10.542 ( -14.915 0.000 21.852) 26.457 11.205 ( 27.259 -0.000 -29.572) 40.219 11.493 ( 24.297 -0.000 -5.376) 24.884 11.593 ( 10.073 -0.000 6.094) 11.773 13.031 ( 4.756 -0.000 -1.961) 5.144 13.464 ( -2.958 0.000 -8.090) 8.614 13.875 ( 10.573 -0.000 0.964) 10.617 14.351 ( 1.058 -0.000 -4.847) 4.961 14.620 ( -8.827 0.000 20.898) 22.686 17.385 ( -13.625 0.000 20.537) 24.646 18.720 ( -5.949 0.000 -13.299) 14.569 19.582 ( 13.669 -0.000 13.188) 18.994 19.780 ( -4.554 0.000 1.928) 4.945 20.547 ( -5.362 0.000 -10.494) 11.785 23.282 ( -16.706 0.000 7.397) 18.270 23.867 ( 20.231 -0.000 5.585) 20.988 24.576 ( 7.795 -0.000 -1.538) 7.945 ======================= Grid point 775 (389/432) ======================= q-point: ( 0.27 0.18 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 3.946 0.321 -3.598) 5.350 2.450 ( 8.123 -5.584 -2.523) 10.176 2.795 ( -6.602 -0.153 0.353) 6.613 3.186 ( -0.075 -3.539 -4.102) 5.419 3.553 ( 7.602 1.350 3.585) 8.512 3.933 ( -8.192 8.432 11.880) 16.714 4.205 ( -8.073 -3.635 3.402) 9.485 4.396 ( 10.779 1.869 7.664) 13.357 4.659 ( -4.809 -0.158 -2.129) 5.261 4.708 ( -7.490 -5.431 -2.082) 9.483 5.296 ( -9.529 1.644 5.813) 11.282 5.537 ( 6.524 1.361 -17.918) 19.117 6.613 ( -8.600 1.685 6.454) 10.884 7.200 ( -2.332 -4.177 -0.941) 4.876 7.619 ( -1.776 -2.840 -8.974) 9.579 9.071 ( -18.484 1.358 -8.858) 20.542 9.380 ( -4.243 7.236 13.393) 15.803 9.525 ( -7.806 -9.683 4.571) 13.251 9.901 ( 4.403 -1.266 -7.910) 9.141 10.572 ( -18.237 0.363 22.628) 29.065 11.215 ( 30.179 1.842 -34.044) 45.532 11.696 ( 11.718 8.433 -2.477) 14.648 11.753 ( 15.720 2.902 0.340) 15.990 13.044 ( 1.407 1.088 -1.263) 2.182 13.382 ( -1.447 -5.903 -4.562) 7.599 13.976 ( 3.758 -1.353 -1.051) 4.131 14.319 ( 1.178 -2.586 -5.149) 5.881 14.761 ( -4.747 0.486 18.777) 19.373 17.510 ( -10.509 -0.586 28.919) 30.774 18.486 ( -2.228 -0.462 -18.752) 18.890 19.754 ( 0.128 0.653 1.367) 1.521 19.849 ( 7.909 2.135 7.434) 11.062 20.383 ( -2.793 -1.687 -10.101) 10.615 23.126 ( -18.572 -3.342 5.352) 19.614 24.129 ( 14.119 9.951 5.578) 18.152 24.669 ( 5.182 -6.504 -1.454) 8.442 ======================= Grid point 776 (390/432) ======================= q-point: ( 0.36 0.18 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( 8.271 4.284 3.837) 10.073 2.648 ( 14.277 -9.208 -2.067) 17.114 2.743 ( -7.386 0.722 7.506) 10.555 3.163 ( -0.891 -6.257 -5.774) 8.561 3.613 ( -1.082 0.464 -0.290) 1.213 3.801 ( -15.286 8.395 7.579) 19.015 4.083 ( -15.574 0.771 0.301) 15.596 4.545 ( 4.094 2.074 3.043) 5.507 4.620 ( -0.026 -4.564 6.484) 7.930 4.756 ( 2.757 -4.069 -0.655) 4.958 5.299 ( -1.373 2.821 10.232) 10.703 5.429 ( 10.338 1.528 -16.855) 19.832 6.577 ( -2.734 1.478 3.098) 4.389 7.211 ( -5.228 -10.000 1.216) 11.349 7.593 ( 1.296 -1.849 -0.056) 2.259 8.707 ( -18.188 -0.653 -8.389) 20.040 9.444 ( -1.720 1.707 10.409) 10.687 9.588 ( -7.685 -8.389 10.021) 15.161 9.921 ( 8.268 1.010 -3.492) 9.032 10.577 ( -20.901 -0.393 23.989) 31.819 11.193 ( 27.969 2.405 -34.585) 44.544 11.631 ( 5.440 13.963 -10.107) 18.075 11.928 ( 16.192 11.645 2.676) 20.123 13.033 ( -1.805 -0.702 0.123) 1.941 13.417 ( 0.576 -8.009 0.341) 8.037 13.992 ( -1.869 -1.480 0.740) 2.496 14.307 ( 1.589 -4.889 -5.939) 7.855 14.880 ( -3.287 1.401 12.081) 12.599 17.754 ( -7.025 -0.884 31.632) 32.415 18.251 ( 1.528 -1.705 -22.256) 22.373 19.802 ( 6.840 -0.565 -0.681) 6.897 19.903 ( 1.653 8.681 -1.659) 8.991 20.295 ( -1.481 -6.916 -5.980) 9.262 22.988 ( -18.449 -6.487 6.319) 20.552 24.195 ( 8.397 15.825 0.654) 17.926 24.772 ( 0.875 -9.141 -1.004) 9.237 ======================= Grid point 777 (391/432) ======================= q-point: ( 0.45 0.18 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.363 ( 7.445 7.066 9.818) 14.204 2.734 ( -4.592 2.290 7.862) 9.388 2.897 ( 11.559 -5.509 1.923) 12.948 3.137 ( -0.423 -6.529 -7.081) 9.640 3.500 ( -14.560 -1.541 -0.092) 14.642 3.617 ( -12.686 0.060 -0.718) 12.706 3.883 ( -8.310 5.862 -0.213) 10.172 4.544 ( -5.250 -1.608 -0.922) 5.568 4.762 ( 0.729 -1.005 6.236) 6.358 4.857 ( 9.654 -3.015 3.865) 10.827 5.396 ( 2.912 2.586 6.434) 7.521 5.445 ( 14.019 1.444 -5.293) 15.054 6.592 ( 2.640 0.174 1.128) 2.876 7.252 ( -7.203 -14.386 2.124) 16.228 7.633 ( 0.770 3.487 3.460) 4.972 8.478 ( -12.412 -8.986 -1.447) 15.391 9.536 ( -2.497 -1.578 10.607) 11.010 9.670 ( -6.444 -5.980 10.185) 13.454 10.030 ( 11.706 2.166 1.799) 12.040 10.579 ( -22.498 -1.877 25.336) 33.935 11.127 ( 23.322 3.078 -32.477) 40.102 11.409 ( 3.926 18.096 -14.534) 23.540 12.035 ( 13.913 17.149 1.991) 22.172 12.996 ( -6.351 -1.675 -0.027) 6.568 13.517 ( 1.165 -5.399 4.565) 7.166 13.986 ( -3.917 -1.477 3.180) 5.257 14.305 ( 2.120 -6.066 -6.855) 9.396 14.914 ( -4.075 2.919 5.445) 7.401 17.902 ( 2.596 2.807 -8.944) 9.727 18.194 ( -0.794 -7.141 14.589) 16.262 19.730 ( -5.061 8.086 -8.688) 12.903 19.924 ( 10.774 0.309 -2.314) 11.024 20.318 ( 3.467 -8.007 -2.508) 9.079 22.890 ( -19.012 -9.303 7.567) 22.478 24.137 ( 6.049 15.517 -3.126) 16.945 24.791 ( -4.651 -5.967 -2.947) 8.119 ======================= Grid point 778 (392/432) ======================= q-point: (-0.45 0.18 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( -0.934 7.119 10.767) 12.941 2.752 ( -4.361 6.251 12.491) 14.633 3.063 ( -1.213 -4.679 -0.180) 4.837 3.097 ( 8.328 -0.352 -7.555) 11.249 3.344 ( -11.109 -3.459 2.100) 11.823 3.450 ( -9.171 -4.501 -5.865) 11.780 3.766 ( -1.828 3.445 -2.408) 4.584 4.426 ( -9.558 -1.678 -3.802) 10.423 4.843 ( 1.767 2.833 7.842) 8.523 5.081 ( 10.951 -5.346 2.590) 12.459 5.502 ( 4.451 1.923 7.215) 8.692 5.593 ( 13.058 1.377 0.464) 13.139 6.670 ( 6.626 -1.495 0.707) 6.829 7.311 ( -6.004 -15.022 1.503) 16.247 7.624 ( -0.818 4.899 3.755) 6.227 8.487 ( -8.914 -16.923 5.324) 19.854 9.635 ( -2.968 3.870 14.159) 14.976 9.780 ( -2.307 -11.344 8.459) 14.337 10.213 ( 10.943 3.327 6.835) 13.324 10.591 ( -22.210 -1.957 25.776) 34.081 11.011 ( 14.188 9.242 -23.902) 29.292 11.155 ( 9.929 11.402 -20.571) 25.530 12.030 ( 9.150 21.791 -1.730) 23.697 12.877 ( -12.221 -1.094 -1.536) 12.366 13.630 ( 1.317 -1.465 6.934) 7.208 13.989 ( -3.271 0.322 4.745) 5.772 14.313 ( 2.891 -6.776 -6.986) 10.153 14.848 ( -5.552 4.322 -0.225) 7.039 17.766 ( 9.961 1.156 -20.673) 22.977 18.494 ( -0.073 -7.647 22.645) 23.902 19.456 ( -9.294 6.163 -11.555) 16.059 19.968 ( 1.547 0.020 -5.115) 5.344 20.511 ( 18.428 -5.982 1.042) 19.402 22.795 ( -22.127 -11.061 7.292) 25.790 24.047 ( 6.554 13.099 -5.143) 15.524 24.686 ( -8.993 -1.750 -4.682) 10.289 ======================= Grid point 779 (393/432) ======================= q-point: (-0.36 0.18 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -6.657 4.025 8.700) 11.670 2.781 ( -5.082 7.617 11.129) 14.412 2.957 ( -7.086 -2.628 -3.146) 8.186 3.178 ( 2.611 1.345 2.519) 3.870 3.305 ( -3.872 -7.538 -10.957) 13.852 3.363 ( 5.780 3.014 2.656) 7.039 3.712 ( 0.556 -1.951 -4.962) 5.361 4.255 ( -10.854 -0.550 -4.001) 11.581 4.939 ( 3.126 3.966 8.355) 9.763 5.259 ( 7.189 -3.735 -0.132) 8.102 5.631 ( 1.437 1.570 11.020) 11.223 5.763 ( 13.090 -0.867 -1.026) 13.159 6.805 ( 8.896 -3.262 1.189) 9.549 7.342 ( -3.756 -6.876 -2.696) 8.286 7.702 ( 2.366 -6.451 9.965) 12.105 8.581 ( -11.142 -21.606 4.578) 24.738 9.714 ( -3.600 6.338 15.574) 17.195 9.990 ( 1.757 -13.714 8.130) 16.040 10.384 ( 3.536 5.277 11.780) 13.383 10.595 ( -15.665 7.525 21.101) 27.336 10.833 ( 5.230 8.757 -10.347) 14.529 11.051 ( 19.261 0.511 -25.101) 31.643 11.860 ( 2.760 26.055 -5.936) 26.865 12.658 ( -17.443 -1.274 -4.416) 18.038 13.732 ( 1.679 1.981 8.019) 8.429 13.998 ( -0.432 4.749 4.731) 6.718 14.336 ( 2.680 -6.852 -5.722) 9.320 14.700 ( -6.566 3.746 -4.953) 9.038 17.722 ( 14.829 0.225 -14.143) 20.493 18.779 ( -0.888 -9.037 11.890) 14.961 19.151 ( -7.889 5.139 -9.440) 13.333 19.875 ( -4.712 -0.150 -6.398) 7.947 20.889 ( 27.253 -3.229 3.790) 27.704 22.631 ( -27.219 -10.397 4.205) 29.439 23.992 ( 8.735 9.428 -4.950) 13.773 24.499 ( -11.249 1.409 -4.195) 12.088 ======================= Grid point 780 (394/432) ======================= q-point: (-0.27 0.18 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( -4.249 0.170 8.117) 9.163 2.712 ( -5.990 2.901 0.691) 6.692 2.926 ( -1.819 -0.162 3.825) 4.238 3.167 ( -5.685 0.310 -2.975) 6.423 3.229 ( 0.702 -1.424 0.454) 1.651 3.475 ( 11.982 4.789 -2.249) 13.098 3.703 ( 2.756 -4.367 -4.194) 6.652 4.060 ( -10.933 1.392 -4.302) 11.831 5.046 ( 3.328 3.648 8.540) 9.865 5.320 ( 2.085 0.115 -2.349) 3.143 5.755 ( -1.044 -0.377 10.652) 10.710 5.911 ( 9.892 -2.416 -2.849) 10.574 6.971 ( 7.780 -3.824 2.487) 9.019 7.279 ( -3.786 -1.307 -4.325) 5.894 8.017 ( 9.121 -17.004 13.242) 23.403 8.650 ( -12.634 -25.148 0.221) 28.144 9.793 ( -4.410 5.331 16.303) 17.711 10.161 ( -0.678 -9.509 0.607) 9.553 10.476 ( 5.556 13.230 7.226) 16.066 10.531 ( -17.215 8.763 22.962) 30.007 10.819 ( 8.169 4.834 -3.124) 9.993 11.042 ( 14.693 -2.237 -20.817) 25.578 11.610 ( 6.474 23.753 -3.822) 24.914 12.339 ( -21.278 -1.285 -8.627) 22.996 13.819 ( 1.087 4.792 8.783) 10.064 13.997 ( 2.572 9.532 2.463) 10.175 14.358 ( -0.548 -3.457 -1.507) 3.811 14.533 ( -3.664 -2.192 -9.223) 10.163 17.833 ( 17.966 0.131 -4.678) 18.565 18.647 ( -17.584 -1.376 -12.807) 21.797 19.194 ( 9.390 -3.426 8.038) 12.827 19.722 ( -7.088 -0.158 -6.402) 9.553 21.343 ( 30.187 -1.367 5.517) 30.717 22.340 ( -31.074 -7.449 -0.617) 31.960 24.012 ( 10.424 5.421 -3.033) 12.134 24.289 ( -11.845 2.920 -2.181) 12.393 ======================= Grid point 781 (395/432) ======================= q-point: (-0.18 0.18 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( -2.170 -1.726 7.784) 8.263 2.652 ( 1.507 -0.407 -2.928) 3.318 2.958 ( -0.246 -0.097 3.350) 3.360 3.059 ( -1.829 0.852 -5.207) 5.584 3.282 ( -2.269 -1.022 8.099) 8.473 3.496 ( 7.723 3.532 -10.186) 13.262 3.766 ( 0.524 0.778 3.452) 3.577 3.866 ( -3.231 2.444 -5.635) 6.940 5.150 ( 2.270 2.667 7.496) 8.274 5.273 ( -1.271 2.056 -4.709) 5.293 5.838 ( -4.987 -1.579 9.108) 10.503 5.988 ( 5.397 -2.690 -5.470) 8.142 7.078 ( -6.027 -1.113 6.226) 8.737 7.216 ( 5.245 -1.848 -6.772) 8.763 8.485 ( 10.723 -22.578 13.281) 28.304 8.674 ( -10.791 -26.179 -5.466) 28.839 9.883 ( -5.310 3.146 17.318) 18.385 10.145 ( -1.696 -1.567 -7.391) 7.743 10.487 ( 2.294 19.749 11.696) 23.067 10.549 ( -13.182 0.750 16.745) 21.324 10.685 ( -5.908 18.675 -5.454) 20.332 11.013 ( 19.643 -2.173 -21.190) 28.976 11.718 ( 21.943 5.929 8.561) 24.289 11.938 ( -22.244 -0.893 -12.027) 25.303 13.854 ( -2.826 8.275 7.345) 11.419 13.953 ( 4.508 11.444 -2.194) 12.494 14.339 ( -6.216 -2.359 4.149) 7.837 14.475 ( 4.308 -6.239 -9.385) 12.065 18.073 ( 19.197 0.393 3.683) 19.551 18.249 ( -19.514 0.182 -12.959) 23.426 19.433 ( 5.456 -4.220 6.193) 9.270 19.564 ( -3.153 -0.309 -6.719) 7.429 21.821 ( 27.288 -1.059 7.350) 28.281 21.946 ( -28.420 -4.294 -4.822) 29.144 24.093 ( -11.201 3.052 -0.469) 11.619 24.099 ( 10.645 2.900 -1.131) 11.091 ======================= Grid point 782 (396/432) ======================= q-point: (-0.09 0.18 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( -1.827 -1.735 0.971) 2.700 2.699 ( 7.622 0.188 -1.627) 7.796 2.951 ( -3.234 1.099 0.174) 3.420 3.040 ( 2.636 0.049 1.515) 3.040 3.336 ( -3.410 -1.281 2.643) 4.500 3.434 ( 5.578 2.053 -8.716) 10.550 3.675 ( -6.936 0.225 3.119) 7.609 3.927 ( 10.592 5.170 2.000) 11.955 5.151 ( -3.755 2.065 -6.564) 7.839 5.225 ( 0.378 1.644 4.651) 4.947 5.848 ( -10.016 -1.882 7.182) 12.467 5.976 ( 1.669 -2.294 -8.188) 8.666 6.998 ( -13.844 -1.503 5.021) 14.803 7.261 ( 6.769 0.888 -4.117) 7.972 8.609 ( -14.055 -24.443 -8.191) 29.362 8.999 ( 11.530 -23.258 7.767) 27.096 9.952 ( -10.410 10.248 12.820) 19.435 10.002 ( -2.450 3.243 -8.081) 9.045 10.243 ( -10.367 13.466 -3.095) 17.274 10.476 ( -2.584 13.746 11.408) 18.049 10.734 ( 4.807 -0.046 12.378) 13.278 11.074 ( 22.999 0.672 -20.298) 30.682 11.532 ( -16.911 -1.770 -13.745) 21.864 12.144 ( 23.953 -0.910 13.097) 27.315 13.768 ( -4.583 9.009 1.495) 10.218 13.888 ( 3.843 10.013 -3.851) 11.395 14.363 ( -6.267 -5.341 8.037) 11.506 14.486 ( 4.861 -1.155 -5.883) 7.718 17.865 ( -19.611 0.141 -7.938) 21.157 18.403 ( 19.294 0.229 9.764) 21.626 19.355 ( -11.230 -1.083 -3.515) 11.817 19.667 ( 10.520 -1.711 0.686) 10.680 21.499 ( -29.332 -2.606 -6.221) 30.097 22.326 ( 29.883 -1.558 8.556) 31.122 23.915 ( -11.318 2.649 -0.068) 11.624 24.224 ( 11.402 1.801 0.054) 11.543 ======================= Grid point 786 (397/432) ======================= q-point: ( 0.27 0.27 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( 10.239 -0.000 4.390) 11.141 2.555 ( 14.996 -0.000 -2.455) 15.196 2.748 ( -5.925 0.000 7.139) 9.278 3.108 ( -1.109 0.000 -4.972) 5.094 3.619 ( -2.424 0.000 -0.247) 2.437 3.881 ( -22.331 0.000 5.907) 23.099 4.087 ( -10.474 0.000 3.892) 11.173 4.531 ( -4.227 0.000 4.102) 5.891 4.644 ( 5.611 -0.000 8.416) 10.115 4.684 ( 5.787 -0.000 -3.691) 6.864 5.324 ( -1.576 0.000 10.133) 10.255 5.443 ( 10.525 -0.000 -18.051) 20.895 6.592 ( -3.385 0.000 2.860) 4.432 7.118 ( -5.101 0.000 -0.801) 5.164 7.576 ( 1.374 -0.000 3.056) 3.351 8.710 ( -19.351 0.000 -10.119) 21.837 9.396 ( -7.111 0.000 3.098) 7.757 9.572 ( -3.442 0.000 18.752) 19.065 9.929 ( 9.116 -0.000 -3.938) 9.930 10.574 ( -21.957 0.000 24.464) 32.873 11.212 ( 29.516 -0.000 -37.142) 47.442 11.757 ( 7.143 -0.000 -10.332) 12.560 12.044 ( 18.588 -0.000 2.891) 18.812 13.034 ( -2.776 0.000 -0.435) 2.810 13.327 ( 1.359 -0.000 0.461) 1.436 13.978 ( -1.665 0.000 0.520) 1.745 14.262 ( 1.330 -0.000 -5.594) 5.750 14.894 ( -4.306 0.000 14.010) 14.656 17.747 ( -8.139 0.000 34.241) 35.195 18.236 ( 1.181 -0.000 -23.580) 23.609 19.796 ( 6.685 -0.000 -0.574) 6.709 20.007 ( 4.006 -0.000 2.523) 4.734 20.206 ( -3.515 0.000 -11.287) 11.822 22.934 ( -18.738 0.000 6.831) 19.944 24.375 ( 6.482 -0.000 4.386) 7.827 24.650 ( 2.247 -0.000 -4.056) 4.637 ======================= Grid point 787 (398/432) ======================= q-point: ( 0.36 0.27 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.459 ( 7.197 3.676 9.433) 12.421 2.718 ( 9.385 -2.753 -3.006) 10.232 2.846 ( 3.728 -0.475 13.202) 13.726 3.056 ( 1.819 -2.779 -6.442) 7.248 3.492 ( -13.058 0.250 -2.301) 13.262 3.604 ( -22.551 -0.847 1.639) 22.626 3.970 ( -8.904 3.022 0.065) 9.403 4.535 ( -5.474 0.279 2.618) 6.074 4.753 ( 6.273 0.607 4.393) 7.682 4.801 ( 5.062 -3.351 4.209) 7.388 5.432 ( 11.330 1.638 -6.254) 13.044 5.460 ( 6.216 0.088 5.811) 8.509 6.599 ( 2.262 0.395 0.333) 2.320 7.064 ( -6.539 -6.432 0.460) 9.184 7.676 ( 0.770 1.440 10.214) 10.344 8.380 ( -15.907 -2.821 -6.693) 17.486 9.392 ( -4.261 -6.386 4.923) 9.120 9.725 ( -4.294 3.702 19.077) 19.902 10.038 ( 11.458 -0.435 -0.644) 11.484 10.556 ( -24.591 -0.671 26.351) 36.049 11.155 ( 26.100 0.699 -36.666) 45.012 11.660 ( 6.945 9.061 -16.084) 19.723 12.278 ( 17.641 9.180 2.267) 20.015 12.964 ( -7.595 -1.512 -0.502) 7.760 13.418 ( 3.054 -4.610 5.379) 7.715 13.957 ( -4.168 -1.287 2.381) 4.969 14.229 ( 1.874 -2.398 -5.746) 6.503 14.953 ( -5.780 1.355 8.854) 10.660 17.964 ( 2.432 4.280 -12.526) 13.459 18.079 ( -3.951 -5.966 20.959) 22.147 19.845 ( -1.917 3.201 -7.323) 8.219 19.974 ( 6.413 7.188 -2.986) 10.085 20.158 ( 5.342 -10.315 -5.112) 12.691 22.787 ( -18.708 -2.982 8.236) 20.658 24.382 ( 1.994 12.302 -1.020) 12.504 24.657 ( -1.910 -8.886 -3.857) 9.874 ======================= Grid point 788 (399/432) ======================= q-point: ( 0.45 0.27 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.562 ( -4.758 3.096 9.452) 11.026 2.815 ( 1.169 1.326 7.840) 8.037 3.011 ( 2.226 -0.427 0.362) 2.295 3.092 ( 12.091 -0.816 -3.446) 12.599 3.286 ( -12.400 -2.870 -3.006) 13.078 3.390 ( -13.934 -2.221 2.830) 14.391 3.826 ( -5.529 2.260 -3.857) 7.110 4.418 ( -10.098 1.113 -2.214) 10.398 4.878 ( 3.568 1.562 7.786) 8.706 4.983 ( 9.364 -5.811 2.638) 11.332 5.533 ( 11.142 1.886 -0.212) 11.303 5.618 ( 6.524 0.918 6.866) 9.516 6.655 ( 6.141 -0.323 -0.164) 6.151 7.070 ( -5.520 -11.489 1.559) 12.842 7.731 ( -3.068 6.912 7.043) 10.334 8.236 ( -11.473 -12.593 1.539) 17.105 9.504 ( -0.093 -9.420 8.172) 12.471 9.824 ( -4.965 6.882 17.652) 19.586 10.224 ( 12.321 -1.493 3.509) 12.898 10.543 ( -25.185 -2.485 27.351) 37.264 11.070 ( 23.277 0.887 -33.971) 41.190 11.441 ( 6.253 16.399 -17.774) 24.978 12.381 ( 13.414 18.025 -1.044) 22.493 12.846 ( -11.753 -2.737 -1.601) 12.173 13.574 ( 3.069 -4.335 7.557) 9.236 13.958 ( -3.416 -3.268 3.772) 6.048 14.220 ( 2.697 -3.494 -5.789) 7.280 14.917 ( -8.186 3.238 4.382) 9.834 17.786 ( 9.680 1.120 -22.452) 24.475 18.381 ( -4.517 -5.117 28.028) 28.847 19.575 ( -10.348 6.900 -11.696) 17.073 19.961 ( -0.984 -0.719 -5.230) 5.370 20.398 ( 23.695 -6.467 -0.629) 24.570 22.661 ( -20.502 -5.052 8.129) 22.626 24.264 ( 1.804 12.273 -4.193) 13.095 24.618 ( -6.443 -6.139 -4.725) 10.076 ======================= Grid point 789 (400/432) ======================= q-point: (-0.45 0.27 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.518 ( -10.813 1.287 7.167) 13.036 2.884 ( -6.095 4.201 9.225) 11.828 2.936 ( -5.990 0.559 -1.773) 6.272 3.170 ( -1.494 -6.494 -5.180) 8.440 3.211 ( 5.461 1.700 -1.774) 5.989 3.394 ( 4.809 0.063 5.844) 7.569 3.710 ( -0.718 0.923 -6.952) 7.050 4.238 ( -11.998 -0.677 -2.695) 12.315 4.995 ( 3.886 2.645 7.179) 8.582 5.171 ( 7.560 -6.102 1.059) 9.773 5.665 ( 5.175 2.238 6.645) 8.714 5.765 ( 8.283 0.521 2.769) 8.749 6.761 ( 7.820 -1.954 0.722) 8.093 7.140 ( -2.964 -13.594 0.759) 13.934 7.700 ( -1.484 4.231 5.074) 6.771 8.253 ( -12.661 -17.370 4.231) 21.907 9.707 ( 1.667 -7.756 10.508) 13.166 9.904 ( -4.182 4.418 16.713) 17.785 10.419 ( -2.551 0.688 14.939) 15.171 10.587 ( -9.240 -4.948 18.245) 21.041 10.993 ( 21.282 2.035 -29.097) 36.107 11.183 ( 6.673 17.566 -15.654) 24.457 12.295 ( 6.502 23.640 -5.898) 25.217 12.647 ( -16.273 -0.016 -3.362) 16.617 13.731 ( 2.673 -1.814 8.449) 9.045 14.017 ( 1.266 -3.464 4.249) 5.627 14.223 ( 3.081 -4.238 -6.428) 8.293 14.783 ( -11.002 4.965 0.614) 12.086 17.727 ( 14.890 0.269 -14.964) 21.112 18.646 ( -3.639 -6.435 17.035) 18.569 19.246 ( -10.587 5.806 -9.441) 15.327 19.858 ( -4.879 -1.712 -7.189) 8.856 20.821 ( 30.851 -4.295 2.278) 31.231 22.494 ( -24.601 -5.818 5.892) 25.958 24.155 ( 3.915 9.532 -4.771) 11.356 24.493 ( -9.117 -2.095 -4.704) 10.471 ======================= Grid point 790 (401/432) ======================= q-point: (-0.36 0.27 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( -6.876 -0.386 7.222) 9.980 2.740 ( -7.660 0.598 -3.913) 8.623 2.944 ( -2.712 1.996 6.876) 7.656 3.127 ( -0.375 -2.862 -6.902) 7.481 3.249 ( -2.125 2.113 7.134) 7.738 3.569 ( 13.535 4.019 2.565) 14.350 3.632 ( 2.886 -2.190 -8.718) 9.441 4.057 ( -11.908 -1.364 -3.144) 12.392 5.100 ( 3.371 2.517 6.760) 7.963 5.288 ( 3.358 -3.795 -1.131) 5.192 5.769 ( -0.294 1.925 8.985) 9.194 5.884 ( 7.849 -0.773 -1.040) 7.955 6.905 ( 7.266 -3.909 2.438) 8.603 7.190 ( -3.692 -9.114 -2.796) 10.223 7.807 ( 5.802 -7.063 8.268) 12.326 8.269 ( -12.982 -19.652 1.118) 23.579 9.861 ( -2.525 1.414 12.750) 13.075 10.022 ( -2.432 -4.880 9.353) 10.826 10.475 ( -22.103 -1.560 26.265) 34.363 10.785 ( 11.588 2.380 6.363) 13.433 10.916 ( 14.394 11.026 -15.528) 23.872 11.028 ( 12.879 3.762 -17.582) 22.117 12.055 ( 3.689 26.657 -7.718) 27.996 12.348 ( -19.048 2.585 -5.694) 20.049 13.859 ( -0.152 -0.036 9.884) 9.885 14.128 ( 7.449 5.163 3.456) 9.700 14.231 ( 3.309 -9.156 -7.476) 12.275 14.570 ( -12.764 4.954 -2.195) 13.866 17.835 ( 18.402 0.157 -4.813) 19.022 18.621 ( -15.177 -1.636 -8.363) 17.405 19.153 ( 2.577 -1.435 8.478) 8.976 19.710 ( -5.748 -1.244 -8.331) 10.198 21.308 ( 32.785 -2.591 3.738) 33.099 22.232 ( -29.031 -5.193 1.886) 29.552 24.111 ( 6.584 6.102 -3.306) 9.567 24.323 ( -10.116 1.034 -3.001) 10.602 ======================= Grid point 791 (402/432) ======================= q-point: (-0.27 0.27 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( -2.174 -1.230 7.630) 8.028 2.642 ( 1.137 -0.862 -4.960) 5.161 2.965 ( -1.686 0.899 4.153) 4.571 3.065 ( 0.372 -0.113 -5.688) 5.701 3.287 ( -5.703 1.591 11.762) 13.168 3.554 ( 8.815 2.927 -13.692) 16.545 3.763 ( 1.533 -0.718 6.370) 6.591 3.887 ( -2.463 0.286 -5.791) 6.300 5.191 ( 1.638 1.779 6.305) 6.752 5.292 ( -0.904 -0.251 -3.838) 3.951 5.826 ( -4.477 0.393 8.084) 9.250 5.950 ( 4.758 -1.562 -4.115) 6.482 7.039 ( -3.124 -3.649 5.593) 7.372 7.158 ( 1.719 -5.306 -5.624) 7.921 8.138 ( 10.276 -17.691 9.107) 22.394 8.271 ( -8.931 -20.967 -3.924) 23.125 9.931 ( -6.922 2.604 14.457) 16.239 10.094 ( 1.224 -3.499 -1.331) 3.938 10.487 ( -23.186 -3.393 24.946) 34.226 10.824 ( 4.616 15.216 3.567) 16.295 10.942 ( -1.038 8.364 -9.514) 12.710 10.987 ( 24.131 0.878 -17.421) 29.775 11.904 ( 11.473 15.851 0.359) 19.571 11.990 ( -15.372 7.841 -7.251) 18.718 13.952 ( -2.658 2.243 10.572) 11.129 14.128 ( 3.752 7.461 -5.321) 9.903 14.314 ( -3.625 -0.675 1.610) 4.024 14.375 ( 1.324 -3.372 -5.121) 6.273 18.081 ( 19.485 0.522 3.780) 19.855 18.254 ( -19.376 0.444 -12.445) 23.032 19.359 ( 4.121 -4.400 9.616) 11.349 19.554 ( -2.137 -0.804 -9.441) 9.713 21.798 ( 27.707 -1.576 4.587) 28.128 21.871 ( -26.527 -4.241 -2.568) 26.987 24.140 ( -3.338 2.673 -0.060) 4.277 24.158 ( 1.504 3.631 -1.730) 4.294 ======================= Grid point 792 (403/432) ======================= q-point: (-0.18 0.27 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.561 ( -0.333 -0.386 2.382) 2.436 2.691 ( 9.605 -0.935 -2.102) 9.876 2.977 ( -2.882 1.841 3.385) 4.812 3.032 ( 2.276 -0.688 -0.524) 2.434 3.322 ( -6.051 -0.237 6.652) 8.996 3.492 ( 8.872 4.322 -12.450) 15.887 3.663 ( -10.647 -1.722 0.802) 10.815 3.991 ( 12.099 2.449 2.099) 12.522 5.188 ( -4.263 1.902 -5.398) 7.136 5.253 ( -0.510 1.183 4.022) 4.223 5.821 ( -9.231 -1.009 6.149) 11.138 5.940 ( 1.441 -1.648 -7.142) 7.470 6.965 ( -14.008 -2.532 2.916) 14.530 7.250 ( 7.798 -2.908 -1.553) 8.466 8.221 ( -10.965 -20.606 -6.520) 24.235 8.603 ( 15.371 -22.823 4.800) 27.932 9.970 ( -7.503 -1.287 9.407) 12.101 10.093 ( 1.856 3.841 -1.859) 4.653 10.477 ( -19.441 1.544 16.812) 25.748 10.614 ( -12.665 14.893 -5.176) 20.224 10.825 ( 2.462 5.641 3.904) 7.289 11.081 ( 25.450 0.457 -21.773) 33.496 11.614 ( -13.319 13.151 -4.643) 19.285 12.157 ( 23.121 3.036 8.566) 24.843 13.929 ( -5.645 9.297 1.688) 11.007 14.038 ( 1.760 5.877 -3.944) 7.293 14.258 ( -7.194 -6.481 5.076) 10.933 14.479 ( 10.039 1.136 -1.886) 10.277 17.868 ( -20.005 0.204 -8.041) 21.562 18.409 ( 19.105 0.444 9.310) 21.257 19.339 ( -8.989 -0.654 -4.548) 10.095 19.628 ( 10.984 -2.942 1.775) 11.509 21.447 ( -30.287 -3.402 -4.551) 30.816 22.290 ( 31.344 -2.590 4.305) 31.745 23.975 ( -10.851 4.407 0.588) 11.727 24.255 ( 9.903 1.713 1.074) 10.107 ======================= Grid point 793 (404/432) ======================= q-point: (-0.09 0.27 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( 1.365 2.680 -3.571) 4.669 2.769 ( 3.204 2.632 -2.990) 5.112 2.968 ( 3.705 0.913 1.291) 4.028 3.087 ( -4.346 1.440 5.148) 6.889 3.281 ( -0.702 -2.088 -0.810) 2.347 3.443 ( 7.632 1.812 -7.900) 11.133 3.669 ( -0.393 -4.314 6.800) 8.063 4.141 ( 10.030 4.360 3.559) 11.501 5.029 ( -5.685 2.678 -6.936) 9.359 5.253 ( -4.429 0.753 2.488) 5.135 5.736 ( -14.077 -1.736 4.008) 14.739 5.862 ( -0.207 -1.774 -10.077) 10.234 6.831 ( -15.202 -3.130 3.960) 16.018 7.321 ( 4.541 2.194 -1.252) 5.196 8.169 ( -7.618 -18.878 -10.368) 22.845 8.994 ( 8.282 -20.898 1.283) 22.516 9.884 ( -3.739 5.351 -10.645) 12.487 10.015 ( -12.954 15.291 5.736) 20.845 10.247 ( -7.950 4.861 10.588) 14.104 10.508 ( -11.377 -1.804 6.178) 13.071 10.875 ( -0.084 -6.441 1.205) 6.554 11.168 ( 26.139 -1.339 -23.456) 35.146 11.365 ( -0.604 16.368 2.090) 16.512 12.559 ( 21.091 -1.743 8.574) 22.833 13.779 ( -2.906 7.220 -3.229) 8.426 13.957 ( 1.800 9.008 -3.634) 9.879 14.315 ( -6.882 -7.452 8.938) 13.520 14.547 ( 6.595 5.322 -0.673) 8.501 17.566 ( -18.646 -0.258 0.551) 18.656 18.780 ( 18.025 -0.746 12.357) 21.867 19.157 ( -8.155 0.192 -7.515) 11.091 19.785 ( 6.325 -0.460 2.151) 6.697 21.048 ( -24.449 -3.429 -6.111) 25.433 22.773 ( 28.837 -4.540 5.610) 29.726 23.796 ( -11.542 4.800 0.549) 12.513 24.396 ( 10.365 1.866 2.414) 10.804 ======================= Grid point 798 (405/432) ======================= q-point: ( 0.36 0.36 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( -7.501 0.000 9.134) 11.819 2.819 ( 5.795 -0.000 4.670) 7.442 3.030 ( 6.543 -0.000 -7.057) 9.623 3.071 ( 10.968 -0.000 7.075) 13.052 3.258 ( -16.607 0.000 -3.346) 16.940 3.376 ( -12.762 0.000 4.155) 13.422 3.840 ( -8.000 0.000 -4.056) 8.969 4.438 ( -10.763 0.000 -1.659) 10.890 4.908 ( 9.971 -0.000 2.684) 10.326 4.909 ( 3.684 -0.000 7.594) 8.440 5.554 ( 15.250 -0.000 -4.665) 15.948 5.622 ( 2.448 -0.000 11.013) 11.282 6.654 ( 5.897 -0.000 -0.506) 5.919 6.968 ( -4.766 0.000 1.176) 4.909 7.810 ( -3.743 0.000 12.865) 13.399 8.108 ( -12.897 0.000 -4.093) 13.531 9.422 ( 1.554 -0.000 8.425) 8.567 9.893 ( -7.270 0.000 20.159) 21.430 10.200 ( 14.617 -0.000 0.222) 14.619 10.522 ( -26.725 0.000 28.070) 38.758 11.076 ( 24.062 -0.000 -35.451) 42.846 11.593 ( 7.059 -0.000 -18.917) 20.191 12.560 ( 16.206 -0.000 -0.989) 16.236 12.805 ( -12.627 0.000 -1.573) 12.725 13.528 ( 4.407 -0.000 7.697) 8.869 13.922 ( -4.924 0.000 3.392) 5.979 14.193 ( 2.741 -0.000 -4.254) 5.061 14.945 ( -8.820 0.000 5.587) 10.441 17.797 ( 9.729 -0.000 -23.836) 25.745 18.336 ( -6.218 0.000 30.781) 31.403 19.644 ( -11.915 0.000 -11.554) 16.597 19.952 ( -3.377 0.000 -5.721) 6.643 20.335 ( 28.025 -0.000 -0.919) 28.040 22.619 ( -19.777 0.000 8.249) 21.428 24.417 ( -2.012 0.000 -3.245) 3.818 24.518 ( -3.488 0.000 -5.267) 6.317 ======================= Grid point 799 (406/432) ======================= q-point: ( 0.45 0.36 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.524 ( -12.740 -0.164 6.880) 14.480 2.919 ( -7.284 0.658 4.568) 8.623 2.979 ( -1.958 3.774 -1.318) 4.451 3.067 ( -2.192 -5.283 -3.512) 6.712 3.251 ( 7.067 1.863 1.449) 7.451 3.386 ( 4.061 -0.498 4.987) 6.450 3.715 ( -1.445 -0.303 -5.379) 5.578 4.241 ( -13.712 0.649 -2.671) 13.985 5.029 ( 4.562 1.552 5.773) 7.520 5.080 ( 7.707 -3.914 2.234) 8.928 5.702 ( 10.073 1.789 1.697) 10.370 5.765 ( 2.808 -0.453 7.709) 8.217 6.740 ( 6.931 -0.571 0.143) 6.956 6.967 ( -1.540 -5.731 1.163) 6.047 7.806 ( -6.196 7.842 5.810) 11.561 8.002 ( -10.872 -12.135 2.493) 16.482 9.602 ( 5.376 -3.464 10.905) 12.642 9.984 ( -9.754 3.230 18.694) 21.332 10.429 ( 10.241 0.699 6.916) 12.378 10.504 ( -18.764 -3.680 23.538) 30.326 11.000 ( 22.998 -0.085 -32.261) 39.619 11.427 ( 4.424 8.493 -16.443) 19.028 12.578 ( -5.262 7.381 -4.158) 9.973 12.668 ( -1.074 3.118 -4.138) 5.291 13.694 ( 6.561 -1.655 6.904) 9.667 13.923 ( -3.077 -4.730 3.648) 6.719 14.200 ( 4.041 0.030 -2.802) 4.917 14.844 ( -12.300 1.968 2.572) 12.720 17.730 ( 15.005 0.126 -15.722) 21.733 18.571 ( -5.188 -2.317 20.511) 21.284 19.326 ( -14.027 2.938 -9.276) 17.072 19.828 ( -4.291 -1.317 -7.889) 9.076 20.764 ( 33.618 -2.033 1.713) 33.723 22.432 ( -22.862 -1.731 6.058) 23.715 24.301 ( -0.608 7.263 -4.809) 8.733 24.433 ( -6.195 -4.634 -4.488) 8.944 ======================= Grid point 800 (407/432) ======================= q-point: (-0.45 0.36 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.462 ( -7.636 -0.686 6.680) 10.169 2.743 ( -9.285 -0.026 -4.471) 10.305 2.970 ( -1.511 0.564 2.571) 3.035 3.103 ( 0.350 0.101 -0.132) 0.387 3.283 ( -1.300 1.952 5.157) 5.666 3.531 ( 6.846 -3.875 1.032) 7.934 3.694 ( 10.596 4.594 -6.233) 13.124 4.029 ( -14.464 -1.534 -1.912) 14.671 5.129 ( 3.251 0.995 4.593) 5.714 5.212 ( 4.258 -4.409 0.341) 6.139 5.810 ( 1.966 2.691 6.346) 7.168 5.876 ( 4.735 -0.649 1.897) 5.142 6.847 ( 5.592 -2.661 1.844) 6.462 7.024 ( -0.896 -8.648 -0.781) 8.729 7.767 ( -0.097 1.361 4.404) 4.610 7.997 ( -10.359 -12.752 1.869) 16.535 9.827 ( 5.678 -3.242 9.532) 11.559 10.015 ( -11.079 1.836 14.976) 18.719 10.455 ( -25.202 -0.760 27.047) 36.976 10.763 ( 20.633 -2.123 2.287) 20.868 10.957 ( 21.394 -0.643 -27.469) 34.823 11.222 ( -0.561 10.823 -8.926) 14.040 12.379 ( -6.546 6.748 -5.221) 10.754 12.478 ( -5.473 15.465 -6.614) 17.688 13.842 ( 0.674 -0.874 7.817) 7.894 14.024 ( 4.706 -10.697 -0.777) 11.712 14.235 ( 7.361 3.504 -0.592) 8.174 14.651 ( -15.147 3.863 0.078) 15.632 17.837 ( 18.835 0.113 -5.016) 19.492 18.596 ( -12.691 -1.221 -3.688) 13.272 19.144 ( -4.856 0.139 7.704) 9.107 19.685 ( -3.873 -1.402 -9.629) 10.473 21.265 ( 34.913 -2.190 2.949) 35.106 22.169 ( -27.080 -2.315 2.288) 27.275 24.208 ( 2.118 5.206 -3.438) 6.588 24.322 ( -7.342 -1.165 -3.100) 8.054 ======================= Grid point 801 (408/432) ======================= q-point: (-0.36 0.36 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( -0.747 -0.616 7.093) 7.159 2.624 ( 0.049 -1.129 -5.519) 5.633 2.984 ( -1.230 1.273 3.507) 3.928 3.061 ( -0.006 -0.169 -4.222) 4.225 3.324 ( -6.100 2.377 12.055) 13.718 3.579 ( 8.116 -0.026 -11.669) 14.214 3.759 ( -5.298 0.456 5.534) 7.675 3.885 ( 4.971 -0.246 -5.869) 7.695 5.202 ( 0.778 -0.360 4.069) 4.158 5.262 ( -0.159 -2.892 -2.037) 3.541 5.851 ( -3.641 2.218 6.380) 7.674 5.936 ( 3.746 -0.281 -2.106) 4.306 6.961 ( -0.984 -4.996 4.328) 6.683 7.043 ( -1.021 -7.627 -3.417) 8.420 7.912 ( 7.873 -9.016 5.092) 13.008 7.989 ( -5.523 -12.373 -2.228) 13.732 9.968 ( -7.925 1.746 11.491) 14.068 10.041 ( 3.445 -2.577 3.569) 5.590 10.437 ( -24.752 -2.370 25.525) 35.635 10.936 ( 17.886 -0.408 -23.106) 29.222 11.016 ( 0.610 5.380 -0.706) 5.460 11.062 ( 9.643 3.269 -3.229) 10.682 12.165 ( -10.797 13.665 -0.397) 17.420 12.221 ( 6.314 17.361 -6.318) 19.524 13.933 ( -3.398 -3.201 9.566) 10.644 14.108 ( 2.286 -7.769 -7.601) 11.107 14.358 ( 11.579 5.648 3.189) 13.272 14.404 ( -12.287 4.127 -1.651) 13.066 18.090 ( 19.866 0.483 3.890) 20.249 18.263 ( -19.341 0.522 -12.137) 22.840 19.292 ( 2.136 -3.371 12.648) 13.263 19.539 ( -0.767 -0.840 -11.367) 11.424 21.769 ( 32.637 -1.856 2.504) 32.786 21.812 ( -29.094 -2.615 -1.740) 29.263 24.180 ( -4.767 2.014 0.707) 5.223 24.213 ( 1.824 2.711 -2.289) 3.990 ======================= Grid point 802 (409/432) ======================= q-point: (-0.27 -0.64 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.561 ( 2.200 0.303 1.858) 2.896 2.673 ( 10.546 -1.156 -1.130) 10.669 2.990 ( -2.572 -0.662 4.792) 5.478 3.042 ( 2.584 2.011 -2.649) 4.212 3.330 ( -8.373 1.280 7.199) 11.116 3.553 ( 9.603 1.549 -9.982) 13.938 3.627 ( -13.277 -1.513 0.112) 13.363 4.020 ( 13.846 1.388 0.132) 13.916 5.203 ( -4.602 -0.262 -3.312) 5.676 5.251 ( -1.660 -1.649 2.234) 3.235 5.821 ( -8.066 0.973 4.249) 9.168 5.928 ( 1.158 0.251 -5.075) 5.212 6.912 ( -12.635 -3.605 1.463) 13.221 7.149 ( 5.370 -8.812 0.719) 10.344 7.952 ( -5.261 -10.770 -5.549) 13.208 8.257 ( 15.943 -17.689 2.465) 23.941 9.944 ( -8.434 -1.649 6.701) 10.897 10.143 ( 6.464 2.394 -1.222) 7.000 10.425 ( -22.966 -3.782 23.511) 33.083 10.848 ( -7.138 3.607 -8.237) 11.481 10.850 ( -6.505 2.927 -3.724) 8.047 11.126 ( 19.315 5.832 -17.910) 26.978 11.932 ( -5.188 21.707 4.006) 22.675 12.254 ( 18.367 8.225 2.828) 20.322 14.027 ( -4.551 -4.216 9.872) 11.659 14.051 ( -2.846 0.994 -7.886) 8.442 14.189 ( -8.133 -0.191 -1.418) 8.258 14.543 ( 14.760 5.882 1.282) 15.940 17.871 ( -20.582 0.196 -8.242) 22.172 18.418 ( 18.802 0.564 8.915) 20.816 19.339 ( -5.147 0.750 -4.991) 7.208 19.569 ( 10.486 -3.980 2.683) 11.532 21.390 ( -31.076 -3.140 -4.232) 31.520 22.243 ( 32.015 -2.848 0.858) 32.153 24.057 ( -8.825 5.103 1.905) 10.370 24.277 ( 7.525 0.741 1.489) 7.706 ======================= Grid point 803 (410/432) ======================= q-point: (-0.18 -0.64 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( 6.186 2.627 -2.693) 7.240 2.797 ( 4.475 1.024 2.111) 5.053 3.010 ( 2.429 4.137 -2.057) 5.220 3.086 ( 2.571 -2.205 6.784) 7.583 3.230 ( -10.509 -2.528 -0.025) 10.808 3.503 ( 5.756 2.673 -9.896) 11.756 3.607 ( 2.018 -1.759 4.066) 4.868 4.186 ( 10.446 1.289 2.657) 10.856 5.069 ( -6.457 1.960 -5.073) 8.442 5.245 ( -5.253 -2.166 1.411) 5.854 5.717 ( -12.558 -0.305 2.088) 12.734 5.850 ( -0.869 0.587 -8.114) 8.181 6.780 ( -14.480 -2.970 2.745) 15.034 7.299 ( 5.176 -6.144 1.065) 8.104 7.901 ( -3.349 -10.933 -8.537) 14.270 8.640 ( 14.288 -20.308 -0.977) 24.850 9.932 ( -2.883 -1.033 -0.799) 3.165 10.103 ( -4.831 2.002 -1.721) 5.505 10.426 ( -18.471 -5.419 15.852) 24.937 10.522 ( -12.784 19.897 -2.541) 23.787 10.760 ( -8.790 -6.097 5.041) 11.826 11.148 ( 24.991 -0.379 -25.204) 35.496 11.740 ( -1.496 25.675 5.571) 26.315 12.550 ( 20.735 0.737 6.116) 21.631 13.881 ( -4.615 3.880 -6.298) 8.719 14.064 ( -0.345 3.678 0.474) 3.724 14.175 ( -5.909 -8.515 7.033) 12.525 14.665 ( 11.542 8.173 -0.252) 14.145 17.561 ( -19.204 -0.360 0.685) 19.219 18.763 ( 16.517 -1.193 9.643) 19.163 19.184 ( -2.895 3.167 -8.572) 9.586 19.765 ( 7.768 -2.064 3.894) 8.931 20.978 ( -27.156 -4.694 -5.122) 28.030 22.684 ( 29.507 -5.626 -0.579) 30.044 23.908 ( -9.870 8.148 3.043) 13.156 24.414 ( 8.817 0.110 3.932) 9.655 ======================= Grid point 804 (411/432) ======================= q-point: (-0.09 -0.64 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.568 ( 2.131 7.086 -8.984) 11.638 2.764 ( -5.385 7.081 0.436) 8.906 2.987 ( -8.566 -0.957 0.092) 8.620 3.091 ( 5.513 -1.302 2.419) 6.159 3.348 ( 6.766 -3.444 7.663) 10.787 3.497 ( 12.764 2.576 -9.303) 16.003 3.721 ( 3.978 -5.015 4.813) 8.009 4.332 ( 7.522 2.033 4.616) 9.056 4.905 ( -6.578 3.065 -4.306) 8.439 5.171 ( -9.391 -1.127 -0.341) 9.465 5.549 ( -16.159 -1.240 1.135) 16.246 5.725 ( -0.494 -0.270 -11.307) 11.321 6.659 ( -13.790 -3.119 4.930) 14.973 7.382 ( 2.879 1.823 0.266) 3.418 7.875 ( 0.523 -12.170 -9.981) 15.748 8.901 ( 4.856 -17.569 -4.091) 18.681 9.768 ( -4.513 8.910 -10.526) 14.511 9.980 ( -14.896 8.917 2.554) 17.548 10.290 ( -1.394 -6.347 -1.977) 6.792 10.383 ( -19.501 3.610 18.555) 27.159 10.824 ( 1.070 -5.779 4.740) 7.551 11.210 ( 25.586 -3.137 -25.559) 36.301 11.610 ( 1.092 18.247 5.647) 19.132 12.850 ( 14.809 -0.891 3.061) 15.148 13.742 ( -1.484 3.761 -5.871) 7.129 14.022 ( 3.777 5.840 -3.102) 7.615 14.267 ( -6.993 -8.098 10.737) 15.158 14.705 ( 7.075 10.197 -0.118) 12.411 17.401 ( -15.970 -0.161 11.741) 19.822 18.944 ( -0.450 -2.045 -12.602) 12.775 19.159 ( 12.638 2.591 10.707) 16.765 19.868 ( 0.705 1.143 3.132) 3.408 20.670 ( -16.703 -5.696 -5.055) 18.357 23.106 ( 26.183 -10.215 -1.477) 28.143 23.724 ( -12.026 10.789 3.865) 16.612 24.581 ( 9.033 1.273 5.009) 10.407 ======================= Grid point 810 (412/432) ======================= q-point: ( 0.45 0.45 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( -7.554 0.000 6.499) 9.965 2.743 ( -10.316 0.000 -4.267) 11.163 2.971 ( 0.205 -0.000 -0.603) 0.637 3.109 ( 0.276 -0.000 3.791) 3.801 3.304 ( -2.669 0.000 4.136) 4.923 3.493 ( 7.584 -0.000 0.110) 7.585 3.735 ( 12.545 -0.000 -4.868) 13.456 4.015 ( -16.908 0.000 -1.466) 16.972 5.139 ( 3.221 -0.000 3.259) 4.582 5.168 ( 4.590 -0.000 1.297) 4.770 5.848 ( 7.455 -0.000 1.381) 7.582 5.857 ( -1.031 0.000 7.100) 7.174 6.824 ( 4.811 -0.000 1.376) 5.004 6.945 ( 0.052 -0.000 -0.159) 0.167 7.833 ( -5.145 0.000 1.051) 5.252 7.837 ( -6.093 0.000 4.411) 7.522 9.797 ( 7.390 -0.000 9.983) 12.420 10.035 ( -13.363 0.000 15.271) 20.292 10.449 ( -26.552 0.000 27.339) 38.110 10.742 ( 23.741 -0.000 1.851) 23.813 10.950 ( 22.002 -0.000 -28.564) 36.055 11.315 ( -3.910 0.000 -10.517) 11.220 12.430 ( -7.685 0.000 -2.193) 7.992 12.632 ( -2.405 0.000 -8.688) 9.015 13.859 ( 9.165 -0.000 2.368) 9.466 13.894 ( -4.173 0.000 4.520) 6.151 14.266 ( 8.644 -0.000 0.138) 8.645 14.685 ( -15.688 0.000 0.721) 15.705 17.838 ( 19.025 -0.000 -5.119) 19.701 18.585 ( -11.719 0.000 -1.698) 11.842 19.147 ( -8.245 0.000 7.285) 11.002 19.672 ( -2.778 0.000 -10.134) 10.508 21.245 ( 35.742 -0.000 2.776) 35.849 22.150 ( -26.275 0.000 2.131) 26.361 24.274 ( 0.315 -0.000 -4.659) 4.670 24.291 ( -6.178 0.000 -1.861) 6.452 ======================= Grid point 811 (413/432) ======================= q-point: (-0.45 -0.55 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( 1.310 -0.132 6.393) 6.528 2.609 ( -1.452 -0.574 -5.303) 5.528 3.000 ( 1.900 0.492 2.835) 3.448 3.061 ( -4.258 0.155 -3.061) 5.247 3.355 ( -4.127 1.020 11.088) 11.875 3.569 ( 8.475 -0.595 -7.415) 11.277 3.770 ( -18.019 0.459 2.958) 18.266 3.883 ( 15.905 -0.009 -5.808) 16.933 5.192 ( 0.236 -0.390 2.035) 2.086 5.216 ( 0.371 -1.932 -0.473) 2.024 5.886 ( -3.378 1.504 4.700) 5.980 5.932 ( 3.378 -0.257 -0.095) 3.389 6.896 ( 0.596 -2.098 2.867) 3.602 6.936 ( -2.854 -3.999 -1.420) 5.114 7.825 ( 3.236 -1.732 1.812) 4.093 7.850 ( -0.466 -4.491 -0.308) 4.525 9.991 ( -7.670 0.984 9.368) 12.147 10.009 ( 3.785 -1.281 6.513) 7.641 10.410 ( -25.674 -0.813 25.913) 36.487 10.926 ( 20.594 -0.379 -25.345) 32.659 11.065 ( 17.756 1.024 0.463) 17.792 11.095 ( -11.556 0.913 -4.932) 12.597 12.353 ( -0.767 6.887 1.802) 7.160 12.447 ( -2.645 7.596 -7.535) 11.022 13.891 ( -3.987 -0.871 5.665) 6.981 13.978 ( 3.688 -5.867 -2.986) 7.546 14.432 ( 14.608 2.452 2.405) 15.007 14.461 ( -16.109 1.952 -0.562) 16.237 18.096 ( 20.154 0.203 3.963) 20.541 18.270 ( -19.360 0.238 -12.016) 22.787 19.252 ( 0.537 -1.270 14.463) 14.528 19.528 ( 0.318 -0.363 -12.310) 12.319 21.744 ( 34.661 -0.889 1.812) 34.720 21.784 ( -29.623 -0.788 -2.127) 29.710 24.204 ( -5.641 0.747 1.214) 5.819 24.245 ( 2.082 0.999 -2.535) 3.429 ======================= Grid point 812 (414/432) ======================= q-point: (-0.36 -0.55 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.571 ( 5.219 0.812 -1.580) 5.513 2.652 ( 10.859 -1.243 1.931) 11.100 2.974 ( -4.477 -0.896 0.844) 4.643 3.076 ( 3.822 1.638 1.912) 4.577 3.367 ( -8.331 3.107 5.335) 10.369 3.519 ( -4.323 -3.946 -5.551) 8.067 3.636 ( -3.286 1.125 0.491) 3.508 4.044 ( 16.073 1.415 -3.098) 16.430 5.187 ( -4.286 -1.226 -0.994) 4.568 5.208 ( -2.835 -2.767 0.072) 3.962 5.844 ( -7.091 1.411 2.121) 7.535 5.941 ( 0.804 0.901 -2.801) 3.050 6.853 ( -10.227 -2.944 0.556) 10.656 6.993 ( 1.017 -8.153 1.935) 8.441 7.852 ( 1.795 -1.885 -3.681) 4.508 8.019 ( 13.668 -10.486 0.045) 17.227 9.920 ( -9.237 -1.104 3.435) 9.917 10.176 ( 10.101 1.403 0.339) 10.204 10.376 ( -25.526 -1.903 25.691) 36.266 10.809 ( -20.948 -2.216 -1.984) 21.158 10.908 ( 13.423 0.890 -17.835) 22.340 11.235 ( 12.982 5.226 -8.578) 16.414 12.264 ( -0.549 16.039 5.174) 16.862 12.403 ( 10.255 7.968 0.473) 12.996 13.916 ( -6.629 -6.060 4.507) 10.048 14.011 ( 1.767 -4.519 -3.909) 6.231 14.235 ( -12.155 3.317 -0.172) 12.601 14.638 ( 16.000 4.567 1.695) 16.725 17.874 ( -21.151 0.115 -8.446) 22.775 18.427 ( 18.458 0.409 8.652) 20.389 19.366 ( -0.042 2.534 -4.944) 5.555 19.498 ( 8.321 -4.411 3.290) 9.976 21.347 ( -31.509 -1.883 -5.057) 31.968 22.202 ( 32.021 -1.877 -0.857) 32.087 24.137 ( -5.850 4.028 3.459) 7.900 24.278 ( 4.683 -0.479 1.123) 4.839 ======================= Grid point 813 (415/432) ======================= q-point: (-0.27 -0.55 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( 10.241 1.298 -3.639) 10.946 2.817 ( 5.003 1.648 4.146) 6.704 3.019 ( 5.344 -4.947 4.354) 8.485 3.092 ( 1.887 4.090 -2.033) 4.942 3.206 ( -14.473 0.317 -0.116) 14.477 3.483 ( -2.974 -3.278 -0.182) 4.430 3.637 ( 8.693 3.055 -3.007) 9.693 4.202 ( 11.566 1.132 0.563) 11.635 5.091 ( -6.571 0.695 -2.855) 7.198 5.181 ( -6.402 -4.898 -0.117) 8.061 5.724 ( -10.902 0.923 -0.440) 10.950 5.876 ( -1.501 2.001 -5.619) 6.151 6.733 ( -13.327 -2.490 2.353) 13.760 7.124 ( 2.694 -12.344 1.672) 12.744 7.828 ( 3.027 1.228 -6.601) 7.365 8.328 ( 16.135 -16.523 -2.632) 23.244 9.864 ( -4.124 -5.169 -1.982) 6.903 10.177 ( -1.413 5.918 -7.382) 9.566 10.354 ( -22.953 -2.947 22.369) 32.186 10.601 ( -13.571 -6.655 0.388) 15.120 10.842 ( -1.715 9.862 1.374) 10.104 11.184 ( 16.064 5.454 -20.560) 26.655 12.163 ( -2.618 23.023 7.042) 24.218 12.577 ( 17.704 2.045 3.421) 18.147 13.874 ( -6.450 -4.514 -4.193) 8.920 14.049 ( -1.670 -5.720 2.981) 6.663 14.114 ( -3.780 2.416 1.487) 4.726 14.797 ( 13.697 6.850 -0.239) 15.316 17.555 ( -19.776 -0.339 0.863) 19.798 18.743 ( 14.714 -1.095 6.385) 16.077 19.262 ( 4.232 5.773 -9.012) 11.509 19.714 ( 8.101 -3.938 6.142) 10.902 20.899 ( -29.917 -4.376 -5.572) 30.745 22.598 ( 28.616 -4.290 -4.092) 29.224 24.054 ( -6.038 8.780 4.952) 11.751 24.397 ( 6.449 -2.208 4.481) 8.157 ======================= Grid point 814 (416/432) ======================= q-point: (-0.18 -0.55 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.672 ( 5.100 4.997 -8.643) 11.211 2.855 ( -6.631 2.942 9.533) 11.979 2.965 ( -11.272 -2.118 -3.396) 11.961 3.088 ( 2.084 2.046 -1.759) 3.409 3.267 ( 12.045 -4.593 6.450) 14.414 3.512 ( 11.423 -2.230 -7.120) 13.644 3.714 ( 6.857 3.704 1.661) 7.969 4.343 ( 6.935 0.110 3.859) 7.937 4.953 ( -6.697 2.577 -2.993) 7.775 5.116 ( -9.079 -5.313 -1.168) 10.584 5.540 ( -14.349 0.027 -1.414) 14.418 5.747 ( -2.398 2.498 -8.692) 9.356 6.614 ( -13.212 -2.226 4.722) 14.206 7.298 ( 4.449 -12.119 1.434) 12.989 7.772 ( 3.933 1.640 -8.374) 9.396 8.607 ( 10.418 -17.200 -6.126) 21.022 9.854 ( -0.101 -6.401 -5.898) 8.705 9.962 ( -6.719 2.599 -7.895) 10.688 10.269 ( -21.492 0.391 8.837) 23.241 10.479 ( -16.068 3.031 11.699) 20.106 10.831 ( -0.855 8.529 14.104) 16.504 11.162 ( 22.991 -1.808 -26.207) 34.910 11.971 ( -5.458 23.074 4.210) 24.082 12.839 ( 15.347 -0.753 2.448) 15.559 13.771 ( -2.910 -0.877 -6.137) 6.849 14.067 ( 0.740 -1.172 -3.200) 3.487 14.143 ( -4.253 -4.688 9.645) 11.537 14.874 ( 10.429 9.228 -2.074) 14.079 17.398 ( -15.809 -0.171 12.784) 20.332 18.894 ( 7.019 -3.254 -12.705) 14.876 19.254 ( 9.714 8.036 5.783) 13.870 19.874 ( 2.779 -0.650 4.040) 4.946 20.552 ( -20.645 -7.956 -3.625) 22.420 22.942 ( 24.790 -8.609 -6.653) 27.073 23.934 ( -7.515 13.450 5.793) 16.460 24.573 ( 7.494 -2.310 6.280) 10.047 ======================= Grid point 815 (417/432) ======================= q-point: (-0.09 -0.55 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( -8.467 6.527 -11.378) 15.613 2.810 ( -8.756 6.774 8.020) 13.670 2.846 ( -3.291 -2.002 -3.559) 5.244 3.177 ( 6.971 -5.887 1.963) 9.333 3.502 ( 5.727 -1.516 6.253) 8.614 3.614 ( 15.518 5.046 -8.549) 18.422 3.816 ( 10.102 -2.225 2.445) 10.629 4.465 ( 1.238 -0.558 6.644) 6.782 4.820 ( -5.250 3.414 -1.383) 6.414 5.003 ( -9.009 -2.795 -3.170) 9.951 5.333 ( -15.940 -0.943 0.589) 15.978 5.591 ( -0.649 1.169 -11.618) 11.695 6.541 ( -10.462 -2.313 6.743) 12.659 7.431 ( 2.404 -1.733 1.663) 3.398 7.739 ( 5.667 -4.215 -10.234) 12.434 8.752 ( 2.776 -15.245 -4.886) 16.248 9.668 ( -7.131 12.203 -10.228) 17.446 9.877 ( -9.238 1.118 2.391) 9.608 10.104 ( -5.366 -9.801 -3.754) 11.788 10.445 ( -16.984 2.394 23.413) 29.024 10.931 ( 4.071 4.191 7.667) 9.640 11.211 ( 23.003 -4.948 -24.317) 33.837 11.763 ( -5.450 14.919 1.453) 15.950 13.012 ( 8.048 0.021 -0.041) 8.048 13.674 ( -1.331 0.716 -6.168) 6.351 14.052 ( 1.177 0.209 -2.416) 2.696 14.256 ( -2.758 -6.547 9.655) 11.987 14.879 ( 7.568 10.702 -2.617) 13.366 17.421 ( -11.066 1.306 22.393) 25.012 18.750 ( 2.569 -0.086 -22.008) 22.158 19.453 ( 10.165 2.243 9.589) 14.153 19.875 ( -5.507 1.052 1.770) 5.879 20.427 ( -5.735 -7.227 -1.340) 9.323 23.245 ( 19.292 -13.041 -8.018) 24.628 23.765 ( -8.977 16.237 6.670) 19.715 24.754 ( 6.669 -0.770 5.913) 8.946 ======================= Grid point 822 (418/432) ======================= q-point: (-0.45 -0.45 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( 7.178 -0.000 -5.682) 9.155 2.639 ( 10.384 -0.000 5.751) 11.870 2.966 ( -5.763 0.000 -0.334) 5.772 3.090 ( 4.134 -0.000 3.805) 5.618 3.412 ( -4.054 0.000 7.020) 8.106 3.467 ( -10.980 0.000 -8.184) 13.694 3.645 ( -2.188 0.000 2.364) 3.221 4.058 ( 17.203 -0.000 -4.468) 17.774 5.177 ( -3.545 0.000 -1.116) 3.716 5.178 ( -3.823 0.000 0.211) 3.828 5.857 ( -6.741 0.000 1.290) 6.863 5.949 ( 0.632 -0.000 -1.923) 2.024 6.827 ( -8.934 0.000 -0.067) 8.934 6.918 ( -0.756 0.000 2.627) 2.734 7.854 ( 5.608 -0.000 -1.341) 5.766 7.917 ( 11.176 -0.000 -2.423) 11.436 9.910 ( -9.584 0.000 2.100) 9.811 10.188 ( 11.619 -0.000 1.165) 11.677 10.360 ( -26.311 0.000 26.529) 37.363 10.789 ( -23.507 0.000 -2.598) 23.650 10.913 ( 16.255 -0.000 -19.410) 25.317 11.279 ( 13.365 -0.000 -5.582) 14.484 12.416 ( 4.350 -0.000 -1.627) 4.644 12.472 ( 3.117 -0.000 6.677) 7.368 13.860 ( -6.317 0.000 2.583) 6.825 13.963 ( 1.925 -0.000 -2.509) 3.163 14.265 ( -12.893 0.000 0.197) 12.894 14.679 ( 16.205 -0.000 1.663) 16.290 17.875 ( -21.397 0.000 -8.531) 23.035 18.430 ( 18.294 -0.000 8.555) 20.195 19.412 ( 5.750 -0.000 -14.447) 15.549 19.435 ( 3.732 -0.000 13.109) 13.629 21.331 ( -31.634 0.000 -5.607) 32.127 22.185 ( 31.930 -0.000 -1.280) 31.955 24.176 ( -4.003 0.000 4.703) 6.176 24.270 ( 2.953 -0.000 0.288) 2.967 ======================= Grid point 823 (419/432) ======================= q-point: (-0.36 -0.45 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( 12.915 0.416 -5.599) 14.083 2.857 ( 8.178 2.988 5.090) 10.085 2.935 ( 0.602 -4.550 4.514) 6.437 3.116 ( -6.319 -0.221 -3.679) 7.315 3.254 ( -6.896 3.485 1.064) 7.799 3.429 ( -1.751 -2.559 1.087) 3.286 3.668 ( 6.290 0.718 -1.899) 6.609 4.225 ( 13.372 1.108 -1.126) 13.465 5.097 ( -6.242 0.083 -1.262) 6.369 5.108 ( -7.341 -2.765 -1.281) 7.949 5.740 ( -10.298 0.653 -1.629) 10.447 5.902 ( -1.649 0.876 -4.593) 4.958 6.702 ( -12.342 -1.040 2.405) 12.617 6.961 ( 0.820 -5.497 1.570) 5.775 7.898 ( 8.010 5.907 -3.464) 10.538 8.094 ( 14.987 -10.560 -5.308) 19.087 9.797 ( -5.538 -2.182 -5.796) 8.308 10.277 ( 1.585 5.129 -4.109) 6.760 10.322 ( -20.808 -1.208 21.658) 30.058 10.491 ( -20.758 -5.155 3.986) 21.757 10.922 ( 11.511 1.359 -9.592) 15.045 11.290 ( 5.505 4.566 -8.921) 11.434 12.472 ( 1.233 12.849 6.142) 14.295 12.590 ( 9.496 -1.826 3.340) 10.230 13.794 ( -6.221 -3.183 -1.674) 7.186 13.971 ( 1.152 -2.996 -1.598) 3.586 14.148 ( -6.350 1.217 2.444) 6.913 14.878 ( 14.299 2.553 -0.425) 14.531 17.551 ( -20.140 -0.141 0.997) 20.165 18.729 ( 13.752 -0.427 4.380) 14.439 19.355 ( 11.213 4.156 -11.173) 16.366 19.646 ( 5.950 -3.257 9.653) 11.798 20.844 ( -31.770 -1.825 -6.519) 32.483 22.548 ( 27.735 -1.555 -5.262) 28.273 24.184 ( -1.997 5.758 6.643) 9.015 24.346 ( 3.553 -3.284 3.802) 6.153 ======================= Grid point 824 (420/432) ======================= q-point: (-0.27 -0.45 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( 7.593 2.359 -7.594) 10.995 2.874 ( -7.153 0.177 9.739) 12.085 2.912 ( -16.531 -3.358 -1.878) 16.973 3.136 ( 5.879 0.537 -1.879) 6.195 3.230 ( 11.650 1.780 1.045) 11.831 3.468 ( 8.433 -2.351 -3.399) 9.392 3.770 ( 10.655 1.843 0.670) 10.834 4.361 ( 7.576 2.102 2.963) 8.402 4.988 ( -6.187 1.491 -2.074) 6.694 5.012 ( -9.824 -6.015 -1.797) 11.659 5.547 ( -13.581 0.599 -3.116) 13.947 5.789 ( -3.261 2.037 -7.218) 8.178 6.585 ( -12.776 -1.184 5.124) 13.816 7.077 ( 4.128 -11.219 0.681) 11.973 7.880 ( 7.823 9.690 -6.473) 14.036 8.328 ( 12.524 -15.782 -6.996) 21.328 9.689 ( -2.798 -8.160 -9.436) 12.785 10.079 ( -9.421 7.347 -3.829) 12.546 10.271 ( -17.446 0.211 10.348) 20.286 10.436 ( -14.027 -5.608 12.201) 19.418 10.989 ( 9.421 4.608 1.408) 10.581 11.199 ( 6.992 7.154 -11.099) 14.942 12.332 ( -9.160 18.248 3.970) 20.800 12.812 ( 13.848 -2.726 1.887) 14.239 13.720 ( -3.512 -3.931 -5.417) 7.559 14.002 ( 0.287 -4.282 -0.715) 4.351 14.121 ( -2.608 0.121 4.020) 4.793 14.998 ( 11.809 5.144 -3.132) 13.256 17.396 ( -15.648 -0.110 13.688) 20.790 18.849 ( 10.041 -1.944 -13.731) 17.121 19.405 ( 12.432 8.981 2.144) 15.486 19.844 ( 4.907 -2.812 6.104) 8.321 20.423 ( -26.053 -6.589 -3.790) 27.140 22.830 ( 23.381 -4.524 -8.377) 25.245 24.156 ( -2.499 12.395 6.508) 14.221 24.503 ( 4.957 -5.942 6.447) 10.072 ======================= Grid point 825 (421/432) ======================= q-point: (-0.18 -0.45 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.557 ( -12.137 4.648 -8.551) 15.557 2.748 ( -16.166 -6.148 4.219) 17.803 2.923 ( -0.245 3.096 4.014) 5.075 3.111 ( 6.852 -1.491 -6.858) 9.808 3.459 ( 11.363 -2.241 3.616) 12.133 3.640 ( 19.076 -1.071 -2.623) 19.285 3.884 ( 11.082 7.010 -0.403) 13.119 4.457 ( 0.502 0.676 6.640) 6.693 4.872 ( -5.001 2.447 -1.990) 5.912 4.918 ( -8.381 -6.750 -2.860) 11.134 5.323 ( -15.356 -0.324 -1.143) 15.402 5.629 ( -3.029 2.661 -9.557) 10.373 6.512 ( -10.320 -1.150 7.380) 12.739 7.262 ( 5.616 -14.153 0.546) 15.236 7.799 ( 6.250 9.036 -9.911) 14.797 8.507 ( 6.918 -13.953 -5.239) 16.431 9.690 ( 1.731 -13.569 -5.984) 14.930 9.874 ( -3.347 8.067 -6.279) 10.757 10.072 ( -18.027 2.770 0.576) 18.247 10.456 ( -20.138 -1.706 24.933) 32.095 11.100 ( -0.150 13.392 15.836) 20.740 11.136 ( 21.333 -3.195 -25.640) 33.507 12.058 ( -11.470 18.247 0.134) 21.553 12.996 ( 8.397 -1.997 0.070) 8.632 13.642 ( -2.704 -4.266 -6.795) 8.467 14.022 ( -0.924 -3.048 -0.451) 3.217 14.171 ( -0.497 -3.285 5.895) 6.767 15.035 ( 9.834 7.443 -5.829) 13.641 17.443 ( -9.658 1.193 23.704) 25.624 18.737 ( 7.395 -1.203 -26.609) 27.644 19.545 ( 8.758 8.275 8.934) 15.000 19.888 ( -6.054 0.634 1.362) 6.238 20.270 ( -6.523 -11.127 1.584) 12.995 23.064 ( 19.773 -8.225 -9.433) 23.401 24.049 ( -5.334 17.067 5.572) 18.729 24.698 ( 4.981 -5.996 6.263) 9.999 ======================= Grid point 826 (422/432) ======================= q-point: (-0.09 -0.45 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( -12.150 3.622 -6.648) 14.316 2.657 ( -17.086 -7.497 8.180) 20.373 2.901 ( 5.486 4.478 -4.969) 8.651 3.217 ( 5.999 -7.987 0.667) 10.011 3.587 ( 0.771 0.857 1.706) 2.059 3.785 ( 13.211 10.413 -7.453) 18.399 4.016 ( 14.846 1.200 2.873) 15.169 4.490 ( -7.133 -0.093 5.916) 9.267 4.777 ( -6.127 1.229 1.270) 6.377 4.858 ( 0.454 -4.658 -5.666) 7.349 5.161 ( -12.591 -0.873 5.865) 13.918 5.471 ( 0.651 1.713 -11.048) 11.199 6.502 ( -5.983 -0.949 8.133) 10.141 7.441 ( 3.123 -9.664 1.705) 10.298 7.683 ( 3.946 3.490 -12.224) 13.311 8.677 ( 6.770 -10.552 2.799) 12.846 9.547 ( -10.381 13.926 -9.331) 19.717 9.827 ( -5.369 -0.534 4.154) 6.809 9.934 ( 1.440 -13.082 -3.731) 13.680 10.487 ( -19.782 -0.342 25.321) 32.134 11.088 ( 8.073 4.381 -7.765) 12.027 11.234 ( 13.666 2.529 -6.665) 15.413 11.764 ( -10.306 11.762 -1.779) 15.739 13.066 ( 1.832 -0.865 -0.869) 2.204 13.579 ( -1.825 -3.654 -4.692) 6.221 14.020 ( -2.847 -1.912 0.963) 3.562 14.283 ( 0.409 -5.747 6.104) 8.394 15.006 ( 8.183 8.498 -8.027) 14.270 17.625 ( -4.645 3.508 26.997) 27.617 18.506 ( 4.738 -1.376 -28.184) 28.613 19.675 ( 5.378 4.476 6.283) 9.404 19.814 ( -3.394 -0.284 -0.312) 3.420 20.344 ( -0.223 -6.887 2.007) 7.177 23.274 ( 14.903 -9.272 -7.906) 19.250 23.864 ( -7.897 17.181 4.048) 19.337 24.853 ( 2.330 -4.549 3.843) 6.395 ======================= Grid point 834 (423/432) ======================= q-point: (-0.36 -0.36 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( 9.044 -0.000 -7.497) 11.747 2.877 ( -7.453 0.000 7.961) 10.905 2.878 ( -18.777 0.000 -0.578) 18.786 3.125 ( 11.066 -0.000 1.384) 11.152 3.268 ( 6.668 -0.000 -3.479) 7.521 3.444 ( 8.523 -0.000 -2.166) 8.794 3.780 ( 11.362 -0.000 0.986) 11.405 4.388 ( 8.877 -0.000 2.832) 9.317 4.952 ( -11.200 0.000 -1.706) 11.330 5.001 ( -5.466 0.000 -2.252) 5.912 5.553 ( -13.615 0.000 -3.518) 14.062 5.807 ( -3.349 0.000 -6.936) 7.703 6.575 ( -12.610 0.000 5.456) 13.740 6.977 ( 3.717 -0.000 0.424) 3.742 8.054 ( 10.282 -0.000 0.906) 10.321 8.103 ( 12.132 -0.000 -14.081) 18.587 9.618 ( -4.304 0.000 -10.599) 11.440 10.155 ( -20.332 0.000 6.664) 21.397 10.281 ( 7.466 -0.000 -17.483) 19.010 10.363 ( -27.174 0.000 32.263) 42.182 11.011 ( 17.559 -0.000 -11.113) 20.780 11.286 ( -1.975 0.000 1.903) 2.743 12.514 ( -12.310 0.000 3.756) 12.871 12.768 ( 14.178 -0.000 2.116) 14.335 13.681 ( -2.709 0.000 -6.117) 6.690 13.960 ( 1.124 -0.000 -0.616) 1.282 14.124 ( -3.161 0.000 3.075) 4.409 15.042 ( 12.173 -0.000 -3.494) 12.665 17.395 ( -15.576 0.000 14.048) 20.975 18.832 ( 10.831 -0.000 -14.268) 17.913 19.499 ( 16.065 -0.000 -0.473) 16.072 19.806 ( 4.670 -0.000 8.594) 9.781 20.362 ( -29.230 0.000 -4.322) 29.548 22.791 ( 22.813 -0.000 -8.693) 24.413 24.307 ( 1.901 -0.000 7.643) 7.876 24.407 ( 1.492 -0.000 5.468) 5.668 ======================= Grid point 835 (424/432) ======================= q-point: (-0.27 -0.36 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( -15.558 2.319 -3.964) 16.221 2.658 ( -17.642 -3.831 2.231) 18.191 2.941 ( 3.799 0.114 3.534) 5.190 3.105 ( 2.487 0.011 -11.126) 11.401 3.440 ( 13.294 -0.150 2.613) 13.550 3.626 ( 20.391 -0.402 -0.700) 20.407 3.965 ( 14.870 2.110 0.453) 15.026 4.503 ( 1.873 3.687 6.165) 7.424 4.800 ( -11.690 -5.638 -1.067) 13.022 4.902 ( -3.347 0.902 -4.242) 5.478 5.321 ( -15.931 -0.011 -1.745) 16.026 5.663 ( -3.854 1.112 -8.773) 9.647 6.501 ( -10.301 -0.248 8.130) 13.125 7.071 ( 5.995 -6.570 -0.195) 8.896 7.972 ( 6.100 9.647 -15.246) 19.045 8.289 ( 10.874 -10.757 0.323) 15.299 9.508 ( 0.353 -6.058 -6.692) 9.033 9.974 ( -12.652 2.954 2.351) 13.204 10.123 ( -2.469 2.567 -13.915) 14.363 10.410 ( -25.483 -2.511 33.410) 42.094 11.089 ( 22.594 -1.462 -24.299) 33.212 11.307 ( -5.599 7.702 17.123) 19.593 12.305 ( -15.164 8.946 0.104) 17.606 12.955 ( 9.345 -2.050 0.551) 9.583 13.566 ( -4.031 -3.318 -8.440) 9.925 13.977 ( 0.178 -1.684 0.239) 1.710 14.138 ( -0.520 -0.823 3.480) 3.613 15.121 ( 10.754 2.585 -7.216) 13.206 17.458 ( -8.715 0.497 24.674) 26.173 18.719 ( 9.764 -0.681 -29.021) 30.627 19.694 ( 11.237 7.203 6.239) 14.734 19.913 ( -4.815 3.309 3.171) 6.647 20.072 ( -11.237 -11.199 2.804) 16.110 22.972 ( 19.555 -2.733 -9.890) 22.083 24.321 ( -0.718 14.482 5.131) 15.381 24.556 ( 1.970 -10.455 6.158) 12.293 ======================= Grid point 836 (425/432) ======================= q-point: (-0.18 -0.36 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.312 ( -17.164 3.227 -4.270) 17.979 2.517 ( -18.769 -8.052 6.810) 21.529 2.956 ( 3.102 2.718 -6.166) 7.418 3.103 ( 6.677 -5.682 -3.221) 9.341 3.593 ( 4.889 0.398 1.720) 5.198 3.910 ( 22.307 3.716 -2.476) 22.750 4.101 ( 13.899 7.196 -1.843) 15.759 4.506 ( -6.959 2.712 6.752) 10.069 4.728 ( -8.004 -7.119 -0.010) 10.712 4.806 ( -1.247 -0.692 -6.407) 6.563 5.148 ( -12.503 -0.653 6.727) 14.212 5.505 ( -1.429 1.857 -9.556) 9.839 6.496 ( -5.745 0.092 9.500) 11.102 7.227 ( 5.559 -11.883 -0.275) 13.122 7.775 ( 1.895 5.246 -15.844) 16.797 8.544 ( 12.157 -5.146 6.391) 14.667 9.571 ( 4.065 -10.523 -3.754) 11.889 9.831 ( -3.329 4.208 -3.488) 6.400 9.874 ( -11.593 3.921 -5.087) 13.253 10.469 ( -24.961 -1.791 31.714) 40.398 11.087 ( 16.469 -1.871 -22.599) 28.026 11.385 ( 1.788 10.633 12.907) 16.818 11.990 ( -15.735 12.673 -2.951) 20.418 13.044 ( 2.298 -1.210 -0.738) 2.700 13.474 ( -4.098 -7.712 -5.228) 10.179 13.987 ( -2.268 -1.656 1.188) 3.049 14.204 ( 1.108 -3.285 4.064) 5.341 15.120 ( 9.738 4.743 -11.116) 15.520 17.680 ( -2.459 2.648 27.797) 28.031 18.475 ( 6.572 -1.905 -32.837) 33.542 19.796 ( 3.345 6.404 3.412) 7.990 19.813 ( -3.082 3.213 2.944) 5.337 20.193 ( 0.649 -10.787 4.387) 11.663 23.144 ( 17.935 -5.484 -8.991) 20.798 24.178 ( -6.088 18.927 2.589) 20.050 24.723 ( 0.260 -10.715 3.843) 11.386 ======================= Grid point 837 (426/432) ======================= q-point: (-0.09 -0.36 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( -9.781 -0.078 1.674) 9.923 2.455 ( -16.556 -10.454 9.736) 21.868 2.934 ( 7.682 0.296 -6.937) 10.355 3.224 ( 4.444 -7.829 0.319) 9.008 3.574 ( -4.884 3.126 -2.532) 6.327 3.941 ( 7.745 13.766 -8.101) 17.751 4.181 ( -4.144 7.539 0.837) 8.644 4.509 ( 8.757 -1.827 0.655) 8.969 4.681 ( -7.483 -5.041 2.012) 9.244 4.791 ( 2.490 -4.829 -2.029) 5.799 5.159 ( -4.760 0.481 13.431) 14.258 5.411 ( 5.842 1.559 -8.218) 10.202 6.553 ( -0.591 1.282 8.183) 8.303 7.386 ( 3.150 -12.688 -1.709) 13.185 7.618 ( 0.920 2.202 -7.623) 7.988 8.837 ( 11.701 -1.272 11.316) 16.327 9.441 ( -7.650 13.213 -7.563) 17.038 9.760 ( -5.311 -4.305 0.339) 6.845 9.883 ( 8.501 -12.077 0.802) 14.791 10.494 ( -24.057 -0.563 28.012) 36.929 11.059 ( 12.301 -2.091 -18.599) 22.396 11.398 ( -2.275 14.762 2.036) 15.074 11.678 ( -9.546 5.854 -1.096) 11.251 13.041 ( -2.456 -1.281 -0.405) 2.799 13.470 ( -2.279 -7.883 -0.361) 8.214 13.974 ( -5.018 -1.935 2.500) 5.931 14.301 ( 0.799 -5.069 3.911) 6.452 15.049 ( 8.267 5.867 -14.306) 17.533 17.915 ( 1.920 5.614 14.625) 15.783 18.255 ( 6.418 -4.045 -19.308) 20.745 19.765 ( -1.583 4.198 -1.592) 4.761 19.839 ( 5.342 2.115 0.325) 5.754 20.321 ( 0.252 -6.706 4.106) 7.867 23.328 ( 14.930 -5.373 -5.970) 16.953 23.914 ( -11.134 18.088 -0.166) 21.241 24.812 ( -3.650 -9.051 0.727) 9.786 ======================= Grid point 846 (427/432) ======================= q-point: (-0.27 -0.27 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( -19.496 0.000 -3.151) 19.749 2.431 ( -19.432 0.000 6.679) 20.547 2.997 ( 4.759 -0.000 -13.758) 14.558 3.035 ( 4.963 -0.000 1.911) 5.318 3.598 ( 5.891 -0.000 1.719) 6.137 3.937 ( 25.580 -0.000 -0.125) 25.580 4.173 ( 16.064 -0.000 -3.663) 16.476 4.578 ( -4.734 0.000 4.501) 6.532 4.615 ( -11.064 0.000 2.493) 11.342 4.800 ( -3.728 0.000 -7.619) 8.482 5.142 ( -12.563 0.000 7.231) 14.495 5.522 ( -2.040 0.000 -9.077) 9.303 6.499 ( -5.607 0.000 10.250) 11.684 7.117 ( 5.736 -0.000 -0.669) 5.775 7.823 ( 0.518 -0.000 -19.419) 19.426 8.502 ( 15.358 -0.000 9.642) 18.133 9.464 ( 5.066 -0.000 -3.187) 5.985 9.848 ( -13.615 0.000 4.821) 14.443 9.943 ( 0.427 -0.000 -17.937) 17.942 10.447 ( -28.628 0.000 37.050) 46.822 11.069 ( 17.688 -0.000 -23.695) 29.568 11.487 ( -1.402 0.000 15.186) 15.251 12.110 ( -17.289 0.000 -2.900) 17.531 13.037 ( 3.827 -0.000 -0.415) 3.849 13.389 ( -6.072 0.000 -5.959) 8.508 13.972 ( -1.571 0.000 1.064) 1.897 14.176 ( 1.213 -0.000 3.049) 3.282 15.161 ( 10.215 -0.000 -11.996) 15.756 17.704 ( -1.555 0.000 28.519) 28.562 18.456 ( 7.041 -0.000 -34.868) 35.571 19.802 ( -2.740 0.000 -1.138) 2.967 19.983 ( 3.982 -0.000 10.342) 11.082 20.007 ( -0.474 0.000 2.387) 2.433 23.097 ( 18.397 -0.000 -9.278) 20.604 24.436 ( -1.911 0.000 -1.104) 2.207 24.537 ( -3.340 0.000 6.914) 7.678 ======================= Grid point 847 (428/432) ======================= q-point: (-0.18 -0.27 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( -14.797 0.872 2.291) 14.999 2.306 ( -16.891 -5.768 9.348) 20.149 2.938 ( 8.310 0.276 -10.596) 13.469 3.127 ( 4.018 -3.315 0.893) 5.285 3.609 ( -3.889 1.048 -1.827) 4.422 4.154 ( 13.586 10.092 -9.333) 19.327 4.287 ( 8.058 2.392 -3.068) 8.948 4.479 ( -8.459 -0.172 0.922) 8.511 4.586 ( -7.468 -5.238 4.961) 10.384 4.712 ( 5.490 -3.442 -3.273) 7.259 5.170 ( -5.105 0.464 15.308) 16.143 5.434 ( 4.526 0.838 -7.200) 8.546 6.578 ( 0.456 1.267 9.971) 10.061 7.202 ( 3.613 -6.950 -0.762) 7.870 7.639 ( 0.662 0.494 -11.739) 11.768 8.842 ( 16.339 1.024 12.620) 20.670 9.537 ( 5.603 -2.587 -3.565) 7.127 9.722 ( -7.381 2.867 -4.186) 8.956 9.770 ( -2.117 -2.587 -2.597) 4.234 10.485 ( -28.467 -0.531 35.191) 45.267 11.028 ( 13.477 -1.143 -20.389) 24.467 11.592 ( 0.584 6.326 7.191) 9.596 11.794 ( -19.671 5.503 -3.819) 20.780 13.038 ( -1.771 0.990 -0.439) 2.076 13.324 ( -3.724 -7.157 0.841) 8.112 13.950 ( -4.625 -0.734 1.558) 4.935 14.239 ( 1.794 -2.012 2.792) 3.881 15.118 ( 9.381 2.182 -16.500) 19.105 18.011 ( 4.051 5.010 18.904) 19.972 18.173 ( 6.546 -4.641 -26.177) 27.379 19.796 ( 4.800 0.248 -3.016) 5.674 19.935 ( -3.108 7.018 -0.559) 7.696 20.192 ( 2.073 -7.245 8.320) 11.226 23.254 ( 18.162 -2.508 -7.465) 19.796 24.231 ( -10.197 16.693 -3.604) 19.891 24.618 ( -5.648 -12.521 3.229) 14.110 ======================= Grid point 848 (429/432) ======================= q-point: (-0.09 -0.27 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.053 ( -3.573 -2.830 9.961) 10.955 2.301 ( -11.499 -9.199 11.926) 18.949 2.971 ( 10.158 -1.103 -6.327) 12.018 3.205 ( 1.121 -5.546 -0.375) 5.671 3.457 ( -9.838 2.536 -4.570) 11.140 4.015 ( 2.002 13.111 -11.775) 17.735 4.107 ( -14.849 9.774 0.753) 17.793 4.478 ( 0.509 -9.574 -9.145) 13.250 4.613 ( -4.888 -4.559 6.918) 9.620 4.921 ( 18.249 -1.041 2.908) 18.508 5.296 ( -2.716 0.994 16.579) 16.829 5.480 ( 13.007 1.474 -4.094) 13.715 6.690 ( 5.688 4.111 5.649) 9.009 7.292 ( 1.682 -9.541 -3.095) 10.170 7.607 ( 1.759 -1.446 3.427) 4.114 9.168 ( 12.232 5.052 13.902) 19.193 9.407 ( -1.735 12.810 -6.776) 14.595 9.667 ( -1.282 -6.066 -0.812) 6.253 9.916 ( 8.069 -14.652 4.500) 17.322 10.499 ( -25.576 1.868 30.923) 40.173 10.979 ( 9.011 -1.949 -17.399) 19.691 11.357 ( -20.257 12.454 -1.679) 23.838 11.643 ( -0.592 1.583 -1.527) 2.278 12.987 ( -5.043 0.340 0.720) 5.105 13.401 ( -1.223 -8.545 5.499) 10.234 13.899 ( -7.402 -2.344 1.509) 7.909 14.313 ( 0.961 -3.462 2.551) 4.406 15.005 ( 8.208 3.649 -19.074) 21.083 17.886 ( 8.138 0.878 -25.778) 27.046 18.389 ( 8.846 0.117 18.103) 20.149 19.718 ( -7.388 6.691 -6.568) 11.937 19.892 ( 6.637 -2.298 -5.272) 8.782 20.369 ( 4.576 -3.580 8.382) 10.199 23.440 ( 15.927 -2.849 -4.408) 16.770 23.845 ( -17.550 16.402 -5.758) 24.702 24.643 ( -8.808 -10.759 0.444) 13.912 ======================= Grid point 858 (430/432) ======================= q-point: (-0.18 -0.18 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( -5.539 0.000 9.856) 11.306 2.216 ( -11.143 0.000 12.262) 16.569 2.962 ( 11.143 -0.000 -8.045) 13.743 3.157 ( 0.901 -0.000 0.550) 1.056 3.478 ( -10.050 0.000 -4.542) 11.028 4.153 ( -1.182 0.000 -12.571) 12.626 4.250 ( -16.801 0.000 -1.763) 16.893 4.325 ( 5.034 -0.000 -7.014) 8.634 4.559 ( -4.285 0.000 6.607) 7.875 4.912 ( 20.010 -0.000 2.477) 20.162 5.308 ( -3.704 0.000 17.588) 17.974 5.493 ( 12.878 -0.000 -3.625) 13.379 6.736 ( 7.462 -0.000 6.151) 9.671 7.193 ( 0.563 -0.000 -0.328) 0.652 7.592 ( 2.906 -0.000 0.794) 3.013 9.207 ( 15.151 -0.000 11.205) 18.845 9.579 ( 4.890 -0.000 -3.852) 6.225 9.627 ( 5.023 -0.000 -11.805) 12.829 9.719 ( -7.583 0.000 13.345) 15.349 10.516 ( -26.862 0.000 35.288) 44.348 10.960 ( 10.416 -0.000 -18.630) 21.344 11.476 ( -25.028 0.000 -2.122) 25.118 11.662 ( -0.506 0.000 -1.311) 1.405 13.000 ( -4.835 0.000 0.711) 4.888 13.308 ( -0.999 0.000 7.121) 7.190 13.879 ( -7.477 0.000 0.414) 7.489 14.282 ( 1.753 -0.000 2.071) 2.713 15.037 ( 8.820 -0.000 -20.110) 21.959 17.894 ( 8.705 -0.000 -28.576) 29.873 18.388 ( 9.373 -0.000 19.827) 21.931 19.808 ( -9.907 0.000 -8.747) 13.216 19.846 ( 7.631 -0.000 -4.765) 8.996 20.332 ( 5.824 -0.000 10.867) 12.329 23.408 ( 18.119 -0.000 -5.992) 19.084 24.033 ( -18.876 0.000 -9.995) 21.359 24.512 ( -8.743 0.000 4.838) 9.992 ======================= Grid point 859 (431/432) ======================= q-point: (-0.09 -0.18 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 787 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( 2.113 -1.838 13.302) 13.594 2.291 ( -4.374 -4.892 15.089) 16.454 3.039 ( 10.625 -0.731 -4.812) 11.687 3.152 ( -2.513 -2.036 -1.302) 3.487 3.275 ( -10.850 0.638 -4.943) 11.940 3.944 ( -3.508 8.443 -13.721) 16.488 4.002 ( -11.643 4.631 0.431) 12.537 4.270 ( -5.129 -6.776 -8.424) 11.966 4.643 ( 1.121 -2.720 8.812) 9.290 5.162 ( 13.510 -0.237 0.186) 13.513 5.469 ( -0.546 0.743 16.690) 16.716 5.660 ( 16.670 1.049 -2.052) 16.829 6.878 ( 11.643 4.778 -0.382) 12.591 7.209 ( -1.161 -5.940 -0.611) 6.083 7.758 ( 6.291 -0.327 16.631) 17.784 9.405 ( 7.337 2.062 -4.112) 8.660 9.566 ( 5.545 19.483 8.701) 22.046 9.606 ( 1.207 -6.360 -0.487) 6.491 9.940 ( 2.891 -18.633 11.318) 21.992 10.575 ( -19.262 3.178 30.709) 36.389 10.869 ( 3.641 0.463 -15.354) 15.786 11.124 ( -21.884 2.628 1.011) 22.065 11.565 ( -3.287 0.524 -10.221) 10.749 12.925 ( -8.156 1.490 1.176) 8.374 13.427 ( 0.266 -4.704 9.521) 10.623 13.775 ( -7.578 -2.394 -1.541) 8.095 14.327 ( 0.547 -1.512 1.975) 2.547 14.909 ( 7.989 1.828 -20.169) 21.770 17.743 ( 11.833 -0.014 -21.694) 24.712 18.723 ( 12.900 0.594 13.343) 18.568 19.503 ( -14.000 3.465 -13.366) 19.663 19.874 ( 2.324 -2.119 -4.578) 5.554 20.580 ( 13.945 -0.621 9.632) 16.959 23.565 ( -12.560 2.926 -14.008) 19.041 23.595 ( 2.693 3.745 0.019) 4.613 24.455 ( -10.956 -5.474 2.444) 12.489 ======================= Grid point 870 (432/432) ======================= q-point: (-0.09 -0.09 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.23e-05 7.23e-05 3.67e-09 3.67e-09 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.345 ( 2.747 -0.000 12.456) 12.755 2.423 ( 0.010 -0.000 15.727) 15.727 3.085 ( -8.509 0.000 -2.722) 8.934 3.098 ( -1.320 0.000 -1.420) 1.939 3.126 ( 9.290 -0.000 -5.057) 10.577 3.749 ( -7.975 0.000 -11.607) 14.082 3.915 ( -3.413 0.000 -3.085) 4.601 4.060 ( -8.572 0.000 -6.969) 11.047 4.778 ( 3.865 -0.000 10.185) 10.894 5.267 ( 3.996 -0.000 -0.577) 4.038 5.658 ( 1.699 -0.000 13.350) 13.458 5.857 ( 15.464 -0.000 -2.404) 15.649 7.049 ( 15.011 -0.000 -5.073) 15.845 7.151 ( -4.543 0.000 2.250) 5.069 8.131 ( 11.316 -0.000 26.301) 28.632 9.470 ( 12.677 -0.000 -8.572) 15.303 9.587 ( -2.706 0.000 5.611) 6.229 9.873 ( 9.221 -0.000 0.139) 9.223 9.925 ( -10.421 0.000 18.141) 20.921 10.655 ( -26.578 0.000 26.771) 37.724 10.744 ( 3.290 -0.000 -16.925) 17.242 10.968 ( -3.530 0.000 10.557) 11.131 11.360 ( -3.177 0.000 -16.639) 16.940 12.778 ( -15.064 0.000 -3.411) 15.446 13.525 ( -0.080 0.000 9.980) 9.980 13.667 ( -1.898 0.000 -2.571) 3.196 14.346 ( -0.673 0.000 2.523) 2.611 14.797 ( 6.731 -0.000 -17.863) 19.089 17.719 ( 14.986 -0.000 -13.564) 20.214 19.006 ( 7.811 -0.000 2.383) 8.166 19.157 ( -9.875 0.000 -11.614) 15.245 19.813 ( -4.114 0.000 -2.657) 4.897 20.924 ( 22.000 -0.000 9.178) 23.837 23.099 ( -30.684 0.000 -10.940) 32.576 23.748 ( 14.152 -0.000 -2.521) 14.375 24.312 ( -11.960 0.000 2.319) 12.183 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/56628 10.0 3614.085 5225.711 3058.567 -0.000 198.550 -0.000 3/56628 20.0 772.567 737.321 693.465 -0.000 13.512 -0.000 3/56628 30.0 254.733 209.426 226.140 -0.000 2.466 -0.000 3/56628 40.0 130.212 98.419 112.183 -0.000 0.508 -0.000 3/56628 50.0 82.568 59.194 69.253 -0.000 0.032 -0.000 3/56628 60.0 58.834 40.800 48.489 -0.000 -0.131 -0.000 3/56628 70.0 45.006 30.567 36.732 -0.000 -0.218 -0.000 3/56628 80.0 36.116 24.214 29.340 -0.000 -0.279 -0.000 3/56628 90.0 30.006 19.960 24.337 -0.000 -0.324 -0.000 3/56628 100.0 25.595 16.948 20.763 -0.000 -0.356 -0.000 3/56628 110.0 22.287 14.721 18.102 -0.000 -0.378 -0.000 3/56628 120.0 19.729 13.017 16.052 -0.000 -0.391 -0.000 3/56628 130.0 17.699 11.675 14.431 -0.000 -0.398 -0.000 3/56628 140.0 16.055 10.592 13.120 -0.000 -0.399 -0.000 3/56628 150.0 14.698 9.701 12.038 -0.000 -0.396 -0.000 3/56628 160.0 13.561 8.955 11.132 -0.000 -0.390 -0.000 3/56628 170.0 12.595 8.320 10.361 -0.000 -0.383 -0.000 3/56628 180.0 11.764 7.774 9.698 -0.000 -0.374 -0.000 3/56628 190.0 11.042 7.299 9.120 -0.000 -0.364 -0.000 3/56628 200.0 10.409 6.881 8.613 -0.000 -0.354 -0.000 3/56628 210.0 9.849 6.511 8.163 -0.000 -0.344 -0.000 3/56628 220.0 9.350 6.181 7.762 -0.000 -0.333 -0.000 3/56628 230.0 8.903 5.884 7.401 -0.000 -0.323 -0.000 3/56628 240.0 8.499 5.615 7.074 -0.000 -0.313 -0.000 3/56628 250.0 8.133 5.371 6.777 -0.000 -0.304 -0.000 3/56628 260.0 7.799 5.149 6.506 -0.000 -0.294 -0.000 3/56628 270.0 7.493 4.945 6.256 -0.000 -0.285 -0.000 3/56628 280.0 7.211 4.757 6.026 -0.000 -0.277 -0.000 3/56628 290.0 6.951 4.583 5.814 -0.000 -0.269 -0.000 3/56628 300.0 6.710 4.422 5.616 -0.000 -0.261 -0.000 3/56628 310.0 6.486 4.272 5.432 -0.000 -0.254 -0.000 3/56628 320.0 6.278 4.133 5.261 -0.000 -0.246 -0.000 3/56628 330.0 6.083 4.002 5.100 -0.000 -0.240 -0.000 3/56628 340.0 5.900 3.880 4.949 -0.000 -0.233 -0.000 3/56628 350.0 5.728 3.765 4.807 -0.000 -0.227 -0.000 3/56628 360.0 5.567 3.657 4.673 -0.000 -0.221 -0.000 3/56628 370.0 5.414 3.555 4.547 -0.000 -0.216 -0.000 3/56628 380.0 5.270 3.459 4.428 -0.000 -0.210 -0.000 3/56628 390.0 5.134 3.368 4.314 -0.000 -0.205 -0.000 3/56628 400.0 5.005 3.282 4.207 -0.000 -0.200 -0.000 3/56628 410.0 4.882 3.200 4.105 -0.000 -0.196 -0.000 3/56628 420.0 4.765 3.122 4.007 -0.000 -0.191 -0.000 3/56628 430.0 4.654 3.048 3.915 -0.000 -0.187 -0.000 3/56628 440.0 4.548 2.978 3.826 -0.000 -0.183 -0.000 3/56628 450.0 4.447 2.910 3.742 -0.000 -0.179 -0.000 3/56628 460.0 4.351 2.846 3.661 -0.000 -0.175 -0.000 3/56628 470.0 4.258 2.785 3.584 -0.000 -0.172 -0.000 3/56628 480.0 4.170 2.726 3.510 -0.000 -0.168 -0.000 3/56628 490.0 4.085 2.669 3.439 -0.000 -0.165 -0.000 3/56628 500.0 4.003 2.615 3.371 -0.000 -0.162 -0.000 3/56628 510.0 3.925 2.563 3.305 -0.000 -0.158 -0.000 3/56628 520.0 3.850 2.514 3.242 -0.000 -0.155 -0.000 3/56628 530.0 3.778 2.466 3.181 -0.000 -0.153 -0.000 3/56628 540.0 3.708 2.419 3.123 -0.000 -0.150 -0.000 3/56628 550.0 3.641 2.375 3.067 -0.000 -0.147 -0.000 3/56628 560.0 3.576 2.332 3.012 -0.000 -0.145 -0.000 3/56628 570.0 3.514 2.291 2.960 -0.000 -0.142 -0.000 3/56628 580.0 3.454 2.251 2.909 -0.000 -0.140 -0.000 3/56628 590.0 3.395 2.213 2.860 -0.000 -0.137 -0.000 3/56628 600.0 3.339 2.176 2.813 -0.000 -0.135 -0.000 3/56628 610.0 3.285 2.140 2.767 -0.000 -0.133 -0.000 3/56628 620.0 3.232 2.105 2.723 -0.000 -0.131 -0.000 3/56628 630.0 3.181 2.071 2.680 -0.000 -0.129 -0.000 3/56628 640.0 3.132 2.039 2.639 -0.000 -0.127 -0.000 3/56628 650.0 3.084 2.007 2.599 -0.000 -0.125 -0.000 3/56628 660.0 3.037 1.977 2.559 -0.000 -0.123 -0.000 3/56628 670.0 2.992 1.947 2.522 -0.000 -0.121 -0.000 3/56628 680.0 2.948 1.918 2.485 -0.000 -0.119 -0.000 3/56628 690.0 2.906 1.890 2.449 -0.000 -0.118 -0.000 3/56628 700.0 2.865 1.863 2.414 -0.000 -0.116 -0.000 3/56628 710.0 2.825 1.837 2.381 -0.000 -0.114 -0.000 3/56628 720.0 2.786 1.811 2.348 -0.000 -0.113 -0.000 3/56628 730.0 2.748 1.786 2.316 -0.000 -0.111 -0.000 3/56628 740.0 2.711 1.762 2.285 -0.000 -0.110 -0.000 3/56628 750.0 2.675 1.739 2.255 -0.000 -0.108 -0.000 3/56628 760.0 2.640 1.716 2.225 -0.000 -0.107 -0.000 3/56628 770.0 2.606 1.693 2.196 -0.000 -0.105 -0.000 3/56628 780.0 2.572 1.671 2.168 -0.000 -0.104 -0.000 3/56628 790.0 2.540 1.650 2.141 -0.000 -0.103 -0.000 3/56628 800.0 2.509 1.630 2.115 -0.000 -0.102 -0.000 3/56628 810.0 2.478 1.609 2.089 -0.000 -0.100 -0.000 3/56628 820.0 2.448 1.590 2.063 -0.000 -0.099 -0.000 3/56628 830.0 2.418 1.570 2.039 -0.000 -0.098 -0.000 3/56628 840.0 2.390 1.552 2.014 -0.000 -0.097 -0.000 3/56628 850.0 2.362 1.533 1.991 -0.000 -0.096 -0.000 3/56628 860.0 2.334 1.516 1.968 -0.000 -0.094 -0.000 3/56628 870.0 2.308 1.498 1.945 -0.000 -0.093 -0.000 3/56628 880.0 2.282 1.481 1.923 -0.000 -0.092 -0.000 3/56628 890.0 2.256 1.464 1.902 -0.000 -0.091 -0.000 3/56628 900.0 2.231 1.448 1.881 -0.000 -0.090 -0.000 3/56628 910.0 2.207 1.432 1.860 -0.000 -0.089 -0.000 3/56628 920.0 2.183 1.417 1.840 -0.000 -0.088 -0.000 3/56628 930.0 2.160 1.401 1.821 -0.000 -0.087 -0.000 3/56628 940.0 2.137 1.386 1.801 -0.000 -0.086 -0.000 3/56628 950.0 2.114 1.372 1.782 -0.000 -0.086 -0.000 3/56628 960.0 2.092 1.357 1.764 -0.000 -0.085 -0.000 3/56628 970.0 2.071 1.343 1.746 -0.000 -0.084 -0.000 3/56628 980.0 2.050 1.330 1.728 -0.000 -0.083 -0.000 3/56628 990.0 2.029 1.316 1.711 -0.000 -0.082 -0.000 3/56628 1000.0 2.009 1.303 1.694 -0.000 -0.081 -0.000 3/56628 Thermal conductivity related properties were written into "kappa-m111113.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:59:03]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|