----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 13:19:49]------------------------- 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: [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.527611070259279 -1.948905930000000 0.000000000000000 b 6.527611070259279 1.948905930000000 0.000000000000000 c -1.867272801180175 0.000000000000000 7.170622947453253 Atomic positions (fractional): *1 K 0.35703724511584 0.35703724511584 0.93681252780331 39.098 2 K 0.64296275488416 0.64296275488416 0.06318747219669 39.098 *3 Sm 0.35040110355847 0.35040110355847 0.42338666218015 150.360 4 Sm 0.64959889644153 0.64959889644153 0.57661333781985 150.360 *5 Pd 0.00733007803357 0.00733007803357 0.27866809358408 106.420 6 Pd 0.99266992196643 0.99266992196643 0.72133190641592 106.420 *7 O 0.83034770013882 0.83034770013882 0.63143969864519 15.999 *8 O 0.84789992397366 0.84789992397366 0.22677946116190 15.999 9 O 0.16965229986118 0.16965229986118 0.36856030135481 15.999 *10 O 0.49359562840617 0.49359562840617 0.68725798979281 15.999 11 O 0.50640437159383 0.50640437159383 0.31274201020719 15.999 12 O 0.15210007602633 0.15210007602633 0.77322053883810 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 13.055222140518557 0.000000000000000 0.000000000000000 b 0.000000000000000 3.897811860000000 0.000000000000000 c -1.867272801180175 0.000000000000000 7.170622947453253 Atomic positions (fractional): *1 K 0.35703724511584 0.00000000000000 0.93681252780331 39.098 > 1 2 K 0.14296275488416 0.50000000000000 0.06318747219669 39.098 > 2 3 K 0.85703724511584 0.50000000000000 0.93681252780331 39.098 > 1 4 K 0.64296275488416 0.00000000000000 0.06318747219669 39.098 > 2 *5 Sm 0.35040110355847 0.00000000000000 0.42338666218015 150.360 > 3 6 Sm 0.14959889644153 0.50000000000000 0.57661333781985 150.360 > 4 7 Sm 0.85040110355847 0.50000000000000 0.42338666218015 150.360 > 3 8 Sm 0.64959889644153 0.00000000000000 0.57661333781985 150.360 > 4 *9 Pd 0.00733007803357 0.00000000000000 0.27866809358408 106.420 > 5 10 Pd 0.49266992196643 0.50000000000000 0.72133190641592 106.420 > 6 11 Pd 0.50733007803357 0.50000000000000 0.27866809358408 106.420 > 5 12 Pd 0.99266992196643 0.00000000000000 0.72133190641592 106.420 > 6 *13 O 0.33034770013882 0.50000000000000 0.63143969864519 15.999 > 7 *14 O 0.34789992397366 0.50000000000000 0.22677946116190 15.999 > 8 15 O 0.16965229986118 0.00000000000000 0.36856030135481 15.999 > 9 *16 O 0.49359562840617 0.00000000000000 0.68725798979281 15.999 > 10 17 O 0.00640437159383 0.50000000000000 0.31274201020719 15.999 > 11 18 O 0.15210007602633 0.00000000000000 0.77322053883810 15.999 > 12 19 O 0.83034770013882 0.00000000000000 0.63143969864519 15.999 > 7 20 O 0.84789992397366 0.00000000000000 0.22677946116190 15.999 > 8 21 O 0.66965229986118 0.50000000000000 0.36856030135481 15.999 > 9 22 O 0.99359562840617 0.50000000000000 0.68725798979281 15.999 > 10 23 O 0.50640437159383 0.00000000000000 0.31274201020719 15.999 > 11 24 O 0.65210007602634 0.50000000000000 0.77322053883810 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.055222140518557 0.000000000000000 0.000000000000000 b 0.000000000000000 11.693435579999999 0.000000000000000 c -3.734545602360350 0.000000000000000 14.341245894906505 Atomic positions (fractional): *1 K 0.35703724511584 0.00000000000000 0.46840626390166 39.098 > 1 2 K 0.35703724511584 0.33333333333333 0.46840626390166 39.098 > 1 3 K 0.35703724511584 0.66666666666667 0.46840626390166 39.098 > 1 4 K 0.35703724511584 0.00000000000000 0.96840626390166 39.098 > 1 5 K 0.35703724511584 0.33333333333333 0.96840626390166 39.098 > 1 6 K 0.35703724511584 0.66666666666667 0.96840626390166 39.098 > 1 7 K 0.14296275488416 0.16666666666667 0.03159373609834 39.098 > 2 8 K 0.14296275488416 0.50000000000000 0.03159373609834 39.098 > 2 9 K 0.14296275488416 0.83333333333333 0.03159373609834 39.098 > 2 10 K 0.14296275488416 0.16666666666667 0.53159373609834 39.098 > 2 11 K 0.14296275488416 0.50000000000000 0.53159373609834 39.098 > 2 12 K 0.14296275488416 0.83333333333333 0.53159373609834 39.098 > 2 13 K 0.85703724511584 0.16666666666667 0.46840626390166 39.098 > 1 14 K 0.85703724511584 0.50000000000000 0.46840626390166 39.098 > 1 15 K 0.85703724511584 0.83333333333333 0.46840626390166 39.098 > 1 16 K 0.85703724511584 0.16666666666667 0.96840626390166 39.098 > 1 17 K 0.85703724511584 0.50000000000000 0.96840626390166 39.098 > 1 18 K 0.85703724511584 0.83333333333333 0.96840626390166 39.098 > 1 19 K 0.64296275488416 0.00000000000000 0.03159373609834 39.098 > 2 20 K 0.64296275488416 0.33333333333333 0.03159373609834 39.098 > 2 21 K 0.64296275488416 0.66666666666667 0.03159373609834 39.098 > 2 22 K 0.64296275488416 0.00000000000000 0.53159373609834 39.098 > 2 23 K 0.64296275488416 0.33333333333333 0.53159373609834 39.098 > 2 24 K 0.64296275488416 0.66666666666667 0.53159373609834 39.098 > 2 *25 Sm 0.35040110355847 0.00000000000000 0.21169333109007 150.360 > 3 26 Sm 0.35040110355847 0.33333333333333 0.21169333109007 150.360 > 3 27 Sm 0.35040110355847 0.66666666666667 0.21169333109007 150.360 > 3 28 Sm 0.35040110355847 0.00000000000000 0.71169333109007 150.360 > 3 29 Sm 0.35040110355847 0.33333333333333 0.71169333109007 150.360 > 3 30 Sm 0.35040110355847 0.66666666666667 0.71169333109007 150.360 > 3 31 Sm 0.14959889644153 0.16666666666667 0.28830666890993 150.360 > 4 32 Sm 0.14959889644153 0.50000000000000 0.28830666890993 150.360 > 4 33 Sm 0.14959889644153 0.83333333333333 0.28830666890993 150.360 > 4 34 Sm 0.14959889644153 0.16666666666667 0.78830666890993 150.360 > 4 35 Sm 0.14959889644153 0.50000000000000 0.78830666890993 150.360 > 4 36 Sm 0.14959889644153 0.83333333333333 0.78830666890993 150.360 > 4 37 Sm 0.85040110355847 0.16666666666667 0.21169333109007 150.360 > 3 38 Sm 0.85040110355847 0.50000000000000 0.21169333109007 150.360 > 3 39 Sm 0.85040110355847 0.83333333333333 0.21169333109007 150.360 > 3 40 Sm 0.85040110355847 0.16666666666667 0.71169333109007 150.360 > 3 41 Sm 0.85040110355847 0.50000000000000 0.71169333109007 150.360 > 3 42 Sm 0.85040110355847 0.83333333333333 0.71169333109007 150.360 > 3 43 Sm 0.64959889644153 0.00000000000000 0.28830666890993 150.360 > 4 44 Sm 0.64959889644153 0.33333333333333 0.28830666890993 150.360 > 4 45 Sm 0.64959889644153 0.66666666666667 0.28830666890993 150.360 > 4 46 Sm 0.64959889644153 0.00000000000000 0.78830666890993 150.360 > 4 47 Sm 0.64959889644153 0.33333333333333 0.78830666890993 150.360 > 4 48 Sm 0.64959889644153 0.66666666666667 0.78830666890993 150.360 > 4 *49 Pd 0.00733007803357 0.00000000000000 0.13933404679204 106.420 > 5 50 Pd 0.00733007803357 0.33333333333333 0.13933404679204 106.420 > 5 51 Pd 0.00733007803357 0.66666666666667 0.13933404679204 106.420 > 5 52 Pd 0.00733007803357 0.00000000000000 0.63933404679204 106.420 > 5 53 Pd 0.00733007803357 0.33333333333333 0.63933404679204 106.420 > 5 54 Pd 0.00733007803357 0.66666666666667 0.63933404679204 106.420 > 5 55 Pd 0.49266992196643 0.16666666666667 0.36066595320796 106.420 > 6 56 Pd 0.49266992196643 0.50000000000000 0.36066595320796 106.420 > 6 57 Pd 0.49266992196643 0.83333333333333 0.36066595320796 106.420 > 6 58 Pd 0.49266992196643 0.16666666666667 0.86066595320796 106.420 > 6 59 Pd 0.49266992196643 0.50000000000000 0.86066595320796 106.420 > 6 60 Pd 0.49266992196643 0.83333333333333 0.86066595320796 106.420 > 6 61 Pd 0.50733007803357 0.16666666666667 0.13933404679204 106.420 > 5 62 Pd 0.50733007803357 0.50000000000000 0.13933404679204 106.420 > 5 63 Pd 0.50733007803357 0.83333333333333 0.13933404679204 106.420 > 5 64 Pd 0.50733007803357 0.16666666666667 0.63933404679204 106.420 > 5 65 Pd 0.50733007803357 0.50000000000000 0.63933404679204 106.420 > 5 66 Pd 0.50733007803357 0.83333333333333 0.63933404679204 106.420 > 5 67 Pd 0.99266992196643 0.00000000000000 0.36066595320796 106.420 > 6 68 Pd 0.99266992196643 0.33333333333333 0.36066595320796 106.420 > 6 69 Pd 0.99266992196643 0.66666666666667 0.36066595320796 106.420 > 6 70 Pd 0.99266992196643 0.00000000000000 0.86066595320796 106.420 > 6 71 Pd 0.99266992196643 0.33333333333333 0.86066595320796 106.420 > 6 72 Pd 0.99266992196643 0.66666666666667 0.86066595320796 106.420 > 6 *73 O 0.33034770013882 0.16666666666667 0.31571984932260 15.999 > 7 74 O 0.33034770013882 0.50000000000000 0.31571984932260 15.999 > 7 75 O 0.33034770013882 0.83333333333333 0.31571984932260 15.999 > 7 76 O 0.33034770013882 0.16666666666667 0.81571984932260 15.999 > 7 77 O 0.33034770013882 0.50000000000000 0.81571984932260 15.999 > 7 78 O 0.33034770013882 0.83333333333333 0.81571984932260 15.999 > 7 *79 O 0.34789992397366 0.16666666666667 0.11338973058095 15.999 > 8 80 O 0.34789992397366 0.50000000000000 0.11338973058095 15.999 > 8 81 O 0.34789992397366 0.83333333333333 0.11338973058095 15.999 > 8 82 O 0.34789992397366 0.16666666666667 0.61338973058095 15.999 > 8 83 O 0.34789992397366 0.50000000000000 0.61338973058095 15.999 > 8 84 O 0.34789992397366 0.83333333333333 0.61338973058095 15.999 > 8 85 O 0.16965229986118 0.00000000000000 0.18428015067740 15.999 > 9 86 O 0.16965229986118 0.33333333333333 0.18428015067740 15.999 > 9 87 O 0.16965229986118 0.66666666666667 0.18428015067740 15.999 > 9 88 O 0.16965229986118 0.00000000000000 0.68428015067740 15.999 > 9 89 O 0.16965229986118 0.33333333333333 0.68428015067740 15.999 > 9 90 O 0.16965229986118 0.66666666666667 0.68428015067740 15.999 > 9 *91 O 0.49359562840617 0.00000000000000 0.34362899489641 15.999 > 10 92 O 0.49359562840617 0.33333333333333 0.34362899489641 15.999 > 10 93 O 0.49359562840617 0.66666666666667 0.34362899489641 15.999 > 10 94 O 0.49359562840617 0.00000000000000 0.84362899489641 15.999 > 10 95 O 0.49359562840617 0.33333333333333 0.84362899489641 15.999 > 10 96 O 0.49359562840617 0.66666666666667 0.84362899489641 15.999 > 10 97 O 0.00640437159383 0.16666666666667 0.15637100510359 15.999 > 11 98 O 0.00640437159383 0.50000000000000 0.15637100510359 15.999 > 11 99 O 0.00640437159383 0.83333333333333 0.15637100510359 15.999 > 11 100 O 0.00640437159383 0.16666666666667 0.65637100510359 15.999 > 11 101 O 0.00640437159383 0.50000000000000 0.65637100510359 15.999 > 11 102 O 0.00640437159383 0.83333333333333 0.65637100510359 15.999 > 11 103 O 0.15210007602633 0.00000000000000 0.38661026941905 15.999 > 12 104 O 0.15210007602633 0.33333333333333 0.38661026941905 15.999 > 12 105 O 0.15210007602633 0.66666666666667 0.38661026941905 15.999 > 12 106 O 0.15210007602633 0.00000000000000 0.88661026941905 15.999 > 12 107 O 0.15210007602633 0.33333333333333 0.88661026941905 15.999 > 12 108 O 0.15210007602633 0.66666666666667 0.88661026941905 15.999 > 12 109 O 0.83034770013882 0.00000000000000 0.31571984932260 15.999 > 7 110 O 0.83034770013882 0.33333333333333 0.31571984932260 15.999 > 7 111 O 0.83034770013882 0.66666666666667 0.31571984932260 15.999 > 7 112 O 0.83034770013882 0.00000000000000 0.81571984932260 15.999 > 7 113 O 0.83034770013882 0.33333333333333 0.81571984932260 15.999 > 7 114 O 0.83034770013882 0.66666666666667 0.81571984932260 15.999 > 7 115 O 0.84789992397366 0.00000000000000 0.11338973058095 15.999 > 8 116 O 0.84789992397366 0.33333333333333 0.11338973058095 15.999 > 8 117 O 0.84789992397366 0.66666666666667 0.11338973058095 15.999 > 8 118 O 0.84789992397366 0.00000000000000 0.61338973058095 15.999 > 8 119 O 0.84789992397366 0.33333333333333 0.61338973058095 15.999 > 8 120 O 0.84789992397366 0.66666666666667 0.61338973058095 15.999 > 8 121 O 0.66965229986118 0.16666666666667 0.18428015067740 15.999 > 9 122 O 0.66965229986118 0.50000000000000 0.18428015067740 15.999 > 9 123 O 0.66965229986118 0.83333333333333 0.18428015067740 15.999 > 9 124 O 0.66965229986118 0.16666666666667 0.68428015067740 15.999 > 9 125 O 0.66965229986118 0.50000000000000 0.68428015067740 15.999 > 9 126 O 0.66965229986118 0.83333333333333 0.68428015067740 15.999 > 9 127 O 0.99359562840617 0.16666666666667 0.34362899489641 15.999 > 10 128 O 0.99359562840617 0.50000000000000 0.34362899489641 15.999 > 10 129 O 0.99359562840617 0.83333333333333 0.34362899489641 15.999 > 10 130 O 0.99359562840617 0.16666666666667 0.84362899489641 15.999 > 10 131 O 0.99359562840617 0.50000000000000 0.84362899489641 15.999 > 10 132 O 0.99359562840617 0.83333333333333 0.84362899489641 15.999 > 10 133 O 0.50640437159383 0.00000000000000 0.15637100510359 15.999 > 11 134 O 0.50640437159383 0.33333333333333 0.15637100510359 15.999 > 11 135 O 0.50640437159383 0.66666666666667 0.15637100510359 15.999 > 11 136 O 0.50640437159383 0.00000000000000 0.65637100510359 15.999 > 11 137 O 0.50640437159383 0.33333333333333 0.65637100510359 15.999 > 11 138 O 0.50640437159383 0.66666666666667 0.65637100510359 15.999 > 11 139 O 0.65210007602634 0.16666666666667 0.38661026941905 15.999 > 12 140 O 0.65210007602634 0.50000000000000 0.38661026941905 15.999 > 12 141 O 0.65210007602634 0.83333333333333 0.38661026941905 15.999 > 12 142 O 0.65210007602634 0.16666666666667 0.88661026941905 15.999 > 12 143 O 0.65210007602634 0.50000000000000 0.88661026941905 15.999 > 12 144 O 0.65210007602634 0.83333333333333 0.88661026941905 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.6061947 0.0000000 0.1029789 0.0000000 8.5565643 0.0000000 0.1029809 0.0000000 4.3207219 -------------------------- Born effective charges -------------------------- 1 K 1.2181553 0.0000000 0.1031310 0.0000000 1.1436136 0.0000000 0.0231798 0.0000000 1.6168010 2 K 1.2181553 0.0000000 0.1031310 0.0000000 1.1436136 0.0000000 0.0231798 0.0000000 1.6168010 3 Sm 4.7460155 0.0000000 -0.2295043 0.0000000 4.1705824 0.0000000 0.0937533 0.0000000 2.7581065 4 Sm 4.7460155 0.0000000 -0.2295043 0.0000000 4.1705824 0.0000000 0.0937533 0.0000000 2.7581065 5 Pd 1.8726243 0.0000000 0.6092935 0.0000000 2.9345702 0.0000000 0.5450981 0.0000000 -0.4752793 6 Pd 1.8726243 0.0000000 0.6092935 0.0000000 2.9345702 0.0000000 0.5450981 0.0000000 -0.4752793 7 O -3.7324241 0.0000000 -0.2722130 0.0000000 -1.7195963 0.0000000 -0.3331021 0.0000000 -1.3184612 8 O -2.5682107 0.0000000 -0.0904818 0.0000000 -1.9247926 0.0000000 -0.2174416 0.0000000 -1.5875897 9 O -3.7324241 0.0000000 -0.2722130 0.0000000 -1.7195963 0.0000000 -0.3331021 0.0000000 -1.3184612 10 O -1.5361603 0.0000000 -0.1202254 0.0000000 -4.6043774 0.0000000 -0.1114874 0.0000000 -0.9935774 11 O -1.5361603 0.0000000 -0.1202254 0.0000000 -4.6043774 0.0000000 -0.1114874 0.0000000 -0.9935774 12 O -2.5682107 0.0000000 -0.0904818 0.0000000 -1.9247926 0.0000000 -0.2174416 0.0000000 -1.5875897 ---------------------------------------------------------------------------- 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: 9324/9324 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2160 Number of blocks in projector: 2160 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: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 400 - Time: 0.980 Solver_block: 200 / 400 - Time: 0.777 Solver_block: 300 / 400 - Time: 0.786 Solver_block: 400 / 400 - Time: 0.784 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.409 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 9324/9324 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2160 Number of blocks in projector: 2160 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: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) 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 2026-01-08 13:20:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:20:15]------------------------- 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): [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.527611070259279 -1.948905930000000 0.000000000000000 b 6.527611070259279 1.948905930000000 0.000000000000000 c -1.867272801180175 0.000000000000000 7.170622947453253 Atomic positions (fractional): 1 K 0.35703724511584 0.35703724511584 0.93681252780331 39.098 2 K 0.64296275488416 0.64296275488416 0.06318747219669 39.098 3 Sm 0.35040110355847 0.35040110355847 0.42338666218015 150.360 4 Sm 0.64959889644153 0.64959889644153 0.57661333781985 150.360 5 Pd 0.00733007803357 0.00733007803357 0.27866809358408 106.420 6 Pd 0.99266992196643 0.99266992196643 0.72133190641592 106.420 7 O 0.83034770013882 0.83034770013882 0.63143969864519 15.999 8 O 0.84789992397366 0.84789992397366 0.22677946116190 15.999 9 O 0.16965229986118 0.16965229986118 0.36856030135481 15.999 10 O 0.49359562840617 0.49359562840617 0.68725798979281 15.999 11 O 0.50640437159383 0.50640437159383 0.31274201020719 15.999 12 O 0.15210007602633 0.15210007602633 0.77322053883810 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.055222140518557 0.000000000000000 0.000000000000000 b 0.000000000000000 11.693435579999999 0.000000000000000 c -3.734545602360350 0.000000000000000 14.341245894906505 Atomic positions (fractional): 1 K 0.35703724511584 0.00000000000000 0.46840626390166 39.098 > 1 2 K 0.35703724511584 0.33333333333333 0.46840626390166 39.098 > 1 3 K 0.35703724511584 0.66666666666667 0.46840626390166 39.098 > 1 4 K 0.35703724511584 0.00000000000000 0.96840626390166 39.098 > 1 5 K 0.35703724511584 0.33333333333333 0.96840626390166 39.098 > 1 6 K 0.35703724511584 0.66666666666667 0.96840626390166 39.098 > 1 7 K 0.14296275488416 0.16666666666667 0.03159373609834 39.098 > 7 8 K 0.14296275488416 0.50000000000000 0.03159373609834 39.098 > 7 9 K 0.14296275488416 0.83333333333333 0.03159373609834 39.098 > 7 10 K 0.14296275488416 0.16666666666667 0.53159373609834 39.098 > 7 11 K 0.14296275488416 0.50000000000000 0.53159373609834 39.098 > 7 12 K 0.14296275488416 0.83333333333333 0.53159373609834 39.098 > 7 13 K 0.85703724511584 0.16666666666667 0.46840626390166 39.098 > 1 14 K 0.85703724511584 0.50000000000000 0.46840626390166 39.098 > 1 15 K 0.85703724511584 0.83333333333333 0.46840626390166 39.098 > 1 16 K 0.85703724511584 0.16666666666667 0.96840626390166 39.098 > 1 17 K 0.85703724511584 0.50000000000000 0.96840626390166 39.098 > 1 18 K 0.85703724511584 0.83333333333333 0.96840626390166 39.098 > 1 19 K 0.64296275488416 0.00000000000000 0.03159373609834 39.098 > 7 20 K 0.64296275488416 0.33333333333333 0.03159373609834 39.098 > 7 21 K 0.64296275488416 0.66666666666667 0.03159373609834 39.098 > 7 22 K 0.64296275488416 0.00000000000000 0.53159373609834 39.098 > 7 23 K 0.64296275488416 0.33333333333333 0.53159373609834 39.098 > 7 24 K 0.64296275488416 0.66666666666667 0.53159373609834 39.098 > 7 25 Sm 0.35040110355847 0.00000000000000 0.21169333109007 150.360 > 25 26 Sm 0.35040110355847 0.33333333333333 0.21169333109007 150.360 > 25 27 Sm 0.35040110355847 0.66666666666667 0.21169333109007 150.360 > 25 28 Sm 0.35040110355847 0.00000000000000 0.71169333109007 150.360 > 25 29 Sm 0.35040110355847 0.33333333333333 0.71169333109007 150.360 > 25 30 Sm 0.35040110355847 0.66666666666667 0.71169333109007 150.360 > 25 31 Sm 0.14959889644153 0.16666666666667 0.28830666890993 150.360 > 31 32 Sm 0.14959889644153 0.50000000000000 0.28830666890993 150.360 > 31 33 Sm 0.14959889644153 0.83333333333333 0.28830666890993 150.360 > 31 34 Sm 0.14959889644153 0.16666666666667 0.78830666890993 150.360 > 31 35 Sm 0.14959889644153 0.50000000000000 0.78830666890993 150.360 > 31 36 Sm 0.14959889644153 0.83333333333333 0.78830666890993 150.360 > 31 37 Sm 0.85040110355847 0.16666666666667 0.21169333109007 150.360 > 25 38 Sm 0.85040110355847 0.50000000000000 0.21169333109007 150.360 > 25 39 Sm 0.85040110355847 0.83333333333333 0.21169333109007 150.360 > 25 40 Sm 0.85040110355847 0.16666666666667 0.71169333109007 150.360 > 25 41 Sm 0.85040110355847 0.50000000000000 0.71169333109007 150.360 > 25 42 Sm 0.85040110355847 0.83333333333333 0.71169333109007 150.360 > 25 43 Sm 0.64959889644153 0.00000000000000 0.28830666890993 150.360 > 31 44 Sm 0.64959889644153 0.33333333333333 0.28830666890993 150.360 > 31 45 Sm 0.64959889644153 0.66666666666667 0.28830666890993 150.360 > 31 46 Sm 0.64959889644153 0.00000000000000 0.78830666890993 150.360 > 31 47 Sm 0.64959889644153 0.33333333333333 0.78830666890993 150.360 > 31 48 Sm 0.64959889644153 0.66666666666667 0.78830666890993 150.360 > 31 49 Pd 0.00733007803357 0.00000000000000 0.13933404679204 106.420 > 49 50 Pd 0.00733007803357 0.33333333333333 0.13933404679204 106.420 > 49 51 Pd 0.00733007803357 0.66666666666667 0.13933404679204 106.420 > 49 52 Pd 0.00733007803357 0.00000000000000 0.63933404679204 106.420 > 49 53 Pd 0.00733007803357 0.33333333333333 0.63933404679204 106.420 > 49 54 Pd 0.00733007803357 0.66666666666667 0.63933404679204 106.420 > 49 55 Pd 0.49266992196643 0.16666666666667 0.36066595320796 106.420 > 55 56 Pd 0.49266992196643 0.50000000000000 0.36066595320796 106.420 > 55 57 Pd 0.49266992196643 0.83333333333333 0.36066595320796 106.420 > 55 58 Pd 0.49266992196643 0.16666666666667 0.86066595320796 106.420 > 55 59 Pd 0.49266992196643 0.50000000000000 0.86066595320796 106.420 > 55 60 Pd 0.49266992196643 0.83333333333333 0.86066595320796 106.420 > 55 61 Pd 0.50733007803357 0.16666666666667 0.13933404679204 106.420 > 49 62 Pd 0.50733007803357 0.50000000000000 0.13933404679204 106.420 > 49 63 Pd 0.50733007803357 0.83333333333333 0.13933404679204 106.420 > 49 64 Pd 0.50733007803357 0.16666666666667 0.63933404679204 106.420 > 49 65 Pd 0.50733007803357 0.50000000000000 0.63933404679204 106.420 > 49 66 Pd 0.50733007803357 0.83333333333333 0.63933404679204 106.420 > 49 67 Pd 0.99266992196643 0.00000000000000 0.36066595320796 106.420 > 55 68 Pd 0.99266992196643 0.33333333333333 0.36066595320796 106.420 > 55 69 Pd 0.99266992196643 0.66666666666667 0.36066595320796 106.420 > 55 70 Pd 0.99266992196643 0.00000000000000 0.86066595320796 106.420 > 55 71 Pd 0.99266992196643 0.33333333333333 0.86066595320796 106.420 > 55 72 Pd 0.99266992196643 0.66666666666667 0.86066595320796 106.420 > 55 73 O 0.33034770013882 0.16666666666667 0.31571984932260 15.999 > 73 74 O 0.33034770013882 0.50000000000000 0.31571984932260 15.999 > 73 75 O 0.33034770013882 0.83333333333333 0.31571984932260 15.999 > 73 76 O 0.33034770013882 0.16666666666667 0.81571984932260 15.999 > 73 77 O 0.33034770013882 0.50000000000000 0.81571984932260 15.999 > 73 78 O 0.33034770013882 0.83333333333333 0.81571984932260 15.999 > 73 79 O 0.34789992397366 0.16666666666667 0.11338973058095 15.999 > 79 80 O 0.34789992397366 0.50000000000000 0.11338973058095 15.999 > 79 81 O 0.34789992397366 0.83333333333333 0.11338973058095 15.999 > 79 82 O 0.34789992397366 0.16666666666667 0.61338973058095 15.999 > 79 83 O 0.34789992397366 0.50000000000000 0.61338973058095 15.999 > 79 84 O 0.34789992397366 0.83333333333333 0.61338973058095 15.999 > 79 85 O 0.16965229986118 0.00000000000000 0.18428015067740 15.999 > 85 86 O 0.16965229986118 0.33333333333333 0.18428015067740 15.999 > 85 87 O 0.16965229986118 0.66666666666667 0.18428015067740 15.999 > 85 88 O 0.16965229986118 0.00000000000000 0.68428015067740 15.999 > 85 89 O 0.16965229986118 0.33333333333333 0.68428015067740 15.999 > 85 90 O 0.16965229986118 0.66666666666667 0.68428015067740 15.999 > 85 91 O 0.49359562840617 0.00000000000000 0.34362899489641 15.999 > 91 92 O 0.49359562840617 0.33333333333333 0.34362899489641 15.999 > 91 93 O 0.49359562840617 0.66666666666667 0.34362899489641 15.999 > 91 94 O 0.49359562840617 0.00000000000000 0.84362899489641 15.999 > 91 95 O 0.49359562840617 0.33333333333333 0.84362899489641 15.999 > 91 96 O 0.49359562840617 0.66666666666667 0.84362899489641 15.999 > 91 97 O 0.00640437159383 0.16666666666667 0.15637100510359 15.999 > 97 98 O 0.00640437159383 0.50000000000000 0.15637100510359 15.999 > 97 99 O 0.00640437159383 0.83333333333333 0.15637100510359 15.999 > 97 100 O 0.00640437159383 0.16666666666667 0.65637100510359 15.999 > 97 101 O 0.00640437159383 0.50000000000000 0.65637100510359 15.999 > 97 102 O 0.00640437159383 0.83333333333333 0.65637100510359 15.999 > 97 103 O 0.15210007602633 0.00000000000000 0.38661026941905 15.999 > 103 104 O 0.15210007602633 0.33333333333333 0.38661026941905 15.999 > 103 105 O 0.15210007602633 0.66666666666667 0.38661026941905 15.999 > 103 106 O 0.15210007602633 0.00000000000000 0.88661026941905 15.999 > 103 107 O 0.15210007602633 0.33333333333333 0.88661026941905 15.999 > 103 108 O 0.15210007602633 0.66666666666667 0.88661026941905 15.999 > 103 109 O 0.83034770013882 0.00000000000000 0.31571984932260 15.999 > 73 110 O 0.83034770013882 0.33333333333333 0.31571984932260 15.999 > 73 111 O 0.83034770013882 0.66666666666667 0.31571984932260 15.999 > 73 112 O 0.83034770013882 0.00000000000000 0.81571984932260 15.999 > 73 113 O 0.83034770013882 0.33333333333333 0.81571984932260 15.999 > 73 114 O 0.83034770013882 0.66666666666667 0.81571984932260 15.999 > 73 115 O 0.84789992397366 0.00000000000000 0.11338973058095 15.999 > 79 116 O 0.84789992397366 0.33333333333333 0.11338973058095 15.999 > 79 117 O 0.84789992397366 0.66666666666667 0.11338973058095 15.999 > 79 118 O 0.84789992397366 0.00000000000000 0.61338973058095 15.999 > 79 119 O 0.84789992397366 0.33333333333333 0.61338973058095 15.999 > 79 120 O 0.84789992397366 0.66666666666667 0.61338973058095 15.999 > 79 121 O 0.66965229986118 0.16666666666667 0.18428015067740 15.999 > 85 122 O 0.66965229986118 0.50000000000000 0.18428015067740 15.999 > 85 123 O 0.66965229986118 0.83333333333333 0.18428015067740 15.999 > 85 124 O 0.66965229986118 0.16666666666667 0.68428015067740 15.999 > 85 125 O 0.66965229986118 0.50000000000000 0.68428015067740 15.999 > 85 126 O 0.66965229986118 0.83333333333333 0.68428015067740 15.999 > 85 127 O 0.99359562840617 0.16666666666667 0.34362899489641 15.999 > 91 128 O 0.99359562840617 0.50000000000000 0.34362899489641 15.999 > 91 129 O 0.99359562840617 0.83333333333333 0.34362899489641 15.999 > 91 130 O 0.99359562840617 0.16666666666667 0.84362899489641 15.999 > 91 131 O 0.99359562840617 0.50000000000000 0.84362899489641 15.999 > 91 132 O 0.99359562840617 0.83333333333333 0.84362899489641 15.999 > 91 133 O 0.50640437159383 0.00000000000000 0.15637100510359 15.999 > 97 134 O 0.50640437159383 0.33333333333333 0.15637100510359 15.999 > 97 135 O 0.50640437159383 0.66666666666667 0.15637100510359 15.999 > 97 136 O 0.50640437159383 0.00000000000000 0.65637100510359 15.999 > 97 137 O 0.50640437159383 0.33333333333333 0.65637100510359 15.999 > 97 138 O 0.50640437159383 0.66666666666667 0.65637100510359 15.999 > 97 139 O 0.65210007602634 0.16666666666667 0.38661026941905 15.999 > 103 140 O 0.65210007602634 0.50000000000000 0.38661026941905 15.999 > 103 141 O 0.65210007602634 0.83333333333333 0.38661026941905 15.999 > 103 142 O 0.65210007602634 0.16666666666667 0.88661026941905 15.999 > 103 143 O 0.65210007602634 0.50000000000000 0.88661026941905 15.999 > 103 144 O 0.65210007602634 0.83333333333333 0.88661026941905 15.999 > 103 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.6061947 0.0000000 0.1029789 0.0000000 8.5565643 0.0000000 0.1029809 0.0000000 4.3207219 -------------------------- Born effective charges -------------------------- 1 K 1.2181553 0.0000000 0.1031310 0.0000000 1.1436136 0.0000000 0.0231798 0.0000000 1.6168010 2 K 1.2181553 0.0000000 0.1031310 0.0000000 1.1436136 0.0000000 0.0231798 0.0000000 1.6168010 3 Sm 4.7460155 0.0000000 -0.2295043 0.0000000 4.1705824 0.0000000 0.0937533 0.0000000 2.7581065 4 Sm 4.7460155 0.0000000 -0.2295043 0.0000000 4.1705824 0.0000000 0.0937533 0.0000000 2.7581065 5 Pd 1.8726243 0.0000000 0.6092935 0.0000000 2.9345702 0.0000000 0.5450981 0.0000000 -0.4752793 6 Pd 1.8726243 0.0000000 0.6092935 0.0000000 2.9345702 0.0000000 0.5450981 0.0000000 -0.4752793 7 O -3.7324241 0.0000000 -0.2722130 0.0000000 -1.7195963 0.0000000 -0.3331021 0.0000000 -1.3184612 8 O -2.5682107 0.0000000 -0.0904818 0.0000000 -1.9247926 0.0000000 -0.2174416 0.0000000 -1.5875897 9 O -3.7324241 0.0000000 -0.2722130 0.0000000 -1.7195963 0.0000000 -0.3331021 0.0000000 -1.3184612 10 O -1.5361603 0.0000000 -0.1202254 0.0000000 -4.6043774 0.0000000 -0.1114874 0.0000000 -0.9935774 11 O -1.5361603 0.0000000 -0.1202254 0.0000000 -4.6043774 0.0000000 -0.1114874 0.0000000 -0.9935774 12 O -2.5682107 0.0000000 -0.0904818 0.0000000 -1.9247926 0.0000000 -0.2174416 0.0000000 -1.5875897 ---------------------------------------------------------------------------- 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 49, 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 73, 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 79, 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 91, 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (zx) -0.00000000 (zx) 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 2026-01-08 13:20:43]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:20:43]------------------------- 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): [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.527611070259279 -1.948905930000000 0.000000000000000 b 6.527611070259279 1.948905930000000 0.000000000000000 c -1.867272801180175 0.000000000000000 7.170622947453253 Atomic positions (fractional): 1 K 0.35703724511584 0.35703724511584 0.93681252780331 39.098 2 K 0.64296275488416 0.64296275488416 0.06318747219669 39.098 3 Sm 0.35040110355847 0.35040110355847 0.42338666218015 150.360 4 Sm 0.64959889644153 0.64959889644153 0.57661333781985 150.360 5 Pd 0.00733007803357 0.00733007803357 0.27866809358408 106.420 6 Pd 0.99266992196643 0.99266992196643 0.72133190641592 106.420 7 O 0.83034770013882 0.83034770013882 0.63143969864519 15.999 8 O 0.84789992397366 0.84789992397366 0.22677946116190 15.999 9 O 0.16965229986118 0.16965229986118 0.36856030135481 15.999 10 O 0.49359562840617 0.49359562840617 0.68725798979281 15.999 11 O 0.50640437159383 0.50640437159383 0.31274201020719 15.999 12 O 0.15210007602633 0.15210007602633 0.77322053883810 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.055222140518557 0.000000000000000 0.000000000000000 b 0.000000000000000 11.693435579999999 0.000000000000000 c -3.734545602360350 0.000000000000000 14.341245894906505 Atomic positions (fractional): 1 K 0.35703724511584 0.00000000000000 0.46840626390166 39.098 > 1 2 K 0.35703724511584 0.33333333333333 0.46840626390166 39.098 > 1 3 K 0.35703724511584 0.66666666666667 0.46840626390166 39.098 > 1 4 K 0.35703724511584 0.00000000000000 0.96840626390166 39.098 > 1 5 K 0.35703724511584 0.33333333333333 0.96840626390166 39.098 > 1 6 K 0.35703724511584 0.66666666666667 0.96840626390166 39.098 > 1 7 K 0.14296275488416 0.16666666666667 0.03159373609834 39.098 > 7 8 K 0.14296275488416 0.50000000000000 0.03159373609834 39.098 > 7 9 K 0.14296275488416 0.83333333333333 0.03159373609834 39.098 > 7 10 K 0.14296275488416 0.16666666666667 0.53159373609834 39.098 > 7 11 K 0.14296275488416 0.50000000000000 0.53159373609834 39.098 > 7 12 K 0.14296275488416 0.83333333333333 0.53159373609834 39.098 > 7 13 K 0.85703724511584 0.16666666666667 0.46840626390166 39.098 > 1 14 K 0.85703724511584 0.50000000000000 0.46840626390166 39.098 > 1 15 K 0.85703724511584 0.83333333333333 0.46840626390166 39.098 > 1 16 K 0.85703724511584 0.16666666666667 0.96840626390166 39.098 > 1 17 K 0.85703724511584 0.50000000000000 0.96840626390166 39.098 > 1 18 K 0.85703724511584 0.83333333333333 0.96840626390166 39.098 > 1 19 K 0.64296275488416 0.00000000000000 0.03159373609834 39.098 > 7 20 K 0.64296275488416 0.33333333333333 0.03159373609834 39.098 > 7 21 K 0.64296275488416 0.66666666666667 0.03159373609834 39.098 > 7 22 K 0.64296275488416 0.00000000000000 0.53159373609834 39.098 > 7 23 K 0.64296275488416 0.33333333333333 0.53159373609834 39.098 > 7 24 K 0.64296275488416 0.66666666666667 0.53159373609834 39.098 > 7 25 Sm 0.35040110355847 0.00000000000000 0.21169333109007 150.360 > 25 26 Sm 0.35040110355847 0.33333333333333 0.21169333109007 150.360 > 25 27 Sm 0.35040110355847 0.66666666666667 0.21169333109007 150.360 > 25 28 Sm 0.35040110355847 0.00000000000000 0.71169333109007 150.360 > 25 29 Sm 0.35040110355847 0.33333333333333 0.71169333109007 150.360 > 25 30 Sm 0.35040110355847 0.66666666666667 0.71169333109007 150.360 > 25 31 Sm 0.14959889644153 0.16666666666667 0.28830666890993 150.360 > 31 32 Sm 0.14959889644153 0.50000000000000 0.28830666890993 150.360 > 31 33 Sm 0.14959889644153 0.83333333333333 0.28830666890993 150.360 > 31 34 Sm 0.14959889644153 0.16666666666667 0.78830666890993 150.360 > 31 35 Sm 0.14959889644153 0.50000000000000 0.78830666890993 150.360 > 31 36 Sm 0.14959889644153 0.83333333333333 0.78830666890993 150.360 > 31 37 Sm 0.85040110355847 0.16666666666667 0.21169333109007 150.360 > 25 38 Sm 0.85040110355847 0.50000000000000 0.21169333109007 150.360 > 25 39 Sm 0.85040110355847 0.83333333333333 0.21169333109007 150.360 > 25 40 Sm 0.85040110355847 0.16666666666667 0.71169333109007 150.360 > 25 41 Sm 0.85040110355847 0.50000000000000 0.71169333109007 150.360 > 25 42 Sm 0.85040110355847 0.83333333333333 0.71169333109007 150.360 > 25 43 Sm 0.64959889644153 0.00000000000000 0.28830666890993 150.360 > 31 44 Sm 0.64959889644153 0.33333333333333 0.28830666890993 150.360 > 31 45 Sm 0.64959889644153 0.66666666666667 0.28830666890993 150.360 > 31 46 Sm 0.64959889644153 0.00000000000000 0.78830666890993 150.360 > 31 47 Sm 0.64959889644153 0.33333333333333 0.78830666890993 150.360 > 31 48 Sm 0.64959889644153 0.66666666666667 0.78830666890993 150.360 > 31 49 Pd 0.00733007803357 0.00000000000000 0.13933404679204 106.420 > 49 50 Pd 0.00733007803357 0.33333333333333 0.13933404679204 106.420 > 49 51 Pd 0.00733007803357 0.66666666666667 0.13933404679204 106.420 > 49 52 Pd 0.00733007803357 0.00000000000000 0.63933404679204 106.420 > 49 53 Pd 0.00733007803357 0.33333333333333 0.63933404679204 106.420 > 49 54 Pd 0.00733007803357 0.66666666666667 0.63933404679204 106.420 > 49 55 Pd 0.49266992196643 0.16666666666667 0.36066595320796 106.420 > 55 56 Pd 0.49266992196643 0.50000000000000 0.36066595320796 106.420 > 55 57 Pd 0.49266992196643 0.83333333333333 0.36066595320796 106.420 > 55 58 Pd 0.49266992196643 0.16666666666667 0.86066595320796 106.420 > 55 59 Pd 0.49266992196643 0.50000000000000 0.86066595320796 106.420 > 55 60 Pd 0.49266992196643 0.83333333333333 0.86066595320796 106.420 > 55 61 Pd 0.50733007803357 0.16666666666667 0.13933404679204 106.420 > 49 62 Pd 0.50733007803357 0.50000000000000 0.13933404679204 106.420 > 49 63 Pd 0.50733007803357 0.83333333333333 0.13933404679204 106.420 > 49 64 Pd 0.50733007803357 0.16666666666667 0.63933404679204 106.420 > 49 65 Pd 0.50733007803357 0.50000000000000 0.63933404679204 106.420 > 49 66 Pd 0.50733007803357 0.83333333333333 0.63933404679204 106.420 > 49 67 Pd 0.99266992196643 0.00000000000000 0.36066595320796 106.420 > 55 68 Pd 0.99266992196643 0.33333333333333 0.36066595320796 106.420 > 55 69 Pd 0.99266992196643 0.66666666666667 0.36066595320796 106.420 > 55 70 Pd 0.99266992196643 0.00000000000000 0.86066595320796 106.420 > 55 71 Pd 0.99266992196643 0.33333333333333 0.86066595320796 106.420 > 55 72 Pd 0.99266992196643 0.66666666666667 0.86066595320796 106.420 > 55 73 O 0.33034770013882 0.16666666666667 0.31571984932260 15.999 > 73 74 O 0.33034770013882 0.50000000000000 0.31571984932260 15.999 > 73 75 O 0.33034770013882 0.83333333333333 0.31571984932260 15.999 > 73 76 O 0.33034770013882 0.16666666666667 0.81571984932260 15.999 > 73 77 O 0.33034770013882 0.50000000000000 0.81571984932260 15.999 > 73 78 O 0.33034770013882 0.83333333333333 0.81571984932260 15.999 > 73 79 O 0.34789992397366 0.16666666666667 0.11338973058095 15.999 > 79 80 O 0.34789992397366 0.50000000000000 0.11338973058095 15.999 > 79 81 O 0.34789992397366 0.83333333333333 0.11338973058095 15.999 > 79 82 O 0.34789992397366 0.16666666666667 0.61338973058095 15.999 > 79 83 O 0.34789992397366 0.50000000000000 0.61338973058095 15.999 > 79 84 O 0.34789992397366 0.83333333333333 0.61338973058095 15.999 > 79 85 O 0.16965229986118 0.00000000000000 0.18428015067740 15.999 > 85 86 O 0.16965229986118 0.33333333333333 0.18428015067740 15.999 > 85 87 O 0.16965229986118 0.66666666666667 0.18428015067740 15.999 > 85 88 O 0.16965229986118 0.00000000000000 0.68428015067740 15.999 > 85 89 O 0.16965229986118 0.33333333333333 0.68428015067740 15.999 > 85 90 O 0.16965229986118 0.66666666666667 0.68428015067740 15.999 > 85 91 O 0.49359562840617 0.00000000000000 0.34362899489641 15.999 > 91 92 O 0.49359562840617 0.33333333333333 0.34362899489641 15.999 > 91 93 O 0.49359562840617 0.66666666666667 0.34362899489641 15.999 > 91 94 O 0.49359562840617 0.00000000000000 0.84362899489641 15.999 > 91 95 O 0.49359562840617 0.33333333333333 0.84362899489641 15.999 > 91 96 O 0.49359562840617 0.66666666666667 0.84362899489641 15.999 > 91 97 O 0.00640437159383 0.16666666666667 0.15637100510359 15.999 > 97 98 O 0.00640437159383 0.50000000000000 0.15637100510359 15.999 > 97 99 O 0.00640437159383 0.83333333333333 0.15637100510359 15.999 > 97 100 O 0.00640437159383 0.16666666666667 0.65637100510359 15.999 > 97 101 O 0.00640437159383 0.50000000000000 0.65637100510359 15.999 > 97 102 O 0.00640437159383 0.83333333333333 0.65637100510359 15.999 > 97 103 O 0.15210007602633 0.00000000000000 0.38661026941905 15.999 > 103 104 O 0.15210007602633 0.33333333333333 0.38661026941905 15.999 > 103 105 O 0.15210007602633 0.66666666666667 0.38661026941905 15.999 > 103 106 O 0.15210007602633 0.00000000000000 0.88661026941905 15.999 > 103 107 O 0.15210007602633 0.33333333333333 0.88661026941905 15.999 > 103 108 O 0.15210007602633 0.66666666666667 0.88661026941905 15.999 > 103 109 O 0.83034770013882 0.00000000000000 0.31571984932260 15.999 > 73 110 O 0.83034770013882 0.33333333333333 0.31571984932260 15.999 > 73 111 O 0.83034770013882 0.66666666666667 0.31571984932260 15.999 > 73 112 O 0.83034770013882 0.00000000000000 0.81571984932260 15.999 > 73 113 O 0.83034770013882 0.33333333333333 0.81571984932260 15.999 > 73 114 O 0.83034770013882 0.66666666666667 0.81571984932260 15.999 > 73 115 O 0.84789992397366 0.00000000000000 0.11338973058095 15.999 > 79 116 O 0.84789992397366 0.33333333333333 0.11338973058095 15.999 > 79 117 O 0.84789992397366 0.66666666666667 0.11338973058095 15.999 > 79 118 O 0.84789992397366 0.00000000000000 0.61338973058095 15.999 > 79 119 O 0.84789992397366 0.33333333333333 0.61338973058095 15.999 > 79 120 O 0.84789992397366 0.66666666666667 0.61338973058095 15.999 > 79 121 O 0.66965229986118 0.16666666666667 0.18428015067740 15.999 > 85 122 O 0.66965229986118 0.50000000000000 0.18428015067740 15.999 > 85 123 O 0.66965229986118 0.83333333333333 0.18428015067740 15.999 > 85 124 O 0.66965229986118 0.16666666666667 0.68428015067740 15.999 > 85 125 O 0.66965229986118 0.50000000000000 0.68428015067740 15.999 > 85 126 O 0.66965229986118 0.83333333333333 0.68428015067740 15.999 > 85 127 O 0.99359562840617 0.16666666666667 0.34362899489641 15.999 > 91 128 O 0.99359562840617 0.50000000000000 0.34362899489641 15.999 > 91 129 O 0.99359562840617 0.83333333333333 0.34362899489641 15.999 > 91 130 O 0.99359562840617 0.16666666666667 0.84362899489641 15.999 > 91 131 O 0.99359562840617 0.50000000000000 0.84362899489641 15.999 > 91 132 O 0.99359562840617 0.83333333333333 0.84362899489641 15.999 > 91 133 O 0.50640437159383 0.00000000000000 0.15637100510359 15.999 > 97 134 O 0.50640437159383 0.33333333333333 0.15637100510359 15.999 > 97 135 O 0.50640437159383 0.66666666666667 0.15637100510359 15.999 > 97 136 O 0.50640437159383 0.00000000000000 0.65637100510359 15.999 > 97 137 O 0.50640437159383 0.33333333333333 0.65637100510359 15.999 > 97 138 O 0.50640437159383 0.66666666666667 0.65637100510359 15.999 > 97 139 O 0.65210007602634 0.16666666666667 0.38661026941905 15.999 > 103 140 O 0.65210007602634 0.50000000000000 0.38661026941905 15.999 > 103 141 O 0.65210007602634 0.83333333333333 0.38661026941905 15.999 > 103 142 O 0.65210007602634 0.16666666666667 0.88661026941905 15.999 > 103 143 O 0.65210007602634 0.50000000000000 0.88661026941905 15.999 > 103 144 O 0.65210007602634 0.83333333333333 0.88661026941905 15.999 > 103 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.6061947 0.0000000 0.1029789 0.0000000 8.5565643 0.0000000 0.1029809 0.0000000 4.3207219 -------------------------- Born effective charges -------------------------- 1 K 1.2181553 0.0000000 0.1031310 0.0000000 1.1436136 0.0000000 0.0231798 0.0000000 1.6168010 2 K 1.2181553 0.0000000 0.1031310 0.0000000 1.1436136 0.0000000 0.0231798 0.0000000 1.6168010 3 Sm 4.7460155 0.0000000 -0.2295043 0.0000000 4.1705824 0.0000000 0.0937533 0.0000000 2.7581065 4 Sm 4.7460155 0.0000000 -0.2295043 0.0000000 4.1705824 0.0000000 0.0937533 0.0000000 2.7581065 5 Pd 1.8726243 0.0000000 0.6092935 0.0000000 2.9345702 0.0000000 0.5450981 0.0000000 -0.4752793 6 Pd 1.8726243 0.0000000 0.6092935 0.0000000 2.9345702 0.0000000 0.5450981 0.0000000 -0.4752793 7 O -3.7324241 0.0000000 -0.2722130 0.0000000 -1.7195963 0.0000000 -0.3331021 0.0000000 -1.3184612 8 O -2.5682107 0.0000000 -0.0904818 0.0000000 -1.9247926 0.0000000 -0.2174416 0.0000000 -1.5875897 9 O -3.7324241 0.0000000 -0.2722130 0.0000000 -1.7195963 0.0000000 -0.3331021 0.0000000 -1.3184612 10 O -1.5361603 0.0000000 -0.1202254 0.0000000 -4.6043774 0.0000000 -0.1114874 0.0000000 -0.9935774 11 O -1.5361603 0.0000000 -0.1202254 0.0000000 -4.6043774 0.0000000 -0.1114874 0.0000000 -0.9935774 12 O -2.5682107 0.0000000 -0.0904818 0.0000000 -1.9247926 0.0000000 -0.2174416 0.0000000 -1.5875897 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- 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 ... [ 13 13 7 ] 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: 0.73, Number of G-points: 297, Lambda: 0.19 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/322) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 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 2.428 ( 0.000 0.000 0.000) 0.000 2.782 ( 0.000 0.000 0.000) 0.000 2.859 ( 0.000 0.000 0.000) 0.000 3.053 ( 0.000 0.000 0.000) 0.000 3.120 ( 0.000 0.000 0.000) 0.000 3.348 ( 0.000 0.000 0.000) 0.000 3.688 ( 0.000 0.000 0.000) 0.000 3.816 ( 0.000 0.000 0.000) 0.000 3.959 ( 0.000 0.000 0.000) 0.000 4.128 ( 0.000 0.000 0.000) 0.000 4.348 ( 0.000 0.000 0.000) 0.000 5.140 ( 0.000 0.000 0.000) 0.000 5.348 ( 0.000 0.000 0.000) 0.000 5.405 ( 0.000 0.000 0.000) 0.000 5.637 ( 0.000 0.000 0.000) 0.000 6.505 ( 0.000 0.000 0.000) 0.000 7.615 ( 0.000 0.000 0.000) 0.000 7.767 ( 0.000 0.000 0.000) 0.000 8.376 ( 0.000 0.000 0.000) 0.000 8.628 ( 0.000 0.000 0.000) 0.000 9.177 ( 0.000 0.000 0.000) 0.000 9.583 ( 0.000 0.000 0.000) 0.000 9.871 ( 0.000 0.000 0.000) 0.000 10.585 ( 0.000 0.000 0.000) 0.000 10.681 ( 0.000 0.000 0.000) 0.000 10.823 ( 0.000 0.000 0.000) 0.000 11.703 ( 0.000 0.000 0.000) 0.000 14.739 ( 0.000 0.000 0.000) 0.000 15.205 ( 0.000 0.000 0.000) 0.000 16.429 ( 0.000 0.000 0.000) 0.000 16.922 ( 0.000 0.000 0.000) 0.000 20.548 ( 0.000 0.000 0.000) 0.000 20.811 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/322) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.487 ( 5.181 -22.193 2.600) 22.937 0.673 ( 18.374 -27.899 3.350) 33.573 1.221 ( 12.338 -55.283 1.422) 56.661 2.532 ( 0.415 -8.810 0.098) 8.821 2.769 ( -0.370 0.315 -0.568) 0.747 2.902 ( -2.046 -3.788 -0.235) 4.311 3.102 ( -0.253 -4.350 -0.083) 4.358 3.202 ( 2.142 -7.430 -0.854) 7.779 3.515 ( -0.595 -12.524 0.139) 12.539 3.819 ( -6.431 -2.854 -5.238) 8.772 3.964 ( 0.353 -0.575 4.683) 4.731 4.215 ( 1.503 -10.309 -0.382) 10.425 4.323 ( 0.051 1.356 0.309) 1.392 4.809 ( -32.012 -18.396 -10.223) 38.311 5.163 ( -1.620 -1.635 7.846) 8.177 5.417 ( 0.334 -0.750 -0.274) 0.866 5.463 ( 21.483 3.794 1.216) 21.849 5.730 ( -0.956 -10.897 -1.695) 11.069 6.475 ( -2.815 1.861 -0.175) 3.379 7.515 ( -3.387 7.360 0.201) 8.105 7.766 ( 0.655 2.485 -3.254) 4.146 8.205 ( 1.135 22.478 0.418) 22.511 8.899 ( -4.672 -14.938 -1.725) 15.746 9.201 ( 6.367 3.319 4.474) 8.460 9.829 ( 1.771 2.872 0.577) 3.423 10.270 ( -6.804 -11.321 -17.335) 21.794 10.442 ( 1.901 10.807 1.813) 11.122 10.655 ( 1.801 1.130 -0.192) 2.135 10.968 ( 4.402 -6.702 9.602) 12.509 11.633 ( 1.185 7.170 1.233) 7.371 14.892 ( 38.963 10.820 9.550) 41.550 15.192 ( 1.427 1.509 -1.145) 2.371 16.427 ( 8.333 5.027 0.958) 9.779 16.892 ( 1.608 3.236 -0.101) 3.615 20.690 ( -0.036 -13.632 -0.001) 13.632 22.700 ( -20.939 -3.388 -5.014) 21.796 ======================= Grid point 2 (3/322) ======================= q-point: ( 0.15 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.925 ( 5.808 -17.884 2.278) 18.940 1.314 ( 15.658 -25.945 3.011) 30.453 2.261 ( 11.663 -39.701 0.587) 41.383 2.724 ( -1.531 -8.900 1.364) 9.133 2.777 ( 0.154 -2.579 -1.900) 3.207 2.994 ( -0.884 -8.258 -0.665) 8.331 3.209 ( -0.499 -6.753 -0.290) 6.778 3.410 ( 2.656 -11.626 -1.830) 12.065 3.647 ( -1.696 -2.345 -0.505) 2.938 3.827 ( -7.040 -2.067 -7.017) 10.153 4.005 ( 0.977 -2.177 5.786) 6.259 4.304 ( 0.569 0.099 0.708) 0.914 4.540 ( 3.645 -12.800 1.174) 13.361 4.930 ( -11.763 -6.998 -2.319) 13.882 5.325 ( -2.432 -17.910 2.447) 18.239 5.447 ( -0.617 -3.321 0.635) 3.437 5.541 ( 7.789 -3.302 -0.786) 8.497 6.042 ( -2.078 -18.030 -3.421) 18.469 6.443 ( -9.070 -5.750 0.612) 10.757 7.317 ( -4.089 10.544 0.053) 11.309 7.594 ( -7.399 15.886 -0.576) 17.534 7.821 ( 9.187 14.088 0.727) 16.834 9.109 ( -1.709 3.019 7.581) 8.337 9.130 ( 4.410 -2.750 -4.388) 6.802 9.745 ( 3.559 8.631 -2.920) 9.782 10.227 ( 0.116 5.931 -0.479) 5.952 10.321 ( -4.504 5.552 -3.315) 7.880 10.806 ( -3.769 -14.549 -5.533) 16.016 11.174 ( 4.267 -10.730 7.660) 13.857 11.483 ( 0.453 5.445 1.158) 5.585 14.944 ( 16.635 1.480 3.306) 17.025 15.168 ( 3.393 1.860 -1.179) 4.045 16.369 ( 4.496 4.284 0.297) 6.218 16.828 ( 3.037 4.189 0.000) 5.174 21.037 ( -0.079 -20.196 0.000) 20.196 22.605 ( -10.225 3.118 -2.286) 10.932 ======================= Grid point 3 (4/322) ======================= q-point: ( 0.23 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.240 ( 6.666 -9.161 1.363) 11.412 1.868 ( 11.480 -21.197 2.083) 24.195 2.650 ( -1.250 1.271 -1.230) 2.166 2.861 ( 2.859 -7.916 -1.486) 8.547 2.953 ( 1.743 -9.724 0.633) 9.900 3.285 ( -2.230 -14.224 -0.989) 14.432 3.409 ( 3.777 -17.444 -0.507) 17.855 3.646 ( 1.519 -6.521 -5.278) 8.526 3.662 ( -0.823 -4.186 -1.515) 4.527 3.827 ( -3.398 -5.034 -0.681) 6.112 4.072 ( 2.661 -2.429 5.177) 6.307 4.322 ( 0.507 -1.707 -0.758) 1.936 4.646 ( 3.997 1.572 3.679) 5.656 4.936 ( -4.903 0.484 0.321) 4.937 5.481 ( -5.861 -3.645 0.664) 6.934 5.618 ( 3.915 -4.962 0.370) 6.332 5.893 ( -0.430 -25.888 -1.336) 25.926 6.166 ( -8.951 -2.461 -2.730) 9.676 6.770 ( -8.986 -23.803 0.599) 25.449 7.032 ( -9.496 12.269 -0.492) 15.522 7.209 ( 2.187 14.247 1.102) 14.456 7.747 ( 9.341 1.250 -0.103) 9.425 8.909 ( 1.341 12.850 5.637) 14.096 9.227 ( 4.576 -0.349 -2.553) 5.251 9.504 ( -1.587 13.892 -3.415) 14.393 10.079 ( -4.144 9.572 -3.709) 11.071 10.247 ( 3.008 -0.535 2.891) 4.206 10.886 ( -1.506 6.091 -3.276) 7.077 11.371 ( 0.288 -10.828 4.462) 11.715 11.699 ( -2.605 -24.495 -0.501) 24.638 15.032 ( 7.260 -2.425 -0.678) 7.684 15.169 ( 6.879 0.554 1.159) 6.998 16.328 ( 3.590 2.000 0.013) 4.110 16.778 ( 4.078 2.755 0.323) 4.932 21.435 ( -0.077 -19.150 -0.064) 19.150 22.456 ( -5.158 6.805 -0.910) 8.587 ======================= Grid point 4 (5/322) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( 6.966 4.278 -0.363) 8.183 2.268 ( 6.217 -12.716 0.514) 14.164 2.545 ( -1.547 5.666 -1.109) 5.977 2.987 ( 2.506 -4.461 -1.859) 5.445 3.131 ( -0.130 -7.538 0.646) 7.567 3.447 ( -3.122 -6.975 -0.602) 7.666 3.629 ( -3.408 -0.450 -1.638) 3.808 3.676 ( -3.190 -5.759 -6.206) 9.047 3.844 ( 2.158 -9.878 -0.857) 10.147 4.070 ( 7.203 -9.880 1.043) 12.271 4.146 ( 5.802 -4.293 4.026) 8.264 4.372 ( -0.331 -3.168 -1.637) 3.581 4.632 ( 6.041 2.522 7.575) 10.012 4.897 ( -3.760 -0.436 -0.101) 3.786 5.478 ( -6.741 0.135 -0.369) 6.752 5.728 ( 2.009 -4.388 0.217) 4.831 6.065 ( -15.933 -2.595 0.146) 16.143 6.273 ( -5.513 -1.998 -1.250) 5.995 6.653 ( 2.876 8.745 1.258) 9.292 6.968 ( 1.638 3.944 -1.270) 4.455 7.397 ( -7.501 -24.310 -0.014) 25.441 7.847 ( 11.288 -4.924 -0.385) 12.321 8.671 ( 2.053 12.504 5.003) 13.624 9.152 ( -1.095 9.812 -2.978) 10.312 9.273 ( 0.299 6.405 -2.935) 7.052 9.863 ( -3.012 8.947 -0.829) 9.477 10.317 ( 1.435 -4.982 1.247) 5.332 10.685 ( 0.476 10.379 -0.708) 10.414 11.685 ( 1.152 -18.145 1.630) 18.255 12.163 ( -6.393 -22.977 -1.288) 23.885 15.092 ( 2.049 -1.256 -3.383) 4.150 15.246 ( 8.645 -2.594 3.435) 9.658 16.346 ( 3.895 -1.796 -0.041) 4.289 16.769 ( 4.208 0.932 0.616) 4.354 21.765 ( -0.022 -13.920 -0.162) 13.921 22.286 ( -1.615 7.974 -0.009) 8.136 ======================= Grid point 5 (6/322) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.157 ( 5.603 16.126 -1.883) 17.175 2.311 ( -2.173 6.206 -0.993) 6.650 2.583 ( 5.724 -6.249 -0.259) 8.478 3.075 ( 1.999 -3.230 -0.878) 3.899 3.235 ( -3.724 -3.788 0.350) 5.324 3.545 ( -0.786 -4.425 -0.438) 4.515 3.612 ( -3.756 -0.550 -1.500) 4.082 3.756 ( -1.471 -4.989 -4.065) 6.601 4.012 ( -0.601 -6.500 0.395) 6.540 4.114 ( 3.408 2.560 0.498) 4.292 4.330 ( 5.835 -4.579 1.556) 7.579 4.420 ( -0.009 -1.885 -2.587) 3.201 4.633 ( 6.584 3.488 8.079) 10.991 4.966 ( -0.696 -7.724 0.229) 7.758 5.425 ( -5.661 0.543 -0.827) 5.747 5.814 ( 2.181 -3.035 0.629) 3.790 5.960 ( -18.154 3.449 1.647) 18.552 6.142 ( -1.872 5.217 -0.597) 5.575 6.628 ( 6.249 1.024 -0.209) 6.335 6.934 ( 0.242 1.419 -1.003) 1.754 7.729 ( -2.973 -12.498 -0.062) 12.846 8.062 ( 11.202 -9.260 -0.320) 14.537 8.477 ( 0.639 8.220 3.456) 8.940 8.906 ( -7.520 10.945 -3.508) 13.734 9.170 ( 2.222 5.329 -1.611) 5.995 9.693 ( -1.402 7.022 0.911) 7.219 10.468 ( 0.175 -8.589 1.066) 8.657 10.544 ( 0.333 3.400 -1.163) 3.609 12.045 ( 3.721 -15.431 1.294) 15.926 12.484 ( -7.928 -13.738 -1.631) 15.945 15.113 ( 1.380 -0.542 -2.379) 2.804 15.343 ( 5.281 -2.121 2.188) 6.097 16.439 ( 4.082 -4.776 0.156) 6.285 16.780 ( 2.923 0.594 0.592) 3.041 21.979 ( 0.014 -7.805 -0.145) 7.806 22.138 ( 0.256 6.295 0.307) 6.308 ======================= Grid point 6 (7/322) ======================= q-point: ( 0.46 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.864 ( 2.435 11.640 -1.312) 11.964 2.193 ( -0.767 3.339 -0.380) 3.447 2.700 ( 2.818 -2.419 -0.272) 3.724 3.129 ( 0.745 -1.297 -0.074) 1.498 3.250 ( -2.687 -0.526 -0.004) 2.738 3.585 ( -1.823 -0.492 -0.260) 1.906 3.626 ( 0.456 -1.656 -0.496) 1.787 3.827 ( -0.699 -2.690 -1.532) 3.174 4.072 ( 1.522 2.098 0.070) 2.593 4.095 ( -0.996 -2.198 0.445) 2.454 4.411 ( 1.953 -1.557 1.640) 2.988 4.440 ( 0.303 -0.487 -2.706) 2.766 4.602 ( 2.030 2.288 3.452) 4.612 5.102 ( 0.940 -3.924 0.346) 4.050 5.402 ( -1.990 -0.377 -0.365) 2.058 5.810 ( -5.973 2.697 0.798) 6.602 5.875 ( 1.599 -1.476 0.568) 2.249 6.068 ( -1.945 1.576 -0.531) 2.560 6.643 ( 1.712 0.010 -0.059) 1.713 6.900 ( 0.179 1.307 -0.386) 1.375 7.881 ( -0.631 -4.076 0.016) 4.124 8.292 ( 12.213 -3.710 1.522) 12.854 8.395 ( -2.822 -3.394 -0.190) 4.418 8.633 ( -8.269 10.925 -1.781) 13.817 9.098 ( 0.912 2.293 -0.500) 2.518 9.583 ( -0.449 3.117 0.535) 3.194 10.511 ( -0.114 -0.038 0.153) 0.195 10.623 ( 0.122 -4.544 -0.283) 4.555 12.295 ( 2.939 -6.455 0.761) 7.134 12.613 ( -4.528 -3.918 -0.943) 6.062 15.124 ( 0.544 -0.186 -0.834) 1.013 15.392 ( 1.677 -0.620 0.692) 1.917 16.548 ( 2.072 -3.161 0.142) 3.782 16.775 ( 0.794 0.874 0.231) 1.203 22.051 ( 0.286 2.238 0.350) 2.283 22.079 ( 0.075 -2.287 -0.244) 2.301 ======================= Grid point 14 (8/322) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.253 ( 19.396 0.000 8.691) 21.254 0.378 ( 30.787 0.000 4.232) 31.077 0.741 ( 60.030 0.000 9.281) 60.743 2.433 ( 0.745 0.000 0.203) 0.772 2.780 ( -0.016 -0.000 -1.369) 1.369 2.825 ( -5.703 -0.000 0.014) 5.703 3.038 ( -2.501 -0.000 0.027) 2.501 3.152 ( 5.738 0.000 -0.788) 5.792 3.338 ( -1.768 -0.000 0.002) 1.768 3.698 ( 1.530 0.000 0.406) 1.583 3.744 ( -8.051 -0.000 -6.493) 10.343 3.987 ( 1.853 0.000 1.208) 2.212 4.145 ( 3.170 0.000 -7.267) 7.928 4.371 ( 3.182 0.000 1.698) 3.607 5.139 ( -5.998 -0.000 6.829) 9.088 5.415 ( 0.277 0.000 -1.159) 1.191 5.588 ( -6.484 -0.000 0.619) 6.514 5.864 ( 1.591 0.000 -0.996) 1.877 6.483 ( -3.218 -0.000 -1.270) 3.460 7.554 ( -9.503 -0.000 -0.393) 9.511 7.836 ( 4.352 0.000 -22.059) 22.484 8.422 ( 7.097 0.000 0.183) 7.100 8.631 ( 0.675 0.000 -0.316) 0.745 9.504 ( -2.240 -0.000 11.280) 11.501 9.587 ( 0.628 0.000 0.402) 0.745 10.157 ( 10.278 0.000 -48.208) 49.291 10.583 ( -0.336 -0.000 -0.214) 0.399 10.698 ( 2.685 0.000 -0.061) 2.685 11.043 ( -10.688 -0.000 17.585) 20.578 11.726 ( 2.659 0.000 3.214) 4.171 15.204 ( 0.798 0.000 -3.212) 3.310 16.051 ( -0.343 -0.000 4.186) 4.200 16.940 ( 3.228 0.000 -0.323) 3.244 18.679 ( -1.101 -0.000 -12.871) 12.918 20.548 ( -0.057 -0.000 -0.021) 0.061 20.811 ( 0.005 0.000 0.000) 0.005 ======================= Grid point 15 (9/322) ======================= q-point: ( 0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.608 ( 12.605 -18.053 5.278) 22.642 0.965 ( 23.998 -23.742 4.592) 34.069 1.528 ( 37.106 -39.791 4.402) 54.585 2.540 ( 0.595 -8.450 0.330) 8.477 2.749 ( -3.315 0.260 -1.278) 3.562 2.862 ( -3.497 -4.949 -0.921) 6.129 3.090 ( -2.131 -4.830 -0.367) 5.292 3.249 ( 6.516 -6.289 -1.360) 9.158 3.501 ( -1.997 -12.619 0.183) 12.778 3.691 ( -10.077 -3.338 -7.219) 12.838 3.971 ( -1.846 -2.266 4.912) 5.715 4.238 ( 1.904 -9.532 0.051) 9.721 4.280 ( -9.066 -11.852 -3.439) 15.313 4.517 ( -7.552 -20.808 -2.689) 22.298 5.136 ( -4.451 -2.898 4.356) 6.869 5.403 ( -3.576 -0.515 -2.068) 4.163 5.588 ( -2.695 -1.209 3.117) 4.294 5.761 ( 7.525 -0.418 -4.031) 8.547 6.418 ( -5.873 3.344 -1.199) 6.864 7.436 ( -9.781 5.263 0.076) 11.107 7.753 ( -0.491 5.956 -5.163) 7.897 8.239 ( 4.020 19.806 0.990) 20.235 8.862 ( 0.085 -16.416 -0.989) 16.446 9.293 ( 4.911 7.907 6.820) 11.538 9.864 ( 3.013 -4.820 2.043) 6.040 10.128 ( -5.239 -5.601 -21.703) 23.018 10.449 ( -0.718 10.801 -0.542) 10.839 10.688 ( 3.359 1.480 0.159) 3.674 11.027 ( -1.393 -5.476 8.660) 10.340 11.667 ( 2.779 7.762 3.736) 9.051 15.179 ( 2.581 3.197 -3.918) 5.678 15.525 ( 40.841 38.356 10.805) 57.061 16.659 ( 30.454 31.235 3.816) 43.791 16.930 ( 4.925 3.481 -0.057) 6.031 20.689 ( -0.100 -13.624 -0.003) 13.624 22.300 ( -36.836 -31.278 -8.882) 49.134 ======================= Grid point 16 (10/322) ======================= q-point: ( 0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( 10.584 -16.171 3.512) 19.644 1.544 ( 19.813 -21.152 3.836) 29.235 2.460 ( 20.375 -29.515 -0.150) 35.865 2.693 ( -4.347 -6.024 1.199) 7.525 2.777 ( 1.035 -7.238 -1.415) 7.447 2.984 ( -0.104 -10.272 -1.171) 10.339 3.197 ( -1.534 -7.562 -0.536) 7.735 3.449 ( 4.782 -10.219 -1.501) 11.382 3.613 ( -2.842 -3.090 -2.432) 4.852 3.731 ( -5.179 -3.419 -4.898) 7.906 4.024 ( -0.036 -3.273 4.528) 5.587 4.309 ( -0.277 -0.590 0.659) 0.927 4.577 ( 1.019 -13.526 0.542) 13.575 4.824 ( -4.270 -11.678 0.479) 12.443 5.281 ( -5.226 -15.053 1.887) 16.046 5.429 ( -2.659 -7.300 -1.717) 7.957 5.596 ( 0.262 -1.256 0.094) 1.286 5.999 ( -2.786 -18.393 -4.639) 19.173 6.306 ( -13.597 -1.178 0.503) 13.657 7.231 ( -10.201 10.322 -0.848) 14.537 7.545 ( -0.636 14.271 0.352) 14.289 7.920 ( 7.160 12.663 1.013) 14.583 9.108 ( -1.281 -1.587 5.530) 5.894 9.193 ( 6.534 1.151 -0.501) 6.654 9.776 ( 3.487 12.798 -5.542) 14.375 10.229 ( -0.177 7.899 -1.687) 8.079 10.239 ( -5.658 -3.924 -3.588) 7.765 10.758 ( -2.077 -8.798 -2.664) 9.425 11.227 ( 0.678 -13.301 5.258) 14.319 11.498 ( 0.894 8.592 2.979) 9.138 15.110 ( 7.249 4.677 -2.463) 8.972 15.303 ( 20.277 9.061 4.273) 22.617 16.451 ( 9.137 8.426 0.635) 12.446 16.880 ( 5.596 4.361 0.115) 7.095 21.036 ( -0.140 -20.196 0.001) 20.197 22.436 ( -15.882 -4.997 -3.539) 17.021 ======================= Grid point 17 (11/322) ======================= q-point: ( 0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 10.243 -7.948 1.673) 13.072 2.029 ( 13.828 -16.923 2.259) 21.970 2.611 ( -4.597 2.376 -1.382) 5.357 2.878 ( 0.243 -6.983 -2.908) 7.568 2.994 ( 5.027 -8.324 0.305) 9.729 3.257 ( -1.984 -10.819 -0.894) 11.035 3.438 ( 1.715 -15.368 -3.004) 15.752 3.630 ( -2.849 0.332 -1.489) 3.232 3.676 ( 4.701 -9.040 -3.961) 10.932 3.839 ( 6.574 -13.352 2.216) 15.047 4.110 ( 1.414 -3.985 4.306) 6.035 4.320 ( -0.484 -1.117 -1.419) 1.869 4.689 ( 0.864 -0.398 3.311) 3.445 4.904 ( -1.340 0.790 2.212) 2.704 5.404 ( -7.112 -3.941 1.190) 8.218 5.635 ( -1.605 -4.505 -0.730) 4.837 5.879 ( -1.196 -24.431 -1.567) 24.511 6.033 ( -11.331 1.054 -2.780) 11.715 6.643 ( -12.181 -30.734 0.126) 33.060 6.909 ( -10.265 12.907 -0.477) 16.498 7.269 ( 7.002 13.356 0.672) 15.095 7.852 ( 7.899 0.020 0.675) 7.928 8.940 ( 0.097 12.246 7.011) 14.112 9.288 ( 6.921 -0.340 -3.181) 7.625 9.466 ( -2.165 16.168 -4.947) 17.045 10.015 ( -4.502 9.186 -3.669) 10.868 10.290 ( 2.568 -0.441 3.024) 3.992 10.858 ( -1.435 2.264 -3.326) 4.272 11.384 ( -0.647 -8.058 4.946) 9.477 11.659 ( -3.616 -22.514 -0.783) 22.816 15.095 ( 4.979 0.595 -3.259) 5.980 15.307 ( 13.802 2.193 3.473) 14.400 16.381 ( 5.437 3.065 0.110) 6.242 16.838 ( 5.610 3.084 0.489) 6.420 21.434 ( -0.108 -19.176 -0.088) 19.177 22.380 ( -6.883 2.696 -1.201) 7.490 ======================= Grid point 18 (12/322) ======================= q-point: ( 0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( 9.431 5.906 -0.599) 11.144 2.343 ( 5.468 -5.723 -0.224) 7.919 2.529 ( 0.027 0.480 -0.498) 0.692 2.982 ( -2.832 -5.307 -0.902) 6.082 3.150 ( 3.927 -5.047 -1.527) 6.575 3.415 ( -2.348 -7.617 0.290) 7.976 3.582 ( -3.489 0.088 -2.018) 4.032 3.637 ( -0.315 -6.355 -5.151) 8.187 3.863 ( 1.695 -8.175 -0.049) 8.349 4.163 ( 6.115 -1.924 2.165) 6.766 4.234 ( 8.687 -10.070 2.234) 13.486 4.355 ( -1.536 -3.552 -2.321) 4.512 4.716 ( 3.494 -1.193 7.728) 8.564 4.851 ( -4.625 0.645 -0.056) 4.670 5.412 ( -3.390 -0.147 0.895) 3.509 5.719 ( -3.682 -5.597 -1.095) 6.789 5.853 ( -18.783 0.956 0.341) 18.810 6.222 ( -2.709 -1.561 -0.918) 3.258 6.687 ( 1.926 0.652 0.919) 2.231 6.990 ( 2.585 2.361 -0.705) 3.571 7.321 ( -4.290 -22.165 -1.192) 22.608 7.968 ( 8.848 -5.913 0.555) 10.656 8.698 ( -0.987 12.421 4.627) 13.292 9.121 ( -1.384 14.729 -3.470) 15.196 9.285 ( 3.040 4.463 -2.932) 6.145 9.824 ( -3.091 7.364 -0.668) 8.015 10.333 ( 0.425 -3.904 1.463) 4.191 10.688 ( 0.455 10.199 -0.738) 10.236 11.704 ( 1.104 -19.967 1.563) 20.058 12.076 ( -7.312 -21.388 -1.420) 22.648 15.115 ( 3.580 -0.259 -3.316) 4.887 15.367 ( 9.651 -0.086 3.170) 10.159 16.399 ( 5.071 -1.691 0.123) 5.347 16.824 ( 4.461 1.717 0.698) 4.831 21.764 ( -0.022 -13.956 -0.194) 13.957 22.265 ( -1.874 5.874 0.003) 6.166 ======================= Grid point 19 (13/322) ======================= q-point: ( 0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.228 ( 7.251 18.112 -1.760) 19.589 2.285 ( -1.742 6.027 -1.063) 6.364 2.650 ( 5.279 -5.183 -0.020) 7.398 3.057 ( -4.321 -4.349 1.322) 6.272 3.237 ( 4.818 -1.792 -2.907) 5.905 3.525 ( -3.124 -4.275 0.400) 5.309 3.579 ( -0.798 -2.325 -1.008) 2.657 3.749 ( 2.061 -4.988 -3.052) 6.200 4.007 ( -0.643 -5.849 1.408) 6.050 4.150 ( 2.597 3.808 0.163) 4.612 4.383 ( 0.897 -3.107 1.700) 3.654 4.415 ( 1.919 -1.874 -2.529) 3.687 4.677 ( -3.362 5.086 3.570) 7.065 4.971 ( 1.265 -9.900 1.729) 10.129 5.400 ( 1.940 0.409 1.096) 2.265 5.744 ( -18.202 -1.376 1.738) 18.336 5.802 ( -4.432 -4.797 -1.462) 6.693 6.135 ( 0.881 4.980 0.362) 5.070 6.717 ( 7.763 2.184 0.335) 8.072 6.942 ( 2.374 2.679 -1.219) 3.781 7.692 ( -2.601 -15.094 -0.706) 15.332 8.179 ( 7.916 -9.971 0.524) 12.742 8.465 ( -5.308 9.473 0.901) 10.896 8.839 ( -0.773 12.807 -1.101) 12.878 9.187 ( 1.535 5.755 -1.914) 6.256 9.678 ( -1.742 6.206 0.929) 6.512 10.469 ( -0.479 -8.689 0.922) 8.751 10.543 ( 0.178 3.811 -1.005) 3.945 12.091 ( 3.371 -15.991 0.830) 16.364 12.384 ( -7.907 -14.597 -1.390) 16.659 15.131 ( 2.824 0.119 -2.155) 3.554 15.413 ( 5.238 0.470 1.891) 5.589 16.493 ( 4.901 -4.067 0.313) 6.376 16.811 ( 1.943 1.853 0.548) 2.741 21.978 ( 0.031 -7.827 -0.158) 7.829 22.142 ( 0.270 5.744 0.332) 5.760 ======================= Grid point 20 (14/322) ======================= q-point: ( 0.54 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.902 ( 4.288 14.321 -0.555) 14.960 2.184 ( -0.641 2.420 -0.308) 2.523 2.717 ( -0.000 0.065 0.052) 0.084 3.102 ( -3.967 -2.178 1.693) 4.832 3.287 ( 7.988 -0.310 -2.996) 8.537 3.570 ( -0.686 -2.444 0.296) 2.556 3.628 ( -0.155 -1.393 0.630) 1.537 3.842 ( 3.420 -2.698 -0.268) 4.364 4.066 ( -2.499 1.076 0.713) 2.813 4.104 ( 1.949 -0.404 0.460) 2.043 4.418 ( -0.802 -0.403 -0.493) 1.024 4.444 ( 0.972 -0.354 -0.005) 1.035 4.561 ( -8.627 2.301 -1.314) 9.024 5.111 ( -0.023 -2.787 0.937) 2.941 5.427 ( 5.486 -0.285 1.385) 5.665 5.720 ( -8.616 -4.713 1.336) 9.911 5.841 ( -6.387 -2.223 -2.070) 7.072 6.087 ( 3.887 1.285 1.116) 4.243 6.705 ( 7.808 3.274 -0.031) 8.466 6.903 ( 0.906 1.774 -0.613) 2.084 7.881 ( 0.832 -4.805 -0.210) 4.881 8.271 ( -12.563 4.620 -2.582) 13.632 8.417 ( 2.911 -8.034 0.838) 8.586 8.627 ( 7.560 7.889 1.933) 11.096 9.099 ( -0.433 2.809 -0.780) 2.947 9.577 ( -0.771 2.601 0.407) 2.743 10.510 ( 0.005 -0.050 -0.013) 0.051 10.619 ( -0.506 -4.698 -0.105) 4.726 12.306 ( -1.269 -3.935 -0.622) 4.181 12.581 ( -0.546 -8.408 0.240) 8.429 15.135 ( 1.754 0.601 -0.601) 1.949 15.414 ( 1.668 1.575 0.543) 2.358 16.576 ( 2.745 -0.751 0.160) 2.850 16.775 ( -0.848 1.625 0.163) 1.841 22.056 ( 0.284 2.584 0.352) 2.624 22.079 ( 0.059 -2.258 -0.251) 2.272 ======================= Grid point 21 (15/322) ======================= q-point: (-0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( -0.353 -8.559 1.612) 8.717 2.204 ( 0.852 -4.439 0.364) 4.535 2.663 ( -3.236 4.164 0.439) 5.291 3.093 ( -4.214 0.713 1.209) 4.442 3.328 ( 8.871 1.616 -2.069) 9.251 3.599 ( -0.260 0.758 0.600) 1.001 3.639 ( 3.188 -0.312 1.591) 3.577 3.868 ( 4.895 3.305 2.471) 6.403 4.042 ( -3.905 -1.782 -0.034) 4.292 4.106 ( 0.702 2.211 0.239) 2.332 4.369 ( -4.785 3.424 -1.621) 6.103 4.442 ( -0.872 0.403 2.634) 2.804 4.516 ( -7.415 -2.670 -6.436) 10.175 5.089 ( -1.169 4.133 0.059) 4.296 5.466 ( 7.244 0.317 1.511) 7.407 5.802 ( -6.662 -1.706 -1.342) 7.007 5.859 ( 0.675 -8.546 -0.797) 8.609 6.119 ( 4.805 -1.189 1.212) 5.096 6.674 ( 6.689 4.697 -0.227) 8.176 6.898 ( -0.455 -1.380 0.174) 1.464 7.882 ( -1.658 4.328 -0.527) 4.664 8.126 ( -12.284 3.040 -1.185) 12.710 8.415 ( 0.931 2.192 -0.410) 2.416 8.764 ( 10.673 -9.328 2.853) 14.460 9.081 ( -1.996 -1.910 0.183) 2.768 9.585 ( 0.117 -3.569 -0.530) 3.610 10.512 ( 0.251 0.029 -0.259) 0.362 10.619 ( -0.669 4.466 0.375) 4.531 12.246 ( -4.207 7.216 -1.304) 8.454 12.678 ( 5.244 1.211 1.274) 5.531 15.127 ( 0.583 0.902 0.874) 1.385 15.373 ( -1.238 2.852 -0.680) 3.183 16.527 ( -1.437 5.404 -0.129) 5.594 16.758 ( -1.679 -0.226 -0.217) 1.708 22.047 ( -0.227 -1.953 -0.279) 1.986 22.079 ( -0.070 2.356 0.192) 2.365 ======================= Grid point 22 (16/322) ======================= q-point: (-0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( -3.351 -14.175 1.431) 14.636 2.344 ( 2.836 -6.482 0.688) 7.108 2.523 ( -4.547 6.995 0.330) 8.350 3.037 ( -3.855 2.541 1.284) 4.792 3.285 ( 3.861 6.554 -1.435) 7.741 3.563 ( 2.089 2.922 1.269) 3.809 3.667 ( 4.840 1.017 1.380) 5.135 3.807 ( 4.748 4.892 4.479) 8.157 4.013 ( -0.739 7.190 -0.949) 7.290 4.065 ( -4.560 -1.961 0.699) 5.013 4.240 ( -8.172 5.958 -2.859) 10.510 4.426 ( -0.191 1.576 1.985) 2.542 4.523 ( -6.270 -2.950 -7.124) 9.938 4.980 ( 1.502 5.393 0.207) 5.602 5.511 ( 7.208 -0.301 1.148) 7.305 5.761 ( -5.456 1.053 -1.336) 5.716 6.128 ( 9.143 -13.887 -1.158) 16.667 6.180 ( 4.511 -2.016 0.679) 4.988 6.591 ( 0.472 5.260 0.293) 5.290 6.935 ( -0.170 -1.481 0.604) 1.608 7.738 ( -2.718 7.657 -0.709) 8.156 7.950 ( -6.308 10.275 1.003) 12.099 8.456 ( -0.742 -6.453 -2.739) 7.050 9.003 ( 6.570 -8.483 2.662) 11.055 9.147 ( -2.253 -5.741 1.282) 6.299 9.705 ( 0.947 -7.923 -0.670) 8.007 10.461 ( -0.396 8.975 -0.803) 9.020 10.542 ( -0.402 -3.309 0.895) 3.452 12.001 ( -2.885 14.504 -1.155) 14.833 12.572 ( 5.807 13.338 1.272) 14.603 15.112 ( -0.119 0.962 2.111) 2.322 15.281 ( -3.924 4.695 -1.985) 6.433 16.398 ( -2.862 5.314 -0.070) 6.036 16.744 ( -2.561 0.311 -0.448) 2.618 21.979 ( 0.000 7.796 0.101) 7.796 22.134 ( -0.183 -6.774 -0.214) 6.780 ======================= Grid point 23 (17/322) ======================= q-point: (-0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.272 ( -3.698 -3.147 0.146) 4.858 2.207 ( -3.546 16.864 -0.444) 17.238 2.564 ( 0.966 -7.517 0.730) 7.614 2.955 ( -2.847 3.999 1.189) 5.051 3.133 ( 0.304 9.162 -0.771) 9.199 3.488 ( 2.983 6.854 0.736) 7.511 3.666 ( 2.103 0.657 0.634) 2.292 3.743 ( 4.116 10.763 3.599) 12.072 3.825 ( -0.841 8.034 5.566) 9.810 4.003 ( -3.875 11.669 -3.873) 12.891 4.058 ( -6.482 -0.239 -3.728) 7.482 4.376 ( -0.037 3.254 0.784) 3.348 4.550 ( -4.030 -3.889 -4.422) 7.136 4.942 ( 3.390 -0.068 0.441) 3.419 5.551 ( 4.896 0.572 0.311) 4.939 5.687 ( -3.878 3.729 -0.604) 5.414 6.199 ( 6.641 5.001 0.242) 8.317 6.356 ( 6.691 5.937 0.876) 8.988 6.624 ( -0.988 -17.457 -1.022) 17.515 6.958 ( -0.739 -2.964 0.765) 3.149 7.486 ( 7.485 22.745 -0.928) 23.963 7.716 ( -10.802 4.209 1.178) 11.653 8.636 ( -1.540 -12.237 -2.976) 12.688 9.159 ( -0.508 -4.824 1.238) 5.006 9.289 ( 1.096 -9.235 2.043) 9.522 9.896 ( 1.970 -10.460 0.609) 10.661 10.297 ( -1.246 6.092 -0.727) 6.261 10.682 ( -0.303 -10.565 0.442) 10.578 11.669 ( -0.770 16.972 -1.066) 17.023 12.228 ( 3.748 24.033 0.775) 24.336 15.086 ( -0.694 3.251 3.089) 4.538 15.152 ( -5.146 3.407 -3.173) 6.940 16.309 ( -2.196 1.824 0.058) 2.855 16.727 ( -2.546 -0.487 -0.360) 2.617 21.765 ( 0.014 13.896 0.093) 13.896 22.301 ( 0.938 -9.514 0.010) 9.560 ======================= Grid point 24 (18/322) ======================= q-point: (-0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.183 ( -2.333 9.848 -0.536) 10.135 1.764 ( -4.647 24.715 -0.877) 25.163 2.654 ( -0.372 2.117 0.494) 2.205 2.841 ( -0.835 6.514 0.241) 6.572 2.939 ( -0.497 10.201 -0.129) 10.214 3.313 ( 1.900 20.865 0.629) 20.961 3.367 ( -2.673 11.716 -0.287) 12.020 3.649 ( -0.498 12.181 3.376) 12.650 3.672 ( 0.530 0.675 -0.529) 1.008 3.891 ( 4.908 0.778 2.958) 5.783 4.016 ( -3.753 0.892 -4.457) 5.895 4.318 ( -0.317 2.199 0.215) 2.232 4.597 ( -2.083 -2.073 -1.564) 3.329 4.994 ( 3.458 -2.226 0.357) 4.128 5.529 ( 2.542 3.788 -0.687) 4.613 5.566 ( -3.539 6.290 -0.026) 7.217 5.899 ( 0.088 26.617 0.523) 26.622 6.247 ( 3.372 5.126 1.173) 6.246 6.842 ( 3.220 18.365 -0.341) 18.648 7.100 ( 1.515 -11.386 0.368) 11.492 7.223 ( 3.643 -14.486 -0.847) 14.961 7.652 ( -5.535 -1.649 0.310) 5.784 8.883 ( -0.739 -13.096 -2.124) 13.288 9.197 ( -1.441 0.441 0.967) 1.791 9.522 ( 0.403 -12.574 1.175) 12.636 10.130 ( 2.573 -10.774 2.510) 11.357 10.206 ( -2.194 1.414 -2.141) 3.375 10.908 ( 0.712 -9.456 1.475) 9.597 11.356 ( -0.315 13.500 -1.902) 13.637 11.721 ( 0.940 25.859 0.168) 25.876 14.955 ( -4.028 6.365 -0.472) 7.548 15.128 ( -1.215 -1.091 0.232) 1.649 16.298 ( -1.279 -1.506 0.002) 1.976 16.744 ( -1.491 -2.659 -0.112) 3.050 21.436 ( 0.028 19.136 0.023) 19.136 22.501 ( 1.923 -9.312 0.342) 9.514 ======================= Grid point 25 (19/322) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.886 ( -0.000 18.617 -0.000) 18.617 1.207 ( -0.000 29.258 -0.000) 29.258 2.192 ( -0.000 42.283 -0.000) 42.283 2.730 ( -0.000 10.671 -0.000) 10.671 2.780 ( -0.000 0.953 -0.000) 0.953 3.001 ( -0.000 7.349 -0.000) 7.349 3.212 ( -0.000 6.621 -0.000) 6.621 3.397 ( -0.000 12.131 -0.000) 12.131 3.657 ( -0.000 2.350 -0.000) 2.350 3.900 ( -0.000 1.512 -0.000) 1.512 3.975 ( -0.000 1.341 -0.000) 1.341 4.298 ( 0.000 -0.305 0.000) 0.305 4.512 ( -0.000 12.821 -0.000) 12.821 5.033 ( -0.000 0.897 -0.000) 0.897 5.319 ( -0.000 17.486 -0.000) 17.486 5.457 ( -0.000 3.451 -0.000) 3.451 5.476 ( -0.000 8.291 -0.000) 8.291 6.061 ( -0.000 17.684 -0.000) 17.684 6.499 ( -0.000 6.981 -0.000) 6.981 7.338 ( 0.000 -11.044 0.000) 11.044 7.700 ( 0.000 -4.391 0.000) 4.391 7.707 ( 0.000 -26.178 0.000) 26.178 9.097 ( 0.000 -7.850 0.000) 7.850 9.122 ( -0.000 7.057 -0.000) 7.057 9.725 ( 0.000 -6.715 0.000) 6.715 10.227 ( 0.000 -6.902 0.000) 6.902 10.353 ( 0.000 -8.058 0.000) 8.058 10.850 ( -0.000 17.352 -0.000) 17.352 11.122 ( -0.000 9.825 -0.000) 9.825 11.480 ( 0.000 -4.118 0.000) 4.118 14.827 ( -0.000 4.646 -0.000) 4.646 15.155 ( 0.000 -1.823 0.000) 1.823 16.343 ( 0.000 -3.084 0.000) 3.084 16.810 ( 0.000 -4.172 0.000) 4.172 21.038 ( -0.000 20.196 -0.000) 20.196 22.671 ( 0.000 -6.725 0.000) 6.725 ======================= Grid point 28 (20/322) ======================= q-point: ( 0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.512 ( 20.216 0.000 7.997) 21.740 0.750 ( 30.039 0.000 4.101) 30.318 1.465 ( 58.032 0.000 7.779) 58.551 2.446 ( 1.094 0.000 0.459) 1.186 2.727 ( -10.659 -0.000 0.106) 10.660 2.774 ( -0.002 -0.000 -2.563) 2.563 2.995 ( -4.694 -0.000 -0.086) 4.695 3.249 ( 10.836 0.000 -0.202) 10.838 3.308 ( -3.169 -0.000 0.128) 3.172 3.620 ( -8.674 -0.000 -7.351) 11.370 3.724 ( 2.508 0.000 0.685) 2.600 3.989 ( -1.136 -0.000 -0.874) 1.433 4.165 ( 1.910 0.000 -1.090) 2.199 4.423 ( 3.917 0.000 2.343) 4.564 5.090 ( -4.184 -0.000 2.337) 4.793 5.354 ( -9.722 -0.000 -3.170) 10.226 5.538 ( -3.230 -0.000 4.415) 5.470 5.858 ( -1.845 -0.000 -4.304) 4.683 6.429 ( -4.382 -0.000 -2.709) 5.151 7.411 ( -13.699 -0.000 -0.604) 13.713 7.813 ( 0.006 0.000 -8.831) 8.831 8.524 ( 9.343 0.000 0.246) 9.346 8.641 ( 1.205 0.000 -0.528) 1.315 9.514 ( -0.899 -0.000 6.397) 6.460 9.600 ( 1.168 0.000 0.695) 1.359 10.131 ( 3.943 0.000 -20.845) 21.214 10.576 ( -0.604 -0.000 -0.379) 0.713 10.735 ( 3.065 0.000 0.459) 3.099 10.948 ( -11.163 -0.000 6.228) 12.783 11.772 ( 2.616 0.000 4.723) 5.399 15.210 ( 2.838 0.000 -5.327) 6.036 16.059 ( -0.065 -0.000 1.817) 1.818 16.996 ( 6.338 0.000 -0.375) 6.349 18.602 ( -6.237 -0.000 -8.866) 10.840 20.547 ( -0.101 -0.000 -0.038) 0.107 20.811 ( 0.010 0.000 0.001) 0.010 ======================= Grid point 29 (21/322) ======================= q-point: ( 0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.802 ( 16.860 -13.895 5.881) 22.625 1.247 ( 22.352 -22.856 3.804) 32.195 2.051 ( 46.154 -23.848 4.165) 52.118 2.541 ( -1.285 -6.962 0.546) 7.100 2.675 ( -8.015 -2.241 -0.562) 8.341 2.831 ( -1.091 -5.432 -2.181) 5.954 3.046 ( -4.874 -6.153 -0.808) 7.891 3.343 ( 8.734 -3.777 1.125) 9.582 3.469 ( -3.214 -12.083 -0.271) 12.506 3.572 ( -4.928 -4.928 -7.136) 9.975 3.963 ( -1.154 -4.281 3.149) 5.438 4.157 ( -7.606 -19.955 -2.008) 21.449 4.255 ( 0.851 -9.272 -0.434) 9.321 4.514 ( 2.424 -10.098 0.824) 10.418 5.102 ( -2.431 -3.357 0.706) 4.204 5.303 ( -11.319 -2.622 -2.820) 11.956 5.540 ( -6.028 -1.861 4.165) 7.560 5.791 ( -1.275 0.857 -4.353) 4.616 6.343 ( -5.351 5.394 -2.609) 8.033 7.296 ( -13.219 3.634 -0.746) 13.730 7.732 ( -0.511 6.299 -3.035) 7.011 8.294 ( 4.457 18.804 1.039) 19.352 8.886 ( 3.731 -14.832 -0.288) 15.297 9.358 ( 2.823 7.893 6.617) 10.680 9.892 ( -0.466 -16.535 0.479) 16.549 10.037 ( 1.002 7.108 -15.092) 16.712 10.431 ( -1.706 11.039 -0.925) 11.208 10.725 ( 2.214 2.020 1.416) 3.315 10.996 ( -5.872 -9.079 3.519) 11.371 11.708 ( 1.672 8.159 4.605) 9.517 15.202 ( 4.282 2.160 -5.360) 7.192 15.842 ( 12.668 22.246 4.139) 25.933 16.987 ( 9.639 9.704 -0.520) 13.688 17.098 ( 31.300 53.777 4.124) 62.359 20.688 ( -0.140 -13.610 -0.005) 13.611 21.873 ( -29.693 -43.661 -7.208) 53.291 ======================= Grid point 30 (22/322) ======================= q-point: ( 0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( 14.242 -14.031 3.750) 20.341 1.780 ( 18.127 -18.415 3.303) 26.050 2.574 ( -6.280 -2.336 -1.294) 6.825 2.708 ( 5.895 -11.917 -3.039) 13.638 2.830 ( 11.311 -13.490 1.436) 17.663 2.995 ( 3.999 -13.594 -1.725) 14.274 3.171 ( -2.106 -10.090 -0.824) 10.340 3.496 ( 2.037 -8.676 1.565) 9.049 3.599 ( 1.901 -4.435 -1.861) 5.172 3.691 ( 2.870 -5.983 -3.295) 7.409 4.037 ( 0.297 -3.841 3.258) 5.045 4.298 ( -1.813 -1.661 0.407) 2.492 4.572 ( -0.976 -14.393 0.838) 14.450 4.814 ( -0.185 -12.657 1.135) 12.709 5.229 ( -3.898 -10.669 1.333) 11.437 5.370 ( -6.077 -14.085 -3.267) 15.684 5.545 ( -8.116 -2.716 -0.237) 8.562 5.937 ( -7.149 -20.422 -2.852) 21.824 6.154 ( -10.567 7.554 -0.741) 13.011 7.088 ( -12.623 9.898 -1.722) 16.134 7.572 ( 4.375 10.742 0.984) 11.641 7.994 ( 4.704 11.856 1.401) 12.831 9.116 ( -0.297 -0.625 5.510) 5.554 9.265 ( 5.173 0.294 -0.487) 5.204 9.789 ( 2.402 15.591 -7.253) 17.362 10.147 ( -5.998 1.600 -3.622) 7.187 10.250 ( 2.621 -2.505 0.012) 3.625 10.733 ( -2.010 -4.272 0.148) 4.723 11.227 ( -2.094 -15.780 1.914) 16.033 11.515 ( -0.074 10.816 3.717) 11.437 15.165 ( 5.621 3.265 -4.351) 7.823 15.556 ( 17.375 13.978 4.149) 22.682 16.585 ( 12.802 15.512 0.897) 20.132 16.957 ( 7.275 5.022 0.385) 8.848 21.034 ( -0.168 -20.197 0.002) 20.198 22.231 ( -16.282 -13.066 -3.608) 21.186 ======================= Grid point 31 (23/322) ======================= q-point: ( 0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( 12.835 -6.309 1.505) 14.380 2.194 ( 12.731 -13.479 1.730) 18.622 2.537 ( -7.226 0.775 -1.023) 7.339 2.852 ( -2.468 -5.748 -2.882) 6.887 3.058 ( 5.516 -7.265 -1.212) 9.202 3.235 ( -1.369 -8.858 -0.463) 8.975 3.438 ( 0.760 -12.344 -3.900) 12.967 3.582 ( -4.127 0.930 -2.271) 4.802 3.726 ( 5.036 -8.058 -1.309) 9.592 4.006 ( 18.900 -17.453 4.673) 26.146 4.134 ( 0.739 -5.120 3.260) 6.115 4.300 ( -2.057 -0.341 -1.759) 2.727 4.691 ( -1.496 -1.549 2.637) 3.405 4.888 ( -3.914 2.016 1.679) 4.712 5.337 ( -4.544 -4.980 2.262) 7.111 5.569 ( -8.757 -5.193 -2.354) 10.450 5.850 ( -4.174 -11.427 -0.531) 12.177 5.907 ( -6.884 -7.546 -2.200) 10.449 6.497 ( -11.942 -35.365 -0.666) 37.333 6.796 ( -8.444 10.357 -0.748) 13.384 7.372 ( 9.949 12.842 0.599) 16.256 7.931 ( 4.884 -1.478 1.303) 5.266 8.946 ( -2.703 12.628 5.733) 14.129 9.340 ( 1.814 -0.190 -4.208) 4.586 9.456 ( 4.788 17.409 -3.471) 18.386 9.954 ( -4.001 8.478 -3.062) 9.862 10.322 ( 1.193 0.495 2.985) 3.252 10.834 ( -1.040 -0.703 -2.523) 2.818 11.384 ( -1.688 -6.406 4.086) 7.783 11.613 ( -3.701 -20.713 -0.919) 21.062 15.145 ( 5.542 1.418 -3.543) 6.729 15.479 ( 12.550 4.825 3.147) 13.809 16.455 ( 6.776 4.697 0.330) 8.251 16.908 ( 5.751 3.814 0.572) 6.925 21.432 ( -0.114 -19.209 -0.090) 19.209 22.294 ( -6.862 -1.772 -1.181) 7.185 ======================= Grid point 32 (24/322) ======================= q-point: ( 0.46 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( 10.576 7.891 -0.708) 13.214 2.370 ( -0.597 2.349 -1.400) 2.799 2.555 ( 3.628 -6.952 0.855) 7.889 2.936 ( -3.379 -5.181 -0.408) 6.199 3.208 ( 6.855 -4.559 -2.830) 8.706 3.388 ( -2.846 -7.565 1.089) 8.155 3.538 ( -2.800 -0.339 -1.999) 3.457 3.635 ( 1.907 -7.878 -3.667) 8.897 3.887 ( 1.922 -6.307 0.913) 6.656 4.221 ( 3.542 0.057 1.308) 3.777 4.295 ( -3.741 -3.718 -0.833) 5.340 4.387 ( 11.061 -5.791 1.026) 12.527 4.760 ( -0.660 -0.465 6.354) 6.405 4.774 ( -6.368 -2.858 -1.037) 7.056 5.411 ( 0.993 -2.952 2.486) 3.985 5.619 ( -12.972 -3.001 -0.706) 13.334 5.667 ( -10.728 0.858 -1.412) 10.854 6.200 ( -0.769 -2.472 -0.299) 2.606 6.700 ( 0.005 -4.623 0.293) 4.632 7.013 ( 0.680 -9.570 0.299) 9.599 7.306 ( 3.005 -10.728 -1.729) 11.275 8.055 ( 5.455 -6.795 1.154) 8.790 8.658 ( -7.311 13.501 1.170) 15.398 9.123 ( 3.045 14.734 -0.394) 15.050 9.317 ( 3.565 6.075 -3.287) 7.773 9.789 ( -2.469 6.262 -0.319) 6.739 10.334 ( -1.039 -3.250 1.360) 3.673 10.691 ( 0.295 10.082 -0.597) 10.104 11.719 ( 0.871 -22.167 1.100) 22.212 11.989 ( -6.543 -19.491 -1.210) 20.596 15.155 ( 4.663 0.465 -2.810) 5.464 15.480 ( 7.727 2.256 2.390) 8.397 16.464 ( 5.770 -1.493 0.398) 5.974 16.873 ( 3.358 2.827 0.589) 4.429 21.763 ( -0.016 -13.998 -0.180) 13.999 22.243 ( -1.694 3.731 0.015) 4.097 ======================= Grid point 33 (25/322) ======================= q-point: ( 0.54 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( 7.282 19.794 -1.206) 21.126 2.263 ( -1.490 5.472 -0.894) 5.741 2.691 ( 1.189 -3.449 0.243) 3.656 3.018 ( -2.151 -4.384 0.950) 4.974 3.312 ( 9.122 -1.875 -3.298) 9.879 3.486 ( -3.037 -4.833 0.411) 5.723 3.576 ( -0.109 -3.615 0.286) 3.628 3.779 ( 3.867 -5.524 -2.086) 7.058 3.998 ( -2.451 -4.643 2.272) 5.721 4.178 ( 2.557 4.194 -0.613) 4.950 4.364 ( -2.684 -3.931 -0.077) 4.761 4.448 ( 2.404 0.373 -0.065) 2.434 4.597 ( -9.024 6.059 -0.032) 10.870 4.999 ( 1.973 -9.082 2.455) 9.612 5.463 ( 6.617 0.102 1.994) 6.912 5.559 ( -13.485 -4.418 1.734) 14.295 5.711 ( -9.138 -5.730 -2.962) 11.185 6.158 ( 2.319 3.467 0.965) 4.281 6.786 ( 3.111 -0.744 0.499) 3.237 7.000 ( 8.151 5.710 -0.724) 9.978 7.669 ( -0.752 -17.109 -0.894) 17.149 8.250 ( 3.953 -9.557 1.067) 10.397 8.352 ( -12.211 11.129 -2.281) 16.678 8.887 ( 7.287 12.510 2.143) 14.635 9.190 ( -0.147 6.478 -2.289) 6.872 9.659 ( -1.741 5.678 0.763) 5.988 10.462 ( -1.052 -9.059 0.534) 9.136 10.542 ( 0.097 4.168 -0.600) 4.212 12.124 ( 1.821 -14.774 -0.079) 14.886 12.299 ( -5.605 -16.963 -0.530) 17.873 15.164 ( 3.512 0.800 -1.608) 3.945 15.472 ( 3.708 2.415 1.299) 4.612 16.555 ( 5.346 -3.383 0.478) 6.344 16.825 ( 0.091 3.331 0.332) 3.349 21.978 ( 0.038 -7.855 -0.134) 7.857 22.146 ( 0.223 5.246 0.281) 5.258 ======================= Grid point 34 (26/322) ======================= q-point: ( 0.62 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.953 ( 4.201 16.171 0.024) 16.707 2.177 ( -0.469 1.696 -0.196) 1.770 2.705 ( -1.694 1.362 0.245) 2.187 3.066 ( -2.716 -1.481 0.669) 3.165 3.389 ( 9.741 -0.612 -2.466) 10.067 3.571 ( 0.693 -3.643 0.267) 3.718 3.633 ( 1.040 -2.071 1.725) 2.889 3.894 ( 4.370 -3.824 0.266) 5.813 4.021 ( -5.495 0.648 0.425) 5.550 4.133 ( 2.771 1.570 1.158) 3.389 4.407 ( -0.612 -0.073 -0.606) 0.864 4.428 ( -10.018 1.311 -4.448) 11.039 4.451 ( -1.213 1.663 1.764) 2.710 5.108 ( -0.689 -1.644 0.805) 1.956 5.512 ( 7.101 -0.390 1.346) 7.238 5.636 ( -5.983 -8.569 1.563) 10.568 5.740 ( -8.523 -3.046 -2.673) 9.438 6.137 ( 3.460 0.573 1.164) 3.695 6.792 ( 5.171 1.501 0.415) 5.400 6.935 ( 5.692 4.992 -0.792) 7.612 7.896 ( 1.455 -4.476 -0.164) 4.710 8.095 ( -14.053 4.914 -2.871) 15.162 8.432 ( 0.118 -4.715 1.078) 4.839 8.752 ( 10.215 4.196 2.313) 11.283 9.082 ( -1.912 3.098 -1.002) 3.776 9.569 ( -0.787 2.106 0.233) 2.260 10.511 ( 0.071 -0.116 -0.105) 0.171 10.612 ( -0.735 -4.841 0.023) 4.896 12.273 ( -3.058 -2.032 -1.107) 3.835 12.593 ( 1.591 -11.851 0.714) 11.979 15.158 ( 2.077 1.301 -0.320) 2.471 15.432 ( 1.066 3.134 0.312) 3.324 16.614 ( 3.472 1.859 0.188) 3.943 16.755 ( -2.534 1.797 0.037) 3.107 22.060 ( 0.214 2.953 0.273) 2.973 22.079 ( 0.031 -2.313 -0.201) 2.322 ======================= Grid point 35 (27/322) ======================= q-point: (-0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 0.459 -6.050 1.102) 6.167 2.214 ( 0.644 -5.506 0.226) 5.548 2.633 ( -1.826 4.901 0.321) 5.240 3.053 ( -2.816 0.934 0.604) 3.028 3.412 ( 5.374 3.461 -1.489) 6.563 3.597 ( -0.086 0.111 0.796) 0.808 3.709 ( 7.769 -1.568 1.993) 8.172 3.939 ( 0.462 4.694 0.643) 4.761 3.980 ( -1.382 -2.937 0.546) 3.291 4.110 ( -0.895 2.547 1.567) 3.122 4.278 ( -8.324 4.191 -3.626) 10.000 4.437 ( -1.386 -0.088 1.330) 1.923 4.442 ( -1.648 -1.716 -3.172) 3.966 5.081 ( -0.193 3.587 0.224) 3.599 5.554 ( 6.347 0.233 0.898) 6.414 5.713 ( -6.885 -1.482 -1.115) 7.130 5.855 ( -0.652 -13.571 -0.288) 13.590 6.167 ( 2.518 -1.392 0.824) 2.992 6.777 ( 9.374 6.771 -0.102) 11.564 6.890 ( -1.031 -0.922 -0.123) 1.389 7.811 ( -8.594 5.718 -0.835) 10.356 8.045 ( -1.662 0.579 -0.229) 1.775 8.421 ( 0.325 2.157 -0.178) 2.189 8.881 ( 7.498 -8.247 2.028) 11.329 9.053 ( -2.739 -1.672 -0.204) 3.216 9.584 ( -0.027 -3.907 -0.336) 3.921 10.515 ( 0.265 -0.042 -0.206) 0.338 10.611 ( -0.662 4.506 0.277) 4.563 12.199 ( -2.739 7.129 -0.900) 7.690 12.733 ( 3.205 -0.126 0.809) 3.308 15.139 ( 0.798 1.401 0.593) 1.718 15.360 ( -0.667 4.466 -0.448) 4.538 16.513 ( -0.723 7.226 -0.084) 7.262 16.739 ( -1.357 0.010 -0.130) 1.363 22.044 ( -0.125 -1.765 -0.154) 1.776 22.079 ( -0.042 2.417 0.105) 2.419 ======================= Grid point 36 (28/322) ======================= q-point: (-0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.086 ( -1.092 -12.920 0.531) 12.977 2.378 ( 2.166 -8.719 0.244) 8.987 2.479 ( -2.550 9.494 0.148) 9.831 3.006 ( -1.635 2.458 0.485) 2.992 3.309 ( 0.976 8.012 -0.610) 8.095 3.590 ( 1.320 1.755 0.605) 2.278 3.729 ( 3.974 4.014 0.910) 5.721 3.884 ( 4.934 1.264 3.814) 6.363 3.981 ( -1.430 3.816 -3.099) 5.120 4.016 ( -5.478 4.017 1.583) 6.975 4.146 ( -4.211 5.414 -2.425) 7.275 4.430 ( 0.001 1.564 1.237) 1.994 4.460 ( -1.876 -2.490 -2.945) 4.289 4.998 ( 1.008 4.026 0.218) 4.156 5.582 ( 3.871 0.234 0.452) 3.904 5.698 ( -3.768 -0.209 -0.685) 3.835 6.180 ( 2.014 -18.278 -0.250) 18.390 6.224 ( 1.404 -3.239 0.184) 3.535 6.626 ( 3.236 10.979 0.044) 11.446 6.933 ( -0.225 -1.848 0.177) 1.870 7.678 ( -4.331 3.213 -0.320) 5.402 7.924 ( -0.130 12.214 0.435) 12.222 8.445 ( -0.202 -5.330 -0.980) 5.423 9.068 ( 3.225 -5.206 0.836) 6.181 9.126 ( -1.734 -7.916 0.600) 8.126 9.711 ( 0.351 -8.542 -0.245) 8.553 10.455 ( -0.186 9.430 -0.290) 9.436 10.540 ( -0.187 -3.416 0.330) 3.437 11.974 ( -1.088 13.902 -0.462) 13.952 12.622 ( 2.126 13.133 0.478) 13.312 15.119 ( 0.225 0.935 0.966) 1.363 15.243 ( -1.527 6.517 -0.921) 6.756 16.374 ( -1.054 5.607 -0.021) 5.705 16.721 ( -1.012 0.774 -0.166) 1.285 21.979 ( 0.002 7.795 0.036) 7.795 22.132 ( -0.067 -7.055 -0.077) 7.055 ======================= Grid point 37 (29/322) ======================= q-point: (-0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.251 ( 0.000 -2.733 0.000) 2.733 2.185 ( -0.000 18.450 -0.000) 18.450 2.571 ( 0.000 -8.012 0.000) 8.012 2.939 ( -0.000 3.919 -0.000) 3.919 3.133 ( -0.000 9.554 -0.000) 9.554 3.509 ( -0.000 6.841 -0.000) 6.841 3.680 ( -0.000 1.083 -0.000) 1.083 3.759 ( -0.000 16.782 -0.000) 16.782 3.884 ( -0.000 7.921 -0.000) 7.921 3.927 ( -0.000 1.703 -0.000) 1.703 4.016 ( -0.000 3.210 -0.000) 3.210 4.377 ( -0.000 3.341 -0.000) 3.341 4.519 ( 0.000 -4.019 0.000) 4.019 4.966 ( 0.000 -0.545 0.000) 0.545 5.584 ( -0.000 1.059 -0.000) 1.059 5.657 ( -0.000 3.519 -0.000) 3.519 6.237 ( -0.000 5.700 -0.000) 5.700 6.400 ( -0.000 8.698 -0.000) 8.698 6.620 ( 0.000 -21.416 0.000) 21.416 6.954 ( 0.000 -2.548 0.000) 2.548 7.548 ( -0.000 24.786 -0.000) 24.786 7.632 ( -0.000 0.828 -0.000) 0.828 8.621 ( 0.000 -12.019 0.000) 12.019 9.157 ( 0.000 -3.552 0.000) 3.552 9.300 ( 0.000 -9.767 0.000) 9.767 9.909 ( 0.000 -11.118 0.000) 11.118 10.288 ( -0.000 6.601 -0.000) 6.601 10.681 ( 0.000 -10.647 0.000) 10.647 11.662 ( -0.000 16.574 -0.000) 16.574 12.252 ( -0.000 24.402 -0.000) 24.402 15.091 ( -0.000 7.826 -0.000) 7.826 15.112 ( 0.000 -0.092 0.000) 0.092 16.296 ( -0.000 1.826 -0.000) 1.826 16.710 ( 0.000 -0.346 0.000) 0.346 21.766 ( -0.000 13.888 -0.000) 13.888 22.307 ( 0.000 -10.081 0.000) 10.081 ======================= Grid point 42 (30/322) ======================= q-point: ( 0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.780 ( 21.343 0.000 6.833) 22.410 1.109 ( 28.736 0.000 3.873) 28.996 2.145 ( 53.426 0.000 4.235) 53.594 2.458 ( 0.480 0.000 0.722) 0.866 2.579 ( -14.326 -0.000 0.624) 14.340 2.765 ( -0.078 -0.000 -3.298) 3.299 2.929 ( -6.149 -0.000 -0.487) 6.169 3.266 ( -3.985 -0.000 0.402) 4.005 3.395 ( 10.965 0.000 3.906) 11.640 3.514 ( -3.162 -0.000 -7.399) 8.046 3.758 ( 2.792 0.000 0.785) 2.900 3.967 ( -1.722 -0.000 -1.125) 2.057 4.176 ( 0.205 0.000 0.036) 0.208 4.464 ( 1.534 0.000 1.643) 2.248 5.058 ( -1.700 -0.000 -3.348) 3.755 5.207 ( -12.393 -0.000 0.183) 12.394 5.505 ( -5.617 -0.000 4.663) 7.300 5.781 ( -9.119 -0.000 -5.281) 10.538 6.377 ( -2.357 -0.000 -3.844) 4.509 7.243 ( -13.931 -0.000 -0.656) 13.947 7.785 ( -1.385 -0.000 -3.940) 4.176 8.632 ( 8.507 0.000 0.250) 8.511 8.655 ( 1.452 0.000 -0.608) 1.574 9.518 ( -1.323 -0.000 4.349) 4.546 9.618 ( 1.508 0.000 0.806) 1.710 10.133 ( 4.917 0.000 -10.652) 11.732 10.567 ( -0.743 -0.000 -0.459) 0.873 10.766 ( 1.543 0.000 1.406) 2.087 10.828 ( -10.986 -0.000 2.095) 11.184 11.807 ( 0.549 0.000 4.555) 4.588 15.244 ( 5.844 0.000 -5.797) 8.232 16.056 ( -1.245 -0.000 0.698) 1.427 17.086 ( 9.092 0.000 0.009) 9.092 18.481 ( -9.787 -0.000 -8.003) 12.642 20.545 ( -0.121 -0.000 -0.046) 0.130 20.812 ( 0.011 0.000 0.001) 0.011 ======================= Grid point 43 (31/322) ======================= q-point: ( 0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( 19.450 -10.830 5.269) 22.877 1.521 ( 22.230 -19.077 3.370) 29.487 2.472 ( -11.167 -2.092 -0.511) 11.373 2.530 ( 15.561 -9.323 -1.418) 18.195 2.656 ( 21.151 -12.197 2.511) 24.545 2.819 ( 0.899 -6.116 -2.790) 6.782 2.978 ( -5.570 -7.309 -1.287) 9.279 3.400 ( -1.733 -2.179 2.666) 3.855 3.439 ( -1.755 -12.731 0.849) 12.879 3.589 ( 12.425 -5.768 -3.257) 14.080 3.968 ( 0.873 -4.802 1.589) 5.133 4.091 ( -3.667 -18.851 0.512) 19.212 4.256 ( -0.449 -9.308 -0.121) 9.319 4.536 ( 0.693 -9.079 0.191) 9.107 5.062 ( -5.848 -3.765 -7.364) 10.130 5.168 ( -7.872 -2.600 3.463) 8.985 5.467 ( -8.436 0.212 3.155) 9.009 5.701 ( -11.586 -0.914 -4.205) 12.359 6.288 ( -2.236 7.082 -2.994) 8.007 7.135 ( -13.137 3.309 -1.302) 13.610 7.725 ( 0.400 4.290 -1.128) 4.454 8.345 ( 3.511 18.470 0.955) 18.825 8.935 ( 4.296 -13.410 0.021) 14.082 9.400 ( 0.982 7.040 5.459) 8.963 9.849 ( -3.761 -14.543 -5.449) 15.979 10.068 ( 7.477 7.344 -4.332) 11.340 10.406 ( -1.723 10.783 -1.062) 10.971 10.742 ( -0.919 2.685 2.899) 4.057 10.931 ( -5.552 -12.120 0.340) 13.336 11.728 ( -0.568 8.266 3.877) 9.147 15.251 ( 6.881 2.204 -5.134) 8.864 15.930 ( 2.698 11.778 1.456) 12.171 17.091 ( 9.300 5.631 0.093) 10.873 17.412 ( 18.878 57.276 0.770) 60.312 20.686 ( -0.148 -13.594 -0.005) 13.595 21.566 ( -19.599 -42.829 -4.761) 47.341 ======================= Grid point 44 (32/322) ======================= q-point: ( 0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( 16.726 -11.771 3.240) 20.708 1.990 ( 15.797 -15.804 2.591) 22.495 2.451 ( -12.485 -3.100 -0.610) 12.879 2.706 ( -2.326 -7.602 -2.857) 8.448 2.921 ( 2.430 -8.313 -0.663) 8.686 3.078 ( 5.307 -7.560 -2.907) 9.684 3.170 ( 5.260 -14.801 -3.096) 16.010 3.514 ( 0.021 -6.898 -0.234) 6.902 3.606 ( 2.270 -5.869 0.989) 6.370 3.844 ( 20.582 -11.292 3.970) 23.810 4.052 ( 1.468 -3.603 1.603) 4.208 4.273 ( -2.622 -2.317 0.924) 3.619 4.572 ( 0.284 -14.786 1.927) 14.913 4.792 ( -3.917 -9.994 -0.777) 10.762 5.201 ( -1.663 -8.992 -0.594) 9.163 5.271 ( -8.589 -20.344 -2.154) 22.188 5.429 ( -10.099 -3.167 -0.966) 10.628 5.793 ( -15.586 -21.015 -1.370) 26.200 6.075 ( -2.896 11.830 -1.123) 12.231 6.937 ( -11.465 8.710 -2.062) 14.545 7.644 ( 7.076 6.694 1.054) 9.798 8.038 ( 1.965 11.995 1.519) 12.250 9.132 ( -0.011 1.654 5.890) 6.118 9.297 ( 1.003 -0.070 -2.976) 3.141 9.803 ( 3.913 13.523 -6.069) 15.330 10.075 ( -4.749 3.826 -1.948) 6.402 10.294 ( 4.713 -3.875 0.410) 6.116 10.703 ( -3.667 -2.329 1.573) 4.620 11.201 ( -2.426 -17.174 0.157) 17.346 11.516 ( -1.536 11.678 2.933) 12.138 15.226 ( 6.779 3.385 -3.906) 8.524 15.717 ( 8.425 11.331 2.264) 14.300 16.741 ( 12.356 21.592 0.701) 24.887 17.048 ( 7.630 6.509 0.664) 10.051 21.032 ( -0.158 -20.198 0.004) 20.198 22.044 ( -13.192 -18.821 -2.901) 23.166 ======================= Grid point 45 (33/322) ======================= q-point: ( 0.46 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 13.976 -4.216 1.069) 14.637 2.324 ( 7.563 -8.978 0.453) 11.748 2.441 ( -7.872 -3.531 0.055) 8.627 2.815 ( -2.009 -5.699 -2.366) 6.489 3.111 ( 3.931 -8.655 -1.274) 9.590 3.225 ( 0.012 -7.272 -0.071) 7.273 3.441 ( 1.680 -11.598 -3.365) 12.193 3.525 ( -3.988 0.773 -2.141) 4.592 3.787 ( 5.618 -6.596 -0.407) 8.673 4.134 ( -2.472 -6.285 2.118) 7.078 4.271 ( -1.285 0.253 -1.132) 1.731 4.286 ( 24.278 -13.834 5.642) 28.506 4.675 ( -2.654 -0.547 1.688) 3.192 4.818 ( -7.442 2.257 0.886) 7.827 5.303 ( -3.177 -5.388 2.205) 6.633 5.420 ( -14.398 -6.612 -4.267) 16.408 5.783 ( -4.963 8.763 1.212) 10.144 5.872 ( -0.047 -25.902 -1.389) 25.939 6.365 ( -9.838 -38.309 -1.241) 39.572 6.707 ( -6.177 6.782 -0.906) 9.218 7.501 ( 11.307 12.670 0.717) 16.997 7.972 ( 1.189 -3.198 1.364) 3.675 8.910 ( -5.218 15.010 2.832) 16.142 9.323 ( -0.847 2.382 -3.560) 4.366 9.539 ( 8.495 14.460 -1.482) 16.836 9.905 ( -2.748 7.357 -2.189) 8.153 10.335 ( -0.489 2.290 2.573) 3.479 10.818 ( -0.606 -2.879 -1.568) 3.334 11.372 ( -2.034 -5.777 2.687) 6.688 11.570 ( -2.939 -19.498 -0.828) 19.736 15.203 ( 5.754 1.985 -2.826) 6.710 15.606 ( 7.528 5.674 1.992) 9.636 16.538 ( 6.809 6.394 0.502) 9.354 16.972 ( 4.574 4.963 0.524) 6.770 21.431 ( -0.094 -19.240 -0.072) 19.241 22.217 ( -5.378 -5.567 -0.914) 7.795 ======================= Grid point 46 (34/322) ======================= q-point: ( 0.54 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 9.354 10.216 -0.576) 13.863 2.339 ( -3.214 2.757 -1.161) 4.391 2.589 ( 0.962 -7.498 0.859) 7.608 2.916 ( 0.222 -5.333 -0.494) 5.361 3.291 ( 8.025 -6.182 -2.185) 10.363 3.356 ( -2.611 -6.011 0.969) 6.625 3.508 ( -1.421 -1.983 -1.119) 2.683 3.653 ( 2.803 -9.031 -2.712) 9.837 3.903 ( -0.640 -3.835 1.734) 4.257 4.228 ( -5.066 -2.935 -1.595) 6.068 4.266 ( 3.336 -1.734 1.025) 3.897 4.504 ( 5.442 2.668 0.999) 6.142 4.665 ( -7.392 4.978 -0.956) 8.963 4.817 ( 5.886 -10.713 5.256) 13.306 5.387 ( -7.297 -5.303 2.040) 9.249 5.474 ( -11.127 -6.487 -4.016) 13.491 5.589 ( -0.662 4.651 1.159) 4.839 6.199 ( 0.320 -3.514 0.085) 3.529 6.694 ( -0.677 -7.115 -0.040) 7.147 7.006 ( -1.595 -23.682 0.137) 23.736 7.373 ( 7.813 1.323 -0.759) 7.960 8.103 ( 1.986 -7.638 1.045) 7.961 8.555 ( -8.745 15.897 -1.085) 18.176 9.177 ( 4.740 11.126 2.091) 12.273 9.342 ( 2.169 9.597 -3.469) 10.433 9.766 ( -1.282 5.947 0.012) 6.083 10.320 ( -1.761 -3.174 0.969) 3.757 10.692 ( 0.123 10.031 -0.380) 10.039 11.731 ( 0.643 -24.421 0.573) 24.436 11.920 ( -4.536 -17.519 -0.784) 18.114 15.202 ( 4.274 1.028 -1.892) 4.786 15.557 ( 4.207 3.656 1.381) 5.742 16.533 ( 5.216 -1.342 0.532) 5.412 16.904 ( 1.603 4.121 0.345) 4.435 21.763 ( -0.008 -14.036 -0.126) 14.036 22.226 ( -1.163 2.016 0.018) 2.327 ======================= Grid point 47 (35/322) ======================= q-point: ( 0.62 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.382 ( 4.773 21.049 -0.548) 21.590 2.246 ( -0.983 4.774 -0.523) 4.902 2.687 ( -1.291 -2.582 0.290) 2.901 3.008 ( -0.255 -3.447 0.041) 3.457 3.412 ( 6.289 -1.947 -1.556) 6.765 3.475 ( 3.199 -6.794 -0.501) 7.526 3.573 ( -1.044 -4.064 1.336) 4.404 3.818 ( 3.726 -5.894 -1.938) 7.237 3.946 ( -7.538 -3.105 2.021) 8.399 4.216 ( 4.361 2.238 -0.172) 4.905 4.341 ( -0.745 -3.193 0.117) 3.281 4.436 ( -5.500 3.067 -1.166) 6.404 4.519 ( -2.438 5.347 0.389) 5.889 5.032 ( 2.392 -6.172 1.895) 6.885 5.448 ( -5.881 -6.400 1.907) 8.899 5.528 ( 1.105 -2.820 -1.360) 3.320 5.600 ( -5.391 -4.569 -0.745) 7.106 6.186 ( 1.650 2.304 0.701) 2.919 6.803 ( 0.334 -2.239 0.180) 2.271 7.104 ( 8.044 6.074 0.060) 10.080 7.668 ( 0.649 -18.402 -0.572) 18.422 8.200 ( -10.392 11.703 -2.137) 15.796 8.287 ( 1.557 -7.550 0.793) 7.750 8.991 ( 8.036 11.790 2.899) 14.560 9.166 ( -2.658 6.861 -2.580) 7.797 9.644 ( -1.118 5.477 0.443) 5.607 10.451 ( -0.885 -9.383 0.216) 9.427 10.542 ( 0.043 4.274 -0.255) 4.281 12.132 ( -0.121 -11.187 -0.657) 11.207 12.254 ( -2.017 -21.250 0.258) 21.348 15.198 ( 2.572 1.327 -0.856) 3.018 15.506 ( 1.625 3.439 0.630) 3.855 16.617 ( 4.403 -3.260 0.448) 5.497 16.817 ( -1.337 4.977 0.065) 5.154 21.978 ( 0.026 -7.878 -0.077) 7.879 22.149 ( 0.126 4.904 0.161) 4.909 ======================= Grid point 48 (36/322) ======================= q-point: (-0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.991 ( 1.754 17.123 0.096) 17.213 2.172 ( -0.178 1.255 -0.068) 1.269 2.689 ( -0.846 1.474 0.128) 1.704 3.044 ( -1.051 -0.764 0.075) 1.301 3.469 ( 3.698 -0.473 -0.825) 3.818 3.580 ( 0.513 -1.682 -0.209) 1.771 3.677 ( 4.680 -6.061 1.617) 7.826 3.892 ( -5.062 -1.186 -0.813) 5.262 3.983 ( 0.400 -3.602 0.443) 3.651 4.187 ( 5.552 4.669 2.343) 7.624 4.299 ( -8.762 3.171 -3.259) 9.872 4.406 ( 0.223 -1.908 -0.251) 1.937 4.444 ( -0.643 2.049 0.433) 2.191 5.106 ( 0.069 -0.977 0.427) 1.069 5.583 ( 4.099 -1.084 -0.379) 4.257 5.595 ( -1.329 -9.473 1.642) 9.706 5.644 ( -5.956 -3.833 -1.375) 7.215 6.168 ( 1.235 0.362 0.452) 1.364 6.822 ( 0.673 -0.775 0.180) 1.042 7.010 ( 4.893 7.365 -0.231) 8.845 7.902 ( -0.975 4.946 -0.040) 5.041 7.965 ( -4.915 -4.383 -1.238) 6.701 8.434 ( -0.061 -3.848 0.480) 3.879 8.853 ( 4.991 3.972 1.196) 6.490 9.053 ( -1.889 2.865 -0.704) 3.503 9.562 ( -0.341 1.790 0.073) 1.823 10.511 ( 0.046 -0.193 -0.058) 0.206 10.605 ( -0.350 -4.915 0.029) 4.927 12.242 ( -1.363 -1.461 -0.479) 2.055 12.610 ( 0.798 -13.250 0.312) 13.278 15.177 ( 0.955 1.733 -0.092) 1.981 15.441 ( 0.312 3.854 0.094) 3.868 16.656 ( 3.221 5.464 0.153) 6.345 16.720 ( -2.953 -0.138 -0.071) 2.957 22.062 ( 0.081 3.237 0.107) 3.239 22.079 ( 0.008 -2.419 -0.080) 2.421 ======================= Grid point 49 (37/322) ======================= q-point: (-0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.865 ( 0.000 -5.084 0.000) 5.084 2.219 ( 0.000 -5.981 0.000) 5.981 2.623 ( -0.000 5.108 -0.000) 5.108 3.036 ( -0.000 1.051 -0.000) 1.051 3.440 ( -0.000 4.534 -0.000) 4.534 3.599 ( 0.000 -0.592 0.000) 0.592 3.823 ( 0.000 -5.406 0.000) 5.406 3.837 ( -0.000 3.481 -0.000) 3.481 4.049 ( 0.000 -0.967 0.000) 0.967 4.082 ( -0.000 6.149 -0.000) 6.149 4.209 ( -0.000 3.452 -0.000) 3.452 4.423 ( 0.000 -0.328 0.000) 0.328 4.438 ( 0.000 -0.838 0.000) 0.838 5.082 ( -0.000 3.301 -0.000) 3.301 5.605 ( -0.000 0.435 -0.000) 0.435 5.657 ( 0.000 -1.891 0.000) 1.891 5.850 ( 0.000 -14.821 0.000) 14.821 6.183 ( 0.000 -1.381 0.000) 1.381 6.855 ( -0.000 9.973 -0.000) 9.973 6.869 ( 0.000 -3.519 0.000) 3.519 7.747 ( -0.000 5.732 -0.000) 5.732 8.041 ( -0.000 0.149 -0.000) 0.149 8.423 ( -0.000 2.146 -0.000) 2.146 8.936 ( 0.000 -8.494 0.000) 8.494 9.028 ( 0.000 -0.971 0.000) 0.971 9.583 ( 0.000 -4.040 0.000) 4.040 10.516 ( 0.000 -0.103 0.000) 0.103 10.607 ( -0.000 4.561 -0.000) 4.561 12.181 ( -0.000 7.036 -0.000) 7.036 12.754 ( 0.000 -0.554 0.000) 0.554 15.145 ( -0.000 1.577 -0.000) 1.577 15.355 ( -0.000 5.048 -0.000) 5.048 16.509 ( -0.000 7.979 -0.000) 7.979 16.730 ( -0.000 0.010 -0.000) 0.010 22.043 ( 0.000 -1.699 0.000) 1.699 22.079 ( -0.000 2.440 -0.000) 2.440 ======================= Grid point 56 (38/322) ======================= q-point: ( 0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( 22.439 0.000 5.304) 23.057 1.448 ( 26.799 0.000 3.533) 27.031 2.382 ( -17.187 -0.000 -0.432) 17.192 2.453 ( -2.220 -0.000 0.683) 2.323 2.740 ( 42.945 0.000 -1.264) 42.963 2.750 ( -0.981 -0.000 -2.852) 3.016 2.855 ( -5.348 -0.000 -1.427) 5.535 3.220 ( -4.018 -0.000 0.701) 4.079 3.413 ( -2.796 -0.000 2.828) 3.977 3.626 ( 16.675 0.000 2.835) 16.914 3.792 ( 2.473 0.000 0.711) 2.573 3.953 ( 0.858 0.000 -0.917) 1.256 4.173 ( -0.493 -0.000 -0.165) 0.520 4.467 ( -1.357 -0.000 0.539) 1.460 4.976 ( -9.411 -0.000 -8.193) 12.477 5.129 ( -1.724 -0.000 4.343) 4.672 5.430 ( -8.992 -0.000 2.895) 9.446 5.610 ( -16.743 -0.000 -5.312) 17.565 6.353 ( 0.133 0.000 -3.542) 3.545 7.088 ( -11.697 -0.000 -0.582) 11.712 7.759 ( -1.391 -0.000 -1.614) 2.131 8.670 ( 1.352 0.000 -0.571) 1.467 8.721 ( 6.413 0.000 0.228) 6.417 9.508 ( -2.088 -0.000 2.671) 3.390 9.639 ( 1.523 0.000 0.724) 1.686 10.184 ( 7.584 0.000 -4.997) 9.082 10.557 ( -0.716 -0.000 -0.434) 0.837 10.707 ( -10.157 -0.000 1.574) 10.278 10.779 ( -0.102 -0.000 0.568) 0.577 11.812 ( -1.570 -0.000 3.313) 3.666 15.312 ( 8.216 0.000 -4.790) 9.511 16.032 ( -2.903 -0.000 -0.004) 2.903 17.207 ( 11.033 0.000 0.791) 11.061 18.328 ( -11.963 -0.000 -7.296) 14.013 20.544 ( -0.114 -0.000 -0.043) 0.122 20.812 ( 0.011 0.000 0.001) 0.011 ======================= Grid point 57 (39/322) ======================= q-point: ( 0.38 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 20.974 -8.536 4.030) 23.000 1.788 ( 21.182 -14.784 2.956) 25.999 2.295 ( -17.178 -2.810 -0.256) 17.408 2.523 ( -5.272 -7.556 -0.664) 9.237 2.787 ( -0.774 -5.051 -1.457) 5.313 2.917 ( -3.209 -8.362 -1.733) 9.123 3.033 ( 23.780 -6.333 -6.717) 25.509 3.375 ( -2.967 -9.697 0.839) 10.175 3.456 ( 6.424 -8.518 3.186) 11.134 3.778 ( 14.170 -6.774 5.918) 16.784 4.007 ( 8.017 -4.982 0.240) 9.442 4.071 ( -0.271 -16.867 2.672) 17.079 4.246 ( -1.040 -9.552 -0.005) 9.608 4.534 ( -0.572 -10.287 -0.469) 10.314 4.916 ( -11.863 -2.555 -6.787) 13.904 5.151 ( 0.327 -1.984 2.165) 2.954 5.359 ( -11.427 1.178 1.127) 11.543 5.508 ( -17.484 -2.088 -4.091) 18.077 6.269 ( 0.009 7.941 -1.907) 8.167 6.989 ( -10.467 3.726 -1.345) 11.192 7.733 ( 1.135 1.429 -0.207) 1.837 8.382 ( 2.300 18.410 0.742) 18.568 8.982 ( 3.400 -12.540 0.201) 12.994 9.412 ( -1.078 6.887 3.327) 7.724 9.799 ( -1.822 -10.452 -4.317) 11.454 10.155 ( 7.643 6.460 -1.078) 10.065 10.392 ( 0.320 8.825 -1.119) 8.901 10.713 ( -5.679 2.254 3.471) 7.027 10.881 ( -2.422 -12.871 -1.062) 13.140 11.721 ( -1.979 8.209 2.456) 8.794 15.327 ( 7.985 2.646 -3.798) 9.230 15.938 ( -1.203 7.277 0.404) 7.387 17.207 ( 9.866 6.843 0.877) 12.039 17.555 ( 6.462 47.089 -1.522) 47.554 20.684 ( -0.122 -13.579 -0.004) 13.580 21.373 ( -11.469 -38.311 -2.769) 40.087 ======================= Grid point 58 (40/322) ======================= q-point: ( 0.46 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 17.652 -9.401 2.316) 20.133 2.165 ( 12.534 -12.034 1.859) 17.475 2.286 ( -14.929 -5.422 -0.436) 15.889 2.655 ( -4.672 -8.634 -2.090) 10.037 2.932 ( 0.454 -9.433 -0.464) 9.455 3.082 ( -0.662 -8.596 -1.135) 8.696 3.237 ( 5.738 -8.623 -4.368) 11.241 3.485 ( -3.213 -2.920 -1.177) 4.499 3.689 ( 10.102 -7.675 -0.277) 12.690 3.999 ( -1.817 -6.602 2.650) 7.343 4.220 ( 27.735 -8.743 5.659) 29.626 4.248 ( -1.723 -2.620 2.610) 4.080 4.584 ( 0.344 -16.157 1.783) 16.259 4.730 ( -4.852 -3.308 -1.834) 6.152 5.117 ( -12.075 -21.516 -3.760) 24.957 5.209 ( -1.387 -3.830 -0.776) 4.147 5.327 ( -6.064 -12.134 -0.053) 13.565 5.588 ( -17.085 -21.574 -1.913) 27.586 6.059 ( -0.068 11.798 0.021) 11.798 6.814 ( -8.043 7.449 -1.758) 11.102 7.736 ( 7.457 1.816 0.797) 7.716 8.049 ( -0.669 13.826 1.182) 13.892 9.150 ( -0.218 5.919 6.091) 8.496 9.276 ( -1.626 -1.281 -5.461) 5.840 9.846 ( 5.362 7.968 -3.259) 10.142 10.020 ( -4.024 7.120 -0.876) 8.225 10.361 ( 6.381 -1.786 0.385) 6.638 10.653 ( -5.692 -3.138 1.748) 6.730 11.176 ( -1.517 -17.740 -0.373) 17.808 11.501 ( -1.928 11.949 1.658) 12.217 15.295 ( 6.154 3.962 -2.612) 7.772 15.782 ( 2.509 7.934 0.987) 8.380 16.865 ( 8.069 23.709 0.281) 25.045 17.133 ( 5.947 8.339 0.635) 10.262 21.031 ( -0.112 -20.199 0.004) 20.199 21.909 ( -8.369 -22.135 -1.827) 23.735 ======================= Grid point 59 (41/322) ======================= q-point: ( 0.54 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.811 ( 11.943 -1.400 0.587) 12.039 2.302 ( -8.206 -3.409 -0.800) 8.922 2.427 ( 2.851 -9.403 0.965) 9.873 2.796 ( -0.290 -7.308 -1.334) 7.435 3.137 ( 0.926 -10.266 -0.312) 10.312 3.237 ( 1.754 -7.044 0.014) 7.259 3.457 ( 2.104 -10.846 -1.734) 11.183 3.481 ( -2.149 -0.479 -1.872) 2.890 3.850 ( 4.995 -3.114 -0.019) 5.886 4.081 ( -6.203 -6.190 0.567) 8.782 4.271 ( 1.153 -0.926 0.162) 1.487 4.583 ( 17.423 -3.313 3.095) 18.003 4.646 ( 2.428 -2.379 1.036) 3.554 4.752 ( -3.341 0.243 2.950) 4.464 5.202 ( -18.493 -8.127 -3.486) 20.498 5.279 ( -2.761 -4.308 -0.980) 5.210 5.754 ( -1.100 8.266 1.352) 8.448 5.878 ( 1.068 -26.993 -0.391) 27.017 6.265 ( -6.090 -40.263 -1.059) 40.734 6.648 ( -3.378 4.045 -0.659) 5.312 7.630 ( 9.313 13.489 0.633) 16.404 7.969 ( -1.946 -5.562 0.788) 5.946 8.855 ( -4.266 17.590 0.684) 18.113 9.310 ( -0.087 1.361 -1.570) 2.080 9.621 ( 5.256 15.210 -0.639) 16.105 9.878 ( -0.973 5.753 -1.162) 5.949 10.330 ( -1.157 4.167 1.572) 4.601 10.810 ( -0.247 -4.323 -0.727) 4.391 11.357 ( -1.368 -5.683 1.272) 5.982 11.541 ( -1.608 -18.893 -0.494) 18.967 15.255 ( 3.919 2.454 -1.557) 4.878 15.670 ( 2.864 5.447 0.890) 6.218 16.608 ( 4.402 7.374 0.379) 8.597 17.015 ( 2.485 6.176 0.320) 6.665 21.430 ( -0.052 -19.264 -0.039) 19.264 22.165 ( -2.923 -8.050 -0.492) 8.578 ======================= Grid point 60 (42/322) ======================= q-point: ( 0.62 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( 4.096 12.384 -0.221) 13.045 2.303 ( -1.882 0.783 -0.410) 2.079 2.590 ( -0.426 -6.426 0.301) 6.447 2.925 ( 0.769 -5.339 -0.271) 5.401 3.320 ( -1.041 -7.665 0.164) 7.737 3.384 ( 4.762 -6.406 -0.553) 8.001 3.494 ( -0.656 -2.581 -0.180) 2.669 3.682 ( 2.642 -9.819 -1.524) 10.281 3.874 ( -3.804 -0.210 1.162) 3.983 4.185 ( -1.393 -5.592 -0.358) 5.774 4.309 ( 2.923 -1.618 0.233) 3.349 4.499 ( -3.415 5.816 -0.274) 6.750 4.622 ( -0.661 5.810 -0.024) 5.848 4.927 ( 7.668 -7.176 3.173) 10.971 5.302 ( -7.045 -9.307 1.384) 11.755 5.343 ( -5.520 -5.921 -3.838) 8.959 5.612 ( 1.593 4.000 0.950) 4.409 6.204 ( 0.293 -4.006 0.086) 4.017 6.688 ( -0.315 -8.127 -0.049) 8.133 6.989 ( -0.901 -29.637 -0.043) 29.651 7.452 ( 4.254 5.472 -0.043) 6.931 8.113 ( -0.132 -8.115 0.347) 8.124 8.474 ( -3.682 17.490 -0.687) 17.887 9.229 ( 2.409 6.448 1.615) 7.070 9.346 ( 0.301 13.911 -1.978) 14.055 9.758 ( -0.258 6.238 0.071) 6.244 10.304 ( -0.896 -3.423 0.354) 3.556 10.692 ( 0.026 10.018 -0.130) 10.019 11.738 ( 0.285 -26.179 0.167) 26.181 11.881 ( -1.661 -15.927 -0.269) 16.016 15.236 ( 1.799 1.355 -0.671) 2.350 15.590 ( 1.162 4.195 0.438) 4.375 16.580 ( 2.243 -1.395 0.260) 2.654 16.915 ( 0.325 5.147 0.099) 5.158 21.762 ( -0.002 -14.058 -0.045) 14.058 22.217 ( -0.412 1.072 0.008) 1.148 ======================= Grid point 61 (43/322) ======================= q-point: ( 0.69 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( -0.000 21.559 -0.000) 21.559 2.239 ( -0.000 4.431 -0.000) 4.431 2.677 ( 0.000 -2.489 0.000) 2.489 3.007 ( 0.000 -2.831 0.000) 2.831 3.430 ( 0.000 -4.116 0.000) 4.116 3.546 ( 0.000 -2.539 0.000) 2.539 3.546 ( 0.000 -7.627 0.000) 7.627 3.863 ( 0.000 -0.658 0.000) 0.658 3.864 ( 0.000 -7.523 0.000) 7.523 4.257 ( 0.000 -1.757 0.000) 1.757 4.355 ( -0.000 6.952 -0.000) 6.952 4.362 ( 0.000 -2.355 0.000) 2.355 4.512 ( -0.000 4.749 -0.000) 4.749 5.053 ( 0.000 -4.216 0.000) 4.216 5.425 ( 0.000 -6.786 0.000) 6.786 5.491 ( 0.000 -8.394 0.000) 8.394 5.596 ( 0.000 -0.570 0.000) 0.570 6.197 ( -0.000 1.924 -0.000) 1.924 6.804 ( 0.000 -2.468 0.000) 2.468 7.157 ( -0.000 5.374 -0.000) 5.374 7.673 ( 0.000 -18.811 0.000) 18.811 8.128 ( -0.000 12.973 -0.000) 12.973 8.297 ( 0.000 -7.506 0.000) 7.506 9.063 ( -0.000 13.270 -0.000) 13.270 9.128 ( -0.000 5.236 -0.000) 5.236 9.637 ( -0.000 5.455 -0.000) 5.455 10.446 ( 0.000 -9.519 0.000) 9.519 10.542 ( -0.000 4.282 -0.000) 4.282 12.128 ( 0.000 -9.495 0.000) 9.495 12.245 ( 0.000 -23.171 0.000) 23.171 15.213 ( -0.000 1.532 -0.000) 1.532 15.516 ( -0.000 3.723 -0.000) 3.723 16.647 ( 0.000 -3.731 0.000) 3.731 16.806 ( -0.000 6.141 -0.000) 6.141 21.978 ( 0.000 -7.887 0.000) 7.887 22.150 ( -0.000 4.783 -0.000) 4.783 ======================= Grid point 71 (44/322) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.339 ( 23.063 0.000 3.624) 23.346 1.759 ( 24.102 0.000 3.052) 24.295 2.157 ( -20.338 -0.000 -0.249) 20.340 2.395 ( -8.333 -0.000 -0.166) 8.334 2.722 ( -2.428 -0.000 -0.854) 2.574 2.809 ( -1.394 -0.000 -2.503) 2.865 3.099 ( 17.878 0.000 -8.670) 19.870 3.179 ( -3.086 -0.000 0.755) 3.177 3.462 ( 10.812 0.000 4.877) 11.861 3.786 ( 3.748 0.000 6.397) 7.414 3.819 ( 1.689 0.000 0.492) 1.759 4.042 ( 15.873 0.000 2.602) 16.084 4.176 ( 2.838 0.000 0.281) 2.852 4.442 ( -2.754 -0.000 0.117) 2.757 4.842 ( -8.492 -0.000 -4.944) 9.827 5.136 ( -0.297 -0.000 -0.575) 0.647 5.291 ( -17.653 -0.000 0.035) 17.653 5.402 ( -12.003 -0.000 -2.797) 12.325 6.351 ( 0.740 0.000 -2.154) 2.278 6.971 ( -7.752 -0.000 -0.400) 7.763 7.743 ( -0.799 -0.000 -0.563) 0.978 8.683 ( 0.949 0.000 -0.418) 1.037 8.783 ( 3.898 0.000 0.168) 3.902 9.489 ( -1.973 -0.000 1.372) 2.403 9.657 ( 1.141 0.000 0.491) 1.242 10.274 ( 8.953 0.000 -1.938) 9.161 10.548 ( -0.518 -0.000 -0.309) 0.603 10.600 ( -8.425 -0.000 0.712) 8.455 10.771 ( -1.520 -0.000 0.606) 1.636 11.796 ( -2.163 -0.000 1.787) 2.805 15.399 ( 8.036 0.000 -2.972) 8.568 15.991 ( -3.774 -0.000 -0.289) 3.785 17.344 ( 11.040 0.000 1.570) 11.151 18.164 ( -11.789 -0.000 -5.871) 13.170 20.542 ( -0.081 -0.000 -0.031) 0.086 20.812 ( 0.007 0.000 0.001) 0.008 ======================= Grid point 72 (45/322) ======================= q-point: ( 0.46 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 21.103 -6.529 2.581) 22.240 2.032 ( 18.544 -10.451 2.406) 21.422 2.077 ( -19.210 -4.503 -0.489) 19.737 2.426 ( -10.622 -8.577 -1.220) 13.707 2.772 ( -0.910 -6.109 -0.389) 6.188 2.889 ( -0.870 -8.236 -1.440) 8.406 3.168 ( 5.355 -1.964 -5.028) 7.603 3.344 ( -2.249 -11.401 0.306) 11.625 3.604 ( 14.891 -6.938 -0.825) 16.449 3.840 ( -4.394 -6.948 4.331) 9.292 4.074 ( 0.944 -15.736 1.706) 15.856 4.225 ( 3.915 -11.756 0.032) 12.391 4.270 ( 22.232 -3.900 7.103) 23.663 4.527 ( -0.244 -13.635 -0.259) 13.639 4.780 ( -7.435 0.418 -3.711) 8.320 5.116 ( -14.714 -1.850 -7.989) 16.845 5.199 ( -7.615 -0.489 4.514) 8.865 5.341 ( -7.666 -0.400 -1.597) 7.840 6.269 ( 0.474 8.092 -0.691) 8.135 6.888 ( -5.857 4.324 -0.872) 7.332 7.747 ( 0.987 -0.993 0.047) 1.401 8.404 ( 1.115 18.532 0.402) 18.570 9.014 ( 1.871 -12.259 0.209) 12.402 9.401 ( -1.536 7.551 1.257) 7.808 9.778 ( -0.302 -9.010 -1.927) 9.219 10.220 ( 3.264 9.905 -0.189) 10.431 10.423 ( 5.774 3.828 -1.065) 7.009 10.636 ( -8.386 1.328 2.413) 8.827 10.863 ( -0.560 -11.942 -0.654) 11.973 11.704 ( -1.650 8.101 1.083) 8.338 15.404 ( 5.866 3.278 -1.960) 7.000 15.916 ( -2.109 5.014 0.041) 5.440 17.320 ( 8.150 8.425 1.379) 11.803 17.577 ( -0.780 38.308 -2.098) 38.373 20.683 ( -0.069 -13.569 -0.002) 13.569 21.270 ( -5.232 -34.557 -1.253) 34.973 ======================= Grid point 73 (46/322) ======================= q-point: ( 0.54 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( 13.442 -6.358 1.142) 14.914 2.112 ( -12.485 -8.421 -0.494) 15.067 2.284 ( 5.851 -7.555 0.880) 9.597 2.598 ( -3.249 -11.860 -0.941) 12.333 2.934 ( 0.121 -9.983 -0.150) 9.985 3.074 ( -0.260 -9.830 -0.368) 9.841 3.273 ( 2.022 -7.617 -1.541) 8.030 3.451 ( -1.615 -1.904 -0.464) 2.540 3.816 ( 11.208 -5.888 -1.303) 12.728 3.936 ( -8.601 -4.440 1.263) 9.761 4.237 ( -0.573 -3.065 1.012) 3.278 4.574 ( 11.995 -15.064 6.318) 20.266 4.599 ( 14.712 -11.918 1.469) 18.990 4.687 ( -0.804 2.456 -0.919) 2.743 4.916 ( -20.129 -9.408 -4.842) 22.740 5.192 ( -0.446 -8.296 -2.237) 8.604 5.293 ( -0.801 -27.377 2.214) 27.478 5.419 ( -8.633 -18.303 -1.723) 20.310 6.063 ( 0.279 11.682 0.237) 11.688 6.744 ( -2.932 6.670 -0.714) 7.321 7.809 ( 3.807 -3.803 0.298) 5.390 8.037 ( -1.262 17.720 0.448) 17.771 9.163 ( -0.222 12.896 3.600) 13.390 9.244 ( -0.892 -6.344 -3.642) 7.369 9.896 ( 3.692 0.700 -1.105) 3.916 9.976 ( -2.903 12.365 -0.110) 12.702 10.437 ( 5.226 4.238 -0.008) 6.728 10.588 ( -5.007 -7.951 0.898) 9.439 11.164 ( -0.460 -17.858 -0.197) 17.865 11.487 ( -0.865 12.032 0.508) 12.074 15.344 ( 2.606 4.514 -0.914) 5.292 15.797 ( 0.254 6.034 0.273) 6.046 16.929 ( 2.715 23.918 0.057) 24.071 17.184 ( 2.235 9.331 0.249) 9.598 21.030 ( -0.040 -20.199 0.002) 20.199 21.839 ( -2.848 -23.577 -0.619) 23.757 ======================= Grid point 74 (47/322) ======================= q-point: ( 0.62 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( -0.000 1.150 -0.000) 1.150 2.236 ( 0.000 -6.351 0.000) 6.351 2.446 ( 0.000 -7.699 0.000) 7.699 2.794 ( 0.000 -8.393 0.000) 8.393 3.140 ( 0.000 -10.184 0.000) 10.184 3.250 ( 0.000 -8.038 0.000) 8.038 3.461 ( 0.000 -0.701 0.000) 0.701 3.474 ( 0.000 -11.225 0.000) 11.225 3.887 ( -0.000 1.434 -0.000) 1.434 4.033 ( 0.000 -8.492 0.000) 8.492 4.281 ( 0.000 -1.931 0.000) 1.931 4.597 ( -0.000 4.749 -0.000) 4.749 4.718 ( -0.000 2.563 -0.000) 2.563 4.859 ( 0.000 -3.755 0.000) 3.755 4.999 ( 0.000 -14.884 0.000) 14.884 5.261 ( 0.000 -3.058 0.000) 3.058 5.752 ( -0.000 7.268 -0.000) 7.268 5.885 ( 0.000 -27.308 0.000) 27.308 6.225 ( 0.000 -40.939 0.000) 40.939 6.626 ( -0.000 3.036 -0.000) 3.036 7.694 ( -0.000 15.119 -0.000) 15.119 7.951 ( 0.000 -7.812 0.000) 7.812 8.829 ( -0.000 18.593 -0.000) 18.593 9.308 ( -0.000 0.765 -0.000) 0.765 9.651 ( -0.000 16.028 -0.000) 16.028 9.872 ( -0.000 4.791 -0.000) 4.791 10.324 ( -0.000 4.992 -0.000) 4.992 10.807 ( 0.000 -4.843 0.000) 4.843 11.350 ( 0.000 -5.703 0.000) 5.703 11.531 ( 0.000 -18.726 0.000) 18.726 15.277 ( -0.000 2.648 -0.000) 2.648 15.687 ( -0.000 5.244 -0.000) 5.244 16.636 ( -0.000 7.607 -0.000) 7.607 17.031 ( -0.000 6.726 -0.000) 6.726 21.429 ( 0.000 -19.272 0.000) 19.272 22.147 ( 0.000 -8.907 0.000) 8.907 ======================= Grid point 86 (48/322) ======================= q-point: ( 0.46 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( 21.892 0.000 1.998) 21.983 1.908 ( -21.005 -0.000 -0.814) 21.020 2.030 ( 20.271 0.000 2.359) 20.408 2.252 ( -15.164 -0.000 -1.400) 15.228 2.700 ( -0.943 -0.000 -0.010) 0.943 2.797 ( 0.031 0.000 -1.213) 1.214 3.155 ( -1.181 -0.000 0.341) 1.229 3.174 ( 2.241 0.000 -3.151) 3.867 3.624 ( 10.791 0.000 -0.431) 10.800 3.782 ( -4.023 -0.000 3.082) 5.068 3.834 ( 0.599 0.000 0.176) 0.624 4.139 ( 1.080 0.000 -0.312) 1.124 4.368 ( 19.355 0.000 6.274) 20.347 4.413 ( -1.597 -0.000 0.086) 1.599 4.769 ( -1.157 -0.000 -1.250) 1.704 4.979 ( -19.451 -0.000 -7.229) 20.751 5.181 ( -1.082 -0.000 2.464) 2.691 5.317 ( -3.133 -0.000 -0.655) 3.201 6.354 ( 0.312 0.000 -0.682) 0.750 6.907 ( -2.713 -0.000 -0.143) 2.716 7.736 ( -0.229 -0.000 -0.128) 0.262 8.690 ( 0.342 0.000 -0.155) 0.375 8.814 ( 1.300 0.000 0.063) 1.301 9.475 ( -0.802 -0.000 0.418) 0.904 9.667 ( 0.424 0.000 0.172) 0.458 10.368 ( 6.563 0.000 -0.600) 6.590 10.515 ( -5.766 -0.000 0.391) 5.779 10.543 ( -0.189 -0.000 -0.112) 0.220 10.755 ( -0.990 -0.000 0.209) 1.012 11.780 ( -0.973 -0.000 0.528) 1.107 15.466 ( 3.646 0.000 -0.981) 3.776 15.952 ( -2.018 -0.000 -0.159) 2.025 17.456 ( 5.738 0.000 1.113) 5.845 18.037 ( -6.022 -0.000 -2.620) 6.567 20.542 ( -0.029 -0.000 -0.011) 0.031 20.812 ( 0.003 0.000 0.000) 0.003 ======================= Grid point 87 (49/322) ======================= q-point: ( 0.54 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( 0.000 -3.710 0.000) 3.710 1.889 ( 0.000 -7.278 0.000) 7.278 2.202 ( 0.000 -3.548 0.000) 3.548 2.305 ( 0.000 -14.371 0.000) 14.371 2.766 ( 0.000 -6.510 0.000) 6.510 2.883 ( 0.000 -8.082 0.000) 8.082 3.187 ( 0.000 -1.834 0.000) 1.834 3.330 ( 0.000 -11.467 0.000) 11.467 3.750 ( 0.000 -9.434 0.000) 9.434 3.761 ( 0.000 -2.980 0.000) 2.980 4.084 ( 0.000 -14.762 0.000) 14.762 4.225 ( 0.000 -10.530 0.000) 10.530 4.512 ( 0.000 -7.451 0.000) 7.451 4.523 ( 0.000 -15.374 0.000) 15.374 4.745 ( -0.000 2.382 -0.000) 2.382 4.903 ( 0.000 -1.379 0.000) 1.379 5.188 ( 0.000 -0.880 0.000) 0.880 5.296 ( -0.000 0.369 -0.000) 0.369 6.272 ( -0.000 8.036 -0.000) 8.036 6.851 ( -0.000 4.607 -0.000) 4.607 7.753 ( 0.000 -1.943 0.000) 1.943 8.411 ( -0.000 18.620 -0.000) 18.620 9.026 ( 0.000 -12.264 0.000) 12.264 9.393 ( -0.000 8.005 -0.000) 8.005 9.774 ( 0.000 -8.702 0.000) 8.702 10.236 ( -0.000 11.731 -0.000) 11.731 10.486 ( -0.000 0.010 -0.000) 0.010 10.562 ( -0.000 2.641 -0.000) 2.641 10.859 ( 0.000 -11.668 0.000) 11.668 11.695 ( -0.000 8.051 -0.000) 8.051 15.438 ( -0.000 3.630 -0.000) 3.630 15.901 ( -0.000 4.213 -0.000) 4.213 17.380 ( -0.000 8.541 -0.000) 8.541 17.559 ( -0.000 35.600 -0.000) 35.600 20.683 ( 0.000 -13.566 0.000) 13.566 21.238 ( 0.000 -33.177 0.000) 33.177 ======================= Grid point 175 (50/322) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.388 ( 1.673 0.000 18.789) 18.863 0.444 ( 9.864 0.000 21.408) 23.571 0.725 ( 2.232 0.000 34.989) 35.060 2.368 ( 1.341 0.000 -5.678) 5.835 2.797 ( -1.896 -0.000 1.431) 2.375 2.884 ( 1.796 0.000 0.209) 1.808 3.049 ( 0.000 0.000 -0.498) 0.498 3.057 ( -1.428 -0.000 -3.374) 3.664 3.373 ( -0.717 -0.000 2.434) 2.538 3.677 ( 0.980 0.000 -1.122) 1.490 3.789 ( -9.547 -0.000 -3.221) 10.076 4.013 ( 3.115 0.000 4.317) 5.324 4.340 ( 3.376 0.000 -0.560) 3.422 4.554 ( -22.024 -0.000 -2.565) 22.172 5.266 ( 1.080 0.000 -4.277) 4.411 5.466 ( 8.819 0.000 2.486) 9.163 5.596 ( -0.272 -0.000 -2.438) 2.453 5.716 ( 0.772 0.000 2.018) 2.161 6.580 ( -2.576 -0.000 7.550) 7.977 7.618 ( -0.739 -0.000 0.320) 0.806 8.322 ( -48.478 -0.000 2.796) 48.559 8.376 ( 0.331 0.000 -0.006) 0.331 8.638 ( -0.846 -0.000 1.124) 1.407 9.207 ( 23.213 0.000 -2.717) 23.372 9.590 ( 0.456 0.000 0.665) 0.807 10.105 ( -38.792 -0.000 -2.257) 38.857 10.577 ( -0.141 -0.000 -0.744) 0.757 10.671 ( -0.710 -0.000 -1.028) 1.250 11.612 ( -27.652 -0.000 0.633) 27.659 11.708 ( 2.071 0.000 0.418) 2.113 15.048 ( 101.310 0.000 0.255) 101.310 15.203 ( 0.816 0.000 -0.222) 0.845 16.455 ( 14.212 0.000 0.633) 14.226 16.918 ( -0.447 -0.000 -0.379) 0.586 20.549 ( -0.049 -0.000 0.064) 0.080 20.811 ( 0.014 0.000 -0.053) 0.055 ======================= Grid point 176 (51/322) ======================= q-point: ( 0.08 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.796 ( 3.023 -15.889 20.203) 25.880 0.856 ( 16.229 -21.248 13.911) 30.139 1.338 ( 13.939 -45.727 10.228) 48.886 2.483 ( 1.696 -9.755 -4.609) 10.921 2.779 ( -1.736 -0.131 1.276) 2.159 2.930 ( -2.363 -3.195 2.519) 4.705 3.097 ( -0.052 -5.918 -5.532) 8.101 3.098 ( 0.460 -5.265 -2.698) 5.934 3.537 ( -0.765 -12.240 1.929) 12.415 3.722 ( -9.399 -1.195 -4.736) 10.593 4.053 ( 2.696 -5.012 3.990) 6.951 4.164 ( -0.046 -20.569 -3.072) 20.797 4.363 ( 1.624 2.292 2.835) 3.991 4.580 ( -17.346 -19.273 -8.523) 27.294 5.271 ( -3.198 -0.865 -2.298) 4.032 5.453 ( -6.970 2.977 6.563) 10.026 5.534 ( 17.204 8.061 2.950) 19.227 5.673 ( -2.949 -10.592 -3.131) 11.432 6.540 ( -5.162 2.198 6.677) 8.721 7.537 ( -4.633 6.885 0.750) 8.333 7.872 ( -11.193 8.482 10.492) 17.530 8.217 ( 2.373 20.525 1.023) 20.687 8.840 ( -1.408 -14.164 -2.870) 14.520 9.254 ( 11.511 2.676 -0.316) 11.822 9.782 ( 1.871 -1.237 -4.085) 4.660 10.041 ( -16.513 -13.962 -4.376) 22.063 10.449 ( -0.695 11.275 -0.644) 11.315 10.650 ( 1.699 0.661 -0.431) 1.873 11.250 ( -4.214 4.024 13.125) 14.360 11.667 ( 5.746 7.104 2.060) 9.367 15.048 ( 32.364 15.613 3.767) 36.130 15.180 ( 9.878 5.121 0.665) 11.147 16.446 ( 9.494 6.076 0.797) 11.300 16.887 ( 1.439 3.088 -0.365) 3.427 20.703 ( -0.389 -14.193 1.277) 14.256 22.067 ( -5.997 -42.323 -40.355) 58.786 ======================= Grid point 177 (52/322) ======================= q-point: ( 0.15 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( 3.280 -13.221 15.965) 20.987 1.425 ( 15.858 -23.080 7.458) 28.979 2.258 ( 11.013 -33.758 -1.379) 35.535 2.706 ( 1.717 -12.327 -2.031) 12.611 2.790 ( -2.960 -1.958 2.246) 4.200 3.008 ( -2.404 -7.496 1.692) 8.052 3.211 ( -1.521 -7.307 0.420) 7.475 3.276 ( 4.286 -10.259 -9.239) 14.456 3.653 ( -3.778 -1.840 0.706) 4.261 3.744 ( -4.912 -4.899 -2.177) 7.271 4.121 ( -1.619 -3.095 5.193) 6.259 4.324 ( 1.194 2.206 1.796) 3.085 4.575 ( 2.446 -14.390 1.382) 14.662 4.891 ( -6.751 -15.266 -0.734) 16.708 5.338 ( -1.852 -14.212 -2.663) 14.578 5.432 ( -2.041 -2.483 0.361) 3.234 5.547 ( 5.709 -0.949 0.208) 5.791 5.976 ( -4.420 -20.029 -2.881) 20.712 6.495 ( -9.220 -3.661 4.713) 10.983 7.321 ( -6.130 11.575 0.014) 13.098 7.617 ( -6.667 16.981 2.165) 18.371 7.875 ( 8.174 13.461 4.756) 16.451 9.035 ( 6.920 -2.712 -4.542) 8.710 9.228 ( 0.535 2.953 3.180) 4.373 9.693 ( -1.815 7.931 -1.611) 8.294 10.204 ( -3.437 8.676 -4.768) 10.480 10.222 ( -1.288 -4.465 -2.079) 5.091 10.734 ( -0.759 -8.199 -1.914) 8.454 11.326 ( -1.217 -10.429 6.202) 12.195 11.534 ( 3.408 7.801 3.907) 9.367 14.993 ( 10.926 3.913 1.066) 11.654 15.163 ( 8.778 2.091 0.896) 9.068 16.379 ( 4.674 4.691 0.575) 6.647 16.827 ( 3.088 3.937 -0.131) 5.005 21.059 ( -0.672 -20.350 2.116) 20.471 22.385 ( -6.233 -7.112 -17.417) 19.819 ======================= Grid point 178 (53/322) ======================= q-point: ( 0.23 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( 4.378 -5.629 10.426) 12.631 1.935 ( 11.188 -18.922 4.253) 22.389 2.606 ( -0.231 -1.809 -3.068) 3.569 2.858 ( 0.247 -5.823 1.236) 5.957 2.962 ( 0.858 -10.432 -0.039) 10.467 3.257 ( -2.563 -15.493 -2.404) 15.886 3.356 ( -0.230 -7.823 -4.272) 8.916 3.539 ( 8.049 -14.536 -2.142) 16.753 3.640 ( -2.547 0.962 -1.351) 3.039 3.853 ( -0.881 -9.282 1.540) 9.450 4.179 ( 0.516 -1.702 5.103) 5.404 4.307 ( 0.018 -0.434 -0.476) 0.644 4.725 ( 2.649 -2.194 3.449) 4.871 4.966 ( -1.881 1.773 2.709) 3.745 5.476 ( -4.550 -2.948 -1.064) 5.525 5.605 ( 2.535 -4.622 -1.638) 5.520 5.858 ( -1.085 -27.523 -2.009) 27.617 6.171 ( -10.688 -4.474 2.812) 11.923 6.763 ( -8.886 -24.705 -0.852) 26.268 7.014 ( -9.520 13.011 -1.279) 16.172 7.230 ( 2.355 16.277 0.790) 16.465 7.790 ( 9.171 2.492 3.976) 10.302 8.954 ( 7.182 12.127 -1.556) 14.180 9.222 ( 0.185 0.272 1.410) 1.448 9.459 ( -4.724 12.110 -0.135) 13.000 9.991 ( -3.394 8.332 -4.433) 10.030 10.295 ( 3.638 -1.239 1.686) 4.197 10.796 ( -0.606 3.169 -4.946) 5.906 11.484 ( 0.081 -5.418 6.041) 8.115 11.685 ( -3.226 -22.886 -0.851) 23.128 15.004 ( 3.381 -0.383 -1.704) 3.805 15.210 ( 10.307 -0.827 2.420) 10.619 16.332 ( 3.569 2.183 0.406) 4.203 16.782 ( 4.263 2.589 0.019) 4.987 21.453 ( -0.678 -18.727 1.800) 18.825 22.369 ( -3.354 2.463 -7.240) 8.351 ======================= Grid point 179 (54/322) ======================= q-point: ( 0.31 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( 4.698 6.864 6.220) 10.387 2.293 ( 5.537 -10.907 1.899) 12.378 2.544 ( -1.640 4.104 0.950) 4.520 2.979 ( 2.419 -4.990 1.167) 5.667 3.141 ( -2.377 -8.487 0.461) 8.825 3.438 ( -1.406 -5.879 -0.431) 6.060 3.520 ( -0.301 -9.516 -7.064) 11.855 3.595 ( -4.206 0.127 -2.458) 4.873 3.850 ( 3.049 -10.740 0.351) 11.170 4.077 ( 8.924 -6.482 -0.302) 11.034 4.215 ( 2.603 -2.865 2.818) 4.788 4.342 ( -1.135 -2.810 -1.001) 3.192 4.787 ( 5.302 -1.645 6.628) 8.646 4.897 ( -2.758 2.794 0.451) 3.952 5.468 ( -5.559 0.427 -0.490) 5.597 5.711 ( 0.359 -5.362 -1.851) 5.683 6.089 ( -14.762 -3.150 1.928) 15.217 6.256 ( -6.800 -2.809 -0.295) 7.363 6.685 ( 2.104 8.229 1.753) 8.673 6.945 ( 2.599 5.244 -0.857) 5.915 7.373 ( -8.092 -25.033 -2.250) 26.405 7.871 ( 12.169 -3.614 2.468) 12.933 8.725 ( 2.975 12.958 -0.364) 13.301 9.118 ( -3.308 9.818 -0.283) 10.364 9.266 ( -0.991 4.978 2.733) 5.765 9.828 ( -2.069 6.225 -2.371) 6.975 10.344 ( 1.917 -3.053 1.336) 3.845 10.646 ( 1.059 8.898 -3.134) 9.493 11.724 ( 0.701 -16.037 2.128) 16.192 12.117 ( -5.987 -21.859 -3.093) 22.874 15.036 ( 1.950 -1.510 -2.131) 3.259 15.305 ( 8.475 -2.103 2.396) 9.055 16.349 ( 3.953 -1.792 0.371) 4.356 16.774 ( 4.385 1.038 -0.171) 4.510 21.771 ( -0.392 -13.379 0.783) 13.408 22.261 ( -0.790 5.894 -2.321) 6.384 ======================= Grid point 180 (55/322) ======================= q-point: ( 0.38 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( 4.045 16.355 4.856) 17.534 2.335 ( -2.860 4.903 3.159) 6.496 2.587 ( 5.679 -5.412 0.733) 7.879 3.078 ( 3.355 -2.845 1.148) 4.547 3.255 ( -7.504 -5.534 1.870) 9.510 3.535 ( 1.743 -4.133 -0.560) 4.520 3.577 ( -3.478 -1.261 -2.205) 4.307 3.683 ( -0.202 -7.601 -2.687) 8.065 4.017 ( 1.467 -5.289 -0.015) 5.489 4.118 ( 3.277 2.113 -0.169) 3.903 4.343 ( 5.173 -3.385 -0.296) 6.189 4.378 ( -0.060 -1.749 -1.407) 2.245 4.767 ( 0.508 5.638 4.507) 7.236 4.955 ( 1.994 -7.285 -1.023) 7.622 5.421 ( -3.452 0.850 0.520) 3.593 5.806 ( -0.471 -4.369 -1.468) 4.633 5.988 ( -17.831 3.881 0.985) 18.275 6.137 ( -0.639 5.532 0.199) 5.572 6.650 ( 5.959 1.516 2.415) 6.606 6.909 ( 0.203 0.764 -1.340) 1.556 7.717 ( -3.850 -13.396 -1.130) 13.984 8.083 ( 12.695 -9.342 2.239) 15.920 8.501 ( -1.988 9.381 -1.565) 9.716 8.890 ( -5.718 10.031 2.370) 11.787 9.179 ( 0.489 4.394 2.595) 5.127 9.692 ( -0.706 6.737 -0.962) 6.842 10.461 ( 0.705 -5.658 -1.657) 5.937 10.527 ( 0.414 0.858 -0.472) 1.063 12.055 ( 3.203 -14.547 -0.380) 14.901 12.428 ( -6.738 -13.699 -3.630) 15.692 15.077 ( 1.601 -1.791 -1.117) 2.649 15.379 ( 4.962 -0.895 1.336) 5.216 16.443 ( 4.209 -4.643 0.212) 6.270 16.779 ( 3.054 0.963 -0.679) 3.273 21.976 ( -0.046 -7.524 -0.110) 7.525 22.140 ( 0.417 5.588 -0.042) 5.603 ======================= Grid point 181 (56/322) ======================= q-point: ( 0.46 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.925 ( 1.554 9.291 6.789) 11.612 2.242 ( -1.876 2.411 4.857) 5.738 2.699 ( 3.188 -2.538 0.263) 4.083 3.126 ( 3.268 0.054 -0.143) 3.272 3.288 ( -8.386 -2.729 3.575) 9.516 3.572 ( -0.414 -0.809 -1.018) 1.365 3.627 ( 2.221 -2.192 0.593) 3.177 3.806 ( 1.023 -4.719 -0.508) 4.855 4.064 ( 2.037 1.467 -0.755) 2.621 4.108 ( 0.035 -0.670 0.699) 0.969 4.377 ( 0.405 -0.399 -3.024) 3.077 4.425 ( 2.615 -1.303 -0.264) 2.934 4.656 ( -5.521 4.255 1.413) 7.112 5.076 ( 2.878 -2.539 -2.970) 4.853 5.407 ( 0.947 0.094 1.055) 1.421 5.824 ( -5.232 4.106 0.450) 6.666 5.862 ( -2.339 -1.963 -1.761) 3.525 6.070 ( 0.860 1.640 0.678) 1.972 6.663 ( 0.855 -0.019 1.945) 2.125 6.890 ( 0.071 0.460 -0.567) 0.733 7.876 ( -0.924 -4.327 -0.509) 4.454 8.301 ( 3.882 1.099 -2.052) 4.526 8.404 ( 1.626 -8.315 2.523) 8.840 8.663 ( -4.576 10.128 4.457) 11.974 9.122 ( -0.450 1.364 2.841) 3.184 9.571 ( -0.038 4.150 -1.665) 4.471 10.479 ( 0.493 -0.228 -2.886) 2.936 10.630 ( 0.080 -4.521 0.679) 4.572 12.277 ( 1.437 -5.445 -2.437) 6.136 12.576 ( -2.076 -5.045 -2.543) 6.019 15.118 ( 0.717 -1.647 0.312) 1.823 15.402 ( 1.525 0.576 0.244) 1.649 16.547 ( 2.147 -2.816 -0.226) 3.548 16.764 ( 1.008 1.311 -1.220) 2.055 22.056 ( 0.321 1.954 0.081) 1.982 22.077 ( 0.011 -1.914 0.057) 1.914 ======================= Grid point 182 (57/322) ======================= q-point: (-0.46 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.967 ( -3.573 -12.235 8.097) 15.101 2.255 ( -0.743 -3.695 5.305) 6.508 2.708 ( -2.596 2.111 0.535) 3.388 3.127 ( 4.385 1.756 -0.165) 4.726 3.286 ( -5.345 -0.492 3.180) 6.239 3.584 ( 2.750 0.634 -0.242) 2.832 3.648 ( 1.349 0.986 1.711) 2.391 3.858 ( 2.018 0.944 1.166) 2.514 4.054 ( -0.916 -0.472 -1.521) 1.837 4.105 ( 1.793 1.422 1.479) 2.725 4.365 ( -0.523 1.346 -2.615) 2.987 4.459 ( -0.736 -1.857 -1.344) 2.407 4.546 ( -8.221 2.628 -1.582) 8.775 5.062 ( 0.831 4.359 -3.713) 5.786 5.421 ( 4.714 0.504 1.634) 5.015 5.797 ( 7.165 -0.937 -0.439) 7.240 5.845 ( -4.391 0.864 -2.245) 5.007 6.085 ( 3.325 -1.355 0.996) 3.726 6.665 ( -2.424 -0.449 2.010) 3.181 6.905 ( -0.510 -1.999 0.068) 2.065 7.876 ( 0.191 3.925 -0.493) 3.960 8.249 ( -10.295 -0.379 -3.224) 10.795 8.417 ( -0.744 8.773 2.725) 9.217 8.720 ( 9.581 -12.059 6.285) 16.635 9.139 ( -2.162 -3.376 3.379) 5.243 9.550 ( 0.856 -2.279 -2.707) 3.641 10.476 ( 0.679 0.613 -2.793) 2.939 10.638 ( -0.173 3.710 0.826) 3.805 12.252 ( -3.299 6.551 -3.268) 8.030 12.607 ( 5.750 3.164 -1.519) 6.737 15.149 ( -0.743 -1.227 1.513) 2.085 15.377 ( -1.581 1.956 -0.773) 2.631 16.542 ( -1.973 3.198 -0.400) 3.779 16.756 ( -0.360 -0.522 -1.523) 1.650 22.045 ( -0.209 -0.776 -0.258) 0.844 22.085 ( -0.138 1.067 0.263) 1.108 ======================= Grid point 183 (58/322) ======================= q-point: (-0.38 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -7.543 -15.327 7.115) 18.505 2.369 ( 0.247 -5.537 4.316) 7.025 2.595 ( -5.573 5.998 0.977) 8.246 3.104 ( 2.122 2.834 1.643) 3.903 3.241 ( -2.581 3.478 1.077) 4.463 3.551 ( 2.407 4.168 0.200) 4.817 3.642 ( 3.507 1.139 1.517) 3.987 3.814 ( 2.552 4.425 0.862) 5.180 4.003 ( -1.245 4.163 -0.441) 4.368 4.116 ( -0.958 -0.504 1.303) 1.694 4.295 ( -6.416 4.708 -1.722) 8.143 4.449 ( -4.244 2.863 -3.249) 6.064 4.486 ( -3.306 -2.554 -2.738) 4.994 4.946 ( 2.388 6.027 -1.593) 6.676 5.450 ( 6.999 0.313 1.601) 7.187 5.785 ( -3.283 2.342 -2.114) 4.553 5.932 ( 18.127 -3.979 -1.017) 18.586 6.157 ( 2.303 -4.683 0.820) 5.283 6.658 ( -5.936 -0.758 2.637) 6.540 6.946 ( -0.992 -2.088 0.231) 2.323 7.720 ( 2.017 12.666 -0.872) 12.855 8.091 ( -11.871 8.269 2.104) 14.619 8.393 ( 1.403 -5.304 -4.246) 6.937 9.011 ( 5.773 -11.057 6.669) 14.144 9.230 ( -3.313 -6.433 4.036) 8.285 9.655 ( 2.100 -7.500 -2.965) 8.334 10.432 ( 0.313 5.575 -2.117) 5.971 10.561 ( -0.404 -0.174 0.286) 0.525 12.008 ( -3.151 14.761 -2.189) 15.251 12.485 ( 7.944 13.489 -1.508) 15.726 15.163 ( -2.272 -0.903 2.167) 3.267 15.300 ( -4.669 3.787 -1.702) 6.248 16.438 ( -3.927 4.429 0.054) 5.919 16.758 ( -2.324 -0.517 -1.473) 2.800 21.981 ( -0.039 7.184 0.086) 7.185 22.130 ( -0.103 -5.415 -0.444) 5.434 ======================= Grid point 184 (59/322) ======================= q-point: (-0.31 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -8.813 -3.640 6.798) 11.710 2.274 ( -6.850 14.060 1.058) 15.675 2.584 ( 0.436 -5.399 2.540) 5.983 3.044 ( -2.607 3.798 3.514) 5.794 3.116 ( -1.671 7.564 -0.785) 7.786 3.462 ( 3.608 6.839 0.857) 7.780 3.645 ( 2.579 0.228 -0.026) 2.590 3.695 ( 2.291 10.244 -3.602) 11.098 3.937 ( -0.263 1.352 6.139) 6.292 4.026 ( -10.409 16.238 -3.755) 19.650 4.077 ( -4.125 2.835 -1.582) 5.249 4.386 ( -1.061 2.473 -0.214) 2.700 4.536 ( -1.499 -4.531 -1.333) 4.955 4.902 ( 4.629 0.545 0.505) 4.688 5.481 ( 7.271 1.700 -0.066) 7.467 5.703 ( -2.363 4.056 -2.143) 5.160 6.086 ( 15.138 -0.309 1.956) 15.267 6.298 ( 6.299 -0.871 1.078) 6.449 6.644 ( -2.948 -4.727 0.624) 5.606 6.990 ( -2.579 -4.591 0.858) 5.336 7.374 ( 5.968 24.447 -2.124) 25.254 7.883 ( -11.043 4.971 2.871) 12.446 8.558 ( 0.974 -10.580 -5.707) 12.061 9.234 ( -2.013 -8.648 4.950) 10.166 9.351 ( -1.376 -7.584 4.486) 8.918 9.850 ( 3.306 -10.790 -2.272) 11.512 10.301 ( -0.992 5.429 -0.239) 5.524 10.673 ( -0.309 -10.111 -1.920) 10.296 11.665 ( -0.447 17.702 -0.269) 17.709 12.163 ( 6.137 22.699 -1.224) 23.546 15.166 ( -2.954 1.713 3.846) 5.144 15.173 ( -7.934 2.314 -3.648) 9.034 16.351 ( -3.940 1.658 0.471) 4.301 16.752 ( -3.539 -1.179 -0.994) 3.861 21.777 ( -0.252 13.465 1.050) 13.508 22.261 ( 2.056 -6.997 -2.398) 7.677 ======================= Grid point 185 (60/322) ======================= q-point: (-0.23 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( -7.596 8.517 8.620) 14.302 1.862 ( -10.601 21.778 1.467) 24.266 2.655 ( -0.713 1.062 -0.850) 1.536 2.895 ( -5.600 9.579 1.458) 11.191 2.952 ( -0.021 8.615 0.734) 8.646 3.303 ( 2.413 14.467 0.765) 14.687 3.406 ( -3.125 14.267 -0.452) 14.612 3.626 ( -5.311 13.440 -5.249) 15.375 3.671 ( 0.581 0.351 -0.580) 0.893 3.961 ( 5.258 -0.442 8.178) 9.732 3.987 ( -3.501 3.356 -1.587) 5.103 4.325 ( -1.334 2.624 -0.410) 2.972 4.616 ( -1.656 -3.077 1.063) 3.653 4.945 ( 6.478 -0.603 1.009) 6.583 5.450 ( 5.810 5.065 -2.224) 8.023 5.592 ( -3.156 5.415 -2.029) 6.588 5.906 ( -0.147 25.672 -0.071) 25.672 6.274 ( 5.563 -0.294 7.394) 9.258 6.734 ( 9.514 23.582 -2.749) 25.577 7.029 ( 10.788 -11.936 -0.932) 16.116 7.197 ( -3.937 -14.371 0.113) 14.901 7.793 ( -9.565 -1.734 4.086) 10.545 8.776 ( 2.437 -10.744 -6.784) 12.938 9.293 ( -4.917 0.346 3.144) 5.847 9.580 ( -2.038 -14.204 4.237) 14.962 10.091 ( 2.532 -11.492 -3.372) 12.241 10.219 ( -1.663 1.982 1.005) 2.776 10.890 ( -0.430 -9.953 -3.242) 10.476 11.347 ( 2.813 14.502 2.388) 14.964 11.706 ( 2.360 23.504 0.194) 23.623 15.020 ( -9.560 4.388 -1.602) 10.640 15.177 ( -4.351 -1.885 1.709) 5.041 16.332 ( -3.673 -1.788 0.426) 4.107 16.771 ( -3.575 -3.067 -0.408) 4.728 21.455 ( -0.374 18.905 1.868) 19.001 22.400 ( 5.591 -4.752 -6.254) 9.642 ======================= Grid point 186 (61/322) ======================= q-point: (-0.15 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.054 ( -5.695 15.101 13.488) 21.033 1.321 ( -12.832 25.624 3.795) 28.908 2.244 ( -10.151 37.804 -1.213) 39.162 2.689 ( 0.843 10.310 -1.635) 10.473 2.818 ( -0.165 2.955 1.611) 3.370 3.032 ( -0.538 8.128 2.613) 8.555 3.225 ( 0.064 7.075 1.346) 7.202 3.345 ( -3.710 11.109 -6.667) 13.476 3.668 ( 0.510 2.383 1.137) 2.689 3.898 ( -3.812 2.483 -4.409) 6.335 4.018 ( 6.695 1.465 10.386) 12.444 4.284 ( 0.374 0.478 -1.175) 1.323 4.548 ( -3.306 11.393 1.640) 11.976 4.960 ( 10.489 7.552 0.480) 12.934 5.281 ( 4.146 16.780 -1.695) 17.368 5.387 ( -2.216 4.086 -3.976) 6.117 5.570 ( -3.324 3.752 0.902) 5.093 6.078 ( -0.874 22.095 -0.710) 22.123 6.489 ( 5.910 0.383 5.931) 8.382 7.326 ( 4.521 -10.904 0.702) 11.825 7.630 ( 7.114 -23.896 1.984) 25.011 7.856 ( -10.109 -9.781 4.647) 14.814 8.952 ( 2.739 -4.972 -7.455) 9.371 9.199 ( -0.564 6.892 2.001) 7.199 9.798 ( -6.733 -7.444 2.410) 10.322 10.230 ( -0.478 -6.886 -0.286) 6.909 10.311 ( 0.671 -7.879 -3.859) 8.799 10.865 ( -5.561 11.727 -2.766) 13.271 11.152 ( 7.141 8.897 8.125) 14.006 11.479 ( 0.877 -2.566 0.518) 2.760 14.888 ( -12.160 2.195 -1.804) 12.487 15.196 ( -4.815 -2.366 1.377) 5.539 16.369 ( -4.001 -3.799 0.243) 5.523 16.827 ( -2.898 -4.320 -0.129) 5.203 21.058 ( -0.386 20.395 2.059) 20.502 22.455 ( 9.836 3.630 -15.645) 18.833 ======================= Grid point 187 (62/322) ======================= q-point: (-0.08 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.733 ( -4.726 20.264 15.338) 25.850 0.763 ( -9.282 19.463 16.020) 26.862 1.284 ( -9.224 49.552 7.807) 51.004 2.483 ( 0.604 9.535 -4.324) 10.487 2.792 ( -0.913 0.053 1.243) 1.543 2.929 ( 1.114 4.192 1.704) 4.660 3.103 ( 0.216 5.283 -0.424) 5.305 3.136 ( -3.750 6.081 -5.189) 8.830 3.533 ( 0.429 11.985 1.780) 12.124 3.830 ( -5.506 1.058 -5.365) 7.760 3.974 ( 6.952 7.910 6.394) 12.320 4.184 ( -1.493 16.329 -2.048) 16.525 4.333 ( 1.087 -0.413 0.334) 1.210 4.733 ( 3.857 13.022 -9.322) 16.472 5.264 ( 16.517 -1.009 7.535) 18.183 5.324 ( -2.412 -1.556 -4.067) 4.978 5.540 ( -7.380 -3.456 3.803) 8.993 5.728 ( -5.393 9.156 -1.372) 10.714 6.551 ( -0.792 -2.437 7.464) 7.892 7.536 ( 4.104 -7.163 1.154) 8.336 7.978 ( -10.823 -14.230 13.624) 22.477 8.198 ( 0.694 -24.359 -0.049) 24.369 8.871 ( -0.408 12.419 -3.601) 12.937 9.134 ( 6.493 1.119 -2.235) 6.957 9.790 ( -1.240 5.824 -2.371) 6.410 10.309 ( -20.465 0.057 -8.380) 22.115 10.455 ( -0.391 -11.331 -0.028) 11.338 10.667 ( -5.792 0.085 0.017) 5.793 11.149 ( 11.967 -5.586 21.461) 25.199 11.618 ( 2.051 -6.792 -0.283) 7.101 14.782 ( -8.153 1.690 -0.358) 8.334 15.211 ( -5.198 -1.728 0.645) 5.516 16.417 ( -4.355 -3.087 0.137) 5.340 16.891 ( -1.840 -3.224 -0.207) 3.718 20.703 ( -0.269 14.160 1.268) 14.219 22.158 ( 13.424 39.450 -41.786) 59.014 ======================= Grid point 189 (63/322) ======================= q-point: ( 0.08 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.591 ( 20.389 0.000 14.195) 24.843 0.700 ( 11.654 0.000 23.692) 26.403 1.073 ( 39.984 0.000 22.096) 45.683 2.372 ( 2.515 0.000 -6.001) 6.506 2.777 ( -2.225 -0.000 1.209) 2.532 2.878 ( -4.269 -0.000 2.675) 5.038 3.032 ( -2.630 -0.000 -0.784) 2.744 3.060 ( 4.912 0.000 -5.993) 7.749 3.364 ( -2.078 -0.000 2.514) 3.261 3.662 ( -9.736 -0.000 -2.961) 10.177 3.694 ( 2.295 0.000 -0.869) 2.454 4.045 ( -0.247 -0.000 2.952) 2.962 4.270 ( -15.834 -0.000 4.639) 16.499 4.406 ( 4.654 0.000 2.331) 5.205 5.228 ( -8.224 -0.000 -1.533) 8.366 5.438 ( -5.645 -0.000 4.682) 7.334 5.573 ( 0.501 0.000 -1.470) 1.553 5.799 ( 2.931 0.000 -3.438) 4.518 6.542 ( -7.267 -0.000 7.154) 10.198 7.551 ( -10.008 -0.000 0.120) 10.009 7.930 ( -18.247 -0.000 14.770) 23.476 8.425 ( 7.279 0.000 0.100) 7.280 8.636 ( -0.043 -0.000 0.876) 0.877 9.428 ( 13.222 0.000 -9.812) 16.465 9.601 ( 0.923 0.000 0.853) 1.257 9.897 ( -2.138 -0.000 2.765) 3.495 10.572 ( -0.402 -0.000 -0.850) 0.941 10.683 ( 2.911 0.000 -1.287) 3.183 11.274 ( -23.738 -0.000 6.866) 24.711 11.787 ( 6.247 0.000 2.669) 6.793 15.132 ( -3.057 -0.000 -3.938) 4.985 15.929 ( 25.136 0.000 -13.497) 28.531 16.927 ( 4.204 0.000 -1.617) 4.505 17.134 ( 87.848 0.000 -48.176) 100.191 20.548 ( -0.099 -0.000 0.054) 0.112 20.811 ( 0.020 0.000 -0.053) 0.057 ======================= Grid point 190 (64/322) ======================= q-point: ( 0.15 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.921 ( 7.134 -11.880 21.218) 25.342 1.112 ( 18.994 -23.102 9.199) 31.290 1.664 ( 34.069 -30.651 8.192) 46.554 2.493 ( 2.460 -9.703 -4.697) 11.057 2.756 ( -3.420 0.075 1.789) 3.860 2.889 ( -5.781 -3.825 3.286) 7.671 3.071 ( -2.729 -5.276 -1.293) 6.079 3.139 ( 9.754 -5.443 -7.951) 13.711 3.524 ( -2.598 -11.720 2.092) 12.186 3.597 ( -8.813 -2.854 -2.872) 9.698 4.058 ( -2.866 -2.349 3.511) 5.105 4.154 ( -1.222 -26.202 -4.061) 26.543 4.315 ( -7.705 -7.170 2.649) 10.853 4.487 ( 2.860 -10.643 -0.209) 11.023 5.188 ( -9.368 -2.278 -1.520) 9.760 5.398 ( -5.988 0.633 3.281) 6.858 5.635 ( -1.497 -1.993 1.136) 2.739 5.679 ( 5.849 1.739 -3.776) 7.176 6.473 ( -8.927 2.984 6.543) 11.463 7.439 ( -11.530 5.206 -0.090) 12.651 7.803 ( -5.491 6.714 8.009) 11.806 8.263 ( 4.391 17.574 1.594) 18.184 8.840 ( 2.320 -14.823 -0.904) 15.031 9.361 ( 6.714 6.118 -0.860) 9.124 9.795 ( 1.739 -2.307 -8.523) 8.999 9.924 ( -2.532 -10.267 1.468) 10.676 10.434 ( -1.319 11.479 -0.855) 11.586 10.687 ( 4.294 0.550 -0.416) 4.349 11.180 ( -10.659 -3.300 6.237) 12.783 11.743 ( 4.660 7.772 3.580) 9.743 15.096 ( -0.238 1.890 -4.244) 4.652 15.622 ( 33.074 30.655 -0.102) 45.096 16.665 ( 27.480 26.040 -2.580) 37.946 16.926 ( 5.537 3.667 -0.400) 6.653 20.702 ( -0.486 -14.209 1.228) 14.271 21.825 ( -14.710 -45.710 -28.609) 55.895 ======================= Grid point 191 (65/322) ======================= q-point: ( 0.23 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( 6.757 -11.835 15.182) 20.401 1.651 ( 17.614 -19.394 6.267) 26.938 2.415 ( 15.327 -22.027 -4.400) 27.193 2.713 ( -1.293 -10.639 -0.614) 10.735 2.766 ( -0.255 -5.398 1.303) 5.559 2.987 ( -1.754 -8.923 1.221) 9.175 3.189 ( -2.287 -8.093 -0.302) 8.415 3.347 ( 12.067 -9.911 -5.549) 16.572 3.600 ( -4.363 -3.976 0.534) 5.928 3.697 ( -2.914 -5.226 -0.069) 5.984 4.111 ( -1.994 -4.007 3.740) 5.833 4.332 ( -0.903 1.181 1.841) 2.366 4.591 ( 0.294 -14.801 0.519) 14.813 4.854 ( -1.110 -17.253 2.569) 17.479 5.281 ( -5.592 -17.137 -3.295) 18.325 5.389 ( -4.418 -3.194 -0.399) 5.466 5.582 ( -0.889 0.607 -1.691) 2.005 5.927 ( -2.589 -18.749 -2.346) 19.071 6.366 ( -14.364 -0.563 5.355) 15.340 7.209 ( -11.904 11.061 -1.251) 16.298 7.585 ( -0.234 14.625 3.026) 14.936 7.978 ( 6.525 12.066 4.575) 14.460 9.103 ( 6.263 -7.732 -2.987) 10.389 9.244 ( 0.718 7.906 1.650) 8.108 9.674 ( -0.115 10.569 -3.352) 11.088 10.140 ( -3.886 2.488 -4.016) 6.117 10.225 ( 1.492 -2.640 -0.137) 3.036 10.737 ( 1.169 -3.591 -0.197) 3.781 11.300 ( -4.609 -13.048 2.309) 14.029 11.578 ( 1.335 9.768 4.360) 10.780 15.051 ( 3.220 2.536 -3.003) 5.081 15.381 ( 21.392 11.268 2.914) 24.354 16.462 ( 9.151 8.780 0.384) 12.688 16.879 ( 5.804 4.127 -0.160) 7.123 21.056 ( -0.763 -20.332 2.033) 20.448 22.234 ( -10.287 -12.965 -14.820) 22.216 ======================= Grid point 192 (66/322) ======================= q-point: ( 0.31 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( 7.278 -4.402 9.686) 12.891 2.090 ( 12.537 -14.909 3.631) 19.816 2.583 ( -2.520 0.672 -1.659) 3.091 2.856 ( -1.618 -8.043 1.245) 8.298 2.978 ( 2.749 -8.069 -2.143) 8.790 3.232 ( -0.709 -13.171 -1.822) 13.315 3.348 ( 1.131 -8.388 -3.862) 9.304 3.577 ( -2.634 -1.139 -2.712) 3.949 3.661 ( 7.176 -9.226 0.598) 11.704 3.898 ( 9.034 -14.513 3.043) 17.364 4.191 ( -0.402 -3.612 3.519) 5.058 4.300 ( -1.026 0.844 -0.220) 1.346 4.742 ( -0.764 -3.444 1.807) 3.964 4.963 ( -1.574 1.557 3.258) 3.939 5.415 ( -4.854 -3.034 -0.082) 5.725 5.594 ( -3.469 -4.449 -3.134) 6.454 5.840 ( -0.875 -28.176 -2.150) 28.272 6.048 ( -11.417 1.358 3.829) 12.118 6.628 ( -12.851 -30.947 -1.409) 33.539 6.888 ( -10.148 12.113 -1.359) 15.860 7.290 ( 7.055 15.534 1.288) 17.110 7.906 ( 7.862 0.990 4.362) 9.046 9.001 ( 0.805 13.389 -2.403) 13.626 9.252 ( 4.671 -0.529 -0.137) 4.703 9.413 ( -2.367 13.251 0.995) 13.498 9.940 ( -3.241 8.077 -3.464) 9.367 10.343 ( 3.195 -1.178 2.054) 3.977 10.780 ( 0.171 1.658 -4.058) 4.387 11.488 ( -2.382 -4.294 4.873) 6.918 11.639 ( -3.937 -21.406 -1.223) 21.800 15.039 ( 4.135 0.483 -2.178) 4.698 15.367 ( 13.730 2.377 2.373) 14.135 16.388 ( 5.541 3.223 0.469) 6.427 16.842 ( 5.687 2.956 -0.133) 6.411 21.450 ( -0.686 -18.741 1.685) 18.829 22.299 ( -4.707 -1.253 -6.401) 8.044 ======================= Grid point 193 (67/322) ======================= q-point: ( 0.38 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( 7.376 8.205 5.988) 12.553 2.360 ( 4.019 -4.249 1.941) 6.162 2.542 ( 1.195 -0.790 1.503) 2.077 2.999 ( -1.434 -6.862 2.906) 7.589 3.115 ( 0.160 -5.450 -1.882) 5.768 3.427 ( -0.884 -7.717 0.911) 7.820 3.523 ( 3.567 -8.489 -5.052) 10.503 3.536 ( -4.008 0.051 -2.854) 4.920 3.882 ( 2.619 -8.788 1.056) 9.231 4.187 ( 6.688 0.782 0.274) 6.739 4.269 ( 7.696 -8.265 1.219) 11.359 4.321 ( -1.941 -3.305 -0.840) 3.924 4.811 ( -3.413 -4.877 -0.732) 5.997 4.880 ( -1.763 4.317 4.805) 6.696 5.429 ( -0.647 -0.129 0.724) 0.980 5.673 ( -5.518 -6.381 -3.308) 9.061 5.886 ( -19.077 1.282 2.589) 19.294 6.207 ( -1.997 -3.235 -0.436) 3.827 6.705 ( 0.473 -0.620 0.766) 1.093 6.990 ( 4.540 4.239 0.800) 6.263 7.286 ( -4.469 -22.518 -2.205) 23.063 8.008 ( 9.357 -5.071 3.187) 11.110 8.712 ( -4.696 13.527 -3.635) 14.773 9.111 ( 2.441 13.294 2.448) 13.736 9.272 ( 0.586 3.664 2.178) 4.302 9.797 ( -2.084 4.995 -1.851) 5.720 10.363 ( 0.498 -1.877 1.500) 2.454 10.650 ( 1.246 8.863 -3.042) 9.453 11.734 ( 0.078 -17.914 1.323) 17.963 12.033 ( -6.419 -20.515 -2.627) 21.656 15.065 ( 4.045 -0.795 -1.536) 4.399 15.416 ( 8.815 0.483 1.694) 8.990 16.406 ( 5.270 -1.668 0.479) 5.549 16.826 ( 4.417 1.855 -0.470) 4.813 21.769 ( -0.317 -13.434 0.706) 13.456 22.243 ( -1.086 3.959 -2.064) 4.595 ======================= Grid point 194 (68/322) ======================= q-point: ( 0.46 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( 6.288 17.842 5.420) 19.678 2.316 ( -2.316 4.879 3.825) 6.618 2.657 ( 5.252 -4.476 0.709) 6.937 3.108 ( -1.710 -4.247 3.532) 5.782 3.191 ( -0.192 -2.949 -1.397) 3.269 3.521 ( -2.952 -3.014 -0.866) 4.306 3.572 ( 1.807 -4.532 0.380) 4.894 3.697 ( 3.534 -7.251 -2.012) 8.313 4.039 ( 1.775 -5.497 1.415) 5.947 4.141 ( 1.002 3.780 -0.842) 4.000 4.358 ( -0.699 -1.360 -1.905) 2.443 4.415 ( 4.852 -2.081 0.403) 5.295 4.708 ( -9.710 5.467 -0.623) 11.161 4.988 ( 2.579 -7.335 -0.252) 7.779 5.432 ( 4.019 0.607 1.991) 4.526 5.753 ( -7.249 -5.197 -3.126) 9.452 5.774 ( -17.543 -1.474 1.017) 17.634 6.147 ( 1.798 4.524 0.790) 4.932 6.744 ( 7.147 2.229 2.233) 7.813 6.922 ( 3.549 3.095 -0.529) 4.738 7.672 ( -2.708 -15.987 -1.221) 16.261 8.221 ( 8.578 -10.171 3.357) 13.722 8.424 ( -9.216 10.343 -4.418) 14.541 8.883 ( 2.594 12.016 4.760) 13.182 9.189 ( -0.172 4.672 2.192) 5.164 9.677 ( -1.437 6.161 -0.993) 6.404 10.460 ( -0.021 -5.145 -1.699) 5.418 10.531 ( 0.284 0.705 -0.365) 0.843 12.085 ( 2.326 -14.647 -1.448) 14.901 12.342 ( -5.982 -15.027 -2.540) 16.373 15.105 ( 3.401 -0.949 -0.447) 3.559 15.440 ( 4.588 1.356 0.785) 4.849 16.499 ( 5.032 -3.817 0.207) 6.319 16.806 ( 1.904 2.162 -1.006) 3.052 21.975 ( 0.032 -7.567 -0.121) 7.568 22.145 ( 0.317 5.101 -0.058) 5.111 ======================= Grid point 195 (69/322) ======================= q-point: ( 0.54 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( 3.104 12.110 7.267) 14.460 2.235 ( -1.778 1.769 5.056) 5.644 2.721 ( 0.041 -0.105 0.280) 0.302 3.151 ( -2.243 -1.034 2.696) 3.657 3.248 ( 3.885 -2.090 -0.483) 4.438 3.572 ( 0.377 -2.734 0.115) 2.762 3.651 ( 1.355 -1.903 1.639) 2.854 3.840 ( 4.395 -4.801 -0.099) 6.509 4.066 ( -1.702 3.068 -0.811) 3.601 4.123 ( 2.141 -1.621 1.590) 3.120 4.371 ( 0.192 -0.563 -2.716) 2.780 4.436 ( -1.639 0.953 -1.521) 2.431 4.551 ( -9.649 3.496 -0.232) 10.265 5.088 ( 0.650 -1.556 -3.327) 3.730 5.462 ( 6.108 -0.047 2.045) 6.442 5.740 ( -8.151 -4.008 0.199) 9.085 5.790 ( -7.425 -2.424 -2.385) 8.167 6.109 ( 4.056 1.143 0.969) 4.324 6.725 ( 7.665 3.770 2.017) 8.777 6.893 ( 1.065 1.173 -0.308) 1.614 7.873 ( 0.840 -5.032 -0.560) 5.133 8.203 ( -12.594 4.259 -3.902) 13.856 8.474 ( 2.518 -8.064 4.602) 9.620 8.697 ( 7.316 7.444 4.665) 11.432 9.118 ( -1.742 1.872 2.578) 3.631 9.562 ( -0.545 3.556 -1.863) 4.051 10.477 ( 0.652 -0.330 -2.876) 2.967 10.630 ( -0.582 -4.553 0.691) 4.642 12.265 ( -1.676 -3.186 -3.224) 4.833 12.565 ( 1.064 -9.118 -1.742) 9.343 15.136 ( 1.967 -0.535 0.672) 2.147 15.420 ( 1.435 2.457 0.021) 2.846 16.575 ( 2.758 -0.350 -0.320) 2.799 16.763 ( -0.624 1.854 -1.340) 2.371 22.059 ( 0.209 1.937 -0.049) 1.949 22.078 ( 0.078 -1.561 0.149) 1.570 ======================= Grid point 196 (70/322) ======================= q-point: (-0.38 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.956 ( -2.685 -8.684 7.783) 11.966 2.262 ( -0.732 -4.449 4.978) 6.716 2.671 ( -3.476 3.873 0.360) 5.216 3.139 ( -3.827 0.826 3.085) 4.984 3.299 ( 6.944 0.977 -0.789) 7.057 3.605 ( 0.518 0.407 0.013) 0.659 3.682 ( 3.751 -0.101 2.567) 4.547 3.905 ( 5.124 2.015 0.864) 5.574 4.016 ( -4.901 -0.200 -2.393) 5.458 4.138 ( 2.309 1.333 3.069) 4.066 4.326 ( -7.576 3.767 -2.524) 8.830 4.396 ( -3.700 -1.567 -4.862) 6.307 4.484 ( -2.230 0.910 0.992) 2.604 5.056 ( 0.444 3.839 -3.096) 4.951 5.500 ( 6.534 0.259 1.778) 6.777 5.768 ( -6.466 -0.317 -1.886) 6.743 5.848 ( 1.747 -8.980 -0.230) 9.151 6.138 ( 4.261 -0.948 0.563) 4.402 6.693 ( 6.165 4.282 2.134) 7.803 6.898 ( -0.673 -1.764 -0.107) 1.891 7.869 ( -2.197 4.266 -0.677) 4.846 8.101 ( -10.629 0.280 -1.502) 10.738 8.427 ( 0.579 6.211 1.735) 6.475 8.853 ( 8.771 -10.284 5.834) 14.722 9.115 ( -3.430 -2.914 2.988) 5.402 9.551 ( 0.793 -2.906 -2.784) 4.102 10.477 ( 0.920 0.596 -2.765) 2.974 10.634 ( -0.883 3.696 0.728) 3.869 12.202 ( -3.072 6.906 -2.831) 8.072 12.669 ( 5.226 1.031 -2.085) 5.720 15.149 ( -0.022 -0.012 1.151) 1.152 15.360 ( -0.832 3.825 -0.465) 3.942 16.521 ( -1.381 5.286 -0.422) 5.480 16.742 ( -1.126 -0.007 -1.323) 1.738 22.042 ( -0.078 -0.700 -0.173) 0.725 22.083 ( -0.185 1.286 0.222) 1.318 ======================= Grid point 197 (71/322) ======================= q-point: (-0.31 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( -5.977 -13.529 6.477) 16.146 2.388 ( 1.092 -4.965 3.401) 6.116 2.537 ( -4.901 5.958 1.057) 7.786 3.086 ( -4.978 2.405 3.397) 6.489 3.260 ( 4.042 6.212 -1.056) 7.487 3.576 ( 1.596 2.787 -0.067) 3.212 3.694 ( 4.354 2.350 1.127) 5.075 3.862 ( 5.215 5.019 -0.285) 7.243 3.959 ( -5.006 1.681 -2.581) 5.878 4.104 ( -4.945 3.560 1.336) 6.237 4.187 ( -6.500 5.577 -1.597) 8.712 4.403 ( -0.784 -0.420 -2.552) 2.702 4.472 ( -0.248 -0.913 0.981) 1.363 4.972 ( 2.513 4.045 -0.750) 4.820 5.536 ( 6.110 0.248 1.274) 6.246 5.729 ( -4.481 0.908 -1.730) 4.888 6.107 ( 10.604 -12.698 -0.747) 16.560 6.192 ( 3.416 -2.651 0.498) 4.352 6.627 ( -0.138 4.430 3.164) 5.446 6.937 ( -0.745 -1.710 -0.414) 1.911 7.723 ( -2.060 8.654 -0.757) 8.928 7.968 ( -8.042 8.421 0.570) 11.658 8.407 ( 2.409 -3.772 -1.900) 4.862 9.083 ( 3.123 -7.849 5.330) 9.988 9.200 ( -3.881 -7.029 3.572) 8.788 9.671 ( 2.075 -8.338 -2.758) 9.025 10.431 ( 0.528 6.127 -1.889) 6.433 10.553 ( -0.956 -0.329 -0.095) 1.015 11.974 ( -1.588 13.799 -1.415) 13.962 12.559 ( 5.336 13.104 -2.429) 14.356 15.141 ( -2.157 0.223 0.269) 2.185 15.257 ( -2.104 5.666 0.061) 6.044 16.398 ( -2.840 4.955 0.101) 5.712 16.728 ( -1.827 0.290 -1.072) 2.138 21.981 ( -0.066 7.199 0.065) 7.199 22.128 ( 0.044 -5.856 -0.365) 5.868 ======================= Grid point 198 (72/322) ======================= q-point: (-0.23 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -5.555 -3.458 6.814) 9.447 2.216 ( -3.380 17.050 1.301) 17.430 2.590 ( -0.593 -6.439 1.677) 6.680 2.994 ( -5.267 4.491 2.538) 7.373 3.123 ( 1.531 8.441 -0.210) 8.581 3.499 ( 1.916 6.258 0.282) 6.550 3.668 ( 1.405 0.981 -0.556) 1.801 3.704 ( 1.977 12.601 -5.052) 13.719 3.862 ( -12.750 13.247 -6.968) 19.662 3.972 ( 3.257 -1.664 3.149) 4.826 4.059 ( -0.672 5.759 4.112) 7.108 4.373 ( -0.812 2.498 -0.256) 2.639 4.537 ( 1.383 -4.204 2.585) 5.125 4.953 ( 3.013 -0.381 0.594) 3.095 5.550 ( 4.400 2.092 -0.402) 4.889 5.663 ( -2.586 3.538 -1.585) 4.660 6.210 ( 5.168 4.414 0.641) 6.827 6.393 ( 7.310 1.725 2.485) 7.911 6.620 ( -0.975 -13.566 0.958) 13.635 6.962 ( -2.047 -3.755 -0.328) 4.290 7.446 ( 7.134 22.885 -2.707) 24.124 7.757 ( -11.187 3.990 2.456) 12.128 8.568 ( 3.102 -10.299 -3.338) 11.262 9.216 ( -2.977 -4.955 3.897) 6.972 9.345 ( -2.165 -9.242 3.518) 10.124 9.874 ( 1.908 -10.900 -2.771) 11.407 10.291 ( -0.437 5.854 0.201) 5.873 10.662 ( -0.360 -9.889 -2.432) 10.190 11.667 ( 0.570 16.022 0.855) 16.055 12.215 ( 3.168 23.404 -1.983) 23.701 15.086 ( -4.624 4.800 -2.988) 7.304 15.153 ( -1.180 1.901 3.233) 3.932 16.314 ( -2.394 1.729 0.403) 2.981 16.717 ( -1.833 -0.701 -0.543) 2.036 21.777 ( -0.342 13.403 1.030) 13.447 22.274 ( 1.493 -8.113 -2.563) 8.639 ======================= Grid point 199 (73/322) ======================= q-point: (-0.15 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.285 ( -3.166 7.963 9.785) 13.006 1.786 ( -2.812 24.152 2.959) 24.494 2.632 ( -1.499 4.961 -2.521) 5.763 2.859 ( -1.744 6.342 1.399) 6.724 2.952 ( -0.322 9.813 1.084) 9.878 3.327 ( 0.548 21.378 0.744) 21.398 3.373 ( -1.991 8.467 0.755) 8.731 3.539 ( -4.627 11.337 -9.767) 15.663 3.676 ( 0.184 -0.648 -0.514) 0.848 3.933 ( -4.152 4.304 -1.669) 6.209 4.061 ( 5.926 -1.570 8.698) 10.641 4.312 ( -0.608 2.590 -0.524) 2.711 4.619 ( 1.325 -1.506 3.390) 3.940 5.007 ( 2.254 -2.712 0.849) 3.627 5.491 ( 2.999 5.750 -2.473) 6.940 5.561 ( -0.986 5.594 -0.806) 5.737 5.897 ( -1.144 26.493 -0.711) 26.527 6.316 ( -1.710 4.931 5.038) 7.254 6.814 ( 4.917 18.717 -1.917) 19.447 7.107 ( 1.165 -10.846 0.156) 10.910 7.202 ( 4.939 -16.656 -0.999) 17.401 7.700 ( -6.972 -2.572 4.017) 8.447 8.803 ( 5.243 -10.701 -4.780) 12.840 9.254 ( -3.506 -0.215 3.285) 4.810 9.556 ( -3.617 -12.511 2.467) 13.255 10.085 ( -1.108 -9.684 -5.127) 11.013 10.221 ( 1.149 0.825 1.880) 2.353 10.862 ( -1.703 -8.417 -5.186) 10.032 11.397 ( 3.422 11.536 5.139) 13.084 11.723 ( 0.481 24.409 0.034) 24.413 14.945 ( -2.209 6.056 -0.452) 6.462 15.142 ( -2.422 -0.777 1.061) 2.756 16.303 ( -1.405 -1.464 0.397) 2.068 16.742 ( -1.090 -2.785 -0.125) 2.994 21.456 ( -0.503 18.821 1.903) 18.924 22.428 ( 2.640 -6.073 -7.176) 9.764 ======================= Grid point 200 (74/322) ======================= q-point: (-0.08 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.064 ( -0.609 14.218 15.602) 21.117 1.277 ( 3.490 27.117 6.552) 28.114 2.188 ( 0.977 38.432 -0.636) 38.450 2.695 ( 1.242 11.413 -2.002) 11.654 2.811 ( -1.752 2.374 1.868) 3.492 3.027 ( -1.651 7.290 2.222) 7.797 3.223 ( -0.940 6.971 1.106) 7.121 3.289 ( -1.115 10.759 -9.162) 14.175 3.673 ( -0.513 1.882 1.136) 2.258 3.823 ( -6.165 3.327 -3.921) 8.028 4.102 ( 2.114 1.942 7.780) 8.293 4.299 ( 2.084 -1.447 0.462) 2.578 4.541 ( 1.245 13.327 2.114) 13.550 4.989 ( -5.403 10.159 -3.313) 11.974 5.334 ( 3.859 11.277 -0.683) 11.939 5.391 ( 5.976 4.960 -1.577) 7.925 5.530 ( -3.417 4.554 1.824) 5.978 6.039 ( -4.376 20.846 -2.251) 21.419 6.540 ( -0.686 3.663 4.656) 5.964 7.354 ( -0.213 -11.892 1.030) 11.938 7.700 ( -2.710 -24.690 -0.424) 24.842 7.778 ( 0.894 -8.076 6.887) 10.652 8.978 ( 5.233 -1.923 -6.019) 8.204 9.211 ( 0.844 2.464 2.838) 3.851 9.733 ( -4.874 -6.474 0.894) 8.153 10.222 ( -0.645 -8.018 -0.591) 8.066 10.280 ( -3.072 -3.006 -6.309) 7.634 10.778 ( -5.230 12.145 -4.110) 13.847 11.272 ( 5.970 7.875 10.790) 14.631 11.494 ( 1.584 -4.159 1.412) 4.669 14.853 ( 6.116 3.230 2.365) 7.309 15.151 ( -2.772 -1.511 -0.403) 3.183 16.348 ( 0.285 -3.185 0.505) 3.237 16.809 ( -0.004 -4.083 -0.108) 4.085 21.059 ( -0.536 20.374 2.124) 20.491 22.471 ( 1.413 3.166 -17.869) 18.202 ======================= Grid point 203 (75/322) ======================= q-point: ( 0.15 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.893 ( 9.861 0.000 23.985) 25.933 0.902 ( 25.026 0.000 10.064) 26.974 1.653 ( 46.802 0.000 9.638) 47.784 2.389 ( 3.397 0.000 -5.963) 6.863 2.753 ( -2.388 -0.000 0.804) 2.520 2.794 ( -11.499 -0.000 5.398) 12.703 2.983 ( -5.032 -0.000 -1.095) 5.150 3.157 ( 15.230 0.000 -6.786) 16.673 3.342 ( -3.120 -0.000 2.931) 4.281 3.555 ( -7.068 -0.000 -0.623) 7.095 3.723 ( 3.007 0.000 -0.839) 3.122 4.021 ( -4.240 -0.000 2.718) 5.037 4.193 ( -1.735 -0.000 1.875) 2.555 4.468 ( 3.575 0.000 2.411) 4.312 5.096 ( -11.303 -0.000 -2.494) 11.575 5.373 ( -7.801 -0.000 4.854) 9.188 5.595 ( 1.095 0.000 1.127) 1.571 5.761 ( -5.578 -0.000 -4.954) 7.461 6.470 ( -7.811 -0.000 6.792) 10.351 7.405 ( -13.938 -0.000 0.104) 13.938 7.853 ( -5.005 -0.000 9.657) 10.877 8.528 ( 9.387 0.000 0.122) 9.388 8.642 ( 0.615 0.000 0.640) 0.887 9.490 ( 3.691 0.000 -7.007) 7.920 9.616 ( 1.221 0.000 0.842) 1.483 9.944 ( 6.963 0.000 -0.750) 7.004 10.563 ( -0.553 -0.000 -0.855) 1.018 10.720 ( 3.560 0.000 -1.409) 3.829 11.061 ( -16.656 -0.000 4.767) 17.325 11.854 ( 3.141 0.000 3.297) 4.554 15.107 ( 1.679 0.000 -4.858) 5.139 16.031 ( 3.806 0.000 -4.332) 5.766 16.984 ( 6.693 0.000 -0.825) 6.744 17.750 ( 43.056 0.000 -49.294) 65.450 20.547 ( -0.131 -0.000 0.054) 0.142 20.811 ( 0.024 0.000 -0.052) 0.058 ======================= Grid point 204 (76/322) ======================= q-point: ( 0.23 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.085 ( 9.916 -9.469 19.354) 23.719 1.361 ( 19.447 -21.915 7.082) 30.143 2.113 ( 36.728 -17.670 1.003) 40.770 2.509 ( 2.198 -9.133 -4.090) 10.246 2.700 ( -7.209 -0.327 3.044) 7.832 2.830 ( -4.885 -6.003 2.171) 8.038 3.021 ( -5.102 -6.281 -1.396) 8.212 3.288 ( 18.899 -4.210 -4.225) 19.818 3.486 ( -4.431 -6.301 1.999) 7.959 3.519 ( -3.642 -8.740 0.343) 9.475 4.030 ( -3.063 -3.698 3.030) 5.678 4.115 ( -2.399 -25.064 -2.078) 25.264 4.282 ( -0.843 -9.613 2.444) 9.954 4.526 ( 2.087 -6.970 0.695) 7.309 5.060 ( -10.476 -3.755 -4.345) 11.947 5.329 ( -7.004 0.054 4.590) 8.374 5.591 ( -6.787 1.025 0.497) 6.882 5.694 ( -1.175 -1.723 -4.539) 4.995 6.389 ( -8.143 4.711 6.837) 11.630 7.283 ( -14.155 4.460 -0.507) 14.850 7.782 ( -2.297 6.039 6.740) 9.337 8.320 ( 4.191 16.794 1.668) 17.389 8.881 ( 4.441 -14.301 -0.211) 14.976 9.412 ( 2.836 6.580 -2.237) 7.506 9.766 ( -1.246 -6.487 -6.405) 9.201 9.964 ( 6.336 -1.833 2.015) 6.897 10.413 ( -1.815 11.635 -0.792) 11.802 10.738 ( 4.188 0.328 -0.004) 4.201 11.063 ( -11.101 -7.704 3.033) 13.849 11.786 ( 0.791 8.138 2.954) 8.694 15.105 ( 4.421 1.351 -4.112) 6.187 15.861 ( 11.063 17.914 -1.749) 21.127 16.955 ( 15.187 18.176 -3.600) 23.958 17.060 ( 22.797 30.073 -5.180) 38.091 20.699 ( -0.534 -14.204 1.128) 14.259 21.581 ( -13.983 -43.951 -17.559) 49.351 ======================= Grid point 205 (77/322) ======================= q-point: ( 0.31 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( 9.531 -10.337 13.434) 19.447 1.866 ( 15.940 -17.297 4.853) 24.017 2.529 ( 3.709 -5.776 -4.297) 8.098 2.671 ( -3.759 -8.590 0.449) 9.388 2.817 ( 8.580 -11.194 -2.846) 14.388 2.975 ( -0.386 -11.086 0.198) 11.095 3.156 ( -2.925 -9.836 -0.619) 10.280 3.490 ( 7.781 -5.967 -1.235) 9.883 3.592 ( 4.267 -4.888 1.065) 6.575 3.696 ( 6.958 -10.227 2.822) 12.688 4.099 ( -1.793 -4.471 2.579) 5.465 4.320 ( -1.652 -0.188 1.905) 2.528 4.602 ( 1.075 -14.123 1.913) 14.292 4.840 ( -3.523 -15.651 1.482) 16.111 5.198 ( -5.912 -21.208 -5.009) 22.580 5.336 ( -4.352 -5.244 0.912) 6.876 5.515 ( -8.406 0.140 -2.557) 8.787 5.880 ( -5.762 -19.857 -2.475) 20.824 6.217 ( -12.436 6.416 6.469) 15.416 7.053 ( -13.111 10.166 -1.554) 16.663 7.620 ( 4.081 11.619 3.276) 12.743 8.053 ( 3.790 10.753 4.339) 12.199 9.159 ( 4.404 -9.903 -1.411) 10.930 9.244 ( -1.163 10.770 -2.238) 11.061 9.680 ( 3.150 11.128 -2.234) 11.779 10.090 ( -3.213 5.282 -1.890) 6.465 10.255 ( 3.399 -5.936 0.486) 6.857 10.749 ( 0.161 -0.302 1.001) 1.057 11.245 ( -4.918 -15.493 0.309) 16.257 11.586 ( -1.899 10.742 2.824) 11.268 15.094 ( 6.047 2.172 -2.582) 6.925 15.608 ( 15.040 13.038 1.041) 19.932 16.591 ( 12.311 14.865 -0.280) 19.303 16.958 ( 7.536 4.973 -0.277) 9.033 21.053 ( -0.789 -20.325 1.888) 20.428 22.068 ( -10.554 -18.118 -11.398) 23.865 ======================= Grid point 206 (78/322) ======================= q-point: ( 0.38 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( 9.643 -3.251 8.612) 13.332 2.242 ( 11.036 -11.698 2.894) 16.341 2.538 ( -4.872 0.154 0.641) 4.916 2.826 ( -3.577 -8.409 0.861) 9.178 3.018 ( 5.347 -6.469 -2.694) 8.814 3.225 ( 0.072 -11.725 -0.689) 11.746 3.355 ( 1.666 -10.323 -3.040) 10.890 3.527 ( -3.705 1.244 -2.788) 4.801 3.735 ( 5.377 -8.024 0.899) 9.701 4.091 ( 20.196 -15.478 3.599) 25.698 4.191 ( -1.191 -5.303 2.164) 5.850 4.283 ( -1.449 2.343 0.456) 2.792 4.724 ( -3.029 -2.174 0.349) 3.744 4.926 ( -5.906 0.783 2.159) 6.337 5.367 ( -3.660 -4.517 0.288) 5.821 5.503 ( -9.814 -4.899 -3.580) 11.538 5.826 ( -0.286 -27.993 -1.767) 28.050 5.936 ( -9.287 7.253 4.766) 12.711 6.469 ( -12.519 -35.878 -1.974) 38.051 6.776 ( -8.141 8.961 -0.969) 12.145 7.398 ( 10.094 14.295 1.754) 17.587 7.993 ( 4.289 -0.821 4.509) 6.277 8.956 ( -5.529 14.782 -5.375) 16.672 9.304 ( 2.629 -2.007 0.802) 3.403 9.436 ( 5.941 15.279 2.203) 16.541 9.895 ( -2.701 7.611 -2.547) 8.468 10.378 ( 1.366 0.095 2.378) 2.744 10.774 ( 0.627 0.319 -3.292) 3.366 11.461 ( -4.091 -4.361 3.219) 6.791 11.590 ( -3.579 -20.116 -1.285) 20.473 15.094 ( 6.281 1.031 -1.397) 6.517 15.524 ( 11.152 4.742 1.285) 12.187 16.463 ( 6.848 4.683 0.456) 8.309 16.909 ( 5.704 3.816 -0.435) 6.876 21.447 ( -0.636 -18.798 1.558) 18.873 22.225 ( -4.602 -4.924 -5.298) 8.573 ======================= Grid point 207 (79/322) ======================= q-point: ( 0.46 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 8.933 9.476 6.012) 14.343 2.385 ( -0.876 1.707 2.727) 3.334 2.583 ( 3.910 -5.999 1.699) 7.359 2.962 ( -4.738 -7.475 3.099) 9.377 3.156 ( 7.143 -4.055 -2.204) 8.504 3.409 ( -3.179 -6.927 0.871) 7.671 3.496 ( -1.069 -2.269 -2.006) 3.212 3.559 ( 4.229 -8.772 -3.299) 10.282 3.923 ( 3.473 -7.439 1.985) 8.446 4.217 ( -0.140 3.317 -0.939) 3.450 4.287 ( -2.450 -4.638 0.052) 5.246 4.409 ( 12.295 -4.198 0.741) 13.013 4.725 ( -8.653 0.587 -3.550) 9.371 4.873 ( -1.321 -2.470 4.306) 5.137 5.437 ( -0.511 -3.587 -0.368) 3.642 5.568 ( -9.923 -7.482 -2.967) 12.777 5.693 ( -13.311 5.870 2.933) 14.841 6.195 ( -0.206 -4.100 -0.182) 4.110 6.703 ( -0.763 -5.341 0.091) 5.396 7.025 ( -0.125 -12.835 0.696) 12.854 7.284 ( 5.562 -6.816 -0.187) 8.800 8.105 ( 5.114 -6.328 3.496) 8.855 8.607 ( -9.424 14.481 -5.559) 18.150 9.181 ( 6.572 14.361 4.837) 16.518 9.287 ( 0.781 4.286 1.080) 4.488 9.770 ( -1.632 4.519 -1.531) 5.043 10.362 ( -1.416 -1.317 1.469) 2.428 10.656 ( 1.189 9.028 -2.900) 9.557 11.736 ( -0.128 -20.306 0.441) 20.312 11.955 ( -5.435 -19.007 -1.954) 19.865 15.120 ( 5.665 -0.024 -0.567) 5.693 15.512 ( 6.555 2.599 0.801) 7.096 16.474 ( 5.850 -1.441 0.467) 6.043 16.870 ( 3.180 3.011 -0.887) 4.468 21.768 ( -0.222 -13.510 0.665) 13.528 22.224 ( -1.010 2.130 -1.822) 2.979 ======================= Grid point 208 (80/322) ======================= q-point: ( 0.54 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( 6.466 19.281 6.012) 21.206 2.303 ( -2.017 4.633 4.524) 6.782 2.699 ( 1.216 -2.789 0.561) 3.094 3.067 ( -4.559 -5.053 3.922) 7.855 3.255 ( 9.822 -1.812 -2.449) 10.284 3.487 ( -2.325 -5.007 -0.031) 5.521 3.593 ( 1.292 -4.876 1.370) 5.227 3.742 ( 4.410 -7.358 -1.545) 8.716 4.053 ( -2.134 -3.716 3.026) 5.246 4.149 ( 2.537 2.833 -2.103) 4.345 4.341 ( -1.215 -1.978 -1.442) 2.733 4.453 ( 0.397 1.364 -0.307) 1.454 4.584 ( -8.744 5.281 -1.210) 10.286 5.008 ( 1.812 -6.289 -1.552) 6.726 5.490 ( 3.078 -1.049 0.112) 3.254 5.587 ( -13.004 -3.437 0.913) 13.481 5.655 ( -7.282 -5.996 -1.816) 9.606 6.173 ( 1.903 2.976 0.424) 3.558 6.799 ( 1.473 -1.598 0.586) 2.252 7.011 ( 10.321 7.092 1.958) 12.675 7.651 ( -0.174 -17.765 -0.823) 17.785 8.280 ( -11.777 11.128 -4.444) 16.801 8.301 ( 3.414 -9.960 3.758) 11.180 8.961 ( 7.167 12.847 4.523) 15.391 9.185 ( -1.630 5.125 2.043) 5.753 9.654 ( -1.714 5.877 -1.237) 6.246 10.451 ( -0.560 -5.655 -1.438) 5.862 10.532 ( 0.147 1.144 -0.591) 1.296 12.100 ( 1.157 -13.089 -2.236) 13.329 12.278 ( -3.722 -17.746 -1.491) 18.193 15.151 ( 4.307 0.049 0.355) 4.322 15.487 ( 2.949 2.921 0.210) 4.156 16.561 ( 5.295 -3.069 0.036) 6.120 16.814 ( 0.011 3.534 -1.349) 3.783 21.976 ( 0.100 -7.585 -0.097) 7.586 22.147 ( 0.160 4.651 -0.135) 4.656 ======================= Grid point 209 (81/322) ======================= q-point: ( 0.62 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( 2.320 14.681 7.158) 16.497 2.231 ( -1.630 1.424 5.234) 5.664 2.708 ( -1.804 1.355 0.042) 2.257 3.110 ( -4.542 -1.563 3.654) 6.035 3.348 ( 10.883 -1.235 -1.692) 11.082 3.575 ( -0.105 -3.503 0.159) 3.508 3.678 ( 2.414 -2.732 2.675) 4.522 3.891 ( 3.110 -5.355 -0.719) 6.234 4.019 ( -5.319 2.601 -0.608) 5.952 4.166 ( 4.236 -0.088 2.277) 4.810 4.339 ( -7.761 1.851 -4.253) 9.041 4.380 ( -0.790 2.076 -1.465) 2.660 4.485 ( -3.000 1.188 0.923) 3.356 5.081 ( 0.344 -0.988 -3.287) 3.449 5.531 ( 4.103 -0.866 0.184) 4.198 5.652 ( -6.028 -8.538 -0.268) 10.455 5.700 ( -6.143 -2.670 -0.524) 6.719 6.151 ( 2.410 0.515 0.131) 2.468 6.808 ( 3.476 0.960 0.881) 3.712 6.941 ( 7.766 5.915 1.636) 9.898 7.890 ( 1.923 -4.153 -0.402) 4.594 8.039 ( -12.126 3.392 -2.627) 12.862 8.487 ( -1.575 -4.105 4.202) 6.082 8.814 ( 8.412 3.974 3.662) 9.998 9.098 ( -2.783 2.348 2.488) 4.410 9.549 ( -0.547 2.825 -2.115) 3.571 10.477 ( 0.831 -0.471 -2.808) 2.966 10.622 ( -0.899 -4.552 0.638) 4.684 12.233 ( -1.592 -1.896 -2.658) 3.632 12.578 ( 1.655 -11.747 -2.060) 12.040 15.165 ( 2.180 0.717 0.960) 2.487 15.434 ( 0.847 3.579 -0.168) 3.682 16.610 ( 3.416 2.290 -0.546) 4.149 16.741 ( -2.247 1.687 -1.354) 3.119 22.061 ( 0.060 1.719 -0.185) 1.730 22.079 ( 0.111 -1.102 0.237) 1.133 ======================= Grid point 210 (82/322) ======================= q-point: (-0.31 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.947 ( -2.789 -5.767 6.873) 9.396 2.267 ( -0.937 -5.146 4.686) 7.022 2.637 ( -2.272 4.657 0.037) 5.181 3.095 ( -4.296 0.864 3.537) 5.631 3.388 ( 7.034 3.202 -0.955) 7.787 3.601 ( -0.797 0.001 -0.367) 0.878 3.756 ( 7.499 -1.023 2.455) 7.957 3.917 ( -9.589 0.803 -2.305) 9.895 3.979 ( 6.429 1.583 -0.686) 6.657 4.144 ( -6.430 3.365 -0.226) 7.261 4.225 ( -2.084 2.462 -0.020) 3.225 4.383 ( 1.339 -0.700 -1.432) 2.081 4.466 ( -1.260 -0.130 0.493) 1.360 5.056 ( 0.736 2.954 -2.503) 3.941 5.569 ( 4.586 -0.410 0.382) 4.620 5.696 ( -4.984 -0.778 -0.369) 5.058 5.852 ( -0.225 -13.489 0.010) 13.491 6.173 ( 1.417 -1.393 -0.284) 2.007 6.801 ( 9.243 6.360 2.372) 11.467 6.888 ( -0.991 -0.532 0.063) 1.126 7.800 ( -7.707 5.091 -0.274) 9.241 8.032 ( -1.093 -0.042 -0.999) 1.481 8.436 ( 0.117 4.379 1.556) 4.648 8.950 ( 4.500 -8.979 4.894) 11.172 9.078 ( -4.039 -2.093 2.470) 5.176 9.553 ( 1.018 -3.633 -2.659) 4.616 10.481 ( 1.058 0.491 -2.740) 2.977 10.624 ( -1.026 3.870 0.598) 4.048 12.170 ( -0.921 6.801 -1.863) 7.111 12.710 ( 2.774 -0.066 -2.969) 4.064 15.151 ( -0.190 1.311 0.557) 1.437 15.355 ( -0.011 4.706 0.010) 4.706 16.508 ( -0.582 6.964 -0.464) 7.004 16.726 ( -0.802 0.054 -1.077) 1.344 22.042 ( 0.078 -0.773 -0.068) 0.780 22.082 ( -0.201 1.528 0.163) 1.550 ======================= Grid point 211 (83/322) ======================= q-point: (-0.23 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( -4.071 -12.805 5.665) 14.582 2.413 ( 0.989 -7.059 3.022) 7.742 2.488 ( -3.503 8.259 0.698) 8.998 3.040 ( -3.709 2.707 2.957) 5.461 3.300 ( 2.882 7.862 -0.275) 8.378 3.581 ( -0.459 1.795 -1.586) 2.439 3.736 ( 1.178 4.903 -0.315) 5.052 3.875 ( -4.657 3.934 -5.040) 7.910 3.936 ( 4.759 1.751 0.489) 5.094 4.007 ( -6.266 5.186 -2.697) 8.570 4.177 ( 1.362 4.158 3.667) 5.709 4.399 ( 0.336 0.338 -0.520) 0.705 4.489 ( 2.652 -2.337 2.772) 4.492 4.990 ( 0.562 3.046 -0.888) 3.222 5.595 ( 2.825 0.568 0.719) 2.970 5.683 ( -1.925 0.013 -0.736) 2.061 6.178 ( 2.976 -18.393 0.058) 18.632 6.222 ( 0.711 -2.935 -0.310) 3.036 6.661 ( 2.271 10.256 3.300) 11.010 6.926 ( -0.564 -1.669 -0.818) 1.942 7.678 ( -3.238 3.552 0.274) 4.814 7.917 ( -1.533 11.682 -1.126) 11.836 8.435 ( 2.705 -3.955 -0.074) 4.792 9.114 ( -0.565 -4.410 3.460) 5.634 9.162 ( -3.842 -8.796 3.106) 10.089 9.686 ( 1.736 -8.668 -2.281) 9.130 10.434 ( 0.917 6.816 -1.600) 7.061 10.540 ( -0.903 -0.770 -0.553) 1.309 11.965 ( 0.493 13.196 -0.442) 13.213 12.591 ( 1.533 12.890 -3.383) 13.414 15.114 ( -2.071 1.782 -1.286) 3.020 15.251 ( 0.567 5.779 1.517) 6.001 16.375 ( -1.040 5.337 0.100) 5.438 16.712 ( -0.299 0.627 -0.697) 0.984 21.980 ( -0.098 7.274 0.030) 7.275 22.129 ( 0.210 -6.150 -0.270) 6.160 ======================= Grid point 212 (84/322) ======================= q-point: (-0.15 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.325 ( -1.979 -4.134 6.762) 8.169 2.203 ( 0.330 17.588 1.704) 17.674 2.582 ( -1.418 -6.612 1.006) 6.837 2.955 ( -2.186 4.532 1.614) 5.284 3.140 ( 1.183 9.156 0.599) 9.252 3.499 ( -1.544 5.645 -1.464) 6.033 3.669 ( -0.943 1.550 -1.391) 2.286 3.690 ( -7.244 8.456 -9.195) 14.440 3.742 ( 2.295 16.487 -1.597) 16.723 4.000 ( 0.806 1.498 -1.373) 2.186 4.098 ( 3.947 3.120 7.537) 9.063 4.364 ( -0.545 2.692 -0.426) 2.779 4.586 ( 4.821 -3.585 5.794) 8.347 4.965 ( -1.133 -0.933 -0.094) 1.471 5.578 ( -0.194 1.898 -0.566) 1.990 5.648 ( 1.396 3.675 -0.841) 4.020 6.233 ( -0.676 5.914 -0.347) 5.963 6.436 ( -2.275 6.903 3.115) 7.907 6.631 ( 1.511 -20.009 1.155) 20.099 6.942 ( -0.896 -2.869 -1.165) 3.223 7.513 ( 3.869 23.980 -2.671) 24.436 7.660 ( -4.023 1.063 2.040) 4.634 8.609 ( 4.859 -10.636 -1.061) 11.742 9.192 ( -2.872 -3.966 2.675) 5.580 9.320 ( -3.552 -9.399 2.392) 10.329 9.876 ( 0.012 -9.824 -3.048) 10.286 10.295 ( 0.906 5.505 0.646) 5.617 10.651 ( 0.021 -9.512 -2.878) 9.938 11.683 ( 1.285 15.045 1.917) 15.221 12.223 ( -0.569 23.447 -2.708) 23.610 15.044 ( -1.455 4.032 -2.520) 4.972 15.163 ( 1.523 3.531 2.857) 4.790 16.300 ( -0.196 1.774 0.323) 1.813 16.708 ( 0.617 -0.501 -0.205) 0.820 21.776 ( -0.406 13.365 0.968) 13.406 22.279 ( 0.680 -8.290 -2.612) 8.718 ======================= Grid point 213 (85/322) ======================= q-point: (-0.08 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( 0.927 6.873 10.490) 12.575 1.817 ( 5.902 22.898 4.120) 24.003 2.615 ( 0.009 4.988 -3.220) 5.937 2.852 ( -0.237 4.663 1.306) 4.848 2.954 ( 0.192 10.814 1.011) 10.863 3.302 ( -3.737 19.219 -0.714) 19.592 3.370 ( -0.005 9.174 -1.158) 9.246 3.487 ( 2.013 11.232 -8.014) 13.944 3.668 ( -1.309 -0.902 -0.895) 1.824 3.882 ( -3.872 6.329 0.034) 7.419 4.140 ( 3.171 -0.553 6.924) 7.636 4.307 ( 0.020 1.855 -0.568) 1.940 4.667 ( 4.229 0.043 4.571) 6.227 4.997 ( -3.311 -2.384 0.797) 4.157 5.512 ( 0.058 4.384 -1.766) 4.727 5.565 ( 2.926 5.197 -0.475) 5.982 5.878 ( -1.380 27.171 -1.473) 27.246 6.272 ( -7.475 6.771 3.086) 10.547 6.830 ( -1.762 19.331 -0.961) 19.435 7.093 ( -3.155 -12.788 -0.445) 13.178 7.230 ( -0.866 -15.819 -0.211) 15.844 7.691 ( 3.959 -2.950 3.798) 6.229 8.868 ( 7.599 -11.065 -2.799) 13.712 9.229 ( -2.203 -0.539 2.782) 3.589 9.513 ( -4.457 -11.838 0.767) 12.672 10.044 ( -2.887 -8.585 -5.080) 10.385 10.251 ( 2.850 0.646 1.598) 3.331 10.825 ( -1.501 -5.493 -5.576) 7.970 11.450 ( 2.325 7.923 6.284) 10.376 11.716 ( -1.583 24.102 -0.347) 24.156 14.960 ( 3.894 3.848 -0.039) 5.474 15.135 ( 1.630 0.780 0.953) 2.043 16.303 ( 1.180 -1.612 0.382) 2.034 16.745 ( 1.780 -2.591 0.020) 3.144 21.455 ( -0.612 18.756 1.879) 18.860 22.417 ( -0.681 -5.208 -7.541) 9.190 ======================= Grid point 217 (86/322) ======================= q-point: ( 0.23 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 11.537 0.000 20.370) 23.410 1.229 ( 25.558 0.000 7.521) 26.642 2.189 ( 40.081 0.000 -0.476) 40.084 2.413 ( 3.299 0.000 -5.352) 6.287 2.656 ( -13.847 -0.000 5.961) 15.075 2.726 ( -2.402 -0.000 -0.029) 2.402 2.909 ( -6.765 -0.000 -1.317) 6.892 3.311 ( -3.744 -0.000 3.603) 5.197 3.378 ( 24.189 0.000 -1.500) 24.236 3.497 ( -2.979 -0.000 2.254) 3.736 3.756 ( 3.060 0.000 -1.000) 3.219 3.983 ( -3.295 -0.000 2.034) 3.873 4.190 ( -0.473 -0.000 0.945) 1.057 4.493 ( -0.260 -0.000 1.399) 1.423 4.960 ( -9.996 -0.000 -4.671) 11.034 5.302 ( -6.913 -0.000 6.953) 9.805 5.562 ( -7.514 -0.000 0.772) 7.554 5.660 ( -8.650 -0.000 -6.150) 10.613 6.415 ( -4.814 -0.000 7.332) 8.771 7.238 ( -13.991 -0.000 0.227) 13.993 7.834 ( -3.320 -0.000 7.712) 8.396 8.636 ( 8.497 0.000 0.093) 8.497 8.653 ( 1.005 0.000 0.379) 1.074 9.494 ( 0.606 0.000 -5.624) 5.657 9.634 ( 1.320 0.000 0.646) 1.470 10.036 ( 8.812 0.000 -0.347) 8.819 10.554 ( -0.562 -0.000 -0.754) 0.941 10.744 ( 0.527 0.000 -1.803) 1.878 10.903 ( -11.968 -0.000 3.795) 12.556 11.874 ( -1.087 -0.000 2.088) 2.354 15.148 ( 7.377 0.000 -3.582) 8.201 16.039 ( -0.210 -0.000 -2.410) 2.420 17.080 ( 9.944 0.000 -0.628) 9.964 17.947 ( 15.839 0.000 -35.526) 38.897 20.545 ( -0.139 -0.000 0.065) 0.154 20.811 ( 0.026 0.000 -0.051) 0.058 ======================= Grid point 218 (87/322) ======================= q-point: ( 0.31 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 12.098 -7.920 16.110) 21.647 1.614 ( 20.056 -18.101 5.526) 27.576 2.445 ( 12.717 -5.223 -4.330) 14.414 2.498 ( -4.153 -5.894 -0.742) 7.248 2.671 ( 9.671 -8.096 -0.476) 12.622 2.790 ( -2.728 -6.929 0.328) 7.454 2.949 ( -5.828 -7.632 -1.202) 9.678 3.447 ( -2.474 -4.431 2.638) 5.720 3.471 ( 1.657 -7.657 1.029) 7.902 3.591 ( 24.644 -7.098 3.886) 25.939 4.009 ( -1.928 -4.044 2.096) 4.946 4.097 ( -0.114 -22.963 -0.184) 22.964 4.283 ( -0.627 -10.971 2.659) 11.306 4.533 ( -0.557 -7.100 -0.165) 7.124 4.916 ( -11.042 -3.136 -6.410) 13.147 5.271 ( -5.842 -0.196 5.464) 8.002 5.487 ( -9.604 1.987 -0.969) 9.855 5.612 ( -10.829 -3.379 -4.028) 12.037 6.338 ( -3.998 6.484 7.627) 10.779 7.116 ( -13.348 4.547 -0.430) 14.108 7.784 ( -0.839 4.158 6.322) 7.613 8.367 ( 2.893 16.710 1.318) 17.010 8.935 ( 4.580 -13.598 -0.037) 14.349 9.415 ( -0.487 6.878 -4.603) 8.291 9.746 ( 0.360 -6.510 -2.326) 6.922 10.060 ( 8.479 0.989 1.630) 8.690 10.389 ( -1.769 11.254 -0.626) 11.409 10.778 ( 1.998 0.746 0.817) 2.284 10.945 ( -9.661 -10.767 1.116) 14.509 11.780 ( -2.727 8.253 1.103) 8.761 15.176 ( 8.938 1.761 -2.236) 9.381 15.929 ( 2.553 10.170 -1.538) 10.597 17.082 ( 10.632 7.155 -1.052) 12.858 17.300 ( 18.419 41.699 -10.145) 46.701 20.696 ( -0.521 -14.173 0.999) 14.217 21.396 ( -10.103 -39.356 -10.234) 41.902 ======================= Grid point 219 (88/322) ======================= q-point: ( 0.38 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 11.794 -8.970 11.131) 18.533 2.056 ( 13.959 -14.797 3.733) 20.681 2.473 ( -10.452 -2.391 1.931) 10.894 2.644 ( -1.368 -8.306 -2.360) 8.742 2.908 ( 5.162 -7.533 -1.628) 9.276 2.997 ( 6.649 -11.902 -3.774) 14.146 3.124 ( -1.581 -12.126 -0.879) 12.260 3.502 ( -1.959 -2.219 -0.532) 3.007 3.631 ( 3.371 -6.111 0.691) 7.013 3.953 ( 27.215 -12.374 6.113) 30.515 4.083 ( -1.651 -4.327 1.305) 4.811 4.312 ( -0.719 -0.473 3.031) 3.151 4.624 ( 1.161 -13.096 3.023) 13.490 4.771 ( -7.764 -11.016 -1.255) 13.536 5.121 ( -4.242 -28.469 -5.279) 29.264 5.270 ( -9.167 -4.161 -1.058) 10.123 5.413 ( -5.674 -1.191 0.627) 5.832 5.748 ( -14.987 -22.524 -2.809) 27.200 6.136 ( -5.042 12.064 6.739) 14.710 6.904 ( -10.972 8.773 -1.021) 14.085 7.694 ( 6.519 8.000 3.447) 10.880 8.091 ( 0.440 10.397 3.695) 11.042 9.183 ( -1.369 2.829 -7.748) 8.361 9.217 ( 0.647 0.147 1.957) 2.067 9.737 ( 6.631 8.845 -0.297) 11.059 10.050 ( -3.013 8.297 -0.494) 8.841 10.306 ( 4.888 -6.746 0.835) 8.373 10.738 ( -2.950 1.120 1.627) 3.550 11.194 ( -3.395 -17.308 -0.594) 17.647 11.555 ( -3.859 11.153 0.750) 11.825 15.177 ( 8.514 2.874 -0.926) 9.034 15.737 ( 7.065 10.165 -0.163) 12.380 16.735 ( 11.702 19.595 -1.234) 22.856 17.048 ( 7.618 6.491 -0.658) 10.030 21.050 ( -0.740 -20.331 1.715) 20.416 21.925 ( -8.200 -21.547 -8.177) 24.462 ======================= Grid point 220 (89/322) ======================= q-point: ( 0.46 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.745 ( 10.999 -2.032 7.600) 13.523 2.351 ( 4.846 -6.909 2.319) 8.752 2.478 ( -5.416 -4.530 2.980) 7.664 2.791 ( -2.045 -8.009 0.359) 8.274 3.083 ( 6.031 -7.276 -1.232) 9.531 3.229 ( 1.039 -9.692 0.147) 9.748 3.369 ( 2.296 -11.662 -2.719) 12.193 3.478 ( -2.960 1.072 -2.462) 3.997 3.805 ( 6.000 -7.566 1.189) 9.729 4.164 ( -4.373 -5.274 1.194) 6.955 4.258 ( 0.897 0.270 0.179) 0.954 4.381 ( 21.891 -8.242 3.335) 23.628 4.667 ( -5.840 0.311 -2.492) 6.357 4.861 ( -5.389 -0.551 3.392) 6.392 5.288 ( -11.816 -6.344 -5.685) 14.567 5.380 ( -7.232 -5.116 2.172) 9.121 5.816 ( -1.940 -12.979 0.379) 13.129 5.871 ( -3.028 -4.237 2.729) 5.880 6.331 ( -9.453 -39.468 -1.949) 40.631 6.693 ( -5.537 5.713 -0.247) 7.959 7.531 ( 11.112 13.195 2.085) 17.376 8.031 ( -0.225 -2.779 4.285) 5.112 8.861 ( -6.428 16.370 -7.067) 18.954 9.327 ( 0.854 -0.869 2.925) 3.169 9.537 ( 8.726 14.929 1.785) 17.384 9.862 ( -1.654 6.765 -1.965) 7.236 10.386 ( -1.194 2.370 2.415) 3.588 10.774 ( 0.933 -1.290 -2.727) 3.158 11.417 ( -4.345 -5.167 1.603) 6.939 11.550 ( -2.400 -19.238 -1.075) 19.417 15.174 ( 7.241 1.798 -0.024) 7.461 15.629 ( 6.213 5.391 0.244) 8.229 16.545 ( 6.548 6.095 0.183) 8.948 16.968 ( 4.404 5.066 -0.863) 6.768 21.445 ( -0.541 -18.884 1.447) 18.947 22.163 ( -3.277 -7.781 -4.211) 9.435 ======================= Grid point 221 (90/322) ======================= q-point: ( 0.54 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( 8.069 11.004 6.258) 15.012 2.370 ( -2.831 2.053 3.983) 5.300 2.616 ( 0.283 -6.451 1.667) 6.669 2.935 ( -1.018 -6.894 2.379) 7.364 3.256 ( 9.967 -5.128 -1.266) 11.280 3.365 ( -3.651 -4.802 -0.130) 6.034 3.493 ( 0.693 -5.054 -0.170) 5.104 3.597 ( 3.721 -9.515 -2.479) 10.513 3.961 ( 0.355 -4.996 3.454) 6.084 4.187 ( -3.005 0.025 -1.808) 3.507 4.279 ( 1.211 -2.922 -0.006) 3.163 4.508 ( 1.782 3.430 -0.875) 3.963 4.627 ( -3.997 2.397 -2.642) 5.357 4.894 ( 3.743 -5.627 2.213) 7.111 5.358 ( -10.474 -8.041 -5.706) 14.385 5.447 ( -9.137 -5.400 2.503) 10.905 5.625 ( -1.087 5.908 1.959) 6.318 6.196 ( 0.364 -4.451 -0.287) 4.475 6.693 ( -0.772 -7.293 -0.071) 7.334 7.005 ( -2.237 -26.627 -0.243) 26.722 7.388 ( 9.479 4.052 2.286) 10.559 8.148 ( 0.556 -7.421 3.307) 8.143 8.485 ( -7.322 15.850 -5.422) 18.282 9.271 ( 3.387 8.903 6.659) 11.623 9.298 ( 2.715 10.801 -0.666) 11.157 9.750 ( -0.827 4.868 -1.531) 5.169 10.342 ( -2.581 -1.615 1.225) 3.282 10.660 ( 1.099 9.299 -2.718) 9.750 11.736 ( 0.032 -22.904 -0.145) 22.905 11.897 ( -3.461 -17.335 -1.338) 17.728 15.189 ( 5.642 0.777 0.625) 5.730 15.571 ( 3.108 3.772 0.011) 4.887 16.540 ( 4.830 -1.295 0.144) 5.003 16.894 ( 1.480 4.312 -1.290) 4.737 21.768 ( -0.132 -13.592 0.667) 13.609 22.209 ( -0.614 0.801 -1.649) 1.933 ======================= Grid point 222 (91/322) ======================= q-point: ( 0.62 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 3.768 20.710 6.382) 21.996 2.297 ( -1.465 4.359 5.234) 6.967 2.695 ( -1.504 -1.966 0.532) 2.532 3.041 ( -1.851 -3.967 3.158) 5.397 3.375 ( 9.707 -1.977 -1.989) 10.104 3.471 ( 0.219 -6.796 0.046) 6.800 3.610 ( 0.267 -5.180 2.271) 5.662 3.782 ( 3.287 -7.172 -1.611) 8.052 3.991 ( -8.382 -0.814 2.208) 8.706 4.204 ( 6.398 -0.781 -0.699) 6.483 4.326 ( -0.189 -0.282 -1.308) 1.351 4.406 ( -6.064 3.320 -1.966) 7.188 4.526 ( -1.990 4.282 0.119) 4.723 5.023 ( 1.245 -4.389 -2.736) 5.320 5.446 ( -6.889 -6.833 -3.677) 10.376 5.503 ( -2.350 -4.912 1.312) 5.601 5.613 ( -0.922 -2.450 1.190) 2.876 6.189 ( 0.673 2.122 -0.393) 2.261 6.804 ( -0.115 -2.478 -0.093) 2.482 7.136 ( 7.866 6.185 2.957) 10.434 7.661 ( 1.766 -18.354 0.058) 18.439 8.148 ( -7.285 12.231 -3.001) 14.549 8.329 ( -0.222 -9.089 3.283) 9.666 9.052 ( 4.823 13.067 2.363) 14.128 9.168 ( -1.680 5.402 3.299) 6.548 9.631 ( -1.290 5.762 -1.602) 6.118 10.440 ( -0.581 -6.614 -1.176) 6.743 10.532 ( 0.305 1.747 -0.820) 1.954 12.104 ( 1.025 -10.677 -1.961) 10.903 12.243 ( -1.712 -20.882 -1.344) 20.995 15.201 ( 3.468 1.051 1.193) 3.815 15.509 ( 0.888 3.606 -0.302) 3.726 16.617 ( 3.933 -3.060 -0.390) 4.999 16.801 ( -1.172 5.085 -1.551) 5.444 21.977 ( 0.133 -7.573 -0.045) 7.574 22.148 ( -0.012 4.332 -0.254) 4.340 ======================= Grid point 223 (92/322) ======================= q-point: (-0.31 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( -0.463 16.607 6.718) 17.921 2.230 ( -1.349 1.416 5.416) 5.759 2.689 ( -1.123 1.637 -0.117) 1.989 3.081 ( -2.186 -0.965 3.537) 4.269 3.453 ( 6.353 -0.718 -0.810) 6.444 3.573 ( 0.103 -2.448 -0.520) 2.504 3.717 ( 0.823 -5.615 2.266) 6.110 3.875 ( -2.871 -0.685 -0.782) 3.053 3.982 ( -0.626 -2.872 -0.533) 2.988 4.211 ( -4.561 6.687 -1.971) 8.331 4.256 ( 3.853 0.091 0.734) 3.923 4.385 ( 1.029 -0.484 -0.663) 1.316 4.460 ( -1.535 1.119 0.354) 1.932 5.073 ( -0.212 -1.020 -3.658) 3.803 5.551 ( 0.402 -5.274 -2.477) 5.841 5.620 ( 1.127 -7.751 1.070) 7.906 5.645 ( -4.175 -1.824 0.869) 4.638 6.164 ( 0.041 0.339 -0.809) 0.878 6.823 ( 0.022 -0.905 -0.086) 0.909 7.041 ( 5.116 7.706 3.168) 9.777 7.898 ( -1.318 8.228 -0.419) 8.344 7.945 ( -0.666 -8.177 -0.678) 8.232 8.474 ( -2.434 -3.233 3.182) 5.148 8.886 ( 1.089 3.176 2.116) 3.969 9.080 ( -0.781 2.992 3.183) 4.437 9.539 ( 0.016 2.134 -2.299) 3.137 10.479 ( 0.884 -0.587 -2.737) 2.935 10.615 ( -0.555 -4.488 0.596) 4.561 12.220 ( 0.589 -1.461 -1.649) 2.280 12.584 ( 0.513 -12.819 -2.718) 13.114 15.188 ( 0.934 1.867 1.145) 2.381 15.439 ( 0.132 3.808 -0.307) 3.822 16.648 ( 2.943 5.858 -0.923) 6.620 16.707 ( -2.400 -0.637 -1.184) 2.751 22.060 ( -0.089 1.511 -0.273) 1.539 22.081 ( 0.099 -0.802 0.279) 0.855 ======================= Grid point 224 (93/322) ======================= q-point: (-0.23 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( -3.308 -4.391 5.930) 8.086 2.267 ( -1.494 -5.292 4.522) 7.119 2.620 ( -0.446 4.946 -0.222) 4.971 3.069 ( -1.711 1.351 3.296) 3.951 3.445 ( 2.632 4.498 0.389) 5.226 3.585 ( -1.342 -0.079 -1.390) 1.934 3.789 ( -10.115 -0.515 -1.735) 10.276 3.866 ( 9.423 -0.514 1.305) 9.527 4.017 ( -9.593 2.164 -3.271) 10.363 4.050 ( 4.181 3.919 -1.700) 5.977 4.259 ( 4.391 2.539 2.597) 5.698 4.401 ( 1.219 -0.358 -0.031) 1.271 4.468 ( 2.083 -1.755 1.854) 3.295 5.051 ( -0.121 2.493 -2.977) 3.885 5.608 ( -1.223 -0.057 0.326) 1.267 5.658 ( 1.785 -1.905 0.165) 2.616 5.853 ( 0.363 -14.753 0.259) 14.760 6.172 ( -1.091 -1.516 -1.085) 2.160 6.864 ( -1.786 -2.628 -0.221) 3.185 6.889 ( 1.358 9.365 2.967) 9.917 7.752 ( 1.455 5.648 0.459) 5.850 8.032 ( 0.614 0.576 -0.738) 1.119 8.439 ( -0.342 2.619 1.370) 2.975 8.962 ( -5.247 -8.451 2.626) 10.288 9.062 ( 0.775 -1.060 3.209) 3.467 9.559 ( 1.254 -4.256 -2.307) 5.001 10.484 ( 0.912 0.323 -2.755) 2.920 10.616 ( -0.453 4.151 0.526) 4.209 12.171 ( 1.758 6.745 -0.950) 7.035 12.714 ( -0.338 -0.316 -3.740) 3.768 15.145 ( -0.963 2.358 0.025) 2.547 15.359 ( 0.601 4.472 0.407) 4.530 16.504 ( 0.259 7.614 -0.442) 7.631 16.720 ( 0.438 -0.139 -0.917) 1.026 22.044 ( 0.222 -1.003 0.037) 1.028 22.080 ( -0.183 1.762 0.097) 1.774 ======================= Grid point 225 (94/322) ======================= q-point: (-0.15 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.135 ( -1.780 -13.337 4.961) 14.341 2.405 ( -3.826 -7.218 2.768) 8.625 2.483 ( 2.384 8.338 0.554) 8.690 3.023 ( -0.524 3.001 2.276) 3.803 3.325 ( 0.915 8.254 0.954) 8.359 3.555 ( -2.340 1.969 -2.961) 4.257 3.703 ( -4.807 2.867 -1.600) 5.822 3.798 ( -6.327 7.745 -4.052) 10.791 3.983 ( 3.008 4.129 -1.356) 5.285 3.995 ( 4.645 0.681 -1.199) 4.845 4.221 ( 3.977 4.424 3.126) 6.720 4.398 ( -0.326 0.980 -0.899) 1.370 4.560 ( 6.940 -3.682 6.278) 10.057 4.980 ( -1.375 3.276 -1.618) 3.904 5.578 ( -5.437 0.329 0.024) 5.447 5.708 ( 5.514 0.407 0.284) 5.536 6.185 ( -1.947 -15.804 0.148) 15.925 6.217 ( -1.068 -6.486 -0.353) 6.583 6.658 ( -4.525 10.987 3.066) 12.271 6.920 ( -0.128 -1.299 -1.094) 1.703 7.691 ( 5.108 2.840 0.915) 5.916 7.902 ( -0.189 13.092 -1.574) 13.188 8.468 ( 2.554 -5.357 1.003) 6.018 9.071 ( -6.918 -6.340 0.861) 9.423 9.152 ( -0.199 -6.254 3.586) 7.212 9.696 ( 1.031 -8.320 -1.700) 8.555 10.443 ( 1.276 7.114 -1.400) 7.362 10.530 ( -0.411 -1.195 -0.840) 1.517 11.981 ( 2.287 13.190 0.244) 13.389 12.574 ( -2.413 12.898 -4.053) 13.734 15.088 ( -1.396 2.491 -1.699) 3.323 15.275 ( 2.531 4.926 1.870) 5.846 16.375 ( 1.098 5.455 0.118) 5.566 16.718 ( 1.574 0.503 -0.479) 1.720 21.979 ( -0.118 7.371 -0.018) 7.372 22.131 ( 0.354 -6.202 -0.170) 6.214 ======================= Grid point 226 (95/322) ======================= q-point: (-0.08 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( 1.509 -5.408 6.546) 8.624 2.232 ( 3.513 15.279 1.929) 15.796 2.564 ( -1.939 -6.008 0.731) 6.356 2.953 ( 1.034 4.529 1.074) 4.768 3.152 ( 0.082 9.414 1.007) 9.468 3.466 ( -2.549 5.157 -2.035) 6.102 3.577 ( -5.401 10.194 -7.991) 14.034 3.644 ( -2.849 0.363 -1.897) 3.442 3.798 ( 5.557 13.928 -0.530) 15.005 4.010 ( 2.729 4.979 -0.913) 5.751 4.167 ( 3.789 1.858 4.928) 6.488 4.355 ( -0.711 2.743 -0.772) 2.937 4.682 ( 7.436 -2.252 7.721) 10.953 4.935 ( -3.268 -0.976 -0.344) 3.428 5.539 ( -5.202 0.577 -0.811) 5.296 5.685 ( 3.952 4.479 -0.768) 6.022 6.198 ( -5.204 5.501 -0.014) 7.573 6.366 ( -10.031 5.597 1.790) 11.625 6.654 ( 1.825 -17.071 1.902) 17.273 6.933 ( 0.226 -3.133 -1.539) 3.497 7.473 ( -7.180 24.387 -2.049) 25.504 7.722 ( 10.835 1.782 1.704) 11.112 8.670 ( 5.425 -11.755 0.293) 12.950 9.162 ( -3.417 -5.650 0.622) 6.632 9.284 ( -3.295 -7.920 2.333) 8.890 9.858 ( -1.441 -8.003 -2.872) 8.624 10.315 ( 2.018 4.418 1.030) 4.965 10.645 ( 0.594 -9.135 -3.106) 9.667 11.705 ( 1.283 15.023 2.401) 15.268 12.186 ( -3.923 22.892 -3.133) 23.436 15.030 ( 0.285 2.498 -2.361) 3.449 15.212 ( 5.488 3.863 2.715) 7.240 16.312 ( 2.093 1.805 0.305) 2.780 16.730 ( 2.963 -0.598 -0.072) 3.024 21.774 ( -0.424 13.356 0.878) 13.391 22.274 ( -0.156 -7.476 -2.524) 7.892 ======================= Grid point 231 (96/322) ======================= q-point: ( 0.31 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.291 ( 13.720 0.000 15.804) 20.929 1.545 ( 24.383 0.000 5.677) 25.035 2.411 ( -11.696 -0.000 2.130) 11.888 2.424 ( 0.355 0.000 -3.809) 3.826 2.674 ( 24.821 0.000 -3.734) 25.101 2.697 ( -1.937 -0.000 -1.904) 2.716 2.824 ( -6.524 -0.000 -1.142) 6.623 3.277 ( -3.909 -0.000 4.423) 5.903 3.495 ( 1.404 0.000 4.678) 4.884 3.709 ( 28.794 0.000 5.014) 29.227 3.787 ( 2.569 0.000 -1.296) 2.877 3.959 ( -0.938 -0.000 1.292) 1.597 4.183 ( -0.890 -0.000 0.946) 1.299 4.481 ( -1.790 -0.000 1.044) 2.072 4.830 ( -9.177 -0.000 -5.703) 10.805 5.242 ( -8.151 -0.000 4.596) 9.357 5.454 ( -9.067 -0.000 0.239) 9.071 5.506 ( -14.316 -0.000 -4.162) 14.909 6.405 ( -1.290 -0.000 8.446) 8.544 7.086 ( -11.628 -0.000 0.436) 11.637 7.819 ( -2.935 -0.000 7.077) 7.661 8.667 ( 1.141 0.000 0.168) 1.153 8.724 ( 6.352 0.000 0.027) 6.352 9.474 ( -0.916 -0.000 -5.251) 5.330 9.650 ( 1.167 0.000 0.334) 1.213 10.148 ( 9.902 0.000 0.525) 9.916 10.546 ( -0.423 -0.000 -0.573) 0.712 10.699 ( -7.085 -0.000 -1.084) 7.167 10.820 ( -4.171 -0.000 2.456) 4.841 11.846 ( -3.832 -0.000 -0.022) 3.832 15.253 ( 11.090 0.000 -0.830) 11.121 16.016 ( -2.381 -0.000 -1.680) 2.914 17.209 ( 11.978 0.000 -0.615) 11.994 17.959 ( 3.692 0.000 -25.082) 25.352 20.544 ( -0.121 -0.000 0.083) 0.147 20.811 ( 0.024 0.000 -0.051) 0.056 ======================= Grid point 232 (97/322) ======================= q-point: ( 0.38 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 14.183 -6.777 12.439) 20.046 1.863 ( 19.325 -13.938 4.177) 24.191 2.339 ( -17.281 -2.468 4.051) 17.921 2.484 ( -3.134 -6.124 -3.095) 7.544 2.763 ( -1.230 -6.950 -1.013) 7.131 2.883 ( 12.842 -8.339 -4.785) 16.042 2.890 ( 4.185 -7.430 -2.875) 9.000 3.414 ( -3.850 -8.680 3.106) 9.991 3.510 ( 5.206 -4.499 1.465) 7.034 3.915 ( 14.495 -7.020 7.174) 17.631 4.020 ( 10.367 -4.900 1.021) 11.512 4.110 ( 3.524 -20.297 0.861) 20.618 4.287 ( 0.019 -11.811 3.586) 12.344 4.525 ( -0.266 -8.481 0.160) 8.487 4.771 ( -9.284 -1.147 -6.751) 11.536 5.184 ( -12.190 -0.254 -1.621) 12.300 5.395 ( -6.016 0.999 4.208) 7.410 5.432 ( -15.572 -2.691 -3.556) 16.198 6.334 ( -1.299 7.792 8.370) 11.509 6.976 ( -10.026 4.813 0.059) 11.122 7.798 ( -0.268 1.503 6.215) 6.400 8.396 ( 1.514 17.154 0.704) 17.235 8.983 ( 3.438 -12.890 -0.102) 13.341 9.381 ( -1.981 7.648 -6.147) 10.011 9.756 ( 1.574 -7.184 0.219) 7.358 10.164 ( 7.776 4.016 1.524) 8.883 10.375 ( 0.134 9.194 -0.553) 9.212 10.771 ( -5.570 2.656 2.240) 6.565 10.861 ( -3.175 -13.931 -0.806) 14.311 11.738 ( -3.961 8.124 -0.924) 9.085 15.292 ( 10.639 2.675 0.394) 10.977 15.931 ( -0.977 6.529 -1.189) 6.708 17.207 ( 10.737 7.498 -0.863) 13.124 17.425 ( 8.773 36.601 -10.175) 38.988 20.693 ( -0.445 -14.119 0.874) 14.153 21.278 ( -5.842 -34.913 -5.879) 35.883 ======================= Grid point 233 (98/322) ======================= q-point: ( 0.46 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.720 ( 13.131 -7.575 8.892) 17.575 2.212 ( 10.375 -10.822 2.711) 15.235 2.328 ( -14.803 -5.372 4.135) 16.282 2.612 ( -2.772 -9.024 -1.818) 9.614 2.927 ( 0.216 -9.634 0.005) 9.636 3.074 ( 3.296 -8.774 -0.070) 9.373 3.139 ( 7.503 -11.481 -4.132) 14.325 3.468 ( -2.826 -0.715 -0.377) 2.939 3.699 ( 7.734 -7.588 0.341) 10.840 4.043 ( -4.248 -4.592 2.106) 6.601 4.248 ( 7.454 -3.610 0.915) 8.333 4.383 ( 19.600 -5.747 6.289) 21.371 4.640 ( -0.128 -11.442 2.911) 11.807 4.674 ( -6.325 -7.391 -2.718) 10.101 5.035 ( -12.617 -22.101 -4.305) 25.810 5.152 ( -2.971 -10.790 -3.982) 11.879 5.391 ( -1.120 -5.017 4.741) 6.993 5.538 ( -17.722 -24.248 -2.608) 30.147 6.118 ( -2.173 13.264 5.761) 14.624 6.797 ( -6.641 7.446 0.175) 9.979 7.786 ( 6.730 3.493 3.740) 8.455 8.085 ( -2.891 11.887 2.519) 12.490 9.115 ( -3.745 11.161 -9.355) 15.037 9.253 ( 2.626 -6.342 3.211) 7.578 9.820 ( 7.039 5.315 0.479) 8.833 10.016 ( -2.767 10.666 0.561) 11.033 10.372 ( 5.773 -4.614 0.776) 7.431 10.686 ( -6.527 -0.096 1.389) 6.674 11.165 ( -1.212 -17.940 -0.601) 17.991 11.508 ( -3.671 11.306 -1.038) 11.932 15.279 ( 8.259 3.962 1.067) 9.222 15.786 ( 1.966 7.334 -0.577) 7.615 16.848 ( 7.984 21.559 -1.880) 23.067 17.125 ( 5.589 8.012 -1.318) 9.857 21.047 ( -0.625 -20.346 1.557) 20.415 21.829 ( -4.361 -23.345 -5.656) 24.413 ======================= Grid point 234 (99/322) ======================= q-point: ( 0.54 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.891 ( 9.290 -0.273 6.848) 11.544 2.337 ( -6.996 -3.493 3.968) 8.769 2.462 ( 0.257 -8.928 2.480) 9.270 2.787 ( 0.898 -8.714 0.457) 8.772 3.130 ( 1.794 -9.889 -0.141) 10.052 3.256 ( 2.530 -7.152 1.599) 7.753 3.398 ( 4.265 -10.819 -2.945) 11.996 3.450 ( -0.378 -0.748 -1.682) 1.879 3.880 ( 5.637 -5.446 1.924) 8.071 4.097 ( -7.171 -4.215 1.530) 8.457 4.267 ( 0.878 -0.256 -0.464) 1.025 4.583 ( -1.099 3.566 -2.843) 4.691 4.629 ( 10.875 -2.636 -1.895) 11.349 4.852 ( 3.646 -3.289 5.649) 7.485 5.076 ( -18.116 -9.484 -7.238) 21.691 5.336 ( -3.307 -3.362 4.449) 6.484 5.784 ( -3.248 5.816 1.751) 6.888 5.870 ( 0.893 -24.112 -0.343) 24.131 6.244 ( -4.353 -40.810 -0.967) 41.053 6.646 ( -2.525 3.820 0.481) 4.604 7.657 ( 8.240 13.173 2.037) 15.671 8.016 ( -3.881 -5.155 3.780) 7.478 8.780 ( -3.081 17.111 -7.234) 18.831 9.346 ( 0.725 0.303 4.090) 4.165 9.631 ( 5.652 15.457 1.847) 16.562 9.847 ( 0.170 5.592 -1.814) 5.882 10.367 ( -3.032 4.476 1.987) 5.760 10.779 ( 1.232 -2.794 -2.266) 3.802 11.374 ( -3.276 -6.170 0.352) 6.995 11.528 ( -0.782 -18.732 -0.697) 18.761 15.255 ( 5.716 2.539 1.516) 6.436 15.675 ( 1.865 5.269 -0.460) 5.609 16.609 ( 3.863 6.954 -0.309) 7.961 17.005 ( 2.276 6.223 -1.329) 6.758 21.443 ( -0.419 -18.977 1.379) 19.032 22.125 ( -1.117 -9.377 -3.351) 10.020 ======================= Grid point 235 (100/322) ======================= q-point: ( 0.62 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( 2.966 12.550 6.545) 14.462 2.354 ( -1.715 0.494 5.213) 5.511 2.608 ( -1.603 -5.934 1.445) 6.314 2.943 ( 0.669 -6.068 2.058) 6.443 3.317 ( -1.260 -7.902 -0.282) 8.007 3.372 ( 6.084 -3.823 -0.952) 7.248 3.501 ( 0.083 -5.275 0.946) 5.359 3.639 ( 4.897 -9.559 -2.104) 10.945 3.935 ( -5.593 -0.277 4.293) 7.056 4.166 ( 0.201 -4.887 -1.410) 5.090 4.307 ( 2.527 -2.257 -0.385) 3.410 4.470 ( -2.608 5.667 -2.627) 6.769 4.612 ( -0.003 4.720 -0.987) 4.822 4.933 ( -1.462 -4.242 -2.741) 5.258 5.239 ( -3.185 -10.808 -3.408) 11.771 5.389 ( -1.731 -4.192 4.178) 6.167 5.620 ( -1.404 3.916 -0.044) 4.161 6.198 ( 0.094 -4.117 -0.601) 4.162 6.687 ( -0.197 -8.008 -0.069) 8.011 6.985 ( -0.693 -30.486 -0.263) 30.495 7.483 ( 3.869 5.784 3.207) 7.663 8.146 ( -1.883 -7.913 2.757) 8.589 8.422 ( -0.525 16.265 -4.359) 16.847 9.270 ( -2.799 7.051 1.999) 7.846 9.368 ( 4.804 13.565 4.191) 14.989 9.740 ( -0.143 5.779 -1.829) 6.063 10.316 ( -2.049 -2.532 0.803) 3.355 10.665 ( 1.078 9.553 -2.470) 9.926 11.735 ( -0.066 -25.228 -0.414) 25.232 11.868 ( -0.662 -15.741 -0.894) 15.780 15.248 ( 3.351 1.424 1.878) 4.097 15.588 ( 0.078 4.175 -0.684) 4.231 16.579 ( 1.506 -1.321 -0.414) 2.046 16.900 ( 0.410 5.234 -1.543) 5.472 21.769 ( -0.068 -13.657 0.710) 13.675 22.201 ( 0.012 0.230 -1.576) 1.592 ======================= Grid point 236 (101/322) ======================= q-point: (-0.31 -0.69 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( -1.031 21.588 6.585) 22.594 2.302 ( -0.618 4.456 5.855) 7.384 2.682 ( -0.644 -2.048 0.405) 2.185 3.038 ( -0.534 -3.238 3.035) 4.470 3.422 ( 0.460 -4.275 -0.876) 4.388 3.512 ( 4.810 -5.287 -1.387) 7.281 3.593 ( -5.247 -4.855 2.656) 7.626 3.828 ( 5.917 -6.215 -1.513) 8.714 3.909 ( -5.386 -1.095 2.397) 5.996 4.237 ( -1.515 -0.753 -2.131) 2.721 4.338 ( -2.340 2.233 -1.447) 3.543 4.369 ( 6.920 0.707 1.006) 7.028 4.510 ( -0.857 4.382 -0.299) 4.475 5.003 ( -2.665 -4.629 -4.948) 7.281 5.384 ( -1.033 -7.477 -2.638) 7.996 5.531 ( 5.911 -6.637 2.527) 9.240 5.591 ( -3.718 -1.037 -0.406) 3.882 6.186 ( -0.848 2.028 -1.072) 2.445 6.802 ( -0.104 -2.435 -0.199) 2.445 7.186 ( -1.311 4.445 2.670) 5.348 7.680 ( 0.655 -17.837 0.826) 17.869 8.120 ( 4.284 12.610 -0.968) 13.353 8.323 ( -2.192 -8.584 2.378) 9.174 9.048 ( -5.204 11.329 -0.020) 12.467 9.198 ( 3.392 7.770 5.273) 9.984 9.616 ( -0.247 5.625 -2.026) 5.984 10.433 ( 0.003 -7.195 -1.166) 7.289 10.535 ( 0.593 2.033 -0.768) 2.253 12.116 ( 1.753 -9.358 -1.104) 9.585 12.225 ( -0.347 -22.458 -1.828) 22.535 15.233 ( 0.897 1.837 1.998) 2.859 15.508 ( -0.816 3.552 -0.842) 3.741 16.637 ( -0.652 -3.582 -0.931) 3.758 16.790 ( 0.462 6.011 -1.522) 6.218 21.979 ( 0.120 -7.527 0.017) 7.528 22.146 ( -0.156 4.203 -0.378) 4.223 ======================= Grid point 237 (102/322) ======================= q-point: (-0.23 -0.69 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( -3.501 17.494 6.521) 18.995 2.233 ( -1.035 1.782 5.572) 5.941 2.684 ( 0.568 1.674 -0.247) 1.785 3.078 ( -0.402 -0.653 3.407) 3.492 3.482 ( -0.874 -1.341 0.188) 1.611 3.580 ( 1.120 -0.190 -0.129) 1.143 3.659 ( -8.440 -5.540 0.006) 10.096 3.907 ( 4.580 -0.720 0.749) 4.696 3.964 ( -0.990 -3.267 -1.448) 3.708 4.139 ( -3.491 4.817 -2.539) 6.468 4.344 ( 6.577 1.402 -0.347) 6.734 4.396 ( 1.494 0.040 0.828) 1.708 4.462 ( 2.033 -0.187 1.940) 2.816 5.055 ( -0.219 -1.766 -4.676) 5.004 5.553 ( 1.009 -7.976 -2.339) 8.373 5.585 ( -5.404 -2.766 0.192) 6.074 5.681 ( 7.506 -4.309 1.795) 8.839 6.149 ( -2.073 0.408 -1.400) 2.534 6.818 ( -0.807 -0.778 -0.146) 1.131 7.046 ( -5.607 7.224 3.089) 9.653 7.897 ( 0.937 1.396 -0.588) 1.781 7.993 ( 8.530 -0.520 1.450) 8.668 8.455 ( -1.941 -3.430 2.299) 4.562 8.846 ( -7.634 2.772 0.822) 8.163 9.103 ( 1.946 3.933 3.914) 5.880 9.536 ( 0.763 1.675 -2.393) 3.019 10.480 ( 0.765 -0.618 -2.709) 2.882 10.615 ( 0.199 -4.349 0.626) 4.399 12.237 ( 2.839 -1.513 -0.977) 3.362 12.573 ( -0.783 -12.613 -3.170) 13.029 15.191 ( -0.955 2.583 1.298) 3.045 15.435 ( -0.560 3.303 -0.472) 3.383 16.643 ( -2.840 4.913 -1.050) 5.771 16.709 ( 2.951 -0.079 -1.158) 3.171 22.057 ( -0.213 1.348 -0.318) 1.401 22.083 ( 0.057 -0.719 0.290) 0.777 ======================= Grid point 238 (103/322) ======================= q-point: (-0.15 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( -2.964 -4.804 5.574) 7.933 2.260 ( -1.987 -4.560 4.510) 6.715 2.626 ( 1.645 4.771 -0.292) 5.055 3.073 ( 0.622 1.498 2.658) 3.114 3.447 ( -3.248 3.711 1.934) 5.298 3.571 ( 0.305 1.234 -1.613) 2.053 3.680 ( -7.458 -1.367 -1.135) 7.667 3.894 ( -7.490 5.219 -2.989) 9.606 3.972 ( 6.925 -1.394 -0.314) 7.071 4.088 ( 2.505 1.615 -1.122) 3.184 4.323 ( 5.026 3.301 0.255) 6.018 4.401 ( -0.404 -0.151 -1.201) 1.276 4.540 ( 7.288 -3.409 5.943) 10.003 5.043 ( 0.781 2.634 -3.592) 4.522 5.539 ( -7.970 -0.055 -0.585) 7.991 5.734 ( 7.896 -2.565 0.959) 8.357 5.863 ( 1.017 -13.079 0.409) 13.125 6.143 ( -3.010 -1.657 -1.452) 3.731 6.801 ( -8.942 4.823 1.984) 10.352 6.894 ( -0.431 1.546 0.383) 1.650 7.829 ( 8.633 5.785 0.820) 10.424 8.046 ( 3.410 2.035 0.106) 3.973 8.437 ( -0.655 1.288 1.051) 1.786 8.873 ( -9.879 -7.801 1.442) 12.670 9.090 ( 1.418 -1.173 3.393) 3.860 9.567 ( 1.155 -4.557 -1.901) 5.071 10.485 ( 0.622 0.206 -2.791) 2.867 10.617 ( 0.294 4.370 0.532) 4.412 12.203 ( 3.761 6.836 -0.591) 7.825 12.681 ( -3.028 0.274 -4.083) 5.091 15.131 ( -1.310 2.742 -0.162) 3.043 15.370 ( 0.943 3.356 0.532) 3.526 16.511 ( 0.999 6.856 -0.341) 6.937 16.730 ( 1.660 -0.342 -0.925) 1.931 22.047 ( 0.324 -1.346 0.115) 1.390 22.078 ( -0.134 1.946 0.041) 1.951 ======================= Grid point 239 (104/322) ======================= q-point: (-0.08 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.145 ( 1.027 -14.736 4.651) 15.487 2.365 ( -3.828 -5.020 2.683) 6.859 2.526 ( 4.277 5.903 0.709) 7.324 3.040 ( 2.147 3.027 1.575) 4.031 3.318 ( -3.388 7.342 1.919) 8.310 3.527 ( -0.379 2.966 -2.279) 3.760 3.638 ( -5.178 1.083 -1.911) 5.624 3.719 ( -4.207 7.983 -3.701) 9.753 4.003 ( 1.397 4.648 -1.044) 4.964 4.063 ( 6.007 0.069 -0.463) 6.025 4.280 ( 4.910 4.435 1.069) 6.702 4.388 ( -0.561 1.075 -1.462) 1.900 4.680 ( 8.638 -4.412 7.920) 12.523 4.958 ( -0.996 4.814 -2.062) 5.331 5.495 ( -7.698 -0.499 -0.416) 7.725 5.777 ( 5.005 2.225 0.159) 5.480 6.145 ( -6.233 -14.696 0.401) 15.968 6.170 ( -6.207 -2.662 -0.148) 6.756 6.615 ( -1.898 5.543 2.577) 6.401 6.914 ( -0.182 -0.746 -1.341) 1.545 7.746 ( 0.856 8.258 -0.022) 8.302 7.939 ( 8.823 10.608 0.164) 13.799 8.498 ( 1.750 -7.420 0.855) 7.672 8.978 ( -8.652 -8.275 0.434) 11.980 9.165 ( 0.403 -4.694 3.076) 5.626 9.699 ( 0.172 -7.545 -1.210) 7.643 10.454 ( 1.262 6.658 -1.428) 6.925 10.526 ( 0.133 -1.244 -0.783) 1.476 12.016 ( 3.237 13.768 0.280) 14.146 12.514 ( -5.438 13.139 -4.174) 14.820 15.073 ( -0.167 2.364 -1.561) 2.838 15.320 ( 4.091 3.217 1.728) 5.484 16.400 ( 2.939 5.224 0.162) 5.997 16.744 ( 2.908 -0.043 -0.480) 2.947 21.977 ( -0.103 7.458 -0.071) 7.459 22.136 ( 0.430 -5.993 -0.085) 6.009 ======================= Grid point 245 (105/322) ======================= q-point: ( 0.38 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 15.907 0.000 11.598) 19.686 1.834 ( 21.971 0.000 4.097) 22.349 2.208 ( -21.302 -0.000 4.808) 21.838 2.375 ( -7.983 -0.000 -1.799) 8.184 2.677 ( 0.572 0.000 -4.102) 4.142 2.761 ( -3.328 -0.000 -0.750) 3.411 2.941 ( 20.496 0.000 -6.271) 21.434 3.248 ( -3.576 -0.000 5.255) 6.356 3.552 ( 5.559 0.000 3.686) 6.670 3.807 ( 1.682 0.000 -1.663) 2.365 3.893 ( -2.229 -0.000 4.207) 4.761 4.107 ( 19.424 0.000 4.163) 19.865 4.197 ( 7.568 0.000 0.285) 7.574 4.471 ( -0.421 -0.000 3.442) 3.468 4.723 ( -5.158 -0.000 -5.807) 7.767 5.083 ( -18.651 -0.000 -5.454) 19.433 5.323 ( -12.598 -0.000 -0.179) 12.599 5.396 ( -3.562 -0.000 4.661) 5.866 6.427 ( -0.108 -0.000 9.929) 9.930 6.974 ( -7.601 -0.000 0.687) 7.632 7.809 ( -2.415 -0.000 6.757) 7.175 8.681 ( 1.063 0.000 0.148) 1.074 8.784 ( 3.782 0.000 -0.078) 3.783 9.444 ( -1.247 -0.000 -5.498) 5.638 9.662 ( 0.715 0.000 -0.005) 0.715 10.267 ( 9.624 0.000 0.730) 9.651 10.541 ( -0.157 -0.000 -0.357) 0.390 10.606 ( -7.683 -0.000 0.206) 7.686 10.786 ( -2.961 -0.000 0.886) 3.090 11.796 ( -3.749 -0.000 -1.852) 4.182 15.388 ( 10.773 0.000 2.076) 10.972 15.977 ( -3.157 -0.000 -1.125) 3.351 17.345 ( 10.819 0.000 -1.500) 10.922 17.910 ( 0.268 0.000 -17.219) 17.221 20.543 ( -0.081 -0.000 0.104) 0.132 20.811 ( 0.021 0.000 -0.051) 0.055 ======================= Grid point 246 (106/322) ======================= q-point: ( 0.46 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 15.462 -5.561 9.270) 18.866 2.087 ( 15.245 -9.485 2.883) 18.184 2.127 ( -19.127 -4.472 4.964) 20.260 2.395 ( -10.157 -8.075 -1.667) 13.082 2.754 ( 0.282 -6.922 -1.493) 7.087 2.863 ( -0.228 -10.320 -0.759) 10.351 3.071 ( 13.480 -3.405 -3.866) 14.431 3.382 ( -2.986 -8.652 3.388) 9.760 3.599 ( 8.976 -5.153 -0.478) 10.361 3.922 ( -5.461 -5.421 4.138) 8.737 4.084 ( -1.075 -17.585 -0.471) 17.624 4.262 ( 3.254 -10.341 3.773) 11.478 4.379 ( 17.456 -10.742 1.398) 20.544 4.544 ( 3.104 -9.722 3.013) 10.641 4.680 ( -1.657 1.366 -5.384) 5.796 4.972 ( -18.228 -1.965 -6.296) 19.385 5.258 ( -10.255 -0.848 -1.774) 10.442 5.375 ( -2.444 0.928 6.574) 7.075 6.350 ( -0.900 9.028 9.180) 12.907 6.888 ( -4.857 4.726 0.904) 6.838 7.812 ( -0.697 -0.747 6.104) 6.189 8.408 ( 0.384 18.048 0.066) 18.053 9.013 ( 1.596 -11.945 -0.457) 12.059 9.341 ( -1.125 7.724 -6.567) 10.200 9.778 ( 1.678 -8.446 1.405) 8.725 10.234 ( 2.997 9.263 1.506) 9.852 10.403 ( 5.285 4.052 -0.900) 6.720 10.675 ( -9.960 0.572 1.585) 10.101 10.852 ( 0.517 -11.808 -0.392) 11.826 11.691 ( -2.791 7.963 -2.363) 8.763 15.412 ( 8.199 3.637 2.794) 9.395 15.909 ( -1.738 4.734 -0.817) 5.109 17.315 ( 7.126 7.810 -1.935) 10.748 17.466 ( 4.161 32.925 -8.129) 34.168 20.691 ( -0.324 -14.058 0.789) 14.084 21.219 ( -1.799 -32.207 -3.467) 32.443 ======================= Grid point 247 (107/322) ======================= q-point: ( 0.54 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 8.816 -5.394 7.040) 12.505 2.159 ( -12.667 -8.389 4.857) 15.951 2.311 ( 2.791 -7.189 1.772) 7.913 2.582 ( -0.438 -12.477 -0.551) 12.497 2.929 ( 0.344 -10.242 -0.175) 10.249 3.090 ( 0.460 -11.077 1.624) 11.205 3.232 ( 7.525 -7.515 -1.917) 10.807 3.445 ( -0.582 -0.518 -0.130) 0.790 3.805 ( 9.569 -7.441 -0.493) 12.131 3.985 ( -6.892 -3.306 3.841) 8.555 4.240 ( -3.824 -2.490 -0.427) 4.583 4.585 ( -0.323 -13.372 -1.523) 13.462 4.633 ( 1.042 2.400 -3.645) 4.487 4.709 ( 10.900 -11.797 3.007) 16.341 4.819 ( -12.298 -8.354 -2.138) 15.020 5.189 ( 7.794 -21.054 0.500) 22.456 5.343 ( -12.761 -25.771 -0.802) 28.768 5.402 ( 0.447 -8.770 3.191) 9.343 6.112 ( -1.713 13.841 5.159) 14.870 6.753 ( -1.195 6.806 1.495) 7.069 7.860 ( 2.707 -2.505 4.362) 5.712 8.047 ( -3.654 16.450 0.748) 16.868 9.052 ( -1.737 11.282 -9.306) 14.728 9.294 ( 2.455 -6.166 3.551) 7.527 9.898 ( 5.499 1.312 0.905) 5.726 9.989 ( -2.174 13.610 1.482) 13.862 10.440 ( 4.629 1.052 0.517) 4.775 10.603 ( -7.139 -5.280 0.466) 8.892 11.159 ( 0.216 -17.819 -0.207) 17.821 11.470 ( -1.886 11.426 -2.214) 11.791 15.364 ( 4.654 4.848 2.879) 7.311 15.792 ( -0.217 5.956 -0.802) 6.013 16.907 ( 3.062 22.263 -2.119) 22.572 17.165 ( 1.887 8.867 -1.999) 9.283 21.045 ( -0.469 -20.364 1.457) 20.421 21.790 ( 0.244 -23.887 -4.018) 24.224 ======================= Grid point 248 (108/322) ======================= q-point: (-0.38 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( -2.680 0.942 6.263) 6.877 2.293 ( -0.005 -6.449 5.353) 8.381 2.462 ( -1.769 -7.802 1.507) 8.141 2.806 ( 1.654 -8.972 1.083) 9.187 3.136 ( 0.058 -9.995 -0.181) 9.997 3.275 ( -0.617 -7.285 2.307) 7.667 3.431 ( 2.373 -5.832 -2.427) 6.748 3.474 ( 4.253 -6.008 -0.142) 7.362 3.938 ( 0.725 0.786 4.161) 4.296 4.030 ( -2.142 -7.524 0.196) 7.825 4.267 ( -0.462 -2.296 -1.307) 2.682 4.569 ( 2.525 4.513 -2.508) 5.747 4.675 ( -1.084 -0.897 -4.826) 5.026 4.785 ( -18.983 -3.763 -4.588) 19.888 5.047 ( 15.559 -9.852 3.387) 18.724 5.324 ( -0.977 -2.934 4.492) 5.453 5.754 ( -2.309 8.245 0.819) 8.602 5.878 ( 0.658 -27.650 -0.720) 27.667 6.228 ( 1.886 -40.132 0.293) 40.177 6.637 ( 0.588 3.750 0.773) 3.873 7.710 ( -1.395 14.109 1.777) 14.289 7.985 ( -2.141 -7.190 3.120) 8.125 8.750 ( 1.582 16.328 -6.929) 17.808 9.369 ( 0.777 1.868 5.051) 5.441 9.672 ( 0.079 15.197 1.921) 15.318 9.856 ( 2.184 5.750 -1.444) 6.318 10.335 ( -2.781 5.040 1.096) 5.860 10.789 ( 1.578 -3.418 -1.756) 4.154 11.344 ( -1.729 -7.104 -0.593) 7.335 11.528 ( 0.883 -18.447 -0.278) 18.470 15.308 ( 1.796 2.951 2.966) 4.553 15.676 ( -1.129 5.250 -1.159) 5.494 16.628 ( -0.449 7.309 -0.732) 7.360 17.013 ( -0.078 6.600 -1.672) 6.809 21.443 ( -0.298 -19.053 1.370) 19.105 22.117 ( 1.469 -9.517 -2.851) 10.043 ======================= Grid point 249 (109/322) ======================= q-point: (-0.31 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -5.236 12.061 6.764) 14.787 2.370 ( 1.486 0.636 5.990) 6.204 2.597 ( -0.951 -6.214 0.912) 6.352 2.952 ( -0.619 -5.488 2.252) 5.964 3.308 ( 0.553 -7.252 -0.978) 7.338 3.399 ( -2.179 -6.389 0.638) 6.780 3.505 ( 0.777 -2.951 0.838) 3.165 3.682 ( 1.978 -9.801 -1.095) 10.058 3.905 ( -0.766 1.071 3.780) 4.003 4.176 ( 2.683 -5.613 -1.181) 6.332 4.299 ( -3.170 -1.221 -0.611) 3.451 4.488 ( 4.817 4.826 -1.121) 6.910 4.611 ( 1.133 5.641 -1.066) 5.851 4.820 ( -11.318 -9.506 -7.074) 16.386 5.272 ( 6.567 -5.437 -0.959) 8.580 5.437 ( 6.790 -6.821 4.054) 10.443 5.588 ( -2.923 4.354 -1.034) 5.345 6.195 ( -0.219 -3.374 -0.760) 3.466 6.688 ( 0.359 -7.914 -0.103) 7.923 6.987 ( 0.954 -29.267 -0.180) 29.283 7.486 ( -4.704 4.606 3.438) 7.427 8.133 ( -1.777 -8.175 2.132) 8.633 8.444 ( 5.982 15.300 -3.631) 16.825 9.235 ( -3.974 10.626 2.355) 11.587 9.418 ( 1.213 11.061 4.613) 12.046 9.736 ( 0.694 6.600 -2.065) 6.951 10.303 ( -0.343 -3.364 0.296) 3.394 10.671 ( 1.052 9.749 -2.173) 10.044 11.729 ( -0.707 -25.706 -0.640) 25.724 11.878 ( 2.622 -15.717 -0.550) 15.944 15.274 ( -0.361 1.740 3.049) 3.529 15.570 ( -2.488 4.043 -1.554) 4.995 16.570 ( -2.597 -1.252 -0.749) 2.979 16.896 ( -0.203 5.101 -1.671) 5.372 21.771 ( -0.039 -13.686 0.783) 13.708 22.200 ( 0.748 0.520 -1.606) 1.846 ======================= Grid point 250 (110/322) ======================= q-point: (-0.23 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -5.521 21.265 6.881) 23.022 2.317 ( -0.040 5.075 6.121) 7.951 2.685 ( 0.859 -2.401 0.143) 2.554 3.037 ( -1.513 -3.554 2.754) 4.744 3.423 ( 0.452 -3.751 -0.547) 3.817 3.496 ( -7.518 -6.055 1.251) 9.734 3.563 ( 1.347 -2.487 0.698) 2.913 3.846 ( -2.741 -5.956 0.204) 6.560 3.925 ( 5.428 -1.892 0.442) 5.765 4.204 ( -1.941 4.003 -1.434) 4.674 4.316 ( 0.037 -3.637 -2.037) 4.169 4.469 ( 4.713 0.160 2.312) 5.252 4.509 ( 3.442 5.593 -0.673) 6.602 4.950 ( -2.447 -7.759 -6.111) 10.175 5.408 ( 6.050 -6.408 -2.183) 9.079 5.517 ( -6.836 -0.733 -1.173) 6.974 5.643 ( 9.744 -5.790 2.345) 11.574 6.165 ( -1.877 2.633 -1.247) 3.466 6.799 ( -0.395 -2.111 -0.121) 2.151 7.130 ( -8.403 4.908 2.455) 10.036 7.682 ( -0.324 -17.076 0.947) 17.106 8.224 ( 11.749 11.065 -0.310) 16.142 8.297 ( -3.029 -9.090 1.903) 9.768 8.968 ( -7.527 11.933 0.971) 14.142 9.246 ( 1.526 8.241 4.895) 9.706 9.614 ( 1.024 5.551 -2.425) 6.143 10.433 ( 0.593 -6.990 -1.437) 7.161 10.541 ( 0.841 1.797 -0.409) 2.026 12.127 ( -0.115 -11.804 -1.153) 11.860 12.234 ( 3.359 -19.794 -1.654) 20.145 15.234 ( -1.838 2.181 2.678) 3.912 15.485 ( -2.567 2.859 -1.505) 4.126 16.602 ( -4.221 -3.204 -0.959) 5.385 16.799 ( 1.374 4.759 -1.638) 5.218 21.980 ( 0.076 -7.446 0.067) 7.447 22.142 ( -0.240 4.279 -0.472) 4.312 ======================= Grid point 251 (111/322) ======================= q-point: (-0.15 -0.62 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.030 ( -5.077 17.092 6.930) 19.129 2.239 ( -0.828 2.381 5.633) 6.171 2.700 ( 1.927 1.576 -0.223) 2.500 3.083 ( -0.388 -1.350 2.303) 2.697 3.445 ( -6.268 -0.341 2.864) 6.900 3.563 ( -3.365 -3.658 -0.509) 4.996 3.610 ( 1.096 -1.122 -0.546) 1.661 3.887 ( -4.064 -1.005 -0.273) 4.196 4.007 ( 5.043 -1.002 -0.827) 5.207 4.111 ( -1.038 2.044 -1.228) 2.601 4.372 ( 1.199 -1.438 -3.111) 3.631 4.429 ( 2.464 3.758 -0.451) 4.516 4.533 ( 6.905 -2.146 5.228) 8.923 5.048 ( 1.570 -2.764 -5.070) 5.984 5.483 ( -7.842 -0.731 -1.635) 8.044 5.607 ( 6.081 -9.551 -0.974) 11.364 5.785 ( 8.214 -2.800 1.638) 8.831 6.110 ( -3.414 0.761 -1.358) 3.752 6.794 ( -3.999 0.715 0.517) 4.095 6.965 ( -7.378 5.824 2.134) 9.639 7.894 ( -0.977 -4.326 -0.328) 4.447 8.142 ( 14.083 4.704 1.393) 14.914 8.446 ( -0.629 -4.262 2.380) 4.922 8.735 ( -10.719 3.861 1.043) 11.441 9.133 ( 0.874 4.208 3.860) 5.777 9.541 ( 1.171 1.577 -2.462) 3.150 10.480 ( 0.600 -0.597 -2.733) 2.861 10.623 ( 0.710 -4.135 0.722) 4.257 12.272 ( 3.105 -2.346 -1.231) 4.081 12.553 ( -0.507 -10.845 -2.972) 11.256 15.177 ( -1.991 2.655 1.471) 3.630 15.422 ( -1.369 2.132 -0.688) 2.625 16.604 ( -3.044 1.462 -0.727) 3.454 16.740 ( 2.578 1.523 -1.453) 3.328 22.053 ( -0.285 1.164 -0.331) 1.243 22.085 ( -0.003 -0.768 0.292) 0.822 ======================= Grid point 252 (112/322) ======================= q-point: (-0.08 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.902 ( -1.072 -6.653 6.006) 9.027 2.250 ( -2.026 -3.396 4.644) 6.099 2.657 ( 3.485 4.102 -0.088) 5.383 3.095 ( 1.840 0.810 1.287) 2.387 3.382 ( -8.491 2.650 3.412) 9.527 3.581 ( 1.015 1.105 -1.112) 1.867 3.614 ( -2.145 0.228 -1.155) 2.447 3.822 ( -3.207 4.837 -1.710) 6.050 4.033 ( 3.775 -0.612 -0.708) 3.889 4.105 ( 0.743 0.586 -0.279) 0.987 4.371 ( 2.990 2.029 -2.007) 4.133 4.397 ( 1.150 0.717 -0.901) 1.628 4.643 ( 5.238 -4.177 5.711) 8.803 5.051 ( 2.534 3.022 -3.605) 5.343 5.444 ( -6.626 -0.134 -0.596) 6.654 5.822 ( 5.479 -4.488 0.683) 7.115 5.871 ( -0.194 -6.476 0.129) 6.480 6.096 ( -3.975 -1.655 -0.944) 4.408 6.699 ( -7.668 4.646 2.184) 9.228 6.891 ( 0.026 -0.335 -0.448) 0.560 7.886 ( 0.491 4.118 -0.190) 4.152 8.155 ( 13.876 4.749 1.586) 14.752 8.426 ( -1.877 1.185 0.347) 2.247 8.753 ( -10.700 -8.685 2.139) 13.946 9.112 ( 0.588 -1.073 3.128) 3.359 9.573 ( 0.649 -4.503 -1.658) 4.842 10.482 ( 0.464 0.184 -2.841) 2.884 10.624 ( 0.512 4.472 0.602) 4.541 12.248 ( 3.978 6.736 -1.113) 7.902 12.625 ( -4.054 1.862 -3.707) 5.800 15.118 ( -0.651 2.444 -0.016) 2.529 15.384 ( 1.246 1.556 0.439) 2.041 16.525 ( 1.615 5.071 -0.243) 5.327 16.749 ( 1.913 -0.702 -1.057) 2.296 22.052 ( 0.361 -1.711 0.138) 1.754 22.077 ( -0.065 2.022 0.020) 2.023 ======================= Grid point 259 (113/322) ======================= q-point: ( 0.46 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 16.118 0.000 8.426) 18.188 1.959 ( -22.553 -0.000 5.496) 23.213 2.082 ( 17.813 0.000 2.478) 17.984 2.226 ( -15.724 -0.000 -1.017) 15.757 2.683 ( 1.696 0.000 -2.583) 3.090 2.743 ( 1.044 0.000 -2.281) 2.508 3.118 ( 12.049 0.000 -1.717) 12.171 3.227 ( -2.696 -0.000 5.910) 6.496 3.631 ( 5.787 0.000 0.303) 5.795 3.815 ( 0.574 0.000 -2.034) 2.114 3.846 ( -7.380 -0.000 3.917) 8.356 4.180 ( 1.337 0.000 3.859) 4.084 4.339 ( 2.903 0.000 -3.849) 4.821 4.492 ( -4.484 -0.000 1.650) 4.778 4.698 ( 3.438 0.000 -4.711) 5.832 4.888 ( -0.662 -0.000 -1.114) 1.296 5.211 ( -5.860 -0.000 -1.559) 6.064 5.384 ( -2.422 -0.000 6.786) 7.205 6.459 ( -0.103 -0.000 12.091) 12.092 6.916 ( -2.539 -0.000 0.929) 2.703 7.804 ( -1.804 -0.000 6.513) 6.759 8.692 ( 0.724 0.000 0.389) 0.822 8.813 ( 1.161 0.000 -0.194) 1.177 9.414 ( -0.593 -0.000 -6.443) 6.470 9.666 ( 0.003 0.000 -0.301) 0.301 10.371 ( 7.259 0.000 0.668) 7.289 10.525 ( -6.146 -0.000 0.803) 6.198 10.540 ( 0.181 0.000 -0.158) 0.240 10.758 ( -1.784 -0.000 0.182) 1.794 11.755 ( -1.810 -0.000 -2.990) 3.496 15.499 ( 5.596 0.000 4.256) 7.030 15.946 ( -1.241 -0.000 -0.553) 1.358 17.426 ( 3.023 0.000 -3.904) 4.938 17.894 ( 5.491 0.000 -10.766) 12.085 20.543 ( -0.029 -0.000 0.124) 0.127 20.811 ( 0.015 0.000 -0.051) 0.053 ======================= Grid point 260 (114/322) ======================= q-point: (-0.46 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( -10.223 -3.580 6.322) 12.541 1.956 ( 3.978 -6.761 6.193) 9.994 2.198 ( -10.104 -4.810 -0.160) 11.192 2.315 ( 8.007 -13.052 0.703) 15.329 2.759 ( 1.100 -6.689 -0.547) 6.800 2.873 ( 2.060 -10.378 -0.947) 10.623 3.185 ( 7.200 -1.725 0.273) 7.409 3.367 ( -1.336 -8.754 3.445) 9.502 3.701 ( 8.246 -6.766 -2.672) 10.996 3.844 ( -11.207 -6.124 6.043) 14.129 4.052 ( -2.965 -14.429 -2.972) 15.028 4.273 ( -1.376 -9.714 4.001) 10.596 4.433 ( -18.452 -11.268 -5.792) 22.383 4.506 ( -0.206 -11.705 -2.290) 11.929 4.701 ( 5.953 1.345 -2.818) 6.722 4.956 ( 17.590 -1.671 2.914) 17.908 5.184 ( -0.836 -0.392 -1.189) 1.506 5.367 ( -2.176 0.789 5.740) 6.189 6.369 ( -0.896 10.403 10.622) 14.895 6.870 ( 1.041 4.083 1.833) 4.595 7.816 ( -1.770 -1.362 5.887) 6.296 8.407 ( -0.551 18.938 -0.393) 18.950 9.018 ( -0.249 -10.575 -0.938) 10.619 9.317 ( 0.384 6.303 -6.802) 9.281 9.803 ( 1.677 -10.134 2.103) 10.484 10.254 ( 0.016 11.779 1.754) 11.909 10.471 ( 4.577 0.653 -1.381) 4.825 10.571 ( -6.533 2.225 1.002) 6.974 10.860 ( 0.916 -11.713 0.083) 11.749 11.661 ( -0.736 7.882 -3.263) 8.562 15.485 ( 1.819 4.050 4.529) 6.342 15.896 ( 0.209 4.465 -0.585) 4.508 17.335 ( -2.003 8.240 -4.059) 9.402 17.503 ( 5.440 32.615 -5.429) 33.509 20.691 ( -0.191 -14.013 0.764) 14.035 21.213 ( 2.262 -31.845 -2.360) 32.012 ======================= Grid point 261 (115/322) ======================= q-point: (-0.38 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.849 ( -16.730 -6.746 5.693) 18.916 2.177 ( 11.072 -8.050 5.593) 14.787 2.279 ( -8.146 -8.556 0.453) 11.822 2.614 ( 5.081 -12.054 0.483) 13.090 2.936 ( 0.805 -9.950 0.219) 9.985 3.102 ( 0.696 -10.551 2.042) 10.770 3.285 ( 1.883 -6.010 -0.014) 6.298 3.461 ( 3.130 -1.672 0.428) 3.574 3.865 ( -5.434 -6.816 2.510) 9.072 3.938 ( 1.117 -4.187 2.419) 4.963 4.193 ( -2.324 -4.903 -3.560) 6.490 4.416 ( -23.553 -8.510 -7.486) 26.138 4.606 ( -4.654 -11.775 0.385) 12.667 4.677 ( 5.332 -1.112 -1.011) 5.539 4.985 ( 17.198 -12.257 2.383) 21.253 5.227 ( -5.294 -14.904 -1.540) 15.891 5.304 ( 6.923 -18.506 3.425) 20.053 5.450 ( 8.251 -17.084 1.546) 19.035 6.113 ( -0.609 14.365 6.210) 15.662 6.776 ( 3.991 7.146 2.148) 8.462 7.849 ( -6.658 -2.330 4.006) 8.112 8.030 ( 0.801 16.655 0.042) 16.675 9.017 ( 0.369 9.940 -8.899) 13.346 9.329 ( 1.670 -6.381 3.108) 7.291 9.944 ( 0.191 3.460 3.290) 4.778 9.987 ( 2.431 12.005 0.795) 12.274 10.440 ( -5.758 5.950 0.589) 8.301 10.572 ( 3.177 -10.593 -0.615) 11.076 11.166 ( 0.796 -17.420 -0.049) 17.438 11.451 ( 0.051 11.332 -2.926) 11.704 15.398 ( -0.848 5.031 4.322) 6.687 15.781 ( -1.179 6.415 -1.371) 6.665 16.905 ( -2.362 22.724 -2.212) 22.953 17.156 ( -2.253 8.775 -2.396) 9.371 21.045 ( -0.312 -20.380 1.441) 20.433 21.811 ( 5.183 -23.380 -3.331) 24.178 ======================= Grid point 262 (116/322) ======================= q-point: (-0.31 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -14.065 -2.450 6.101) 15.526 2.370 ( 7.558 -3.776 5.648) 10.163 2.424 ( -5.059 -9.762 0.673) 11.015 2.830 ( 1.852 -7.412 1.733) 7.834 3.137 ( 0.184 -9.842 -0.057) 9.844 3.261 ( -2.585 -6.154 2.211) 7.032 3.451 ( 1.987 -8.028 -1.733) 8.449 3.519 ( 3.042 -3.312 1.328) 4.689 3.904 ( -6.073 -1.582 5.176) 8.135 4.064 ( 4.393 -6.559 -1.178) 7.981 4.259 ( 0.436 -2.373 -0.918) 2.582 4.463 ( -22.741 -11.460 -7.611) 26.578 4.609 ( 3.182 2.366 -2.094) 4.484 4.726 ( 4.956 3.241 -0.798) 5.975 5.217 ( 8.918 -4.963 -0.045) 10.206 5.355 ( 6.013 -5.968 3.555) 9.188 5.747 ( 1.190 8.324 1.301) 8.508 5.884 ( 0.865 -25.863 0.337) 25.880 6.282 ( 6.588 -38.675 0.648) 39.237 6.662 ( 3.341 5.428 0.429) 6.388 7.640 ( -10.017 12.356 1.966) 16.028 7.985 ( -0.130 -5.231 2.275) 5.706 8.766 ( 4.189 14.191 -7.073) 16.400 9.397 ( 1.172 3.290 5.858) 6.820 9.647 ( -4.841 14.068 1.784) 14.984 9.887 ( 3.507 7.764 -0.327) 8.526 10.312 ( -1.426 3.816 0.025) 4.074 10.806 ( 2.061 -2.722 -1.096) 3.586 11.328 ( -0.526 -8.088 -1.441) 8.232 11.546 ( 2.312 -18.437 0.039) 18.581 15.314 ( -2.517 2.902 4.128) 5.639 15.639 ( -4.422 5.564 -2.210) 7.443 16.595 ( -4.400 7.107 -0.794) 8.397 16.993 ( -2.304 5.998 -1.754) 6.661 21.445 ( -0.203 -19.094 1.426) 19.148 22.142 ( 4.065 -8.193 -2.782) 9.560 ======================= Grid point 263 (117/322) ======================= q-point: (-0.23 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( -10.713 9.391 6.889) 15.824 2.414 ( 2.093 2.685 5.963) 6.866 2.584 ( -1.982 -7.756 0.373) 8.014 2.947 ( -0.737 -4.463 2.270) 5.061 3.320 ( -0.039 -8.304 -0.611) 8.327 3.351 ( -3.638 -4.623 1.741) 6.135 3.529 ( 2.670 -1.374 0.793) 3.106 3.681 ( -0.935 -9.280 -0.185) 9.328 3.916 ( -0.147 -1.209 3.197) 3.421 4.214 ( 1.466 -6.398 -2.157) 6.909 4.267 ( 0.416 2.077 0.383) 2.153 4.478 ( -7.104 -0.559 -1.543) 7.291 4.652 ( 3.315 3.637 -3.325) 5.939 4.712 ( 0.417 -9.467 -3.552) 10.120 5.340 ( 4.313 -4.895 -2.925) 7.150 5.514 ( 4.753 -0.125 0.540) 4.786 5.606 ( 7.199 0.093 2.454) 7.606 6.192 ( 0.363 -2.251 -0.513) 2.337 6.693 ( 0.445 -7.089 -0.220) 7.106 7.002 ( 1.394 -23.271 -0.207) 23.313 7.416 ( -7.707 0.251 3.521) 8.477 8.109 ( -3.306 -7.703 1.567) 8.528 8.519 ( 7.659 12.806 -4.367) 15.547 9.200 ( -3.044 14.295 4.106) 15.181 9.424 ( -2.493 8.208 4.333) 9.611 9.747 ( 2.282 7.396 -1.894) 7.969 10.307 ( 0.727 -3.786 -0.172) 3.859 10.676 ( 0.918 9.909 -1.867) 10.125 11.715 ( -1.212 -24.196 -0.928) 24.244 11.924 ( 5.355 -17.419 -0.333) 18.226 15.261 ( -3.285 1.649 3.936) 5.385 15.516 ( -5.706 3.284 -2.650) 7.097 16.521 ( -4.850 -1.203 -0.516) 5.024 16.882 ( -1.504 4.116 -1.752) 4.720 21.773 ( -0.046 -13.670 0.872) 13.698 22.208 ( 1.460 1.614 -1.731) 2.780 ======================= Grid point 264 (118/322) ======================= q-point: (-0.15 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.403 ( -7.984 19.788 7.249) 22.536 2.336 ( 0.061 5.789 5.899) 8.266 2.690 ( -0.797 -3.576 0.196) 3.669 3.025 ( -0.615 -3.752 1.454) 4.070 3.385 ( -8.041 -2.410 3.876) 9.246 3.467 ( 3.418 -5.092 -1.441) 6.300 3.582 ( 1.399 -2.479 0.910) 2.988 3.814 ( -2.493 -4.726 0.956) 5.428 3.972 ( 2.636 -3.527 0.083) 4.403 4.175 ( -2.762 4.618 -0.742) 5.432 4.328 ( 2.542 -3.364 -2.991) 5.169 4.472 ( -1.350 -0.615 1.521) 2.125 4.587 ( 5.147 3.505 -0.922) 6.295 4.919 ( 0.250 -9.836 -5.170) 11.114 5.417 ( -4.862 -1.733 -2.740) 5.843 5.532 ( 12.362 -2.717 -0.524) 12.668 5.754 ( 7.317 -5.215 1.172) 9.061 6.141 ( -1.424 3.846 -0.686) 4.158 6.784 ( -2.668 -1.000 0.359) 2.871 7.031 ( -8.373 5.227 2.246) 10.123 7.685 ( 0.433 -16.060 0.615) 16.078 8.262 ( -4.019 -9.665 1.897) 10.638 8.351 ( 8.588 8.218 -2.318) 12.111 8.902 ( -3.646 13.827 3.766) 14.787 9.262 ( -1.051 7.565 4.525) 8.877 9.624 ( 1.875 5.857 -2.709) 6.720 10.435 ( 0.639 -6.211 -1.849) 6.512 10.551 ( 0.860 1.119 0.076) 1.414 12.103 ( -2.773 -15.291 -2.085) 15.680 12.295 ( 7.294 -15.588 -0.905) 17.233 15.212 ( -3.105 2.033 3.079) 4.822 15.437 ( -4.538 1.362 -2.130) 5.195 16.544 ( -4.815 -3.332 -0.547) 5.881 16.803 ( -0.020 3.165 -1.800) 3.642 21.981 ( 0.024 -7.341 0.093) 7.342 22.137 ( -0.255 4.542 -0.512) 4.578 ======================= Grid point 265 (119/322) ======================= q-point: (-0.08 -0.54 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.993 ( -4.804 15.285 7.673) 17.765 2.247 ( -0.762 3.025 5.547) 6.364 2.719 ( 0.726 0.387 0.202) 0.848 3.089 ( 1.365 -2.213 0.277) 2.615 3.363 ( -8.675 0.270 4.507) 9.780 3.555 ( 1.964 -2.271 -1.218) 3.240 3.628 ( 1.499 -0.821 0.696) 1.845 3.853 ( -1.541 -0.411 0.690) 1.738 4.048 ( 2.455 -0.688 -0.943) 2.719 4.097 ( -0.743 0.330 -0.228) 0.844 4.374 ( 0.647 -1.092 -3.297) 3.533 4.451 ( 1.581 2.379 -0.306) 2.873 4.600 ( 0.610 -2.284 1.934) 3.055 5.056 ( 2.005 -3.798 -4.455) 6.188 5.407 ( -3.096 -0.623 -0.487) 3.196 5.697 ( 9.092 -6.041 -0.841) 10.948 5.860 ( 3.066 -2.066 -0.220) 3.704 6.073 ( -1.702 1.554 -0.168) 2.311 6.724 ( -7.424 2.766 1.730) 8.109 6.915 ( -2.007 2.921 0.635) 3.601 7.881 ( -0.898 -4.445 -0.273) 4.543 8.281 ( 7.123 2.678 -2.056) 7.882 8.444 ( -2.964 -8.416 3.429) 9.559 8.643 ( -2.567 10.011 3.862) 11.032 9.145 ( -0.752 3.892 3.645) 5.385 9.547 ( 1.105 1.816 -2.568) 3.333 10.478 ( 0.549 -0.595 -2.778) 2.894 10.633 ( 0.540 -3.887 0.817) 4.009 12.286 ( -0.311 -4.695 -2.543) 5.348 12.558 ( 2.985 -6.921 -1.941) 7.783 15.158 ( -1.712 2.151 1.588) 3.175 15.400 ( -1.841 0.266 -0.833) 2.038 16.569 ( -2.483 -0.975 -0.489) 2.712 16.757 ( 1.091 1.242 -1.581) 2.287 22.049 ( -0.285 0.955 -0.312) 1.044 22.085 ( -0.072 -0.892 0.285) 0.939 ======================= Grid point 273 (120/322) ======================= q-point: (-0.46 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( -24.822 -0.000 6.309) 25.611 1.986 ( 17.756 0.000 6.375) 18.865 1.997 ( -21.144 -0.000 -0.808) 21.159 2.275 ( 12.665 0.000 0.778) 12.689 2.698 ( 1.983 0.000 -0.115) 1.987 2.767 ( 3.958 0.000 -3.509) 5.290 3.222 ( -1.273 -0.000 6.158) 6.288 3.227 ( 6.606 0.000 2.418) 7.035 3.647 ( -8.680 -0.000 -0.712) 8.710 3.743 ( -8.880 -0.000 1.984) 9.099 3.808 ( -0.552 -0.000 -2.340) 2.405 4.164 ( -13.055 -0.000 -1.434) 13.134 4.228 ( -7.769 -0.000 -2.459) 8.149 4.415 ( 0.075 0.000 -0.938) 0.941 4.756 ( 8.970 0.000 -1.564) 9.105 5.062 ( 15.942 0.000 -1.536) 16.016 5.193 ( 5.389 0.000 3.482) 6.416 5.378 ( -0.665 -0.000 4.381) 4.432 6.498 ( -0.374 -0.000 14.877) 14.882 6.921 ( 2.841 0.000 1.112) 3.050 7.808 ( -0.853 -0.000 6.556) 6.611 8.699 ( 0.099 0.000 0.809) 0.815 8.810 ( -1.404 -0.000 -0.277) 1.431 9.392 ( 0.486 0.000 -8.087) 8.102 9.660 ( -0.793 -0.000 -0.515) 0.945 10.406 ( -3.809 -0.000 3.431) 5.127 10.501 ( 4.003 0.000 -1.126) 4.158 10.544 ( 0.509 0.000 -0.019) 0.510 10.751 ( 0.611 0.000 -0.007) 0.611 11.735 ( 0.121 0.000 -3.833) 3.834 15.534 ( -2.221 -0.000 5.509) 5.940 15.953 ( 2.513 0.000 -0.076) 2.514 17.392 ( -5.516 -0.000 -4.746) 7.277 17.973 ( 11.797 0.000 -9.050) 14.868 20.543 ( 0.025 0.000 0.138) 0.140 20.811 ( 0.010 0.000 -0.051) 0.052 ======================= Grid point 274 (121/322) ======================= q-point: (-0.38 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( -23.796 -6.350 6.366) 25.438 2.001 ( -19.383 -10.970 -0.552) 22.279 2.144 ( 16.644 -4.325 5.579) 18.079 2.438 ( 8.980 -8.987 -0.061) 12.705 2.780 ( 2.592 -6.306 0.586) 6.843 2.900 ( 2.840 -9.883 -0.573) 10.299 3.243 ( 1.272 0.271 2.295) 2.638 3.370 ( -0.114 -9.434 2.696) 9.812 3.655 ( -24.663 -10.710 3.444) 27.108 3.755 ( 1.681 -6.883 -2.734) 7.594 4.011 ( -1.053 -13.069 -4.192) 13.765 4.150 ( -18.157 -6.860 -3.315) 19.691 4.270 ( -0.762 -9.874 2.992) 10.346 4.524 ( 1.563 -12.569 -0.762) 12.689 4.815 ( 13.182 -1.278 0.480) 13.252 5.115 ( 6.471 -0.337 -4.900) 8.124 5.267 ( 8.638 -1.158 5.438) 10.272 5.386 ( 7.814 0.062 2.430) 8.184 6.397 ( -0.445 11.372 12.908) 17.208 6.921 ( 6.264 3.208 2.366) 7.425 7.809 ( -2.279 0.311 5.821) 6.259 8.393 ( -1.483 19.374 -0.606) 19.440 9.003 ( -1.624 -9.657 -1.046) 9.848 9.303 ( 0.670 4.543 -7.658) 8.929 9.833 ( 2.160 -12.737 2.356) 13.132 10.250 ( -1.942 11.560 2.909) 12.078 10.445 ( -4.907 3.481 1.126) 6.121 10.586 ( 5.850 1.788 -2.077) 6.460 10.874 ( 1.441 -11.812 0.420) 11.907 11.651 ( 0.633 7.853 -4.063) 8.865 15.483 ( -4.355 3.645 5.646) 8.008 15.908 ( 1.633 5.909 -0.853) 6.189 17.269 ( -6.304 7.461 -3.321) 10.317 17.529 ( 0.944 37.167 -6.795) 37.795 20.691 ( -0.080 -13.997 0.801) 14.020 21.259 ( 6.864 -33.880 -2.363) 34.649 ======================= Grid point 275 (122/322) ======================= q-point: (-0.31 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( -20.078 -9.756 6.091) 23.139 2.145 ( -13.849 -12.906 -0.002) 18.931 2.345 ( 13.093 -5.399 4.983) 15.014 2.680 ( 5.275 -10.079 0.221) 11.378 2.949 ( 0.932 -8.936 1.303) 9.078 3.117 ( 0.634 -8.908 2.095) 9.173 3.279 ( -3.162 -6.015 -0.294) 6.801 3.508 ( 3.673 -3.993 0.975) 5.512 3.740 ( -15.976 -9.575 4.399) 19.138 3.924 ( -6.027 -9.596 -4.246) 12.101 4.115 ( -11.442 -4.052 -2.712) 12.437 4.226 ( 0.484 -5.297 -1.046) 5.421 4.567 ( -2.245 -11.907 -0.226) 12.119 4.751 ( 6.202 -5.041 0.668) 8.020 5.172 ( 10.225 -7.467 0.389) 12.667 5.184 ( 2.305 -19.968 -1.404) 20.149 5.361 ( 3.230 -10.285 1.132) 10.839 5.610 ( 15.997 -18.967 0.313) 24.814 6.142 ( 1.559 14.496 8.893) 17.078 6.855 ( 8.103 8.299 1.926) 11.758 7.757 ( -9.615 4.215 2.640) 10.826 8.043 ( 0.385 12.104 0.854) 12.140 9.001 ( 1.159 8.209 -8.443) 11.833 9.345 ( -0.540 -7.401 1.594) 7.589 9.941 ( -1.955 15.026 5.484) 16.115 10.039 ( 5.285 2.399 0.635) 5.838 10.360 ( -6.744 1.363 0.525) 6.901 10.629 ( 5.539 -7.146 -0.356) 9.048 11.176 ( 0.940 -16.520 -0.545) 16.555 11.449 ( 1.021 10.656 -3.325) 11.209 15.376 ( -4.940 4.647 5.288) 8.600 15.746 ( -4.318 8.648 -2.653) 10.023 16.837 ( -7.963 22.490 -2.360) 23.974 17.103 ( -5.305 7.524 -2.200) 9.466 21.046 ( -0.196 -20.394 1.506) 20.451 21.890 ( 10.048 -21.721 -3.677) 24.213 ======================= Grid point 276 (123/322) ======================= q-point: (-0.23 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( -16.037 -5.392 6.271) 18.044 2.325 ( -10.688 -11.958 0.568) 16.048 2.489 ( 8.084 -1.627 4.555) 9.420 2.865 ( 2.991 -5.659 2.046) 6.720 3.131 ( -2.246 -9.332 0.974) 9.647 3.239 ( -1.383 -5.558 1.243) 5.861 3.462 ( 0.643 -10.971 -1.260) 11.062 3.563 ( 3.804 0.394 1.466) 4.096 3.854 ( -5.240 -6.074 6.060) 10.053 4.072 ( -3.415 -8.623 -4.217) 10.188 4.172 ( -17.090 -12.002 -4.645) 21.394 4.301 ( 2.369 -2.075 1.454) 3.469 4.627 ( 1.540 0.901 -2.664) 3.206 4.808 ( 7.256 3.456 -0.246) 8.041 5.253 ( 1.319 -4.718 -3.119) 5.808 5.480 ( 10.905 -6.105 1.544) 12.593 5.798 ( 5.965 2.600 2.286) 6.897 5.910 ( 3.263 -18.368 2.799) 18.865 6.377 ( 9.016 -36.812 -0.064) 37.900 6.716 ( 5.761 8.338 -0.245) 10.138 7.513 ( -11.938 11.013 2.068) 16.373 7.980 ( -2.136 -2.872 2.101) 4.150 8.791 ( 3.476 11.943 -7.763) 14.662 9.428 ( 0.458 1.771 5.325) 5.630 9.585 ( -5.957 16.001 3.117) 17.356 9.935 ( 4.551 9.415 0.367) 10.463 10.297 ( -1.157 1.755 -0.743) 2.229 10.832 ( 2.595 -0.516 -0.348) 2.668 11.320 ( 0.062 -9.524 -2.160) 9.766 11.581 ( 3.348 -18.930 0.191) 19.224 15.281 ( -5.104 2.492 4.771) 7.418 15.551 ( -9.252 5.656 -3.500) 11.395 16.528 ( -6.314 5.966 -0.412) 8.697 16.950 ( -4.154 4.964 -1.569) 6.661 21.447 ( -0.159 -19.094 1.531) 19.156 22.194 ( 6.223 -5.568 -3.165) 8.930 ======================= Grid point 277 (124/322) ======================= q-point: (-0.15 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( -12.221 6.691 6.878) 15.538 2.431 ( -3.247 -0.278 4.047) 5.196 2.558 ( -1.632 -5.280 1.385) 5.698 2.965 ( 2.869 -3.248 2.018) 4.780 3.260 ( -7.304 -6.000 2.226) 9.711 3.373 ( 3.651 -6.877 -0.246) 7.790 3.568 ( 3.342 -0.134 0.868) 3.455 3.672 ( -0.224 -8.748 -0.369) 8.759 3.921 ( -0.748 -2.712 4.678) 5.458 4.174 ( -4.635 -3.439 -3.034) 6.520 4.284 ( -3.167 -3.897 -1.958) 5.390 4.388 ( -3.223 -6.658 0.612) 7.423 4.626 ( -2.018 -1.067 -6.310) 6.710 4.786 ( 6.976 -0.054 0.161) 6.978 5.350 ( 1.556 -3.544 -3.344) 5.115 5.624 ( 12.113 -0.079 0.334) 12.118 5.712 ( 8.983 0.532 2.292) 9.286 6.205 ( 1.914 -0.904 0.085) 2.118 6.693 ( -0.523 -5.300 -0.306) 5.335 7.014 ( 0.495 -11.807 0.303) 11.821 7.348 ( -4.747 -9.287 2.389) 10.700 8.063 ( -5.452 -7.032 1.824) 9.083 8.573 ( 3.712 10.868 -6.328) 13.112 9.197 ( -0.073 16.243 6.150) 17.368 9.395 ( -4.091 5.640 4.078) 8.073 9.776 ( 3.429 8.508 -1.709) 9.331 10.314 ( 0.414 -4.141 -0.473) 4.188 10.680 ( 0.600 10.048 -1.628) 10.197 11.696 ( -1.399 -22.041 -1.122) 22.114 11.998 ( 7.104 -19.498 -0.350) 20.754 15.228 ( -4.284 1.187 4.378) 6.239 15.420 ( -8.883 1.607 -3.611) 9.723 16.460 ( -5.185 -1.346 0.010) 5.357 16.849 ( -3.098 2.951 -1.689) 4.600 21.775 ( -0.088 -13.615 0.957) 13.649 22.223 ( 2.000 3.304 -1.929) 4.317 ======================= Grid point 278 (125/322) ======================= q-point: (-0.08 -0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( -8.428 17.625 7.388) 20.887 2.353 ( -0.005 6.048 5.254) 8.012 2.657 ( -4.818 -5.419 0.645) 7.280 3.050 ( 4.354 -3.062 0.432) 5.340 3.302 ( -7.612 -2.455 3.408) 8.694 3.514 ( 4.134 -4.495 -0.571) 6.134 3.605 ( 2.010 -1.677 1.478) 3.007 3.799 ( -0.451 -4.335 1.187) 4.518 3.997 ( 1.469 -4.261 0.853) 4.588 4.138 ( -2.719 2.792 -0.736) 3.966 4.335 ( -0.332 -2.495 -2.469) 3.526 4.467 ( -0.599 -2.151 2.083) 3.054 4.578 ( -4.993 1.439 -6.050) 7.975 4.925 ( 2.328 -8.406 -2.766) 9.150 5.389 ( 1.843 -0.669 -0.085) 1.963 5.713 ( 17.720 -0.708 -1.117) 17.769 5.808 ( 1.595 -3.848 -0.816) 4.245 6.135 ( 0.737 4.823 0.380) 4.894 6.731 ( -6.637 1.205 1.612) 6.936 6.967 ( -3.422 3.460 1.225) 5.018 7.698 ( 1.697 -14.603 -0.128) 14.702 8.203 ( -7.787 -10.432 2.756) 13.307 8.395 ( 1.687 7.324 -5.379) 9.242 8.924 ( 4.211 13.678 6.685) 15.796 9.253 ( -2.597 6.755 4.262) 8.399 9.639 ( 2.092 6.572 -2.902) 7.482 10.435 ( 0.390 -5.575 -2.126) 5.979 10.560 ( 0.391 0.452 0.367) 0.701 12.057 ( -3.614 -15.599 -2.446) 16.198 12.389 ( 8.673 -14.099 -0.914) 16.578 15.185 ( -2.920 1.557 3.015) 4.477 15.369 ( -5.539 -1.017 -2.345) 6.101 16.488 ( -4.498 -3.851 -0.147) 5.924 16.787 ( -1.602 1.718 -1.751) 2.929 21.981 ( -0.014 -7.240 0.096) 7.241 22.133 ( -0.207 4.944 -0.498) 4.973 ======================= Grid point 287 (126/322) ======================= q-point: (-0.38 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( -25.682 -0.000 7.572) 26.775 1.724 ( -24.705 -0.000 -0.294) 24.707 2.218 ( 17.994 0.000 5.314) 18.762 2.384 ( 5.862 0.000 -1.158) 5.975 2.737 ( 4.398 0.000 0.750) 4.462 2.806 ( 4.296 0.000 -2.523) 4.982 3.235 ( -22.709 -0.000 2.986) 22.905 3.236 ( 0.429 0.000 5.838) 5.854 3.379 ( -14.542 -0.000 -2.700) 14.791 3.696 ( -3.110 -0.000 -0.341) 3.129 3.789 ( -1.488 -0.000 -2.518) 2.925 4.010 ( -6.250 -0.000 -0.264) 6.255 4.198 ( -1.981 -0.000 1.796) 2.674 4.438 ( 2.393 0.000 -0.484) 2.441 4.891 ( 13.557 0.000 0.757) 13.578 5.129 ( 1.961 0.000 -3.014) 3.596 5.303 ( 3.794 0.000 0.677) 3.854 5.473 ( 16.580 0.000 3.461) 16.937 6.539 ( -1.283 -0.000 17.314) 17.361 6.988 ( 7.780 0.000 1.200) 7.872 7.829 ( 1.050 0.000 7.574) 7.647 8.699 ( -0.672 -0.000 1.225) 1.397 8.778 ( -3.934 -0.000 -0.300) 3.946 9.375 ( 1.254 0.000 -10.163) 10.240 9.645 ( -1.403 -0.000 -0.621) 1.534 10.360 ( -4.837 -0.000 6.721) 8.280 10.552 ( 0.741 0.000 0.030) 0.742 10.566 ( 6.805 0.000 -2.720) 7.329 10.768 ( 1.943 0.000 0.416) 1.987 11.729 ( 0.869 0.000 -4.741) 4.820 15.496 ( -6.596 -0.000 6.352) 9.157 15.990 ( 3.205 0.000 -0.397) 3.230 17.292 ( -8.515 -0.000 -3.307) 9.135 18.084 ( 11.740 0.000 -13.848) 18.155 20.544 ( 0.066 0.000 0.143) 0.157 20.811 ( 0.005 0.000 -0.052) 0.052 ======================= Grid point 288 (127/322) ======================= q-point: (-0.31 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( -23.455 -8.134 7.732) 26.001 1.756 ( -21.785 -14.969 -0.074) 26.432 2.348 ( 14.816 -2.865 4.425) 15.726 2.515 ( 4.858 -8.810 -1.157) 10.127 2.819 ( 2.601 -5.215 1.555) 6.031 2.936 ( 3.480 -9.442 -0.085) 10.063 3.101 ( -33.635 -7.139 -0.796) 34.394 3.352 ( -1.996 -4.340 -1.586) 5.034 3.446 ( -3.068 -13.613 2.803) 14.233 3.731 ( -4.172 -5.514 2.218) 7.262 4.007 ( -4.165 -12.709 -0.828) 13.399 4.025 ( 1.431 -6.942 -0.467) 7.104 4.273 ( -0.052 -10.256 2.157) 10.481 4.532 ( 0.104 -10.528 -0.740) 10.554 4.993 ( 15.358 -3.061 0.991) 15.691 5.143 ( 0.344 -1.322 -0.185) 1.378 5.315 ( 4.229 -0.016 -3.277) 5.350 5.574 ( 16.939 -0.299 2.077) 17.069 6.436 ( -0.309 11.119 15.059) 18.721 7.026 ( 10.041 2.564 2.207) 10.596 7.806 ( -1.070 4.077 6.595) 7.827 8.368 ( -2.511 19.352 -0.599) 19.523 8.974 ( -2.808 -9.970 -0.676) 10.380 9.279 ( -0.409 3.962 -8.964) 9.809 9.865 ( 2.129 -16.358 1.166) 16.538 10.233 ( -2.439 11.196 6.623) 13.235 10.417 ( -0.579 7.522 1.391) 7.671 10.644 ( 4.917 1.174 -2.723) 5.742 10.897 ( 2.128 -11.515 0.396) 11.716 11.646 ( 0.702 7.801 -4.858) 9.217 15.432 ( -6.846 3.135 6.383) 9.871 15.913 ( -0.610 8.865 -2.300) 9.179 17.177 ( -7.692 5.867 -1.881) 9.855 17.462 ( -8.546 44.736 -10.346) 46.706 20.694 ( -0.015 -14.006 0.886) 14.034 21.363 ( 12.509 -37.846 -3.796) 40.040 ======================= Grid point 289 (128/322) ======================= q-point: (-0.23 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( -18.856 -11.890 7.057) 23.382 1.962 ( -17.003 -16.220 -0.024) 23.498 2.501 ( 10.649 -3.304 3.927) 11.821 2.732 ( 3.471 -9.784 -0.302) 10.386 2.952 ( -3.408 -7.668 2.239) 8.685 3.107 ( -7.108 -7.273 -0.098) 10.170 3.196 ( -6.780 -15.172 -0.666) 16.632 3.500 ( -6.401 -13.538 -1.299) 15.031 3.614 ( -0.866 -4.197 1.427) 4.517 3.835 ( -5.958 -6.672 3.425) 9.579 4.028 ( -4.271 -1.933 -0.434) 4.708 4.262 ( 3.594 -5.053 -0.350) 6.211 4.556 ( 0.590 -11.710 0.203) 11.726 4.803 ( 1.488 -10.225 0.509) 10.345 5.163 ( 0.815 -4.770 -3.299) 5.856 5.326 ( 8.947 -19.974 1.325) 21.926 5.425 ( 8.756 -7.805 -1.250) 11.796 5.794 ( 14.927 -18.190 -1.217) 23.562 6.203 ( 3.337 13.892 11.462) 18.316 6.973 ( 10.873 9.759 1.195) 14.659 7.656 ( -8.284 9.423 1.923) 12.693 8.038 ( -1.994 10.314 1.794) 10.657 8.988 ( 0.877 7.003 -8.163) 10.791 9.323 ( -3.582 -8.473 0.069) 9.199 9.935 ( -2.291 17.834 5.784) 18.888 10.112 ( 6.714 0.378 1.122) 6.817 10.297 ( -4.310 1.114 1.059) 4.576 10.695 ( 5.540 -7.157 1.315) 9.146 11.180 ( 0.247 -14.704 -2.034) 14.846 11.452 ( 1.090 8.992 -3.130) 9.583 15.324 ( -6.545 4.340 5.589) 9.638 15.647 ( -11.196 11.612 -4.705) 16.803 16.710 ( -11.904 19.271 -2.207) 22.758 17.026 ( -6.512 5.970 -1.464) 8.954 21.049 ( -0.146 -20.406 1.630) 20.471 22.021 ( 14.184 -18.593 -5.189) 23.954 ======================= Grid point 290 (129/322) ======================= q-point: (-0.15 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( -14.678 -7.253 6.703) 17.691 2.178 ( -13.993 -14.781 0.240) 20.355 2.584 ( 5.795 0.657 3.428) 6.765 2.908 ( 2.978 -5.724 1.899) 6.726 3.079 ( -7.111 -7.975 1.412) 10.778 3.244 ( 1.553 -7.970 0.327) 8.127 3.461 ( -0.249 -12.816 -1.529) 12.909 3.612 ( 3.543 1.435 0.841) 3.914 3.806 ( -6.968 -15.020 3.597) 16.943 3.933 ( -10.194 -9.311 -0.137) 13.807 4.074 ( -3.049 -5.203 -2.440) 6.506 4.335 ( 1.490 -2.088 1.393) 2.919 4.637 ( 1.481 1.427 -2.390) 3.153 4.861 ( 1.839 2.078 -0.862) 2.906 5.283 ( 6.294 -5.093 -3.073) 8.660 5.587 ( 6.383 -4.891 -0.444) 8.054 5.867 ( 3.924 -17.467 0.726) 17.917 6.000 ( 9.627 1.232 6.902) 11.909 6.491 ( 10.636 -34.385 -1.363) 36.018 6.796 ( 8.118 11.378 -0.795) 14.000 7.382 ( -10.953 10.845 1.685) 15.505 7.947 ( -4.808 -1.149 2.740) 5.652 8.795 ( 1.476 10.860 -8.302) 13.749 9.414 ( -5.059 -1.816 2.593) 5.968 9.558 ( -0.781 19.072 6.225) 20.078 9.994 ( 5.124 10.563 0.185) 11.742 10.277 ( -1.970 -0.149 -0.939) 2.187 10.863 ( 2.665 3.267 0.031) 4.216 11.316 ( 0.408 -11.792 -2.222) 12.006 11.624 ( 3.837 -20.098 0.223) 20.462 15.228 ( -6.217 1.706 4.523) 7.875 15.404 ( -13.122 4.490 -4.141) 14.474 16.452 ( -6.272 4.216 0.101) 7.558 16.889 ( -5.201 4.062 -1.210) 6.710 21.450 ( -0.179 -19.056 1.659) 19.129 22.265 ( 7.453 -2.031 -3.969) 8.685 ======================= Grid point 291 (130/322) ======================= q-point: (-0.08 -0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( -11.245 4.732 6.818) 13.976 2.363 ( -8.277 -9.199 1.501) 12.465 2.566 ( 0.991 2.514 2.995) 4.033 3.016 ( 4.021 -3.481 2.014) 5.687 3.178 ( -7.366 -6.032 1.519) 9.641 3.416 ( 3.690 -7.230 0.425) 8.128 3.609 ( 3.210 0.272 0.553) 3.268 3.677 ( 1.588 -8.685 -1.476) 8.952 3.929 ( -1.046 -3.077 6.312) 7.100 4.105 ( -4.798 -5.664 -3.443) 8.182 4.186 ( -9.645 -11.202 -2.431) 14.981 4.391 ( 0.376 -3.092 0.681) 3.188 4.576 ( -3.090 2.955 -5.178) 6.715 4.849 ( 4.356 -0.645 -0.080) 4.404 5.394 ( 6.769 -1.943 -0.942) 7.105 5.713 ( 2.541 -5.088 -1.572) 5.901 5.876 ( 17.360 4.427 2.387) 18.074 6.239 ( 3.674 0.152 0.636) 3.732 6.676 ( -2.230 -1.575 -0.030) 2.730 7.011 ( -1.438 0.440 1.243) 1.951 7.331 ( 1.429 -20.514 -0.215) 20.565 7.990 ( -8.278 -6.221 2.568) 10.668 8.573 ( 0.423 10.664 -7.032) 12.781 9.225 ( 0.621 14.248 6.342) 15.608 9.363 ( -3.156 4.993 4.296) 7.304 9.814 ( 3.753 9.786 -1.860) 10.645 10.312 ( -0.516 -4.714 -0.504) 4.769 10.679 ( 0.114 10.139 -1.610) 10.267 11.677 ( -1.183 -19.792 -0.968) 19.851 12.084 ( 7.496 -21.350 -0.648) 22.637 15.192 ( -3.839 0.399 4.334) 5.804 15.294 ( -9.944 -0.872 -3.987) 10.749 16.402 ( -4.777 -1.530 0.382) 5.031 16.801 ( -3.966 1.937 -1.418) 4.636 21.777 ( -0.160 -13.540 1.022) 13.580 22.242 ( 2.229 5.246 -2.167) 6.098 ======================= Grid point 301 (131/322) ======================= q-point: (-0.31 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.115 ( -24.591 -0.000 9.951) 26.528 1.418 ( -27.155 -0.000 0.665) 27.163 2.416 ( 1.235 0.000 -2.629) 2.905 2.436 ( 16.069 0.000 4.498) 16.687 2.715 ( -51.576 -0.000 -2.896) 51.657 2.790 ( 3.267 0.000 0.776) 3.358 2.858 ( 5.688 0.000 -0.983) 5.772 3.266 ( 1.783 0.000 5.063) 5.368 3.355 ( -0.920 -0.000 -3.281) 3.408 3.674 ( -1.082 -0.000 8.050) 8.123 3.760 ( -2.062 -0.000 -2.526) 3.261 3.989 ( 0.519 0.000 2.511) 2.564 4.186 ( -0.488 -0.000 0.942) 1.061 4.449 ( -0.374 -0.000 -1.420) 1.468 5.051 ( 9.742 0.000 -1.310) 9.830 5.136 ( 2.913 0.000 3.789) 4.780 5.343 ( 5.556 0.000 -5.550) 7.853 5.685 ( 15.867 0.000 1.816) 15.970 6.569 ( -2.965 -0.000 17.783) 18.028 7.107 ( 11.597 0.000 1.180) 11.657 7.886 ( 4.078 0.000 10.531) 11.293 8.691 ( -1.332 -0.000 1.508) 2.012 8.716 ( -6.399 -0.000 -0.272) 6.405 9.356 ( 1.286 0.000 -12.140) 12.208 9.625 ( -1.607 -0.000 -0.587) 1.710 10.354 ( -0.338 -0.000 11.084) 11.089 10.561 ( 0.816 0.000 -0.019) 0.816 10.633 ( 6.037 0.000 -4.663) 7.628 10.798 ( 2.751 0.000 1.649) 3.207 11.721 ( 0.339 0.000 -5.530) 5.540 15.431 ( -7.347 -0.000 6.915) 10.089 16.014 ( 1.134 0.000 -2.127) 2.410 17.181 ( -8.763 -0.000 -1.716) 8.930 18.138 ( 6.405 0.000 -25.240) 26.040 20.546 ( 0.087 0.000 0.137) 0.162 20.811 ( 0.002 0.000 -0.053) 0.053 ======================= Grid point 302 (132/322) ======================= q-point: (-0.23 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.094 ( -21.277 -9.943 10.093) 25.562 1.493 ( -22.800 -18.735 0.722) 29.519 2.476 ( -0.537 -7.223 -0.698) 7.277 2.556 ( -26.951 -9.752 0.394) 28.663 2.599 ( -5.101 -9.815 -1.232) 11.130 2.871 ( 0.704 -6.031 1.928) 6.370 2.991 ( 5.144 -8.239 0.020) 9.713 3.332 ( -1.768 -2.021 -3.243) 4.210 3.463 ( 1.932 -13.303 2.866) 13.744 3.704 ( -1.886 -4.555 6.949) 8.520 3.959 ( -3.040 -5.495 1.336) 6.421 4.087 ( 7.096 -13.752 0.226) 15.476 4.283 ( 0.708 -10.679 2.278) 10.942 4.517 ( -2.101 -10.238 -1.852) 10.614 5.087 ( -0.750 -1.936 -2.748) 3.444 5.214 ( 12.899 -2.799 4.356) 13.899 5.376 ( 7.654 -1.655 -5.347) 9.482 5.748 ( 11.329 0.961 0.120) 11.370 6.476 ( -1.024 9.381 15.363) 18.030 7.164 ( 12.096 2.550 1.472) 12.450 7.832 ( 1.799 9.183 8.954) 12.951 8.330 ( -3.655 19.127 -0.441) 19.478 8.934 ( -3.721 -11.362 -0.165) 11.957 9.238 ( -1.602 4.639 -9.929) 11.076 9.878 ( -0.278 -17.543 -1.339) 17.597 10.260 ( 2.859 11.127 11.523) 16.272 10.428 ( 1.388 9.071 1.040) 9.235 10.686 ( 3.327 0.535 -1.078) 3.538 10.923 ( 1.988 -10.289 -0.716) 10.504 11.635 ( -0.076 7.612 -5.184) 9.210 15.370 ( -6.878 2.929 6.504) 9.909 15.862 ( -6.960 14.484 -5.813) 17.088 17.082 ( -7.668 4.791 -0.741) 9.072 17.250 ( -21.348 49.147 -14.019) 55.387 20.696 ( -0.009 -14.033 0.997) 14.069 21.533 ( 19.303 -42.434 -7.676) 47.246 ======================= Grid point 303 (133/322) ======================= q-point: (-0.15 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.248 ( -15.741 -13.599 8.647) 22.527 1.748 ( -19.258 -18.589 0.273) 26.767 2.604 ( 3.510 -2.872 1.249) 4.705 2.744 ( -11.811 -17.332 0.127) 20.974 2.789 ( -8.881 -13.746 -1.855) 16.470 3.031 ( -1.706 -10.776 1.852) 11.066 3.190 ( 1.681 -10.031 1.082) 10.228 3.445 ( -2.246 -10.923 -2.640) 11.460 3.637 ( 1.680 -2.852 1.700) 3.721 3.820 ( 0.596 -4.664 7.657) 8.986 3.988 ( -2.614 -2.027 -0.825) 3.409 4.291 ( 1.290 -3.453 -0.577) 3.731 4.584 ( 2.774 -11.387 2.212) 11.927 4.791 ( -1.677 -11.246 -1.281) 11.443 5.186 ( 4.374 -9.498 -2.831) 10.833 5.396 ( 3.899 -13.191 -1.095) 13.798 5.536 ( 8.297 -5.985 -0.835) 10.265 5.949 ( 11.895 -21.487 -1.833) 24.628 6.286 ( 4.634 11.919 11.905) 17.471 7.111 ( 11.750 10.712 0.423) 15.906 7.584 ( -4.503 14.752 1.824) 15.531 8.007 ( -4.567 9.923 2.935) 11.311 8.971 ( 0.569 6.562 -8.175) 10.498 9.269 ( -4.937 -8.991 -0.111) 10.258 9.914 ( -4.032 14.566 4.521) 15.775 10.196 ( 6.411 1.201 -0.068) 6.523 10.267 ( -1.334 5.437 2.162) 6.002 10.772 ( 6.177 -8.918 4.709) 11.826 11.162 ( -1.898 -12.044 -4.322) 12.936 11.457 ( 1.107 6.131 -1.951) 6.528 15.257 ( -7.884 4.881 4.363) 10.248 15.451 ( -18.411 11.405 -5.874) 22.440 16.561 ( -11.597 12.738 -1.298) 17.275 16.945 ( -6.349 5.039 -0.736) 8.138 21.052 ( -0.167 -20.412 1.784) 20.490 22.184 ( 16.458 -13.827 -7.971) 22.926 ======================= Grid point 304 (134/322) ======================= q-point: (-0.08 -0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( -11.639 -8.284 7.498) 16.134 2.010 ( -14.256 -17.976 0.497) 22.948 2.643 ( 2.687 1.375 1.528) 3.383 2.939 ( 0.977 -7.036 2.019) 7.385 2.984 ( -8.484 -9.597 0.238) 12.811 3.271 ( 2.553 -10.698 0.494) 11.009 3.442 ( -2.109 -15.161 -1.690) 15.400 3.647 ( 1.898 0.790 0.268) 2.073 3.715 ( -6.649 -17.870 -2.170) 19.190 3.899 ( 0.175 -1.882 8.494) 8.702 4.032 ( -2.877 -4.084 -3.063) 5.860 4.340 ( -0.854 -2.427 0.318) 2.593 4.637 ( -1.003 3.400 -1.199) 3.742 4.880 ( 3.379 -0.240 -0.245) 3.397 5.369 ( 8.504 -4.951 -2.124) 10.067 5.622 ( 0.176 -4.625 -1.875) 4.994 5.899 ( 1.452 -24.316 0.287) 24.361 6.150 ( 10.585 4.953 8.226) 14.291 6.616 ( 11.381 -30.075 -2.529) 32.256 6.903 ( 10.379 12.954 -1.061) 16.633 7.271 ( -8.368 11.837 0.913) 14.525 7.884 ( -7.560 0.352 3.627) 8.392 8.781 ( 0.862 10.749 -8.061) 13.464 9.350 ( -6.219 -0.903 2.588) 6.796 9.577 ( -0.124 16.531 5.833) 17.531 10.052 ( 4.735 11.399 -0.986) 12.383 10.246 ( -2.626 -1.468 -0.439) 3.041 10.889 ( 1.583 7.743 -0.887) 7.953 11.320 ( 1.307 -14.289 -0.712) 14.367 11.669 ( 3.550 -21.808 0.222) 22.096 15.149 ( -9.867 -0.634 1.009) 9.938 15.249 ( -9.517 2.798 -1.080) 9.979 16.384 ( -5.284 2.696 0.380) 5.944 16.824 ( -5.043 3.456 -0.791) 6.165 21.453 ( -0.257 -18.989 1.781) 19.074 22.340 ( 7.306 1.729 -5.076) 9.063 ======================= Grid point 315 (135/322) ======================= q-point: (-0.23 -0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.875 ( -22.058 -0.000 13.977) 26.114 1.092 ( -28.608 -0.000 2.365) 28.705 2.064 ( -56.106 -0.000 -2.563) 56.165 2.410 ( -0.372 -0.000 -3.628) 3.647 2.624 ( 13.054 0.000 3.782) 13.591 2.815 ( 0.782 0.000 1.022) 1.287 2.929 ( 6.124 0.000 -0.275) 6.130 3.295 ( -6.330 -0.000 -4.494) 7.763 3.305 ( 2.252 0.000 4.143) 4.715 3.727 ( -2.148 -0.000 -2.347) 3.181 3.731 ( 4.501 0.000 12.988) 13.746 4.010 ( 0.737 0.000 2.133) 2.257 4.202 ( 3.081 0.000 2.813) 4.172 4.419 ( -3.337 -0.000 -3.038) 4.513 5.061 ( -1.005 -0.000 -1.582) 1.874 5.280 ( 13.225 0.000 4.163) 13.864 5.393 ( 5.533 0.000 -5.918) 8.102 5.839 ( 9.377 0.000 0.048) 9.377 6.577 ( -4.057 -0.000 15.430) 15.955 7.261 ( 13.696 0.000 1.062) 13.737 7.995 ( 7.812 0.000 15.752) 17.583 8.627 ( -8.484 -0.000 -0.229) 8.487 8.678 ( -1.698 -0.000 1.630) 2.353 9.328 ( 0.576 0.000 -13.660) 13.672 9.605 ( -1.361 -0.000 -0.392) 1.416 10.432 ( 6.903 0.000 15.652) 17.107 10.570 ( 0.721 0.000 -0.156) 0.738 10.675 ( 3.791 0.000 -4.430) 5.831 10.843 ( 3.445 0.000 2.102) 4.036 11.702 ( -0.562 -0.000 -5.515) 5.543 15.370 ( -6.605 -0.000 6.664) 9.383 15.996 ( -2.367 -0.000 -6.202) 6.639 17.079 ( -7.755 -0.000 -0.718) 7.788 18.037 ( -7.458 -0.000 -46.478) 47.072 20.547 ( 0.082 0.000 0.122) 0.147 20.811 ( 0.002 0.000 -0.053) 0.053 ======================= Grid point 316 (136/322) ======================= q-point: (-0.15 -0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.901 ( -17.394 -11.872 13.638) 25.090 1.226 ( -23.059 -21.519 1.946) 31.600 1.989 ( -46.012 -25.905 -1.198) 52.817 2.503 ( 0.266 -8.256 -3.046) 8.804 2.710 ( 8.503 -1.553 2.362) 8.961 2.885 ( 0.408 -5.628 2.398) 6.131 3.050 ( 4.516 -6.967 -0.166) 8.305 3.281 ( -4.781 -4.164 -3.453) 7.220 3.494 ( 1.780 -12.682 2.247) 13.002 3.739 ( 4.176 -5.106 6.377) 9.175 3.937 ( -1.920 -3.113 2.274) 4.306 4.172 ( 5.716 -13.465 -0.329) 14.632 4.317 ( 3.753 -9.907 4.597) 11.549 4.482 ( -0.867 -12.798 -2.437) 13.057 5.071 ( 0.775 -1.944 -1.720) 2.709 5.353 ( 7.211 -0.183 -0.464) 7.229 5.462 ( 9.252 -4.998 -2.082) 10.719 5.832 ( 2.785 1.884 -0.727) 3.440 6.505 ( -1.352 6.758 13.034) 14.744 7.312 ( 12.192 3.565 0.817) 12.729 7.903 ( 4.316 14.550 12.599) 19.725 8.279 ( -4.832 19.069 -0.390) 19.675 8.891 ( -3.219 -13.271 0.137) 13.657 9.184 ( -2.125 5.294 -9.997) 11.510 9.855 ( -2.248 -14.500 -2.288) 14.851 10.358 ( 6.468 11.341 10.442) 16.718 10.451 ( 1.903 9.039 0.934) 9.285 10.729 ( 3.613 -0.148 6.213) 7.188 10.927 ( -0.808 -8.478 -3.466) 9.194 11.616 ( -0.390 7.164 -4.244) 8.336 15.311 ( -6.319 3.199 5.469) 8.948 15.674 ( -22.540 24.743 -12.996) 35.905 16.891 ( -29.892 39.318 -12.747) 51.009 16.996 ( -6.561 3.659 -0.370) 7.522 20.699 ( -0.058 -14.072 1.112) 14.116 21.766 ( 25.881 -45.064 -15.824) 54.323 ======================= Grid point 317 (137/322) ======================= q-point: (-0.08 -0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( -11.226 -14.781 10.873) 21.511 1.516 ( -19.767 -21.409 1.332) 29.169 2.434 ( -20.668 -30.845 -2.393) 37.206 2.680 ( 1.385 -9.316 -0.312) 9.424 2.803 ( 2.009 -5.049 1.017) 5.528 3.029 ( -0.557 -9.239 2.776) 9.663 3.213 ( 1.303 -7.872 1.179) 8.066 3.405 ( -3.262 -10.825 -4.125) 12.035 3.656 ( 0.860 -2.774 1.496) 3.267 3.889 ( 6.390 -3.465 5.836) 9.322 3.958 ( -2.342 -1.481 1.258) 3.043 4.291 ( -0.370 -1.879 -1.341) 2.337 4.591 ( -3.525 -10.357 2.053) 11.131 4.824 ( 8.971 -10.266 0.354) 13.638 5.235 ( 4.914 -15.369 -2.616) 16.346 5.416 ( 0.225 -7.235 -2.650) 7.708 5.588 ( 0.999 -3.181 -0.819) 3.433 6.053 ( 5.879 -23.641 -0.688) 24.371 6.386 ( 6.731 6.451 9.137) 13.054 7.241 ( 9.523 10.551 0.124) 14.213 7.570 ( 1.396 20.444 2.197) 20.609 7.947 ( -7.440 10.082 3.944) 13.136 8.955 ( 1.053 6.285 -8.171) 10.362 9.218 ( -3.477 -8.853 0.862) 9.550 9.867 ( -6.001 10.163 3.313) 12.259 10.233 ( 0.484 3.614 -0.658) 3.705 10.290 ( 3.422 9.215 0.091) 9.830 10.862 ( 4.852 -10.194 6.415) 12.986 11.117 ( -2.169 -10.399 -3.649) 11.232 11.467 ( 1.162 3.446 -0.424) 3.662 15.106 ( -19.499 6.120 -3.436) 20.724 15.263 ( -8.761 3.655 1.133) 9.560 16.441 ( -8.167 6.837 -0.312) 10.655 16.875 ( -5.110 4.591 -0.300) 6.876 21.056 ( -0.254 -20.408 1.937) 20.502 22.345 ( 15.329 -8.102 -11.790) 20.968 ======================= Grid point 329 (138/322) ======================= q-point: (-0.15 -0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.690 ( -17.868 -0.000 19.555) 26.489 0.766 ( -28.428 -0.000 5.579) 28.970 1.393 ( -56.504 -0.000 1.778) 56.532 2.391 ( -0.442 -0.000 -4.434) 4.456 2.763 ( 8.796 0.000 2.106) 9.044 2.819 ( -0.542 -0.000 1.391) 1.493 2.993 ( 4.707 0.000 -0.201) 4.712 3.200 ( -7.244 -0.000 -3.241) 7.936 3.341 ( 1.803 0.000 3.321) 3.778 3.697 ( -1.643 -0.000 -1.999) 2.587 3.835 ( 5.527 0.000 12.261) 13.450 3.997 ( -3.383 -0.000 -1.304) 3.625 4.301 ( 11.038 0.000 8.869) 14.160 4.365 ( -2.800 -0.000 -3.088) 4.169 5.071 ( 3.639 0.000 0.926) 3.755 5.384 ( 2.002 0.000 -3.588) 4.109 5.467 ( 9.884 0.000 -0.104) 9.884 5.898 ( 0.508 0.000 -1.116) 1.226 6.574 ( -3.228 -0.000 11.372) 11.821 7.426 ( 13.315 0.000 0.869) 13.343 8.174 ( 13.338 0.000 21.583) 25.372 8.520 ( -9.300 -0.000 -0.191) 9.302 8.662 ( -1.722 -0.000 1.597) 2.349 9.280 ( -1.659 -0.000 -15.061) 15.152 9.592 ( -0.805 -0.000 -0.061) 0.807 10.577 ( 0.489 0.000 -0.351) 0.602 10.578 ( 7.024 0.000 1.841) 7.262 10.745 ( 10.569 0.000 9.675) 14.328 10.890 ( 5.231 0.000 8.699) 10.151 11.681 ( -0.084 -0.000 -3.578) 3.579 15.315 ( -5.873 -0.000 5.139) 7.804 15.891 ( -12.499 -0.000 -19.056) 22.789 16.996 ( -6.022 -0.000 -0.565) 6.048 17.582 ( -42.813 -0.000 -76.088) 87.306 20.548 ( 0.053 0.000 0.102) 0.115 20.811 ( 0.004 0.000 -0.053) 0.054 ======================= Grid point 330 (139/322) ======================= q-point: (-0.08 -0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.776 ( -11.726 -13.755 17.708) 25.304 0.960 ( -23.544 -21.881 4.449) 32.449 1.514 ( -32.530 -40.046 3.221) 51.694 2.493 ( -0.043 -9.121 -3.869) 9.908 2.782 ( 2.559 -0.011 1.411) 2.922 2.903 ( 1.701 -5.319 2.227) 6.012 3.090 ( 2.225 -5.811 -0.154) 6.224 3.207 ( -5.545 -5.655 -3.809) 8.788 3.518 ( 1.164 -12.113 1.806) 12.302 3.829 ( 7.859 -6.753 0.603) 10.379 3.920 ( -2.620 -1.824 4.857) 5.812 4.200 ( 0.285 -13.907 -1.827) 14.030 4.341 ( -1.626 -2.588 -0.003) 3.056 4.575 ( 16.779 -17.942 1.633) 24.619 5.111 ( 6.374 -1.213 2.292) 6.882 5.377 ( -0.940 -0.075 -4.742) 4.834 5.553 ( 4.744 -2.291 -0.332) 5.279 5.808 ( -6.089 -0.433 0.010) 6.104 6.529 ( -0.431 4.152 9.644) 10.508 7.447 ( 9.842 5.466 0.866) 11.291 7.990 ( 1.223 18.133 15.531) 23.906 8.219 ( -4.173 20.661 -0.985) 21.101 8.870 ( -0.039 -14.393 -0.390) 14.399 9.132 ( -1.449 3.520 -8.156) 9.001 9.819 ( -2.356 -10.482 -2.214) 10.969 10.425 ( 1.021 11.241 0.442) 11.296 10.471 ( -0.261 10.007 -0.869) 10.048 10.775 ( -7.152 3.610 6.360) 10.229 10.934 ( 9.223 -7.562 9.118) 15.013 11.607 ( 0.645 6.798 -1.960) 7.104 15.182 ( -35.983 20.090 -12.421) 43.043 15.286 ( -13.944 5.642 -1.215) 15.091 16.557 ( -19.236 14.173 -4.543) 24.322 16.930 ( -4.546 3.430 -0.095) 5.696 20.702 ( -0.151 -14.117 1.208) 14.169 22.018 ( 26.679 -42.948 -29.331) 58.452 ======================= Grid point 343 (140/322) ======================= q-point: (-0.08 -0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.480 ( -22.630 -0.000 12.233) 25.724 0.557 ( -19.235 -0.000 19.029) 27.057 0.809 ( -39.546 -0.000 18.966) 43.859 2.375 ( 0.254 0.000 -5.127) 5.134 2.812 ( -1.360 -0.000 1.513) 2.034 2.845 ( 4.592 0.000 0.683) 4.643 3.035 ( 2.551 0.000 -0.294) 2.568 3.113 ( -5.688 -0.000 -3.134) 6.494 3.366 ( 0.702 0.000 2.721) 2.811 3.678 ( -0.519 -0.000 -1.547) 1.632 3.889 ( -5.008 -0.000 3.177) 5.931 3.961 ( 1.935 0.000 2.093) 2.851 4.325 ( -0.143 -0.000 -2.785) 2.788 4.540 ( 19.172 0.000 7.826) 20.708 5.174 ( 12.779 0.000 7.607) 14.872 5.355 ( -2.082 -0.000 -6.168) 6.510 5.564 ( 5.683 0.000 -0.813) 5.741 5.838 ( -9.952 -0.000 -1.983) 10.148 6.575 ( -1.731 -0.000 8.479) 8.654 7.565 ( 8.909 0.000 0.615) 8.930 8.419 ( -6.920 -0.000 -0.131) 6.921 8.441 ( 18.697 0.000 16.415) 24.880 8.648 ( -1.389 -0.000 1.449) 2.007 9.179 ( -8.134 -0.000 -14.169) 16.337 9.586 ( -0.146 -0.000 0.328) 0.359 10.544 ( -12.001 -0.000 -16.117) 20.094 10.579 ( 0.179 0.000 -0.563) 0.591 10.738 ( -9.983 -0.000 -4.385) 10.904 11.326 ( 50.173 0.000 31.468) 59.225 11.698 ( 4.764 0.000 2.788) 5.520 15.251 ( -20.367 -0.000 -9.244) 22.367 15.298 ( -71.259 -0.000 -46.823) 85.266 16.680 ( -50.037 -0.000 -33.161) 60.028 16.945 ( -4.266 -0.000 -0.452) 4.290 20.549 ( 0.005 0.000 0.081) 0.081 20.811 ( 0.009 0.000 -0.054) 0.054 ======================= Grid point 344 (141/322) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.732 ( 1.286 0.000 15.158) 15.212 0.832 ( 7.191 0.000 16.867) 18.336 1.361 ( 2.956 0.000 27.782) 27.939 2.226 ( 0.983 0.000 -7.735) 7.797 2.765 ( 0.531 0.000 -9.495) 9.510 2.835 ( -1.520 -0.000 2.253) 2.718 3.029 ( -0.194 -0.000 -1.577) 1.589 3.106 ( -1.771 -0.000 5.712) 5.980 3.438 ( -1.412 -0.000 3.810) 4.063 3.643 ( 1.717 0.000 -2.215) 2.802 3.698 ( -7.963 -0.000 -5.504) 9.680 4.087 ( 0.000 0.000 2.465) 2.465 4.334 ( 4.683 0.000 -0.237) 4.688 4.499 ( -10.674 -0.000 -2.298) 10.918 5.211 ( 1.280 0.000 -1.254) 1.792 5.487 ( 6.931 0.000 -0.117) 6.932 5.556 ( -2.343 -0.000 -1.489) 2.776 5.720 ( 0.738 0.000 -1.500) 1.672 6.784 ( -4.781 -0.000 11.629) 12.573 7.626 ( -0.932 -0.000 0.414) 1.019 8.376 ( 0.423 0.000 -0.038) 0.425 8.382 ( -20.093 -0.000 2.741) 20.279 8.675 ( -1.436 -0.000 2.567) 2.941 9.133 ( 13.249 0.000 -4.469) 13.982 9.606 ( 0.578 0.000 0.889) 1.060 10.052 ( -14.965 -0.000 -2.725) 15.211 10.559 ( -0.187 -0.000 -0.971) 0.989 10.643 ( -0.674 -0.000 -1.537) 1.679 11.627 ( -13.286 -0.000 0.802) 13.310 11.717 ( 3.003 0.000 0.475) 3.041 15.055 ( 37.138 0.000 0.373) 37.140 15.197 ( 1.012 0.000 -0.334) 1.065 16.470 ( 5.680 0.000 0.774) 5.733 16.908 ( -0.589 -0.000 -0.500) 0.773 20.550 ( -0.062 -0.000 0.080) 0.101 20.809 ( 0.018 0.000 -0.067) 0.070 ======================= Grid point 345 (142/322) ======================= q-point: ( 0.08 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( 12.658 -16.601 12.023) 24.091 1.187 ( 4.180 -22.009 14.781) 26.840 1.597 ( 8.832 -20.748 13.595) 26.331 2.380 ( 1.346 -13.504 -4.790) 14.391 2.769 ( 1.486 -1.493 -4.461) 4.933 2.913 ( 0.497 -7.248 -1.999) 7.535 3.024 ( -1.016 0.569 -0.171) 1.177 3.116 ( -3.807 -5.019 3.120) 7.030 3.582 ( -0.911 -9.980 1.257) 10.100 3.632 ( -6.155 -3.502 -2.820) 7.622 4.084 ( 2.078 -27.061 -2.420) 27.249 4.133 ( -2.380 -5.359 1.119) 5.970 4.426 ( 4.719 0.583 3.426) 5.860 4.462 ( -9.760 -13.699 -3.899) 17.266 5.214 ( -2.340 -0.612 -2.273) 3.319 5.505 ( -0.501 -0.070 -0.462) 0.685 5.582 ( 2.485 8.944 0.949) 9.332 5.628 ( 0.253 -7.785 -1.227) 7.885 6.725 ( -6.504 3.645 10.882) 13.191 7.545 ( -5.322 6.508 0.190) 8.409 8.048 ( -9.618 15.249 5.797) 18.938 8.257 ( 2.284 16.073 2.893) 16.490 8.814 ( 0.402 -10.821 0.559) 10.843 9.186 ( 9.822 0.430 -5.921) 11.477 9.728 ( -1.212 -6.169 -1.303) 6.421 10.005 ( -8.295 -4.494 -0.482) 9.447 10.431 ( -0.598 11.255 -0.870) 11.305 10.638 ( 1.617 -0.553 -0.738) 1.861 11.438 ( -13.712 3.432 6.371) 15.504 11.706 ( 9.377 6.022 1.589) 11.257 15.052 ( 2.900 4.931 -1.835) 6.008 15.208 ( 24.560 9.134 1.177) 26.230 16.457 ( 7.018 5.019 0.303) 8.633 16.880 ( 1.383 2.855 -0.346) 3.191 20.738 ( -0.663 -16.254 2.139) 16.408 21.452 ( -0.248 -42.734 -20.886) 47.566 ======================= Grid point 346 (143/322) ======================= q-point: ( 0.15 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 2.232 -8.301 16.688) 18.771 1.578 ( 13.114 -19.211 7.076) 24.313 2.192 ( 8.041 -25.340 -5.312) 27.111 2.676 ( -0.183 -15.272 -1.080) 15.311 2.818 ( -0.497 -3.230 0.015) 3.268 3.038 ( -2.322 -4.927 0.655) 5.486 3.127 ( 6.768 -11.061 -3.546) 13.444 3.243 ( -1.457 -9.042 2.526) 9.501 3.665 ( -4.759 -1.229 0.367) 4.929 3.712 ( -1.072 -5.900 -1.062) 6.090 4.193 ( -2.915 -4.095 2.176) 5.477 4.373 ( 0.455 3.105 2.307) 3.895 4.579 ( 1.585 -16.137 -0.340) 16.219 4.914 ( -1.309 -23.157 2.486) 23.327 5.253 ( -2.799 -11.633 -4.576) 12.810 5.443 ( -3.211 1.205 -0.300) 3.442 5.537 ( 2.872 -1.040 -0.953) 3.199 5.928 ( -2.879 -22.069 -1.855) 22.333 6.632 ( -9.613 1.119 8.439) 12.840 7.316 ( -7.966 12.307 -0.379) 14.665 7.650 ( -3.727 21.266 0.913) 21.609 7.992 ( 6.533 12.327 6.030) 15.199 8.962 ( 7.272 0.000 -2.628) 7.732 9.212 ( 0.665 -1.201 -4.247) 4.463 9.705 ( -4.506 5.388 2.723) 7.533 10.102 ( -1.131 1.437 -3.942) 4.345 10.212 ( 0.395 2.462 -0.091) 2.495 10.710 ( 1.379 -4.175 -0.819) 4.472 11.414 ( -6.685 -6.937 3.028) 10.098 11.616 ( 4.071 6.161 3.471) 8.159 14.986 ( 1.838 2.459 -1.413) 3.379 15.195 ( 14.741 3.383 1.832) 15.235 16.389 ( 4.407 4.700 0.415) 6.456 16.824 ( 3.009 3.733 -0.151) 4.797 21.120 ( -1.292 -20.794 3.972) 21.209 22.016 ( -2.118 -18.921 -17.466) 25.837 ======================= Grid point 347 (144/322) ======================= q-point: ( 0.23 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( 2.891 -0.541 10.902) 11.292 2.019 ( 9.960 -16.543 3.622) 19.647 2.542 ( 1.456 -7.876 -2.922) 8.526 2.884 ( 1.534 -5.913 0.148) 6.110 2.956 ( -2.252 -11.668 0.350) 11.888 3.187 ( 0.250 -10.452 -2.962) 10.866 3.320 ( -0.970 -7.039 0.373) 7.115 3.532 ( 7.373 -14.632 0.529) 16.393 3.608 ( -1.519 1.993 -1.728) 3.043 3.874 ( 1.806 -9.322 0.637) 9.517 4.256 ( -2.087 -2.549 2.123) 3.919 4.315 ( 0.674 2.192 1.569) 2.778 4.775 ( 0.103 -4.840 1.696) 5.129 5.024 ( -0.528 2.752 2.247) 3.591 5.445 ( -3.301 -2.938 -1.798) 4.771 5.559 ( 0.312 -5.122 -2.731) 5.812 5.825 ( -1.328 -29.061 -0.950) 29.107 6.250 ( -8.908 -7.165 4.461) 12.271 6.754 ( -10.505 -22.182 0.149) 24.544 6.987 ( -10.094 13.380 -1.235) 16.806 7.240 ( 4.007 18.292 0.270) 18.728 7.880 ( 9.642 4.677 4.404) 11.586 8.876 ( 4.947 10.232 -5.595) 12.668 9.228 ( 0.102 0.684 -0.447) 0.823 9.530 ( -4.707 8.857 6.582) 11.997 9.914 ( -1.786 8.486 -3.282) 9.272 10.313 ( 4.615 -3.269 0.155) 5.657 10.708 ( 0.508 4.982 -3.624) 6.182 11.587 ( -1.545 -3.651 3.694) 5.419 11.668 ( -3.734 -19.854 -0.665) 20.213 14.974 ( 2.117 -0.201 -1.152) 2.419 15.252 ( 10.767 -0.827 1.561) 10.911 16.342 ( 3.628 2.200 0.492) 4.271 16.779 ( 4.005 2.683 -0.290) 4.829 21.504 ( -1.275 -17.563 3.214) 17.900 22.201 ( -1.389 -4.629 -8.689) 9.942 ======================= Grid point 348 (145/322) ======================= q-point: ( 0.31 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( 4.176 9.333 7.380) 12.610 2.335 ( 5.495 -9.870 2.065) 11.484 2.578 ( -1.125 1.455 2.276) 2.927 3.022 ( 2.754 -5.339 2.390) 6.465 3.162 ( -3.410 -10.665 2.198) 11.411 3.390 ( 4.202 -7.679 -3.968) 9.611 3.448 ( -1.951 -7.302 -0.456) 7.572 3.547 ( -4.518 -1.494 -1.942) 5.140 3.847 ( 4.492 -10.336 -0.542) 11.283 4.059 ( 9.638 -4.052 -1.433) 10.553 4.265 ( 0.361 -1.445 2.039) 2.525 4.330 ( -0.934 -1.761 -0.139) 1.998 4.831 ( -3.521 -2.188 -1.621) 4.451 4.949 ( 2.186 4.481 3.618) 6.160 5.462 ( -3.999 -0.835 -0.034) 4.085 5.661 ( -1.635 -6.247 -2.782) 7.032 6.127 ( -11.674 -2.627 1.603) 12.072 6.263 ( -9.704 -0.545 0.938) 9.765 6.717 ( 0.518 3.836 1.335) 4.095 6.944 ( 5.401 8.349 0.932) 9.987 7.319 ( -7.826 -26.058 -2.757) 27.348 7.929 ( 13.188 -2.308 2.984) 13.717 8.655 ( -0.958 11.439 -5.828) 12.874 9.151 ( -0.344 7.046 3.385) 7.824 9.371 ( -2.514 6.058 7.079) 9.651 9.775 ( -0.885 4.959 -2.982) 5.854 10.370 ( 2.363 -1.775 1.340) 3.244 10.566 ( 1.466 7.467 -4.547) 8.864 11.759 ( -0.676 -13.021 1.001) 13.077 12.056 ( -5.075 -20.307 -2.520) 21.083 15.009 ( 2.582 -1.889 -0.555) 3.248 15.338 ( 7.688 -1.610 0.834) 7.899 16.359 ( 4.070 -1.663 0.528) 4.428 16.763 ( 3.953 1.426 -0.843) 4.286 21.794 ( -0.714 -11.955 1.423) 12.061 22.203 ( -0.084 2.110 -3.136) 3.780 ======================= Grid point 349 (146/322) ======================= q-point: ( 0.38 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.321 ( 4.548 15.787 7.372) 18.007 2.418 ( -1.760 2.527 4.514) 5.464 2.610 ( 5.168 -4.003 1.505) 6.708 3.107 ( 1.051 -1.870 1.368) 2.544 3.321 ( -7.699 -7.516 4.948) 11.843 3.503 ( 0.760 -2.806 -3.219) 4.337 3.544 ( 2.984 -4.607 -0.110) 5.490 3.657 ( -0.783 -8.618 -0.124) 8.654 4.006 ( 3.044 -4.005 -0.968) 5.123 4.111 ( 4.460 0.963 -0.474) 4.587 4.342 ( -0.535 0.005 -1.049) 1.178 4.348 ( 4.736 -3.236 -0.257) 5.742 4.776 ( -7.068 3.502 -3.553) 8.651 4.948 ( 3.315 -1.675 0.231) 3.721 5.445 ( -1.109 0.575 1.795) 2.187 5.762 ( -2.875 -5.270 -2.614) 6.547 5.994 ( -17.402 4.721 -0.462) 18.037 6.149 ( 0.132 5.213 0.932) 5.297 6.715 ( 5.352 1.835 3.655) 6.736 6.888 ( 1.060 0.733 -0.535) 1.395 7.690 ( -3.871 -14.674 -1.380) 15.239 8.135 ( 14.597 -8.465 2.272) 17.026 8.430 ( -5.779 7.285 -4.408) 10.291 8.988 ( -2.985 8.853 6.680) 11.486 9.262 ( -0.984 4.855 5.309) 7.261 9.656 ( -0.114 6.886 -2.748) 7.415 10.418 ( 0.666 0.427 -2.339) 2.469 10.515 ( 0.904 -4.960 -0.773) 5.101 12.030 ( 1.692 -12.534 -2.028) 12.809 12.360 ( -5.006 -13.519 -2.722) 14.671 15.070 ( 2.413 -2.650 0.413) 3.608 15.394 ( 4.316 -0.288 0.067) 4.326 16.447 ( 4.207 -4.158 0.168) 5.918 16.756 ( 2.621 1.380 -1.497) 3.319 21.975 ( -0.102 -6.607 -0.013) 6.608 22.136 ( 0.468 3.890 -0.334) 3.932 ======================= Grid point 350 (147/322) ======================= q-point: ( 0.46 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.091 ( 1.984 7.730 8.673) 11.786 2.360 ( -1.857 1.589 6.128) 6.598 2.709 ( 3.322 -2.291 0.660) 4.089 3.124 ( 0.957 0.380 -0.044) 1.030 3.377 ( -9.703 -3.036 4.629) 11.171 3.552 ( 2.856 -1.521 -0.732) 3.317 3.651 ( 3.457 -3.034 1.865) 4.963 3.803 ( 1.104 -5.503 -0.052) 5.613 4.041 ( 1.722 0.942 -1.482) 2.459 4.127 ( 2.507 -0.442 1.372) 2.892 4.331 ( 0.313 0.548 -1.582) 1.704 4.409 ( 2.282 -0.942 -1.023) 2.672 4.644 ( -9.301 3.990 -2.679) 10.470 4.991 ( 2.429 -0.448 -5.037) 5.610 5.444 ( 3.048 0.517 2.379) 3.901 5.802 ( -5.916 -0.337 -2.686) 6.506 5.840 ( -3.450 2.123 -0.027) 4.051 6.088 ( 1.653 1.658 0.981) 2.539 6.714 ( 0.693 0.568 2.828) 2.967 6.882 ( 0.311 -0.137 -0.100) 0.354 7.863 ( -0.855 -4.555 -0.660) 4.682 8.220 ( -1.884 3.305 -4.996) 6.279 8.492 ( 7.454 -12.333 5.163) 15.308 8.784 ( -4.591 10.322 6.981) 13.279 9.198 ( -1.232 1.318 4.358) 4.717 9.522 ( 0.191 5.017 -3.163) 5.934 10.414 ( 0.653 -0.448 -3.281) 3.375 10.638 ( 0.254 -4.332 0.069) 4.340 12.210 ( 0.267 -4.435 -3.888) 5.904 12.524 ( -0.587 -5.483 -2.321) 5.982 15.135 ( 1.130 -2.458 1.242) 2.977 15.401 ( 1.260 1.124 -0.373) 1.730 16.540 ( 2.105 -2.426 -0.368) 3.233 16.732 ( 0.870 1.528 -1.825) 2.534 22.054 ( 0.206 -0.631 -0.251) 0.710 22.081 ( 0.075 0.545 0.318) 0.635 ======================= Grid point 351 (148/322) ======================= q-point: (-0.46 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( -3.911 -11.140 7.992) 14.257 2.375 ( -1.539 -3.227 5.932) 6.926 2.719 ( -2.731 1.881 0.461) 3.348 3.125 ( 5.208 1.200 -0.094) 5.345 3.359 ( -7.796 0.158 3.693) 8.628 3.580 ( 3.419 0.889 -0.225) 3.540 3.693 ( 2.399 0.817 2.697) 3.701 3.857 ( 1.579 1.251 -1.536) 2.533 4.023 ( -2.154 0.403 -1.359) 2.578 4.154 ( 4.215 -0.049 3.204) 5.294 4.325 ( 1.778 0.330 -0.903) 2.022 4.404 ( -7.975 0.226 -3.519) 8.720 4.522 ( -4.861 2.798 -1.314) 5.760 4.969 ( 2.281 3.031 -4.955) 6.240 5.462 ( 5.599 0.762 2.154) 6.047 5.782 ( 1.651 -0.832 -1.855) 2.619 5.810 ( 1.231 1.225 -0.151) 1.743 6.102 ( 2.780 -1.307 0.647) 3.139 6.715 ( -2.208 -0.871 2.710) 3.603 6.905 ( -1.039 -2.176 -0.059) 2.412 7.864 ( -0.034 3.924 -0.616) 3.972 8.171 ( -5.905 -1.617 -3.984) 7.304 8.498 ( -4.482 11.893 4.683) 13.545 8.858 ( 9.081 -13.293 6.816) 17.482 9.217 ( -2.814 -3.802 4.100) 6.260 9.483 ( 0.805 -1.601 -3.637) 4.054 10.415 ( 0.814 0.490 -3.097) 3.240 10.646 ( -0.089 3.564 -0.078) 3.566 12.180 ( -2.520 5.819 -3.474) 7.230 12.560 ( 5.114 3.193 -2.851) 6.669 15.176 ( -1.306 -1.453 1.044) 2.215 15.366 ( -1.171 2.358 -0.231) 2.643 16.534 ( -1.974 2.860 -0.299) 3.488 16.721 ( 0.025 -0.479 -1.740) 1.805 22.042 ( -0.147 0.686 -0.034) 0.703 22.089 ( -0.154 -0.185 0.147) 0.282 ======================= Grid point 352 (149/322) ======================= q-point: (-0.38 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( -8.367 -14.841 6.584) 18.265 2.457 ( -1.559 -2.810 3.884) 5.041 2.619 ( -5.190 4.178 1.336) 6.796 3.127 ( 5.843 2.232 0.592) 6.283 3.282 ( -7.080 3.981 3.009) 8.662 3.551 ( 2.473 3.505 -0.303) 4.300 3.666 ( 2.828 3.353 0.660) 4.436 3.775 ( 1.789 7.319 -4.257) 8.654 3.996 ( -4.413 -0.305 -0.257) 4.431 4.162 ( 1.985 2.281 2.471) 3.905 4.238 ( -13.487 7.029 -4.986) 16.005 4.387 ( 3.405 -2.907 2.002) 4.904 4.485 ( -1.426 0.013 -0.468) 1.501 4.916 ( 4.171 2.768 -1.035) 5.112 5.482 ( 6.965 1.359 1.439) 7.241 5.739 ( -2.842 2.669 -2.251) 4.503 5.924 ( 17.715 -4.802 0.317) 18.358 6.171 ( 1.996 -4.568 0.589) 5.019 6.721 ( -4.694 -0.636 3.320) 5.785 6.944 ( -2.520 -2.669 -0.481) 3.702 7.698 ( 1.702 13.735 -1.294) 13.900 8.124 ( -14.009 4.181 0.771) 14.640 8.334 ( 4.730 0.211 -1.186) 4.881 9.149 ( 3.775 -10.306 6.239) 12.625 9.318 ( -3.463 -6.962 4.766) 9.120 9.580 ( 2.385 -7.609 -4.343) 9.080 10.393 ( 0.396 2.487 -1.694) 3.035 10.550 ( -0.489 2.738 -1.268) 3.057 11.968 ( -1.942 13.083 -1.588) 13.321 12.433 ( 6.830 13.042 -3.410) 15.112 15.173 ( -4.540 0.221 -1.323) 4.734 15.299 ( -2.663 2.973 1.724) 4.348 16.442 ( -3.905 3.847 0.283) 5.489 16.728 ( -1.645 -0.781 -1.294) 2.234 21.981 ( -0.003 5.984 -0.067) 5.984 22.123 ( -0.081 -3.467 -0.211) 3.474 ======================= Grid point 353 (150/322) ======================= q-point: (-0.31 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( -8.937 -5.149 7.384) 12.685 2.306 ( -6.833 13.725 2.073) 15.472 2.631 ( -0.882 -3.419 1.783) 3.956 3.089 ( 3.094 6.015 -0.537) 6.785 3.132 ( -8.168 5.862 3.764) 10.735 3.477 ( 3.078 5.831 0.429) 6.607 3.585 ( 0.208 10.991 -6.685) 12.866 3.621 ( 2.334 1.794 -2.477) 3.847 3.916 ( -10.189 13.471 -4.706) 17.534 3.997 ( -7.032 1.164 -0.428) 7.141 4.123 ( 2.246 2.336 4.352) 5.426 4.405 ( -1.529 2.725 2.123) 3.777 4.554 ( 4.023 -5.776 2.758) 7.560 4.921 ( 4.782 -0.252 1.472) 5.010 5.477 ( 6.894 3.929 -0.256) 7.939 5.653 ( -1.492 4.265 -2.493) 5.161 6.126 ( 13.227 -2.318 1.749) 13.542 6.310 ( 7.870 -4.084 0.131) 8.867 6.678 ( -1.599 0.111 2.441) 2.920 7.003 ( -4.786 -6.344 0.458) 7.960 7.323 ( 4.824 25.320 -2.743) 25.921 7.944 ( -12.332 3.445 2.752) 13.096 8.466 ( 4.112 -8.593 -3.006) 9.989 9.315 ( -3.645 -5.368 2.112) 6.824 9.457 ( -1.854 -8.754 6.386) 10.993 9.777 ( 3.259 -10.449 -4.867) 11.979 10.310 ( -1.045 3.911 1.193) 4.220 10.612 ( -0.569 -8.435 -4.022) 9.362 11.676 ( 1.030 15.112 1.293) 15.202 12.121 ( 5.315 21.097 -2.740) 21.928 15.102 ( -6.917 2.974 -3.261) 8.205 15.242 ( -3.947 1.050 3.562) 5.419 16.362 ( -4.104 1.498 0.558) 4.404 16.735 ( -2.827 -1.615 -0.621) 3.315 21.804 ( -0.284 12.097 1.443) 12.187 22.201 ( 1.847 -3.469 -3.250) 5.100 ======================= Grid point 354 (151/322) ======================= q-point: (-0.23 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( -6.286 4.811 11.003) 13.555 1.922 ( -9.212 20.154 4.285) 22.570 2.615 ( -3.604 6.730 -2.974) 8.193 2.913 ( -3.247 7.769 0.112) 8.421 2.972 ( -1.147 10.911 1.017) 11.018 3.307 ( 3.049 14.457 -1.172) 14.822 3.378 ( -1.559 6.914 -2.522) 7.523 3.534 ( -11.519 14.451 -2.052) 18.594 3.644 ( 1.559 -2.379 -2.178) 3.582 3.924 ( -2.074 4.302 -2.205) 5.261 4.148 ( 3.859 -1.852 7.197) 8.373 4.324 ( -1.509 4.228 0.610) 4.530 4.676 ( 0.679 -2.456 4.325) 5.020 4.972 ( 6.646 -1.162 1.585) 6.930 5.404 ( 5.125 6.456 -1.989) 8.480 5.547 ( -1.459 5.791 -2.260) 6.385 5.891 ( -0.376 26.702 -1.403) 26.741 6.406 ( 2.210 0.912 3.901) 4.576 6.693 ( 11.321 21.041 -0.061) 23.894 7.001 ( 11.635 -12.519 -1.615) 17.167 7.212 ( -5.591 -15.477 1.149) 16.495 7.885 ( -10.293 -3.866 4.459) 11.865 8.668 ( 4.491 -9.084 -3.479) 10.714 9.326 ( -3.885 1.862 -0.121) 4.310 9.673 ( -3.914 -12.845 4.886) 14.289 9.985 ( 1.480 -9.791 -6.361) 11.770 10.252 ( -1.794 1.502 1.686) 2.884 10.789 ( -1.984 -8.487 -5.755) 10.444 11.436 ( 5.490 10.551 5.484) 13.097 11.707 ( 2.431 20.371 -0.042) 20.516 14.986 ( -7.251 3.733 -1.522) 8.296 15.219 ( -5.924 -1.120 2.139) 6.397 16.342 ( -3.790 -1.702 0.528) 4.188 16.764 ( -3.110 -3.299 -0.166) 4.537 21.506 ( -0.479 17.940 3.138) 18.219 22.236 ( 4.534 1.966 -9.159) 10.408 ======================= Grid point 355 (152/322) ======================= q-point: (-0.15 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -2.775 10.771 16.076) 19.549 1.450 ( -9.970 21.278 8.592) 25.019 2.202 ( -8.275 30.071 -3.335) 31.366 2.674 ( -0.193 15.331 0.327) 15.336 2.828 ( 0.647 2.902 -0.788) 3.076 3.070 ( 0.164 9.257 0.493) 9.271 3.194 ( -6.131 8.602 -5.605) 11.958 3.278 ( -3.152 7.515 2.439) 8.506 3.683 ( 0.929 0.739 0.266) 1.216 3.815 ( -3.636 3.991 -3.915) 6.668 4.204 ( 2.019 3.485 6.588) 7.722 4.270 ( 4.297 -1.374 0.777) 4.578 4.577 ( -3.226 13.540 0.780) 13.941 4.961 ( 4.198 17.227 0.159) 17.732 5.242 ( 5.565 8.146 -2.770) 10.247 5.337 ( 1.207 5.453 -0.271) 5.592 5.564 ( -0.507 2.866 -1.300) 3.187 6.020 ( -0.432 23.968 -4.186) 24.335 6.660 ( 1.204 -4.151 9.621) 10.547 7.332 ( 6.140 -11.931 -0.204) 13.420 7.651 ( 4.943 -26.878 0.345) 27.331 7.984 ( -9.274 -10.661 6.829) 15.694 8.837 ( 4.009 -5.043 -3.406) 7.288 9.203 ( 0.376 8.758 -1.552) 8.902 9.837 ( -6.451 -3.774 1.218) 7.573 10.177 ( -0.545 -10.100 -5.822) 11.671 10.241 ( -2.458 -2.400 -1.240) 3.652 10.780 ( -6.271 6.150 -4.004) 9.653 11.367 ( 10.563 2.777 10.212) 14.952 11.500 ( 0.659 -0.524 1.736) 1.929 14.878 ( -5.285 3.069 0.698) 6.151 15.219 ( -7.941 -2.570 0.852) 8.390 16.378 ( -3.637 -3.656 0.576) 5.189 16.824 ( -2.775 -4.239 -0.150) 5.069 21.118 ( -0.535 20.880 3.808) 21.232 22.086 ( 6.407 16.589 -18.850) 25.915 ======================= Grid point 356 (153/322) ======================= q-point: (-0.08 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.997 ( -4.348 17.926 13.502) 22.859 1.138 ( -3.532 20.775 15.705) 26.281 1.518 ( -4.037 25.857 14.198) 29.773 2.385 ( 0.158 12.948 -4.768) 13.799 2.783 ( -0.835 1.243 -3.559) 3.861 2.921 ( -0.264 6.592 -1.583) 6.784 3.045 ( -2.255 2.096 -1.718) 3.526 3.143 ( -2.665 4.710 3.044) 6.209 3.579 ( 0.183 9.898 2.427) 10.193 3.715 ( -4.757 3.370 -5.586) 8.074 4.059 ( 1.838 20.376 0.341) 20.462 4.158 ( -1.930 10.647 0.020) 10.821 4.347 ( 5.226 3.360 1.680) 6.436 4.586 ( -4.074 8.100 -5.403) 10.555 5.228 ( -1.239 1.483 -2.897) 3.482 5.392 ( 15.237 -3.284 3.552) 15.987 5.577 ( 0.494 -2.957 0.467) 3.034 5.687 ( -7.090 5.552 -2.844) 9.444 6.749 ( -3.679 -3.722 11.095) 12.267 7.550 ( 4.112 -6.675 0.334) 7.847 8.144 ( -7.371 -16.973 1.653) 18.578 8.245 ( -2.395 -21.286 5.263) 22.057 8.822 ( -1.803 8.640 -0.188) 8.829 9.079 ( 9.798 3.197 -3.680) 10.943 9.750 ( -1.807 8.677 -1.553) 8.998 10.157 ( -13.899 0.980 -6.340) 15.308 10.438 ( 0.013 -11.068 -1.032) 11.116 10.654 ( -4.330 0.668 -1.092) 4.515 11.483 ( 7.171 -7.794 10.285) 14.763 11.623 ( 0.230 -7.884 1.087) 7.962 14.839 ( 9.776 0.377 4.620) 10.819 15.218 ( -9.672 -2.235 0.176) 9.928 16.429 ( -2.410 -2.937 0.898) 3.903 16.885 ( -1.978 -3.066 -0.375) 3.668 20.738 ( -0.374 16.128 2.108) 16.270 21.495 ( 4.586 44.121 -23.011) 49.972 ======================= Grid point 358 (154/322) ======================= q-point: ( 0.08 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.869 ( 13.652 0.000 12.496) 18.507 1.084 ( 21.928 0.000 14.693) 26.395 1.523 ( 12.010 0.000 20.026) 23.352 2.225 ( 2.781 0.000 -7.871) 8.348 2.788 ( 8.732 0.000 -8.082) 11.899 2.819 ( -2.543 -0.000 2.640) 3.665 3.006 ( -2.691 -0.000 -1.647) 3.155 3.086 ( -4.516 -0.000 5.666) 7.245 3.429 ( -2.065 -0.000 3.740) 4.272 3.605 ( -5.444 -0.000 -2.515) 5.997 3.663 ( 2.655 0.000 -2.203) 3.450 4.089 ( -0.961 -0.000 1.454) 1.742 4.284 ( -9.926 -0.000 -1.332) 10.015 4.465 ( 4.328 0.000 3.031) 5.284 5.176 ( -7.820 -0.000 -2.135) 8.106 5.495 ( -3.375 -0.000 0.215) 3.382 5.549 ( 3.503 0.000 -0.520) 3.541 5.735 ( -0.475 -0.000 -3.327) 3.361 6.744 ( -8.046 -0.000 11.975) 14.427 7.558 ( -10.064 -0.000 0.551) 10.079 8.185 ( -15.102 -0.000 10.361) 18.314 8.426 ( 7.349 0.000 -0.081) 7.350 8.669 ( -0.946 -0.000 2.401) 2.580 9.256 ( 10.276 0.000 -7.992) 13.018 9.617 ( 0.805 0.000 0.709) 1.072 9.948 ( -2.644 -0.000 2.176) 3.424 10.553 ( -0.323 -0.000 -0.879) 0.936 10.655 ( 2.951 0.000 -1.365) 3.252 11.370 ( -22.674 -0.000 3.588) 22.956 11.830 ( 8.551 0.000 1.692) 8.717 15.050 ( -5.426 -0.000 -4.178) 6.848 15.647 ( 37.947 0.000 -12.171) 39.852 16.663 ( 28.884 0.000 -8.894) 30.223 16.924 ( 3.842 0.000 -0.530) 3.878 20.550 ( -0.100 -0.000 0.090) 0.134 20.810 ( 0.025 0.000 -0.067) 0.072 ======================= Grid point 359 (155/322) ======================= q-point: ( 0.15 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 12.542 -21.674 8.639) 26.489 1.335 ( 11.206 -9.394 17.637) 22.910 1.792 ( 19.534 -17.239 2.774) 26.201 2.387 ( 2.429 -13.244 -5.099) 14.398 2.785 ( 0.588 -0.044 0.288) 0.656 2.925 ( 0.071 -6.089 -0.744) 6.135 3.034 ( 4.997 -3.081 -2.098) 6.234 3.081 ( -1.457 -4.920 4.171) 6.613 3.548 ( -3.642 -4.205 -1.994) 5.909 3.582 ( -2.960 -9.254 3.582) 10.355 4.080 ( -0.569 -27.617 -3.723) 27.873 4.109 ( -2.954 -3.281 1.774) 4.757 4.348 ( -4.953 -11.565 0.764) 12.604 4.511 ( 4.559 -4.559 2.040) 6.762 5.128 ( -10.075 -1.426 -2.720) 10.533 5.455 ( -5.305 1.733 0.848) 5.645 5.616 ( 1.169 4.223 -2.602) 5.096 5.636 ( 0.211 -4.611 -0.631) 4.659 6.665 ( -9.093 4.338 11.765) 15.489 7.438 ( -12.059 5.803 0.079) 13.383 7.972 ( -6.407 13.481 7.400) 16.659 8.308 ( 4.355 13.653 2.929) 14.627 8.836 ( 2.856 -12.317 0.660) 12.661 9.259 ( 6.032 3.301 -8.283) 10.766 9.716 ( -0.232 -4.738 -0.765) 4.805 9.967 ( 0.766 -4.057 2.732) 4.951 10.419 ( -1.078 11.421 -0.585) 11.486 10.676 ( 4.705 -0.863 -0.532) 4.813 11.278 ( -15.123 -2.698 3.903) 15.850 11.797 ( 4.561 7.216 1.657) 8.696 15.015 ( -0.713 0.850 -3.820) 3.977 15.568 ( 27.472 18.450 -4.317) 33.373 16.601 ( 17.791 13.229 -3.155) 22.393 16.917 ( 5.177 3.127 -0.362) 6.059 20.735 ( -0.904 -16.274 2.023) 16.424 21.372 ( -3.199 -39.665 -16.101) 42.927 ======================= Grid point 360 (156/322) ======================= q-point: ( 0.23 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( 3.683 -6.581 15.158) 16.930 1.767 ( 15.118 -17.356 4.607) 23.474 2.296 ( 12.416 -18.839 -6.929) 23.603 2.670 ( 0.387 -14.215 -2.770) 14.488 2.806 ( -2.277 -2.947 1.885) 4.174 3.016 ( -2.258 -6.583 1.283) 7.077 3.180 ( -0.284 -7.421 -0.262) 7.431 3.310 ( 14.290 -12.596 1.594) 19.115 3.619 ( -2.622 -2.116 1.407) 3.652 3.702 ( -0.089 -6.759 0.578) 6.784 4.165 ( -2.874 -4.337 1.756) 5.491 4.368 ( -1.672 0.083 0.958) 1.928 4.606 ( 2.914 -14.447 1.453) 14.809 4.912 ( -1.887 -21.051 2.699) 21.307 5.179 ( -6.432 -17.869 -5.342) 19.728 5.393 ( -3.936 0.432 -0.465) 3.987 5.537 ( -2.969 0.320 -2.447) 3.861 5.895 ( -2.660 -20.481 -1.048) 20.680 6.519 ( -13.268 4.426 9.585) 16.956 7.187 ( -12.688 11.854 -0.808) 17.383 7.637 ( 0.913 18.308 1.768) 18.416 8.087 ( 5.821 10.705 5.737) 13.468 9.033 ( 5.876 -0.348 -4.463) 7.387 9.199 ( -0.180 -0.083 -4.518) 4.522 9.681 ( -0.889 6.617 3.572) 7.572 10.085 ( -0.649 4.552 -1.550) 4.852 10.229 ( 2.377 -2.344 0.459) 3.370 10.736 ( 2.859 -1.270 0.058) 3.129 11.334 ( -7.697 -10.493 1.298) 13.078 11.644 ( -0.758 8.047 1.732) 8.266 15.000 ( 3.372 1.006 -2.024) 4.060 15.413 ( 18.569 9.548 0.360) 20.883 16.465 ( 8.257 7.715 -0.065) 11.301 16.874 ( 5.560 4.023 -0.306) 6.869 21.115 ( -1.564 -20.770 3.731) 21.160 21.927 ( -4.333 -20.963 -14.287) 25.736 ======================= Grid point 361 (157/322) ======================= q-point: ( 0.31 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( 5.284 -0.245 9.629) 10.986 2.157 ( 11.501 -13.300 2.616) 17.776 2.552 ( 1.024 -4.387 -0.993) 4.613 2.916 ( 4.054 -8.097 -1.134) 9.126 2.921 ( -4.039 -11.190 2.266) 12.111 3.194 ( 1.493 -11.347 -1.216) 11.509 3.320 ( 0.778 -6.651 0.455) 6.712 3.533 ( -3.838 0.972 -1.552) 4.253 3.665 ( 7.520 -9.791 -0.319) 12.349 3.948 ( 11.346 -12.257 1.798) 16.799 4.237 ( -1.913 -3.579 1.015) 4.183 4.320 ( -0.723 2.603 1.937) 3.324 4.764 ( -2.639 -2.848 0.465) 3.910 5.009 ( -3.251 0.470 0.832) 3.389 5.398 ( -3.897 -3.220 -1.780) 5.360 5.527 ( -4.000 -4.355 -2.982) 6.622 5.809 ( -0.976 -30.372 -0.629) 30.394 6.156 ( -9.802 1.194 6.221) 11.671 6.599 ( -14.461 -28.430 -1.151) 31.917 6.864 ( -9.424 11.562 -0.891) 14.943 7.316 ( 8.259 16.365 1.203) 18.371 8.002 ( 8.110 2.764 4.636) 9.742 8.872 ( -2.007 11.950 -8.926) 15.051 9.259 ( 4.731 0.080 0.903) 4.817 9.513 ( -1.533 9.280 7.641) 12.118 9.884 ( -1.911 8.496 -2.189) 8.979 10.369 ( 4.380 -2.820 0.556) 5.238 10.707 ( 1.025 4.972 -2.963) 5.878 11.556 ( -4.649 -4.931 1.192) 6.881 11.621 ( -4.048 -18.259 0.064) 18.703 15.012 ( 5.004 0.019 -0.504) 5.030 15.397 ( 12.320 2.325 0.531) 12.549 16.398 ( 5.524 3.054 0.503) 6.332 16.833 ( 5.220 3.157 -0.668) 6.137 21.498 ( -1.352 -17.649 2.990) 17.951 22.154 ( -2.281 -6.959 -7.392) 10.405 ======================= Grid point 362 (158/322) ======================= q-point: ( 0.38 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( 7.108 9.689 7.578) 14.207 2.410 ( 5.370 -5.304 2.619) 7.989 2.582 ( 0.908 -1.190 2.413) 2.839 3.068 ( 3.609 -4.416 -0.357) 5.714 3.110 ( -5.950 -9.871 5.646) 12.834 3.432 ( 3.716 -8.951 -3.232) 10.216 3.453 ( 1.801 -5.314 0.762) 5.662 3.489 ( -3.167 -3.489 -1.634) 4.988 3.892 ( 3.906 -8.762 -0.027) 9.593 4.181 ( 8.925 1.078 -0.753) 9.021 4.278 ( 2.473 -5.085 -0.983) 5.739 4.325 ( 0.512 -2.539 1.857) 3.187 4.754 ( -7.745 -0.009 -4.239) 8.830 4.958 ( -2.309 1.869 2.099) 3.637 5.436 ( -1.238 -2.129 -0.233) 2.474 5.606 ( -5.639 -6.776 -2.753) 9.235 5.939 ( -18.377 4.572 2.304) 19.077 6.208 ( -2.070 -3.908 0.473) 4.447 6.717 ( -0.804 -2.827 0.457) 2.974 7.021 ( 5.017 2.915 2.021) 6.145 7.246 ( -1.607 -20.504 -1.372) 20.612 8.078 ( 9.933 -4.252 3.336) 11.308 8.588 ( -6.497 12.099 -7.637) 15.714 9.187 ( 4.046 9.510 4.611) 11.317 9.370 ( -1.299 5.660 6.878) 9.002 9.754 ( -1.300 4.296 -2.562) 5.168 10.394 ( 0.687 -0.442 1.601) 1.797 10.572 ( 1.790 7.573 -4.563) 9.021 11.747 ( -1.290 -15.073 -0.225) 15.130 11.987 ( -5.353 -19.532 -1.575) 20.314 15.055 ( 5.200 -1.195 0.437) 5.353 15.432 ( 7.754 0.783 -0.088) 7.794 16.416 ( 5.237 -1.493 0.534) 5.472 16.807 ( 3.852 2.262 -1.343) 4.665 21.790 ( -0.614 -12.102 1.333) 12.190 22.191 ( -0.365 0.735 -2.817) 2.934 ======================= Grid point 363 (159/322) ======================= q-point: ( 0.46 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( 6.598 17.095 8.030) 20.006 2.416 ( -1.365 3.395 5.479) 6.589 2.676 ( 4.615 -3.743 1.039) 6.032 3.135 ( 4.163 -0.848 -1.000) 4.365 3.236 ( -8.573 -6.272 5.598) 12.007 3.502 ( -0.106 -3.902 -0.670) 3.961 3.589 ( 3.221 -5.427 1.251) 6.434 3.670 ( 3.349 -8.822 -0.675) 9.461 4.048 ( 4.602 -3.984 -0.513) 6.109 4.136 ( -0.327 2.495 0.614) 2.590 4.332 ( -0.536 -0.626 -0.954) 1.260 4.410 ( 4.893 -1.195 -0.565) 5.069 4.656 ( -10.152 3.459 -4.399) 11.592 4.958 ( -0.361 -2.314 -2.615) 3.511 5.467 ( 2.176 -0.756 1.082) 2.545 5.694 ( -6.292 -5.165 -2.172) 8.426 5.782 ( -17.034 -0.526 -0.257) 17.044 6.162 ( 1.203 4.081 0.572) 4.293 6.788 ( 3.479 0.065 1.621) 3.839 6.935 ( 7.960 5.670 2.047) 9.985 7.649 ( -2.006 -16.776 -0.845) 16.916 8.286 ( 7.281 -4.683 0.615) 8.679 8.328 ( -6.860 2.778 -2.534) 7.822 9.000 ( 1.329 11.395 6.514) 13.193 9.266 ( -1.219 4.999 5.020) 7.189 9.639 ( -1.204 6.507 -2.752) 7.167 10.418 ( 0.504 0.747 -2.224) 2.399 10.519 ( 0.133 -4.867 -0.753) 4.927 12.040 ( 1.309 -12.564 -2.846) 12.948 12.297 ( -4.408 -14.975 -1.687) 15.702 15.113 ( 4.335 -1.521 1.246) 4.760 15.443 ( 3.968 1.641 -0.536) 4.327 16.501 ( 4.788 -3.296 0.030) 5.813 16.776 ( 1.503 2.429 -1.905) 3.434 21.974 ( 0.018 -6.695 -0.010) 6.695 22.140 ( 0.308 3.546 -0.386) 3.580 ======================= Grid point 364 (160/322) ======================= q-point: ( 0.54 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( 2.516 11.070 8.571) 14.224 2.357 ( -1.772 1.521 6.334) 6.750 2.727 ( -0.647 0.060 0.354) 0.740 3.173 ( 6.904 0.095 -0.470) 6.921 3.290 ( -6.416 -3.376 4.165) 8.361 3.577 ( 1.098 -2.592 0.323) 2.834 3.694 ( 2.828 -2.742 2.700) 4.775 3.830 ( 3.492 -5.067 -1.032) 6.240 4.041 ( -1.191 2.826 -1.426) 3.382 4.165 ( 3.071 -2.007 2.437) 4.404 4.332 ( -0.138 -0.116 -0.936) 0.953 4.391 ( -5.059 2.936 -2.690) 6.437 4.534 ( -5.975 2.275 -1.482) 6.563 4.992 ( 1.147 -0.814 -5.625) 5.798 5.497 ( 3.324 -0.396 0.961) 3.483 5.715 ( -6.831 -3.696 -1.663) 7.943 5.772 ( -6.605 -3.070 0.000) 7.284 6.121 ( 2.754 1.153 0.134) 2.989 6.773 ( 6.155 3.395 2.239) 7.377 6.899 ( 3.400 2.079 1.093) 4.133 7.862 ( 1.067 -5.001 -0.445) 5.133 8.126 ( -9.982 3.038 -3.571) 11.028 8.580 ( 2.222 -8.869 5.393) 10.615 8.799 ( 4.430 7.708 5.126) 10.262 9.190 ( -2.483 1.909 4.202) 5.241 9.510 ( -0.479 4.388 -3.151) 5.424 10.413 ( 0.880 -0.493 -3.188) 3.344 10.637 ( -0.522 -4.345 0.016) 4.376 12.193 ( -0.736 -2.935 -3.493) 4.622 12.520 ( 0.802 -8.545 -2.489) 8.936 15.160 ( 2.240 -0.759 1.546) 2.825 15.415 ( 1.273 2.603 -0.590) 2.957 16.566 ( 2.449 -0.046 -0.504) 2.501 16.728 ( -0.534 1.736 -1.917) 2.641 22.055 ( 0.130 -0.725 -0.313) 0.800 22.083 ( 0.101 0.899 0.336) 0.965 ======================= Grid point 365 (161/322) ======================= q-point: (-0.38 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( -3.897 -7.389 7.278) 11.080 2.375 ( -1.400 -3.441 5.653) 6.765 2.676 ( -4.004 3.456 0.142) 5.291 3.195 ( 3.348 1.237 1.816) 4.004 3.307 ( -0.416 0.603 2.029) 2.157 3.600 ( 0.187 0.732 -0.517) 0.916 3.735 ( 3.687 0.861 2.581) 4.583 3.884 ( 3.718 1.894 -3.100) 5.198 3.976 ( -4.899 1.507 -0.969) 5.216 4.206 ( 1.959 0.548 2.781) 3.446 4.251 ( -11.990 3.634 -5.084) 13.521 4.362 ( 3.837 -1.685 2.279) 4.770 4.484 ( -2.638 0.843 -0.817) 2.887 4.983 ( 2.395 1.770 -3.774) 4.807 5.525 ( 3.785 -0.332 0.352) 3.815 5.741 ( -3.348 -0.160 -0.484) 3.387 5.849 ( 1.480 -8.464 0.239) 8.595 6.140 ( 2.942 -1.155 -0.308) 3.175 6.749 ( 6.359 3.576 2.970) 7.877 6.896 ( -0.479 -0.996 -0.089) 1.109 7.858 ( -1.830 4.096 -0.446) 4.508 8.067 ( -8.227 -1.056 -1.585) 8.444 8.476 ( -1.479 9.644 2.729) 10.131 8.981 ( 7.685 -11.475 6.292) 15.176 9.186 ( -4.549 -3.310 3.803) 6.790 9.482 ( 0.988 -2.274 -3.779) 4.520 10.416 ( 1.036 0.486 -3.081) 3.286 10.639 ( -0.857 3.646 -0.181) 3.750 12.146 ( -1.462 6.086 -2.427) 6.713 12.606 ( 4.115 1.396 -3.805) 5.776 15.167 ( -0.809 0.754 0.483) 1.207 15.357 ( -0.245 3.393 0.192) 3.407 16.512 ( -1.530 4.753 -0.348) 5.005 16.712 ( -0.620 -0.174 -1.485) 1.618 22.041 ( 0.003 0.703 0.029) 0.703 22.087 ( -0.223 0.020 0.120) 0.254 ======================= Grid point 366 (162/322) ======================= q-point: (-0.31 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( -6.980 -13.417 5.980) 16.263 2.457 ( -0.098 -0.368 2.928) 2.953 2.565 ( -4.869 2.269 1.721) 5.641 3.165 ( -3.046 2.377 4.146) 5.667 3.245 ( 2.233 6.407 -0.205) 6.788 3.560 ( -0.673 2.708 -1.522) 3.178 3.701 ( 2.705 4.646 -0.940) 5.458 3.790 ( 2.750 8.401 -4.785) 10.051 3.949 ( -3.098 -1.498 0.378) 3.462 4.053 ( -12.515 7.657 -4.611) 15.379 4.198 ( 2.020 2.610 1.441) 3.601 4.430 ( -0.688 0.181 3.436) 3.509 4.486 ( 4.118 -3.841 1.776) 5.905 4.957 ( 2.669 1.482 -0.628) 3.117 5.553 ( 4.755 0.491 0.214) 4.785 5.702 ( -2.476 2.015 -0.747) 3.279 6.102 ( 11.001 -12.378 0.276) 16.562 6.198 ( 2.277 -3.505 0.017) 4.179 6.703 ( 0.347 3.601 3.897) 5.317 6.920 ( -1.320 -1.344 -1.209) 2.239 7.708 ( -0.227 10.401 -0.691) 10.426 7.970 ( -10.937 5.972 -0.207) 12.463 8.388 ( 4.598 -0.801 -0.047) 4.667 9.187 ( -0.197 -6.028 3.658) 7.054 9.291 ( -3.846 -8.303 6.162) 11.031 9.599 ( 3.087 -8.439 -4.301) 9.963 10.394 ( 0.752 2.766 -1.619) 3.292 10.535 ( -1.231 2.933 -1.563) 3.544 11.952 ( -0.113 12.125 -0.566) 12.139 12.487 ( 4.250 12.589 -4.331) 13.975 15.121 ( -3.402 2.442 -1.814) 4.564 15.284 ( -1.025 3.666 2.104) 4.349 16.401 ( -2.933 4.418 0.226) 5.308 16.707 ( -1.210 -0.097 -0.904) 1.514 21.981 ( -0.036 6.007 -0.043) 6.008 22.122 ( 0.070 -3.826 -0.210) 3.833 ======================= Grid point 367 (163/322) ======================= q-point: (-0.23 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( -5.682 -5.892 7.404) 11.037 2.254 ( -3.087 15.639 2.340) 16.111 2.621 ( -1.480 -3.514 1.301) 4.028 3.048 ( -6.289 7.403 2.415) 10.010 3.126 ( 2.253 6.451 0.620) 6.861 3.476 ( -2.751 4.849 -3.644) 6.660 3.594 ( 4.111 10.907 -4.285) 12.418 3.634 ( 0.689 2.872 -3.126) 4.300 3.759 ( -10.972 13.961 -2.890) 17.990 3.969 ( 0.024 0.362 -1.065) 1.126 4.165 ( 2.577 1.435 4.591) 5.457 4.386 ( -2.060 2.764 0.916) 3.567 4.625 ( 5.529 -4.808 5.966) 9.449 4.966 ( 1.671 -1.177 0.708) 2.163 5.537 ( 4.022 4.069 -0.780) 5.774 5.632 ( -1.043 3.848 -1.409) 4.229 6.218 ( 2.929 4.958 0.171) 5.761 6.433 ( 10.108 -5.819 1.211) 11.726 6.667 ( -1.524 -6.580 3.358) 7.543 6.947 ( -3.768 -5.357 -1.024) 6.629 7.392 ( 7.487 24.517 -2.417) 25.749 7.799 ( -12.425 1.475 1.558) 12.609 8.520 ( 5.791 -8.025 -1.185) 9.967 9.273 ( -4.217 -3.806 0.969) 5.762 9.444 ( -3.643 -8.908 6.537) 11.634 9.795 ( 2.297 -9.534 -4.902) 10.964 10.304 ( -0.382 4.327 1.099) 4.480 10.591 ( -0.561 -8.037 -4.350) 9.156 11.700 ( 1.958 13.090 2.286) 13.431 12.158 ( 2.392 21.385 -3.344) 21.777 15.033 ( -3.490 3.791 -2.310) 5.647 15.214 ( -2.193 2.669 2.707) 4.389 16.323 ( -2.573 1.609 0.434) 3.065 16.708 ( -1.336 -1.093 -0.302) 1.752 21.804 ( -0.473 11.959 1.508) 12.063 22.210 ( 1.506 -4.099 -3.465) 5.575 ======================= Grid point 368 (164/322) ======================= q-point: (-0.15 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.514 ( -2.399 3.134 11.749) 12.394 1.870 ( -1.714 21.595 4.999) 22.232 2.566 ( -2.386 10.320 -3.776) 11.245 2.884 ( -1.713 5.418 0.720) 5.727 2.970 ( -0.037 10.685 0.596) 10.701 3.315 ( -3.849 8.458 -8.380) 12.513 3.345 ( -0.526 17.518 0.955) 17.552 3.423 ( -4.133 9.030 1.093) 9.991 3.651 ( 0.492 -2.456 -1.878) 3.130 3.898 ( -1.710 5.655 -1.675) 6.141 4.216 ( 3.795 -3.231 6.052) 7.840 4.310 ( -1.151 3.789 0.504) 3.992 4.706 ( 2.221 1.226 4.671) 5.316 5.027 ( 1.427 -3.451 1.085) 3.889 5.448 ( 3.887 6.305 -1.586) 7.575 5.535 ( 0.198 5.968 -1.557) 6.171 5.873 ( -1.648 27.111 -1.487) 27.202 6.400 ( -4.136 9.287 2.201) 10.402 6.801 ( 5.967 15.678 1.336) 16.828 7.100 ( 2.922 -11.363 -0.863) 11.765 7.192 ( 2.826 -19.357 -0.029) 19.563 7.785 ( -7.302 -5.212 3.830) 9.754 8.727 ( 6.884 -8.592 -2.340) 11.256 9.284 ( -3.134 0.755 -0.619) 3.282 9.631 ( -5.601 -11.115 4.926) 13.386 9.973 ( -0.316 -9.026 -5.853) 10.762 10.246 ( 0.320 2.169 0.653) 2.288 10.748 ( -1.676 -6.597 -5.392) 8.683 11.514 ( 4.494 7.074 5.776) 10.179 11.722 ( 0.058 20.547 -0.177) 20.548 14.939 ( -0.505 3.800 -0.091) 3.835 15.165 ( -3.628 0.843 1.103) 3.884 16.312 ( -1.487 -1.513 0.464) 2.171 16.740 ( -0.875 -2.876 -0.025) 3.006 21.509 ( -0.781 17.736 3.296) 18.057 22.249 ( 2.524 1.684 -9.741) 10.203 ======================= Grid point 369 (165/322) ======================= q-point: (-0.08 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( -0.743 9.064 17.143) 19.406 1.438 ( 4.938 22.203 8.895) 24.422 2.150 ( 0.901 29.474 -3.570) 29.703 2.677 ( 0.217 15.696 0.381) 15.702 2.825 ( -0.381 3.333 -1.224) 3.571 3.070 ( -1.721 8.261 1.659) 8.600 3.106 ( -2.181 8.381 -7.247) 11.292 3.260 ( -2.103 7.368 2.465) 8.048 3.693 ( -0.008 -0.131 0.750) 0.761 3.753 ( -4.560 5.966 -3.239) 8.178 4.214 ( -1.585 4.155 2.776) 5.242 4.338 ( 4.081 -3.882 3.442) 6.601 4.565 ( 0.683 15.568 0.071) 15.583 4.947 ( -4.093 21.618 -0.419) 22.006 5.271 ( 1.512 8.510 -3.689) 9.397 5.410 ( 7.759 -0.165 1.537) 7.912 5.538 ( -2.663 3.042 -0.779) 4.117 5.978 ( -3.769 23.415 -3.429) 23.963 6.681 ( -3.052 -1.034 8.527) 9.116 7.366 ( -0.557 -12.546 0.176) 12.560 7.689 ( -0.497 -25.019 -0.551) 25.030 7.929 ( -1.337 -11.565 6.994) 13.581 8.889 ( 6.178 -2.556 -2.469) 7.127 9.209 ( 1.466 4.961 -2.786) 5.875 9.764 ( -6.448 -4.296 2.086) 8.024 10.138 ( -2.196 -4.007 -6.204) 7.705 10.217 ( -1.077 -3.920 -0.519) 4.098 10.718 ( -2.361 6.310 -2.109) 7.060 11.460 ( -2.178 4.211 6.776) 8.270 11.535 ( 6.679 -3.853 2.921) 8.246 14.908 ( 7.908 0.445 2.791) 8.398 15.141 ( -4.037 -0.672 -0.550) 4.129 16.360 ( 0.331 -3.405 0.594) 3.472 16.806 ( -0.010 -3.876 -0.124) 3.878 21.121 ( -0.918 20.837 3.995) 21.236 22.076 ( 1.839 17.184 -19.254) 25.873 ======================= Grid point 372 (166/322) ======================= q-point: ( 0.15 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.104 ( 19.777 0.000 9.069) 21.757 1.341 ( 11.018 0.000 19.620) 22.502 1.778 ( 25.907 0.000 1.223) 25.936 2.244 ( 4.413 0.000 -7.514) 8.714 2.791 ( -3.556 -0.000 2.485) 4.339 2.860 ( -1.047 -0.000 0.014) 1.047 2.956 ( -4.886 -0.000 -1.403) 5.084 3.114 ( 13.513 0.000 3.793) 14.035 3.414 ( -2.530 -0.000 4.055) 4.779 3.557 ( -2.251 -0.000 0.983) 2.456 3.690 ( 3.072 0.000 -2.447) 3.928 4.063 ( -4.058 -0.000 1.454) 4.311 4.210 ( -2.175 -0.000 0.101) 2.177 4.513 ( 1.324 0.000 1.429) 1.948 5.046 ( -11.628 -0.000 -1.229) 11.693 5.447 ( -4.415 -0.000 1.179) 4.570 5.593 ( 2.126 0.000 -0.766) 2.260 5.666 ( -8.525 -0.000 -4.590) 9.683 6.684 ( -7.890 -0.000 13.552) 15.682 7.414 ( -13.862 -0.000 0.738) 13.882 8.086 ( -8.567 -0.000 12.009) 14.751 8.528 ( 9.414 0.000 -0.110) 9.415 8.667 ( -0.495 -0.000 1.826) 1.892 9.323 ( 5.692 0.000 -9.109) 10.741 9.629 ( 0.906 0.000 0.379) 0.982 9.978 ( 5.114 0.000 3.070) 5.965 10.547 ( -0.360 -0.000 -0.698) 0.785 10.693 ( 3.508 0.000 -1.132) 3.686 11.142 ( -17.928 -0.000 3.660) 18.298 11.900 ( 2.017 0.000 1.217) 2.356 15.022 ( 3.368 0.000 -3.568) 4.906 15.890 ( 12.694 0.000 -9.283) 15.727 16.949 ( 13.276 0.000 -5.686) 14.442 17.059 ( 29.107 0.000 -17.279) 33.850 20.549 ( -0.122 -0.000 0.107) 0.162 20.810 ( 0.029 0.000 -0.067) 0.073 ======================= Grid point 373 (167/322) ======================= q-point: ( 0.23 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 9.274 -11.067 13.481) 19.754 1.514 ( 12.928 -14.303 10.099) 21.765 2.061 ( 26.231 -12.178 -6.081) 29.553 2.406 ( 3.621 -12.331 -5.238) 13.878 2.764 ( -4.858 0.188 2.797) 5.609 2.877 ( -6.537 -4.992 1.223) 8.316 3.008 ( -5.187 -7.306 0.386) 8.968 3.265 ( 22.998 -3.845 1.683) 23.378 3.532 ( 2.534 -4.034 2.615) 5.434 3.556 ( -3.456 -9.343 3.666) 10.615 4.067 ( 0.137 -22.143 -2.419) 22.275 4.076 ( -2.914 -7.057 1.392) 7.760 4.330 ( -0.193 -14.155 2.005) 14.297 4.539 ( -0.197 -4.655 -0.004) 4.659 4.986 ( -12.310 -1.427 -2.000) 12.553 5.400 ( -4.809 2.103 1.206) 5.385 5.551 ( -7.819 3.492 -3.482) 9.244 5.636 ( -2.529 -5.047 -1.701) 5.896 6.602 ( -7.474 5.952 13.743) 16.738 7.280 ( -14.176 5.585 0.208) 15.238 7.939 ( -3.341 11.359 7.727) 14.138 8.364 ( 3.334 13.378 2.748) 14.058 8.881 ( 4.324 -12.985 0.288) 13.689 9.278 ( 2.044 5.337 -9.684) 11.245 9.720 ( 1.181 -4.736 0.249) 4.887 10.019 ( 5.702 -2.140 3.571) 7.060 10.402 ( -1.495 11.442 -0.238) 11.542 10.735 ( 5.035 -1.531 -0.121) 5.264 11.117 ( -13.713 -6.055 2.505) 15.198 11.817 ( -1.673 8.007 -0.118) 8.181 15.044 ( 7.376 0.756 -1.878) 7.649 15.786 ( 12.964 13.775 -5.444) 19.684 16.825 ( 21.116 21.127 -7.534) 30.806 16.999 ( 9.016 5.147 -1.333) 10.467 20.730 ( -1.028 -16.165 1.795) 16.297 21.286 ( -3.923 -35.812 -11.066) 37.688 ======================= Grid point 374 (168/322) ======================= q-point: ( 0.31 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 5.404 -6.044 12.184) 14.634 1.953 ( 14.320 -15.866 3.283) 21.624 2.426 ( 11.424 -10.408 -4.697) 16.152 2.667 ( -0.135 -12.328 -2.440) 12.568 2.789 ( 0.015 -5.865 1.647) 6.091 2.992 ( -2.426 -9.015 0.992) 9.388 3.157 ( -2.751 -9.531 0.959) 9.966 3.471 ( 7.987 -5.973 -0.643) 9.995 3.612 ( -0.350 -0.624 0.628) 0.952 3.781 ( 16.044 -11.971 5.090) 20.655 4.137 ( -2.671 -4.537 1.449) 5.461 4.354 ( -0.553 -1.397 0.763) 1.685 4.653 ( 3.420 -11.618 3.393) 12.577 4.858 ( -8.240 -14.678 -0.288) 16.835 5.088 ( -5.641 -27.781 -4.813) 28.754 5.343 ( -6.018 -1.487 -1.351) 6.344 5.468 ( -5.232 0.563 -1.450) 5.458 5.834 ( -7.850 -20.946 -2.065) 22.464 6.402 ( -11.309 10.417 11.414) 19.149 7.032 ( -12.592 10.716 -0.482) 16.542 7.677 ( 4.780 15.073 2.085) 15.949 8.156 ( 2.707 8.857 5.484) 10.763 9.049 ( -0.334 6.007 -9.131) 10.935 9.201 ( 2.617 -5.507 -1.089) 6.193 9.708 ( 3.218 7.014 3.993) 8.688 10.072 ( -1.221 8.816 0.019) 8.900 10.270 ( 4.078 -6.371 0.961) 7.625 10.766 ( 1.534 1.475 0.838) 2.287 11.248 ( -6.768 -13.983 0.111) 15.536 11.612 ( -4.793 9.002 -0.515) 10.212 15.067 ( 8.529 1.540 -0.145) 8.668 15.601 ( 13.184 10.478 -1.596) 16.916 16.578 ( 10.710 11.864 -0.972) 16.013 16.948 ( 6.927 4.866 -0.719) 8.495 21.107 ( -1.658 -20.771 3.336) 21.103 21.834 ( -4.636 -22.605 -10.798) 25.477 ======================= Grid point 375 (169/322) ======================= q-point: ( 0.38 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( 7.841 -0.542 8.512) 11.585 2.298 ( 10.573 -10.854 2.226) 15.315 2.555 ( -0.786 -2.256 1.336) 2.737 2.871 ( -4.893 -10.660 1.630) 11.842 2.984 ( 7.131 -8.122 1.122) 10.866 3.208 ( 1.274 -12.577 -0.678) 12.659 3.336 ( 1.323 -8.640 0.653) 8.765 3.480 ( -3.995 3.024 -1.730) 5.300 3.737 ( 5.760 -8.996 -0.697) 10.705 4.138 ( 16.495 -10.926 0.714) 19.798 4.225 ( 0.965 -5.156 1.553) 5.471 4.314 ( -0.962 3.692 2.180) 4.394 4.704 ( -7.338 0.388 -2.197) 7.670 4.963 ( -4.104 -1.289 1.204) 4.467 5.320 ( -8.870 -5.364 -4.818) 11.431 5.465 ( -4.666 -3.639 -0.133) 5.919 5.802 ( 0.191 -30.473 -0.406) 30.476 6.059 ( -9.959 10.530 6.834) 16.024 6.428 ( -13.040 -35.452 -1.964) 37.825 6.766 ( -7.014 8.254 -0.033) 10.831 7.436 ( 11.111 14.034 2.078) 18.020 8.090 ( 4.125 0.657 4.622) 6.230 8.790 ( -6.132 13.180 -9.749) 17.503 9.326 ( 5.374 -1.050 1.390) 5.649 9.544 ( 2.765 11.196 7.433) 13.720 9.856 ( -1.937 8.441 -1.521) 8.793 10.413 ( 2.349 -1.098 1.008) 2.782 10.712 ( 1.088 4.431 -2.638) 5.270 11.494 ( -5.722 -6.322 -0.348) 8.535 11.574 ( -3.854 -17.710 0.124) 18.125 15.091 ( 8.099 0.883 0.977) 8.206 15.529 ( 9.758 4.270 -0.723) 10.676 16.471 ( 6.457 4.196 0.310) 7.707 16.892 ( 5.076 4.071 -1.170) 6.611 21.491 ( -1.281 -17.836 2.709) 18.086 22.106 ( -2.233 -9.094 -6.022) 11.134 ======================= Grid point 376 (170/322) ======================= q-point: ( 0.46 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( 8.887 10.076 7.900) 15.585 2.461 ( 1.262 -0.322 4.360) 4.550 2.616 ( 3.344 -4.743 1.604) 6.021 3.037 ( -5.200 -8.846 2.615) 10.589 3.144 ( 6.198 -3.348 2.512) 7.478 3.414 ( -4.976 -3.702 -0.419) 6.216 3.464 ( 3.123 -8.124 -1.037) 8.765 3.519 ( 4.622 -8.513 -0.528) 9.701 3.948 ( 5.571 -8.271 0.498) 9.984 4.215 ( -1.189 4.941 0.578) 5.115 4.283 ( -1.666 -3.514 -0.345) 3.904 4.411 ( 10.685 -3.506 -0.371) 11.252 4.635 ( -8.887 0.781 -5.382) 10.419 4.923 ( -3.326 0.744 0.585) 3.459 5.381 ( -8.240 -6.324 -4.468) 11.307 5.545 ( -3.582 -6.380 0.475) 7.332 5.753 ( -13.080 8.443 2.711) 15.802 6.194 ( -0.682 -4.731 0.111) 4.782 6.705 ( -1.229 -5.740 0.061) 5.871 7.032 ( -2.662 -20.397 -0.086) 20.570 7.311 ( 10.799 0.009 2.904) 11.182 8.178 ( 5.120 -5.835 3.317) 8.442 8.472 ( -8.524 12.620 -7.209) 16.848 9.259 ( 5.377 10.902 3.401) 12.623 9.382 ( -0.228 6.603 7.171) 9.751 9.730 ( -1.341 4.233 -2.484) 5.087 10.393 ( -1.593 0.118 1.679) 2.318 10.580 ( 1.861 7.955 -4.469) 9.312 11.732 ( -0.833 -17.678 -0.898) 17.720 11.923 ( -4.658 -18.583 -0.942) 19.181 15.132 ( 7.091 -0.165 1.624) 7.276 15.511 ( 5.699 2.617 -0.893) 6.335 16.481 ( 5.382 -1.242 0.275) 5.530 16.841 ( 2.668 3.382 -1.808) 4.672 21.788 ( -0.456 -12.292 1.247) 12.364 22.179 ( -0.399 -0.485 -2.518) 2.595 ======================= Grid point 377 (171/322) ======================= q-point: ( 0.54 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( 6.303 18.840 8.218) 21.499 2.418 ( -1.190 3.789 6.293) 7.441 2.711 ( 0.786 -2.052 0.543) 2.264 3.164 ( -5.941 -5.868 5.192) 9.833 3.213 ( 9.488 -1.081 -1.641) 9.689 3.492 ( -1.481 -5.730 0.601) 5.949 3.627 ( 2.625 -5.938 2.073) 6.815 3.717 ( 4.129 -8.139 -1.041) 9.186 4.105 ( -3.911 4.388 -0.326) 5.887 4.115 ( 5.488 -5.083 1.305) 7.593 4.318 ( -1.605 -0.915 -0.606) 1.944 4.423 ( -2.906 2.652 -2.608) 4.720 4.552 ( -4.257 2.894 -1.848) 5.469 4.945 ( 0.460 -3.085 -4.457) 5.440 5.449 ( -5.296 -5.083 -3.646) 8.196 5.604 ( -10.317 -0.702 0.728) 10.366 5.651 ( -2.276 -5.095 1.020) 5.673 6.174 ( 0.613 2.846 -0.342) 2.932 6.804 ( -0.054 -2.320 0.058) 2.322 7.074 ( 12.143 7.627 3.847) 14.846 7.643 ( 1.281 -17.569 0.243) 17.618 8.188 ( -9.763 9.491 -4.476) 14.333 8.383 ( 3.260 -11.178 3.837) 12.260 9.050 ( 3.759 12.657 4.323) 13.893 9.264 ( -1.633 5.732 5.198) 7.908 9.613 ( -1.656 6.302 -2.761) 7.077 10.416 ( 0.264 0.215 -1.844) 1.875 10.514 ( -0.364 -4.407 -1.041) 4.543 12.047 ( 1.561 -11.750 -2.703) 12.158 12.246 ( -3.320 -17.022 -1.444) 17.402 15.176 ( 5.233 -0.099 2.036) 5.617 15.480 ( 2.493 2.932 -0.989) 3.974 16.557 ( 4.684 -2.607 -0.349) 5.372 16.777 ( -0.161 3.611 -2.143) 4.202 21.975 ( 0.129 -6.738 0.008) 6.739 22.141 ( 0.099 3.213 -0.444) 3.245 ======================= Grid point 378 (172/322) ======================= q-point: ( 0.62 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.194 ( 1.121 14.325 7.912) 16.403 2.357 ( -1.609 1.714 6.582) 6.989 2.707 ( -2.175 1.572 -0.060) 2.685 3.201 ( -3.893 -1.180 5.101) 6.524 3.320 ( 10.231 -2.190 -1.178) 10.529 3.577 ( -1.018 -2.859 -0.004) 3.035 3.738 ( 3.096 -3.198 3.293) 5.537 3.862 ( 1.774 -4.443 -2.142) 5.242 4.004 ( -4.021 3.151 -0.747) 5.162 4.215 ( 4.260 -1.796 1.737) 4.938 4.253 ( -9.519 4.132 -4.147) 11.175 4.375 ( 2.427 0.281 1.677) 2.963 4.483 ( -3.526 1.421 -1.003) 3.932 4.990 ( 1.022 -1.364 -5.366) 5.630 5.508 ( -0.360 -3.086 -2.303) 3.867 5.649 ( -3.770 -7.576 0.214) 8.465 5.710 ( -4.022 -2.505 1.078) 4.859 6.143 ( 1.017 0.538 -0.935) 1.482 6.818 ( 0.991 -0.147 0.183) 1.019 6.999 ( 11.076 7.603 3.722) 13.941 7.883 ( 2.293 -3.214 -0.205) 3.953 7.994 ( -9.716 1.262 -1.672) 9.940 8.579 ( -3.639 -2.837 4.379) 6.361 8.890 ( 6.693 2.064 3.697) 7.920 9.168 ( -3.034 2.916 4.058) 5.846 9.494 ( -0.475 3.579 -3.059) 4.732 10.415 ( 1.047 -0.535 -3.100) 3.315 10.628 ( -0.839 -4.349 -0.065) 4.430 12.179 ( 0.143 -1.968 -2.397) 3.104 12.521 ( 0.764 -10.652 -3.229) 11.157 15.193 ( 2.274 1.183 1.700) 3.076 15.425 ( 0.812 3.300 -0.680) 3.466 16.595 ( 2.846 2.483 -0.833) 3.867 16.708 ( -1.861 1.215 -1.795) 2.857 22.055 ( 0.036 -0.651 -0.314) 0.724 22.085 ( 0.086 0.996 0.306) 1.046 ======================= Grid point 379 (173/322) ======================= q-point: (-0.31 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( -4.131 -4.476 6.509) 8.914 2.377 ( -1.358 -3.792 5.590) 6.890 2.636 ( -2.620 4.235 -0.086) 4.981 3.187 ( -4.046 1.193 5.407) 6.857 3.371 ( 7.837 2.902 -0.859) 8.401 3.584 ( -2.160 0.850 -1.238) 2.631 3.797 ( 5.525 1.580 1.240) 5.879 3.864 ( -6.450 0.428 -2.593) 6.965 3.960 ( 4.000 2.237 -1.012) 4.694 4.087 ( -11.616 4.846 -4.040) 13.219 4.244 ( 2.354 0.781 0.519) 2.534 4.426 ( 2.199 -1.350 5.177) 5.785 4.455 ( 1.137 -1.194 -0.923) 1.889 4.991 ( 0.407 0.832 -3.784) 3.896 5.565 ( 4.288 -1.777 -0.726) 4.698 5.705 ( -3.859 0.160 1.145) 4.028 5.854 ( 0.088 -13.628 0.148) 13.629 6.158 ( 0.296 -1.750 -1.163) 2.121 6.844 ( 4.839 0.466 1.001) 4.964 6.908 ( 4.004 5.998 2.343) 7.583 7.798 ( -6.890 4.361 0.053) 8.155 8.012 ( -0.577 0.343 -0.692) 0.964 8.470 ( -0.848 6.389 1.474) 6.611 9.069 ( 3.253 -10.331 6.477) 12.620 9.136 ( -5.196 -1.683 2.943) 6.204 9.486 ( 1.674 -3.322 -3.762) 5.291 10.420 ( 1.081 0.449 -3.125) 3.337 10.627 ( -0.899 3.877 -0.226) 3.986 12.135 ( 0.561 6.043 -1.445) 6.239 12.629 ( 1.908 0.430 -4.578) 4.979 15.158 ( -0.849 2.773 0.100) 2.901 15.360 ( 0.448 3.673 0.460) 3.728 16.498 ( -0.693 6.230 -0.456) 6.285 16.701 ( -0.396 -0.225 -1.250) 1.330 22.042 ( 0.156 0.606 0.069) 0.629 22.084 ( -0.250 0.222 0.100) 0.349 ======================= Grid point 380 (174/322) ======================= q-point: (-0.23 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( -4.907 -13.109 5.636) 15.089 2.474 ( 1.664 1.934 2.245) 3.399 2.514 ( -4.818 0.103 2.290) 5.336 3.122 ( -4.825 3.607 5.099) 7.893 3.295 ( 4.771 7.746 -0.422) 9.107 3.528 ( -3.055 2.913 -3.461) 5.459 3.706 ( -1.256 5.514 -2.922) 6.366 3.800 ( -0.851 7.915 -2.408) 8.317 3.922 ( -1.715 6.541 -2.570) 7.234 3.950 ( -0.949 -0.886 -1.282) 1.824 4.228 ( 2.210 2.174 1.830) 3.600 4.410 ( -2.276 1.026 -0.037) 2.497 4.576 ( 7.747 -4.990 6.457) 11.252 4.964 ( -0.993 0.843 -1.763) 2.192 5.607 ( 3.775 0.890 0.370) 3.896 5.672 ( -1.950 1.119 -0.277) 2.265 6.183 ( 3.598 -18.170 0.458) 18.528 6.213 ( -0.100 -3.770 -0.548) 3.811 6.740 ( 1.930 9.450 4.021) 10.449 6.904 ( -0.726 -0.879 -1.348) 1.766 7.686 ( -1.850 3.826 0.541) 4.285 7.888 ( -2.933 11.744 -1.521) 12.200 8.439 ( 3.820 -2.577 0.359) 4.622 9.166 ( -4.534 -3.992 1.435) 6.209 9.270 ( -3.141 -8.379 7.377) 11.597 9.624 ( 3.138 -8.643 -3.862) 9.974 10.400 ( 1.076 2.797 -1.614) 3.403 10.516 ( -0.982 3.202 -1.730) 3.770 11.961 ( 1.514 11.503 0.131) 11.603 12.504 ( 0.907 12.352 -4.872) 13.309 15.083 ( -2.159 3.520 -1.553) 4.411 15.287 ( 0.562 4.136 1.796) 4.544 16.377 ( -1.096 4.863 0.162) 4.988 16.697 ( 0.054 0.160 -0.707) 0.727 21.980 ( -0.104 6.142 -0.013) 6.143 22.123 ( 0.266 -4.122 -0.236) 4.137 ======================= Grid point 381 (175/322) ======================= q-point: (-0.15 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( -2.304 -7.211 7.406) 10.590 2.247 ( 0.421 15.555 2.438) 15.750 2.606 ( -1.749 -3.237 1.309) 3.906 3.000 ( -2.969 6.687 2.630) 7.775 3.152 ( 1.958 8.455 0.534) 8.695 3.416 ( -3.549 5.755 -6.108) 9.112 3.582 ( -6.889 9.808 -2.159) 12.178 3.623 ( 0.670 2.519 -3.002) 3.976 3.710 ( 3.883 13.840 -1.278) 14.431 3.970 ( 0.776 1.305 -1.341) 2.026 4.210 ( 2.564 0.512 4.147) 4.902 4.365 ( -1.771 2.401 -0.009) 2.984 4.720 ( 6.982 -2.911 6.953) 10.274 4.961 ( -2.154 -2.256 -0.310) 3.135 5.565 ( -0.373 3.697 -0.605) 3.764 5.626 ( 1.886 3.946 -1.231) 4.544 6.226 ( -1.050 6.576 -0.287) 6.665 6.494 ( -1.892 0.795 2.138) 2.963 6.672 ( 0.939 -14.631 2.943) 14.953 6.913 ( -1.480 -3.645 -1.626) 4.257 7.461 ( 3.318 25.264 -2.316) 25.586 7.697 ( -3.102 -1.335 1.465) 3.681 8.588 ( 6.039 -8.597 -0.851) 10.541 9.223 ( -4.551 -3.900 0.187) 5.996 9.415 ( -4.464 -8.279 6.889) 11.659 9.800 ( 0.973 -7.946 -4.437) 9.153 10.311 ( 1.118 4.151 0.996) 4.413 10.574 ( 0.088 -7.720 -4.476) 8.924 11.731 ( 1.832 11.941 2.664) 12.371 12.156 ( -0.926 21.292 -3.613) 21.616 15.002 ( -1.003 3.201 -1.637) 3.732 15.213 ( 1.091 3.970 2.068) 4.608 16.307 ( -0.265 1.671 0.391) 1.736 16.703 ( 0.784 -0.857 -0.242) 1.186 21.802 ( -0.636 11.882 1.527) 11.997 22.214 ( 0.976 -4.044 -3.518) 5.448 ======================= Grid point 382 (176/322) ======================= q-point: (-0.08 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 0.530 1.551 11.738) 11.852 1.911 ( 5.670 20.002 4.732) 21.322 2.541 ( 0.101 10.382 -3.747) 11.038 2.875 ( -0.157 4.692 0.417) 4.713 2.970 ( -0.482 11.007 0.538) 11.031 3.224 ( -4.591 10.319 -6.214) 12.891 3.337 ( -1.761 11.083 0.480) 11.232 3.445 ( 5.481 13.422 0.998) 14.532 3.640 ( -1.578 -2.817 -1.803) 3.698 3.875 ( -1.298 7.335 -0.604) 7.473 4.262 ( 0.386 -1.594 4.832) 5.103 4.302 ( 0.196 1.536 0.104) 1.552 4.750 ( 2.568 3.899 3.443) 5.801 5.025 ( -1.173 -3.591 1.748) 4.163 5.474 ( 0.192 4.538 -1.800) 4.885 5.544 ( 2.344 5.266 -1.561) 5.972 5.847 ( -1.839 28.109 -1.352) 28.202 6.337 ( -7.393 10.895 2.680) 13.436 6.829 ( -2.260 17.250 1.225) 17.440 7.081 ( -4.492 -13.809 -0.699) 14.538 7.220 ( 0.596 -18.374 -0.632) 18.395 7.775 ( 4.197 -5.645 4.007) 8.096 8.808 ( 7.791 -8.862 -2.810) 12.129 9.248 ( -2.425 -0.346 -1.116) 2.692 9.577 ( -6.031 -9.697 5.484) 12.668 9.946 ( -1.403 -8.590 -4.631) 9.860 10.267 ( 2.955 2.896 0.065) 4.138 10.720 ( -0.523 -5.355 -4.503) 7.016 11.570 ( 1.950 4.705 5.203) 7.281 11.707 ( -2.343 20.323 -0.573) 20.466 14.955 ( 2.083 1.255 -0.387) 2.463 15.160 ( 3.175 2.590 1.296) 4.298 16.312 ( 1.174 -1.697 0.455) 2.113 16.745 ( 1.751 -2.629 -0.071) 3.159 21.508 ( -1.068 17.597 3.325) 17.940 22.236 ( 0.344 2.679 -9.563) 9.937 ======================= Grid point 386 (177/322) ======================= q-point: ( 0.23 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( 21.842 0.000 6.223) 22.711 1.481 ( 4.806 0.000 17.254) 17.911 2.115 ( 31.017 0.000 -6.337) 31.657 2.280 ( 5.392 0.000 -6.663) 8.572 2.748 ( -5.079 -0.000 1.540) 5.307 2.767 ( -12.355 -0.000 4.092) 13.015 2.887 ( -6.095 -0.000 -0.676) 6.132 3.396 ( -2.738 -0.000 4.684) 5.425 3.399 ( 26.267 0.000 1.560) 26.313 3.571 ( 5.331 0.000 6.901) 8.720 3.718 ( 2.954 0.000 -2.850) 4.105 4.020 ( -3.575 -0.000 1.608) 3.920 4.203 ( -0.374 -0.000 0.427) 0.567 4.503 ( -2.009 -0.000 -1.249) 2.365 4.908 ( -11.664 -0.000 -0.025) 11.664 5.394 ( -7.254 -0.000 0.655) 7.284 5.531 ( -8.932 -0.000 -2.883) 9.386 5.570 ( -6.274 -0.000 -2.563) 6.777 6.657 ( -4.048 -0.000 16.012) 16.516 7.251 ( -13.834 -0.000 0.946) 13.867 8.038 ( -6.082 -0.000 11.610) 13.107 8.635 ( 8.471 0.000 -0.149) 8.473 8.668 ( -0.033 -0.000 1.022) 1.023 9.340 ( 2.233 0.000 -9.312) 9.576 9.641 ( 0.916 0.000 0.002) 0.916 10.069 ( 8.223 0.000 3.101) 8.788 10.541 ( -0.298 -0.000 -0.476) 0.561 10.716 ( 0.289 0.000 -0.909) 0.954 10.972 ( -12.624 -0.000 3.312) 13.051 11.884 ( -4.288 -0.000 -1.271) 4.473 15.110 ( 12.052 0.000 0.083) 12.052 15.955 ( 3.740 0.000 -6.009) 7.078 17.063 ( 10.305 0.000 -1.063) 10.360 17.324 ( 23.924 0.000 -24.296) 34.098 20.548 ( -0.123 -0.000 0.128) 0.177 20.810 ( 0.031 0.000 -0.066) 0.073 ======================= Grid point 387 (178/322) ======================= q-point: ( 0.31 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 6.344 -5.248 13.156) 15.520 1.718 ( 17.300 -16.308 4.161) 24.136 2.335 ( 19.556 -6.232 -5.036) 21.134 2.441 ( 4.978 -10.625 -4.604) 12.604 2.701 ( -4.806 -2.029 3.123) 6.080 2.806 ( -5.657 -7.292 0.659) 9.253 2.945 ( -5.414 -8.454 0.931) 10.082 3.448 ( 6.903 -0.559 -2.026) 7.216 3.524 ( -3.866 -7.752 4.071) 9.572 3.727 ( 27.050 -6.589 8.126) 29.003 4.043 ( -2.774 -3.549 1.573) 4.772 4.080 ( 2.139 -25.192 -1.193) 25.311 4.335 ( -0.295 -15.863 1.939) 15.983 4.526 ( -0.476 -5.453 -1.400) 5.650 4.830 ( -12.999 0.269 -1.449) 13.082 5.306 ( -12.838 1.949 -2.625) 13.247 5.470 ( -3.939 1.517 -0.511) 4.252 5.550 ( -10.030 -3.948 -2.035) 10.969 6.582 ( -3.743 8.230 16.035) 18.408 7.118 ( -12.884 5.581 0.568) 14.052 7.936 ( -1.477 8.410 7.744) 11.527 8.400 ( 1.420 13.857 1.985) 14.070 8.933 ( 4.253 -12.652 -0.239) 13.350 9.254 ( -0.542 6.791 -10.107) 12.189 9.743 ( 2.250 -6.007 0.894) 6.477 10.111 ( 7.567 -0.027 3.489) 8.333 10.383 ( -1.577 11.054 0.073) 11.167 10.786 ( 3.449 -2.308 0.367) 4.166 10.972 ( -11.948 -7.731 1.548) 14.315 11.765 ( -5.694 8.017 -2.673) 10.191 15.169 ( 13.218 2.029 1.759) 13.488 15.869 ( 4.784 8.905 -4.336) 10.999 17.023 ( 16.150 18.999 -6.619) 25.798 17.112 ( 11.220 11.383 -5.252) 16.824 20.723 ( -0.994 -15.938 1.530) 16.042 21.216 ( -3.181 -32.184 -7.105) 33.112 ======================= Grid point 388 (179/322) ======================= q-point: ( 0.38 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( 8.030 -6.191 9.462) 13.869 2.122 ( 12.772 -13.950 2.401) 19.065 2.491 ( -0.612 -3.593 0.423) 3.670 2.635 ( -4.207 -10.499 0.389) 11.317 2.863 ( 12.101 -9.026 -0.812) 15.118 2.970 ( -1.085 -11.387 0.306) 11.442 3.130 ( -2.143 -11.583 1.250) 11.846 3.501 ( -1.208 -0.109 0.516) 1.318 3.622 ( 3.369 -5.343 -1.363) 6.461 4.054 ( 20.742 -8.197 2.264) 22.418 4.117 ( 1.174 -5.752 3.462) 6.815 4.367 ( 2.354 -1.254 1.518) 3.068 4.680 ( -4.811 0.523 1.074) 4.957 4.749 ( -4.764 -19.534 0.428) 20.111 5.031 ( -1.510 -34.758 -3.382) 34.955 5.202 ( -15.132 -1.438 -4.357) 15.812 5.443 ( -0.423 -1.376 0.969) 1.736 5.694 ( -14.120 -22.485 -2.282) 26.649 6.329 ( -7.357 15.871 11.978) 21.201 6.900 ( -9.489 9.015 0.447) 13.097 7.757 ( 7.329 11.596 2.402) 13.926 8.181 ( -1.282 7.602 5.015) 9.196 8.986 ( -3.929 10.321 -10.886) 15.507 9.245 ( 4.257 -8.634 0.817) 9.661 9.773 ( 5.533 6.115 3.311) 8.886 10.056 ( -1.670 11.602 1.027) 11.767 10.327 ( 5.043 -7.452 1.226) 9.081 10.765 ( -2.664 3.012 1.239) 4.208 11.183 ( -3.896 -16.712 -0.479) 17.166 11.538 ( -6.308 9.247 -2.521) 11.474 15.191 ( 11.399 3.174 2.330) 12.060 15.712 ( 6.977 8.675 -2.263) 11.360 16.700 ( 10.370 15.417 -1.969) 18.684 17.026 ( 6.584 6.088 -1.435) 9.081 21.097 ( -1.543 -20.793 2.900) 21.051 21.757 ( -3.417 -23.594 -7.823) 25.091 ======================= Grid point 389 (180/322) ======================= q-point: ( 0.46 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.910 ( 9.680 -0.832 7.837) 12.483 2.406 ( 5.808 -7.841 2.648) 10.111 2.540 ( -2.759 -3.790 3.123) 5.633 2.824 ( -3.571 -10.395 2.053) 11.182 3.081 ( 7.557 -7.401 1.651) 10.705 3.228 ( 3.170 -12.011 0.308) 12.426 3.352 ( 1.003 -10.550 0.614) 10.615 3.433 ( -2.857 2.879 -1.935) 4.494 3.810 ( 7.101 -9.057 -0.664) 11.528 4.183 ( -1.654 -4.965 0.178) 5.237 4.285 ( -1.724 1.510 2.976) 3.757 4.412 ( 17.717 -3.532 -0.256) 18.067 4.591 ( -8.749 1.397 -4.857) 10.104 4.930 ( -2.195 -0.568 2.984) 3.747 5.155 ( -15.351 -6.909 -6.753) 18.138 5.425 ( -2.796 -4.802 1.626) 5.790 5.810 ( 1.150 -26.819 -0.211) 26.844 5.965 ( -9.328 12.643 5.623) 16.687 6.295 ( -8.091 -40.232 -1.435) 41.063 6.698 ( -4.708 5.739 0.473) 7.438 7.582 ( 11.717 11.984 2.977) 17.023 8.124 ( -0.759 -1.468 4.471) 4.767 8.686 ( -5.716 14.182 -9.349) 17.922 9.385 ( 3.625 -1.234 2.608) 4.633 9.616 ( 5.433 12.753 5.585) 14.945 9.830 ( -1.639 8.176 -1.330) 8.444 10.426 ( -0.763 1.896 1.439) 2.499 10.717 ( 1.185 2.704 -2.718) 4.013 11.426 ( -5.313 -7.350 -0.866) 9.110 11.535 ( -2.433 -18.176 -0.171) 18.338 15.200 ( 9.173 2.117 2.585) 9.762 15.616 ( 5.557 4.939 -1.479) 7.580 16.545 ( 5.759 5.330 -0.164) 7.849 16.941 ( 3.747 5.219 -1.702) 6.646 21.485 ( -1.082 -18.073 2.441) 18.269 22.067 ( -1.361 -10.615 -4.885) 11.764 ======================= Grid point 390 (181/322) ======================= q-point: ( 0.54 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( 7.980 11.091 8.146) 15.907 2.475 ( -1.060 0.804 5.870) 6.019 2.648 ( 0.562 -5.085 1.376) 5.298 3.001 ( -2.350 -8.594 3.706) 9.650 3.242 ( 9.383 -2.581 -0.051) 9.732 3.358 ( -4.324 -4.845 -0.188) 6.497 3.501 ( 3.137 -8.353 0.878) 8.966 3.564 ( 3.431 -9.447 -0.783) 10.081 4.015 ( 4.056 -7.128 1.488) 8.335 4.180 ( -4.792 4.216 1.352) 6.525 4.268 ( 0.724 -3.315 -0.682) 3.461 4.459 ( -3.552 3.433 -3.990) 6.350 4.572 ( 1.743 -0.215 -2.754) 3.266 4.898 ( -1.116 -0.131 -1.947) 2.248 5.249 ( -9.242 -9.346 -4.520) 13.900 5.495 ( -5.460 -4.191 1.979) 7.162 5.662 ( -4.543 6.933 1.710) 8.463 6.188 ( -0.373 -4.525 -0.509) 4.568 6.691 ( -0.900 -7.156 -0.113) 7.214 6.997 ( -2.343 -28.940 -0.458) 29.038 7.464 ( 11.434 5.266 5.128) 13.593 8.218 ( 0.179 -7.123 3.151) 7.791 8.361 ( -5.876 13.467 -6.402) 16.027 9.315 ( 1.941 10.032 2.229) 10.458 9.416 ( 2.456 9.594 7.129) 12.203 9.708 ( -1.008 4.660 -2.678) 5.469 10.369 ( -3.077 -0.338 1.574) 3.473 10.588 ( 1.903 8.445 -4.243) 9.640 11.724 ( -0.008 -20.630 -0.948) 20.652 11.874 ( -3.092 -17.154 -0.738) 17.446 15.224 ( 7.062 0.967 2.745) 7.638 15.557 ( 2.541 3.648 -1.405) 4.662 16.538 ( 3.966 -1.093 -0.265) 4.122 16.858 ( 1.225 4.555 -2.091) 5.160 21.787 ( -0.284 -12.483 1.183) 12.542 22.167 ( -0.187 -1.291 -2.299) 2.644 ======================= Grid point 391 (182/322) ======================= q-point: ( 0.62 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 3.260 20.786 7.992) 22.507 2.427 ( -0.759 4.062 6.988) 8.118 2.706 ( -1.414 -1.025 0.429) 1.798 3.127 ( -3.022 -4.808 5.169) 7.679 3.332 ( 10.130 -2.493 -2.344) 10.692 3.476 ( -1.069 -6.544 0.443) 6.646 3.661 ( 1.088 -6.061 2.787) 6.760 3.754 ( 3.253 -7.466 -1.242) 8.238 4.027 ( -7.931 2.599 1.341) 8.453 4.190 ( 3.932 -3.051 -1.135) 5.105 4.297 ( 0.562 3.070 -1.486) 3.456 4.374 ( -2.457 -0.443 -0.220) 2.507 4.517 ( -2.074 3.816 -1.025) 4.463 4.930 ( -1.313 -3.390 -6.206) 7.192 5.368 ( -4.543 -7.519 -3.452) 9.439 5.530 ( -1.716 -3.593 0.899) 4.082 5.637 ( -2.554 -2.835 1.185) 3.996 6.173 ( -0.335 2.233 -1.102) 2.513 6.801 ( -0.321 -2.558 -0.144) 2.583 7.207 ( 7.257 4.479 3.635) 9.270 7.679 ( 3.560 -16.400 1.904) 16.890 8.082 ( -4.850 10.600 -3.493) 12.169 8.402 ( -1.510 -10.493 3.448) 11.148 9.094 ( 0.832 12.072 2.244) 12.307 9.269 ( 0.219 7.315 5.593) 9.211 9.586 ( -1.390 6.098 -2.687) 6.807 10.412 ( -0.070 -1.136 -1.401) 1.805 10.508 ( 0.107 -3.436 -1.427) 3.722 12.063 ( 2.443 -10.412 -1.919) 10.866 12.208 ( -2.392 -19.153 -1.886) 19.393 15.242 ( 4.316 1.400 2.702) 5.280 15.493 ( 0.448 3.393 -1.319) 3.667 16.603 ( 3.102 -2.727 -0.898) 4.227 16.762 ( -0.955 4.974 -2.104) 5.484 21.977 ( 0.183 -6.726 0.028) 6.728 22.140 ( -0.091 2.960 -0.485) 3.001 ======================= Grid point 392 (183/322) ======================= q-point: (-0.31 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( -1.345 16.763 7.304) 18.335 2.360 ( -1.398 2.113 6.794) 7.251 2.686 ( -1.183 1.986 -0.109) 2.314 3.177 ( -2.565 -1.210 5.871) 6.520 3.431 ( 7.555 -1.510 -1.639) 7.876 3.562 ( -0.724 -2.174 -0.495) 2.344 3.763 ( -3.202 -4.444 2.304) 5.942 3.861 ( 2.061 -0.669 -0.802) 2.311 3.966 ( -2.021 -0.944 -0.799) 2.370 4.139 ( -6.734 5.526 -4.335) 9.730 4.274 ( 4.787 0.535 0.362) 4.830 4.417 ( 0.389 -1.215 3.090) 3.343 4.453 ( 2.019 0.410 -0.021) 2.060 4.969 ( -1.622 -2.067 -6.459) 6.973 5.504 ( 1.119 -7.568 -1.956) 7.897 5.637 ( 2.395 -6.776 0.429) 7.200 5.664 ( -5.268 -1.754 1.161) 5.672 6.140 ( -0.699 0.411 -1.485) 1.692 6.820 ( -0.205 -0.914 -0.131) 0.946 7.121 ( 5.201 7.947 4.303) 10.427 7.881 ( -2.243 7.310 -1.247) 7.747 7.945 ( 2.710 -7.825 0.671) 8.308 8.541 ( -4.238 -1.460 3.028) 5.410 8.942 ( -0.827 0.187 3.440) 3.543 9.158 ( -0.008 4.247 3.949) 5.799 9.482 ( 0.089 2.711 -2.956) 4.012 10.418 ( 1.019 -0.548 -3.065) 3.276 10.620 ( -0.375 -4.294 -0.102) 4.312 12.185 ( 1.795 -1.537 -1.609) 2.859 12.515 ( -0.042 -11.607 -3.781) 12.207 15.218 ( 0.947 2.993 1.751) 3.594 15.429 ( 0.092 3.110 -0.691) 3.187 16.624 ( 2.238 5.699 -1.287) 6.257 16.679 ( -1.720 -1.129 -1.458) 2.522 22.054 ( -0.087 -0.500 -0.278) 0.579 22.087 ( 0.066 0.886 0.258) 0.925 ======================= Grid point 393 (184/322) ======================= q-point: (-0.23 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( -3.854 -3.063 6.313) 8.006 2.376 ( -1.745 -3.802 5.686) 7.059 2.617 ( -0.523 4.608 -0.084) 4.638 3.163 ( -2.800 1.896 5.838) 6.747 3.447 ( 4.832 3.774 -0.590) 6.159 3.552 ( -1.821 1.736 -1.517) 2.938 3.760 ( -8.176 1.453 -1.349) 8.413 3.882 ( 6.514 0.257 0.192) 6.522 3.948 ( -9.215 3.563 -2.895) 10.296 4.013 ( 4.696 2.712 -2.156) 5.836 4.276 ( 3.002 1.348 0.218) 3.298 4.405 ( -2.571 0.078 -1.059) 2.782 4.545 ( 8.384 -3.852 6.248) 11.143 4.968 ( -1.414 0.329 -5.205) 5.404 5.616 ( -1.225 -1.455 0.388) 1.941 5.664 ( 1.947 -1.352 0.365) 2.399 5.859 ( 0.588 -14.736 0.329) 14.751 6.145 ( -1.523 -1.888 -1.433) 2.817 6.857 ( -0.510 -2.724 -0.436) 2.806 6.963 ( -0.490 10.260 3.887) 10.982 7.759 ( 2.169 5.055 0.104) 5.501 8.020 ( 1.374 1.686 -0.270) 2.191 8.463 ( -0.969 3.586 0.778) 3.796 9.040 ( -8.664 -7.012 4.974) 12.206 9.142 ( 2.195 -2.623 4.295) 5.490 9.498 ( 2.229 -4.431 -3.576) 6.115 10.422 ( 0.888 0.406 -3.219) 3.364 10.620 ( -0.189 4.129 -0.169) 4.137 12.149 ( 2.379 6.009 -1.100) 6.556 12.623 ( -0.540 0.251 -4.825) 4.862 15.146 ( -1.165 4.005 0.081) 4.172 15.368 ( 0.698 3.287 0.452) 3.391 16.494 ( 0.336 6.794 -0.518) 6.822 16.698 ( 0.541 -0.490 -1.175) 1.383 22.045 ( 0.269 0.451 0.064) 0.529 22.082 ( -0.220 0.345 0.104) 0.422 ======================= Grid point 394 (185/322) ======================= q-point: (-0.15 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.251 ( -2.111 -13.701 5.801) 15.028 2.466 ( -4.222 0.721 2.513) 4.966 2.508 ( 2.682 1.228 2.316) 3.750 3.095 ( -2.232 4.073 4.775) 6.662 3.343 ( 3.144 8.500 0.699) 9.090 3.485 ( -1.546 3.608 -3.468) 5.238 3.659 ( -5.050 3.842 -3.287) 7.145 3.738 ( -6.015 8.614 -1.445) 10.605 3.951 ( 5.218 7.299 -2.206) 9.239 3.964 ( 3.661 -1.997 -1.265) 4.358 4.262 ( 2.603 1.967 1.783) 3.718 4.383 ( -1.927 0.733 -1.167) 2.369 4.700 ( 9.223 -4.974 7.265) 12.751 4.932 ( -2.554 1.051 -3.192) 4.221 5.582 ( -6.728 0.724 0.393) 6.778 5.707 ( 6.214 1.566 -0.412) 6.421 6.185 ( -2.759 -10.609 -0.072) 10.962 6.214 ( -0.072 -12.607 -0.045) 12.607 6.732 ( -5.309 10.366 3.852) 12.267 6.894 ( -0.293 -0.364 -1.324) 1.404 7.708 ( 4.755 2.450 0.569) 5.379 7.872 ( 1.380 14.226 -1.161) 14.340 8.476 ( 2.177 -4.658 -0.295) 5.150 9.101 ( -6.910 -4.916 2.065) 8.728 9.260 ( -2.207 -6.608 6.784) 9.724 9.646 ( 2.405 -8.197 -3.330) 9.169 10.409 ( 1.177 2.067 -1.793) 2.979 10.505 ( -0.008 3.779 -1.573) 4.093 11.985 ( 2.303 11.455 0.074) 11.684 12.480 ( -2.236 12.391 -4.775) 13.466 15.060 ( -1.031 3.710 -1.025) 3.985 15.308 ( 2.157 3.761 1.285) 4.522 16.378 ( 1.122 5.021 0.144) 5.147 16.705 ( 1.580 -0.001 -0.772) 1.758 21.978 ( -0.169 6.319 0.001) 6.321 22.127 ( 0.441 -4.245 -0.267) 4.276 ======================= Grid point 395 (186/322) ======================= q-point: (-0.08 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 0.966 -8.514 7.360) 11.296 2.276 ( 3.275 13.333 2.245) 13.912 2.589 ( -1.726 -2.633 1.704) 3.580 2.994 ( 0.457 6.060 2.695) 6.648 3.172 ( 0.564 9.957 0.977) 10.021 3.376 ( 0.200 6.734 -5.247) 8.539 3.498 ( -5.755 9.075 -1.302) 10.824 3.599 ( -2.938 1.149 -2.234) 3.865 3.780 ( 7.004 13.065 -1.203) 14.873 3.987 ( 3.412 2.747 -1.260) 4.558 4.246 ( 1.516 0.389 3.325) 3.675 4.345 ( -1.392 2.082 -0.556) 2.565 4.819 ( 5.396 0.782 4.952) 7.366 4.931 ( -1.834 -4.521 0.273) 4.886 5.523 ( -5.175 1.827 -0.706) 5.533 5.659 ( 2.845 5.285 -1.699) 6.238 6.199 ( -3.392 6.269 0.207) 7.131 6.410 ( -12.393 1.333 2.101) 12.640 6.697 ( 1.560 -13.126 2.330) 13.422 6.905 ( 1.235 -4.501 -1.028) 4.779 7.421 ( -6.992 25.390 -2.812) 26.485 7.767 ( 11.643 -0.036 2.378) 11.884 8.646 ( 4.151 -10.039 -2.539) 11.156 9.172 ( -3.880 -5.047 0.886) 6.428 9.386 ( -3.871 -7.147 7.183) 10.847 9.792 ( -0.146 -6.248 -3.685) 7.255 10.336 ( 2.450 3.205 1.073) 4.174 10.566 ( 0.858 -7.534 -4.506) 8.820 11.754 ( 0.694 11.906 2.171) 12.122 12.117 ( -3.604 20.917 -3.329) 21.484 14.995 ( 0.500 2.398 -1.192) 2.724 15.256 ( 5.144 3.626 1.557) 6.483 16.320 ( 2.149 1.703 0.438) 2.776 16.724 ( 2.794 -0.956 -0.442) 2.986 21.798 ( -0.724 11.879 1.495) 11.995 22.212 ( 0.398 -3.315 -3.395) 4.762 ======================= Grid point 400 (187/322) ======================= q-point: ( 0.31 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( 6.865 0.000 12.168) 13.971 1.649 ( 21.571 0.000 3.967) 21.933 2.323 ( 4.442 0.000 -5.195) 6.835 2.401 ( 11.806 0.000 -2.486) 12.065 2.669 ( 1.597 0.000 2.875) 3.289 2.678 ( -6.968 -0.000 -0.243) 6.972 2.817 ( -5.370 -0.000 0.374) 5.383 3.379 ( -2.690 -0.000 5.521) 6.141 3.549 ( 5.011 0.000 0.340) 5.022 3.741 ( 2.402 0.000 -3.315) 4.093 3.851 ( 29.503 0.000 8.683) 30.755 3.989 ( -2.678 -0.000 1.863) 3.262 4.194 ( -1.073 -0.000 0.106) 1.078 4.489 ( 1.168 0.000 -1.514) 1.912 4.771 ( -11.358 -0.000 0.280) 11.361 5.227 ( -18.526 -0.000 -4.299) 19.018 5.426 ( -12.329 -0.000 -4.283) 13.052 5.500 ( -1.453 -0.000 2.882) 3.228 6.686 ( -0.436 -0.000 18.838) 18.843 7.103 ( -11.440 -0.000 1.140) 11.496 8.007 ( -5.140 -0.000 10.802) 11.962 8.673 ( 0.588 0.000 0.364) 0.692 8.722 ( 6.267 0.000 -0.216) 6.271 9.322 ( -0.204 -0.000 -9.801) 9.803 9.650 ( 0.793 0.000 -0.312) 0.852 10.181 ( 9.042 0.000 2.642) 9.420 10.537 ( -0.149 -0.000 -0.271) 0.309 10.685 ( -4.931 -0.000 -0.223) 4.936 10.868 ( -6.865 -0.000 2.561) 7.327 11.808 ( -6.511 -0.000 -3.874) 7.576 15.287 ( 15.669 0.000 4.408) 16.277 15.960 ( 0.129 0.000 -4.070) 4.072 17.187 ( 10.756 0.000 -1.476) 10.857 17.477 ( 14.713 0.000 -20.997) 25.639 20.547 ( -0.103 -0.000 0.148) 0.180 20.810 ( 0.029 0.000 -0.066) 0.072 ======================= Grid point 401 (188/322) ======================= q-point: ( 0.38 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 9.091 -5.073 9.665) 14.205 1.934 ( 17.383 -13.016 2.440) 21.853 2.412 ( -6.157 -2.662 0.810) 6.756 2.425 ( -5.311 -7.085 -0.446) 8.865 2.748 ( -3.434 -9.602 -0.238) 10.200 2.802 ( 19.541 -5.667 -0.902) 20.366 2.892 ( -3.929 -9.644 0.972) 10.459 3.492 ( -3.516 -4.416 4.489) 7.212 3.507 ( 5.307 -3.266 -1.428) 6.393 4.016 ( -1.983 -3.226 1.040) 3.927 4.082 ( 25.655 -5.295 5.020) 26.672 4.098 ( 0.752 -25.001 -0.594) 25.019 4.341 ( 1.105 -17.578 1.628) 17.688 4.538 ( 2.884 -5.916 -1.549) 6.761 4.688 ( -9.341 1.937 0.646) 9.562 5.100 ( -18.853 -0.014 -4.903) 19.480 5.347 ( -14.540 -1.572 -4.877) 15.417 5.490 ( -1.384 0.528 3.331) 3.645 6.604 ( -1.737 11.090 17.885) 21.115 6.990 ( -9.002 5.218 1.203) 10.474 7.948 ( -0.789 4.673 7.744) 9.079 8.412 ( -0.016 15.211 0.926) 15.239 8.972 ( 2.565 -10.583 -1.337) 10.971 9.214 ( -0.792 6.146 -9.420) 11.276 9.775 ( 2.441 -7.910 1.028) 8.341 10.209 ( 6.948 2.738 3.025) 8.058 10.370 ( -0.324 9.333 0.116) 9.340 10.806 ( -3.290 2.203 1.487) 4.230 10.854 ( -5.923 -13.396 0.138) 14.648 11.683 ( -5.731 7.723 -4.494) 10.615 15.346 ( 14.007 3.720 4.985) 15.327 15.889 ( 0.893 6.081 -3.073) 6.872 17.172 ( 11.638 12.531 -3.330) 17.422 17.212 ( 9.112 18.574 -9.118) 22.609 20.716 ( -0.817 -15.655 1.305) 15.731 21.169 ( -1.683 -29.528 -4.528) 29.921 ======================= Grid point 402 (189/322) ======================= q-point: ( 0.46 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( 10.302 -6.206 7.665) 14.262 2.263 ( 9.400 -10.601 1.974) 14.305 2.420 ( -11.192 -5.012 4.458) 13.048 2.592 ( -2.956 -11.027 -0.174) 11.417 2.937 ( -0.572 -10.074 1.057) 10.145 3.060 ( 15.303 -8.988 0.044) 17.748 3.117 ( -0.476 -13.035 0.916) 13.076 3.473 ( -3.104 2.126 0.866) 3.861 3.686 ( 7.924 -7.804 -1.481) 11.220 4.080 ( -1.825 -4.282 1.199) 4.807 4.285 ( 5.331 -2.425 2.898) 6.534 4.448 ( 11.835 -5.690 0.018) 13.132 4.565 ( -6.424 0.656 -6.115) 8.893 4.752 ( -1.272 -14.857 5.393) 15.857 4.970 ( -15.515 -16.868 -1.089) 22.945 5.071 ( 5.146 -18.943 -3.845) 20.003 5.414 ( -6.744 -13.871 -2.889) 15.693 5.532 ( -9.968 -15.471 1.780) 18.490 6.294 ( -4.877 19.093 11.545) 22.839 6.816 ( -5.048 7.840 1.329) 9.419 7.858 ( 7.952 7.921 2.929) 11.600 8.156 ( -5.469 7.628 4.389) 10.362 8.908 ( -3.171 11.563 -10.785) 16.127 9.297 ( 3.890 -9.266 1.432) 10.151 9.850 ( 5.762 4.391 2.130) 7.551 10.041 ( -1.628 13.389 1.744) 13.600 10.394 ( 5.523 -6.133 1.316) 8.357 10.707 ( -7.527 1.802 0.834) 7.785 11.156 ( -0.655 -17.647 -0.303) 17.662 11.460 ( -5.027 9.467 -3.716) 11.345 15.334 ( 10.471 4.887 4.277) 12.321 15.759 ( 2.467 6.835 -2.108) 7.566 16.800 ( 7.502 17.596 -2.548) 19.298 17.087 ( 4.483 7.240 -2.279) 8.816 21.089 ( -1.247 -20.820 2.540) 21.011 21.708 ( -1.155 -23.986 -5.810) 24.707 ======================= Grid point 403 (190/322) ======================= q-point: ( 0.54 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 8.243 -0.308 7.436) 11.106 2.434 ( -2.849 -4.680 4.996) 7.414 2.519 ( -1.926 -7.796 3.053) 8.591 2.808 ( 0.164 -10.846 1.391) 10.936 3.137 ( 1.289 -9.678 0.906) 9.806 3.297 ( 5.945 -5.991 2.771) 8.883 3.365 ( 1.357 -10.120 -0.395) 10.218 3.413 ( 1.492 -1.240 -1.848) 2.680 3.896 ( 7.486 -8.064 -0.262) 11.006 4.154 ( -4.521 -3.311 3.674) 6.701 4.259 ( -2.945 1.969 0.151) 3.546 4.498 ( -1.864 2.846 -4.963) 6.017 4.570 ( 6.704 -1.628 -4.331) 8.146 4.904 ( -13.181 1.555 -3.999) 13.862 4.989 ( 1.536 -10.825 2.177) 11.149 5.401 ( -2.334 -4.213 1.480) 5.039 5.824 ( 0.642 -13.413 1.191) 13.482 5.880 ( -6.557 -2.347 2.400) 7.366 6.233 ( -2.201 -39.435 0.080) 39.497 6.657 ( -2.406 4.642 0.280) 5.236 7.715 ( 8.297 11.112 3.908) 14.408 8.102 ( -4.811 -3.745 4.216) 7.412 8.611 ( -1.868 14.554 -8.840) 17.130 9.431 ( 2.582 -0.263 3.920) 4.701 9.690 ( 3.978 13.754 3.676) 14.782 9.812 ( -0.247 7.613 -1.540) 7.771 10.405 ( -3.372 4.644 1.757) 6.002 10.725 ( 1.724 0.624 -2.950) 3.473 11.369 ( -3.870 -8.721 -0.892) 9.583 11.517 ( -0.510 -18.225 -0.303) 18.235 15.311 ( 7.342 3.158 3.841) 8.867 15.652 ( 1.441 5.071 -1.818) 5.576 16.598 ( 3.137 6.186 -0.678) 6.969 16.968 ( 1.828 6.127 -2.106) 6.732 21.481 ( -0.799 -18.297 2.248) 18.452 22.045 ( 0.114 -11.282 -4.185) 12.034 ======================= Grid point 404 (191/322) ======================= q-point: (-0.38 -0.69 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 2.666 12.443 8.143) 15.108 2.484 ( -0.420 -0.103 6.955) 6.969 2.641 ( -1.982 -4.800 1.586) 5.430 2.999 ( -0.177 -7.737 3.248) 8.393 3.313 ( -3.070 -5.681 -0.254) 6.462 3.344 ( 7.416 -3.734 -1.496) 8.437 3.532 ( 0.507 -7.603 2.037) 7.888 3.609 ( 5.116 -9.415 -0.948) 10.757 4.018 ( -4.134 -0.103 3.171) 5.211 4.143 ( -1.119 -2.380 -0.364) 2.655 4.303 ( 3.220 -3.818 0.485) 5.018 4.405 ( 0.116 5.042 -3.480) 6.127 4.580 ( 0.320 2.508 -2.290) 3.411 4.828 ( -9.884 -2.879 -7.007) 12.453 5.200 ( 2.781 -7.919 -0.736) 8.426 5.459 ( -0.900 -3.585 2.391) 4.402 5.620 ( -3.717 4.912 0.299) 6.167 6.182 ( -0.326 -3.794 -0.979) 3.932 6.684 ( -0.270 -7.895 -0.217) 7.903 6.980 ( -0.441 -30.977 -0.282) 30.982 7.579 ( 4.001 5.358 6.234) 9.142 8.209 ( -2.729 -7.911 3.023) 8.898 8.312 ( 1.017 13.687 -6.225) 15.070 9.323 ( -1.426 10.775 3.481) 11.413 9.472 ( 3.083 10.619 5.249) 12.240 9.690 ( -0.473 5.486 -2.972) 6.257 10.338 ( -2.726 -1.426 1.441) 3.398 10.598 ( 1.953 8.809 -3.974) 9.859 11.723 ( -0.009 -23.529 -0.734) 23.540 11.850 ( -0.447 -15.328 -0.818) 15.356 15.305 ( 4.658 1.879 3.650) 6.209 15.562 ( -0.736 4.007 -1.863) 4.480 16.566 ( 0.882 -1.065 -0.732) 1.565 16.860 ( 0.424 5.287 -2.149) 5.723 21.789 ( -0.136 -12.624 1.150) 12.677 22.161 ( 0.223 -1.530 -2.195) 2.685 ======================= Grid point 405 (192/322) ======================= q-point: (-0.31 -0.69 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( -1.335 21.971 7.705) 23.321 2.443 ( -0.455 4.598 7.357) 8.688 2.692 ( -0.876 -1.165 0.507) 1.543 3.120 ( -1.214 -4.400 4.943) 6.728 3.393 ( 1.148 -4.341 -2.050) 4.936 3.490 ( 3.335 -5.540 -0.809) 6.516 3.649 ( -4.430 -4.873 2.925) 7.206 3.801 ( 4.813 -7.068 -1.246) 8.641 3.956 ( -3.808 1.829 2.292) 4.806 4.175 ( -2.020 1.238 -3.778) 4.460 4.310 ( -1.200 0.957 -1.065) 1.868 4.413 ( 8.568 -1.532 3.553) 9.401 4.496 ( -0.895 3.834 -1.127) 4.095 4.867 ( -4.704 -5.437 -8.284) 10.968 5.337 ( 0.515 -7.038 -2.030) 7.342 5.571 ( 7.113 -4.830 1.331) 8.700 5.585 ( -6.358 -2.300 -0.092) 6.762 6.161 ( -1.063 2.232 -1.262) 2.776 6.798 ( -0.027 -2.456 -0.111) 2.459 7.249 ( -2.013 1.829 3.211) 4.208 7.713 ( 0.302 -14.629 2.679) 14.875 8.079 ( 6.269 10.619 -3.275) 12.759 8.381 ( -3.144 -9.967 3.091) 10.899 9.076 ( -4.398 11.692 2.648) 12.770 9.305 ( 2.506 8.700 4.857) 10.274 9.566 ( -0.634 5.781 -2.708) 6.415 10.407 ( -0.115 -2.410 -1.219) 2.703 10.510 ( 1.065 -2.481 -1.561) 3.118 12.090 ( 2.473 -9.029 -1.370) 9.461 12.181 ( -0.699 -20.834 -2.357) 20.978 15.287 ( 1.612 2.708 3.209) 4.497 15.482 ( -1.523 3.003 -1.714) 3.779 16.615 ( -0.828 -3.236 -1.157) 3.535 16.752 ( 0.594 5.687 -1.979) 6.051 21.979 ( 0.164 -6.644 0.032) 6.647 22.136 ( -0.210 2.824 -0.484) 2.873 ======================= Grid point 406 (193/322) ======================= q-point: (-0.23 -0.69 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( -3.365 17.783 7.284) 19.509 2.365 ( -1.278 2.608 6.844) 7.434 2.681 ( 0.498 2.002 -0.031) 2.064 3.171 ( -2.123 -0.852 5.643) 6.089 3.466 ( 0.533 -2.355 -1.855) 3.045 3.576 ( 2.922 -0.961 -0.397) 3.102 3.681 ( -9.473 -2.418 2.177) 10.017 3.925 ( 6.487 -0.306 0.493) 6.513 3.928 ( -3.712 -1.598 -1.486) 4.306 4.084 ( -0.794 3.908 -2.910) 4.937 4.317 ( 2.095 0.053 -0.965) 2.307 4.401 ( -0.555 2.177 -1.151) 2.524 4.537 ( 7.619 -2.988 5.268) 9.733 4.928 ( -0.791 -3.069 -7.750) 8.373 5.508 ( -0.528 -8.567 -1.986) 8.810 5.596 ( -5.117 -4.032 0.891) 6.575 5.707 ( 8.054 -3.860 0.724) 8.961 6.119 ( -1.947 0.587 -1.328) 2.428 6.817 ( -0.377 -0.791 0.002) 0.876 7.120 ( -7.058 7.410 3.921) 10.959 7.880 ( 1.668 1.256 -1.056) 2.340 8.013 ( 8.564 -1.026 0.284) 8.630 8.510 ( -2.096 -1.469 2.866) 3.842 8.895 ( -8.097 0.648 3.936) 9.026 9.188 ( 2.108 4.700 3.923) 6.475 9.478 ( 0.778 1.900 -3.009) 3.643 10.419 ( 0.827 -0.521 -3.084) 3.235 10.620 ( 0.506 -4.140 -0.071) 4.172 12.208 ( 2.739 -1.614 -1.731) 3.620 12.499 ( -0.454 -11.352 -3.722) 11.955 15.223 ( -0.905 4.116 1.775) 4.573 15.423 ( -0.736 2.257 -0.723) 2.481 16.620 ( -2.060 4.596 -1.154) 5.167 16.680 ( 2.381 -0.518 -1.553) 2.890 22.051 ( -0.205 -0.412 -0.226) 0.513 22.089 ( 0.043 0.697 0.218) 0.732 ======================= Grid point 407 (194/322) ======================= q-point: (-0.15 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.044 ( -2.384 -3.286 6.962) 8.059 2.371 ( -2.120 -3.037 5.801) 6.883 2.624 ( 1.868 4.338 0.140) 4.725 3.152 ( -2.231 2.002 4.880) 5.728 3.472 ( 0.263 2.300 -0.286) 2.332 3.555 ( 2.391 4.072 0.687) 4.772 3.653 ( -9.255 -0.218 -1.568) 9.390 3.847 ( -5.284 5.646 -1.286) 7.839 3.962 ( 5.673 -0.254 -0.726) 5.725 4.058 ( 3.963 1.272 -1.879) 4.566 4.314 ( 3.177 1.425 -0.024) 3.482 4.375 ( -1.496 0.101 -1.940) 2.452 4.664 ( 7.464 -4.471 5.921) 10.524 4.943 ( 0.796 0.528 -6.094) 6.168 5.532 ( -8.810 -0.893 -0.101) 8.856 5.750 ( 7.999 -2.830 0.511) 8.500 5.868 ( 0.568 -12.736 0.035) 12.749 6.117 ( -2.356 -2.110 -0.913) 3.292 6.835 ( -4.559 -0.152 0.966) 4.663 6.915 ( -6.093 7.311 1.934) 9.711 7.835 ( 7.602 4.844 -0.363) 9.022 8.051 ( 5.321 3.197 0.110) 6.209 8.452 ( -1.209 2.554 0.534) 2.875 8.943 ( -10.064 -6.856 5.341) 13.297 9.174 ( 0.934 -1.797 4.577) 5.005 9.513 ( 2.057 -5.142 -3.341) 6.468 10.421 ( 0.639 0.395 -3.300) 3.384 10.622 ( 0.613 4.281 -0.057) 4.325 12.179 ( 3.128 6.018 -1.674) 6.986 12.591 ( -2.255 0.895 -4.349) 4.980 15.133 ( -1.087 4.266 0.378) 4.419 15.378 ( 0.758 2.270 0.233) 2.404 16.502 ( 1.215 6.158 -0.477) 6.295 16.706 ( 1.477 -0.779 -1.317) 2.126 22.048 ( 0.310 0.361 -0.006) 0.476 22.080 ( -0.132 0.273 0.153) 0.340 ======================= Grid point 408 (195/322) ======================= q-point: (-0.08 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( 1.271 -14.694 6.488) 16.113 2.433 ( -2.946 -1.174 3.475) 4.705 2.552 ( 3.772 2.969 1.907) 5.165 3.095 ( -0.247 3.461 3.599) 4.999 3.363 ( -1.182 8.305 2.576) 8.775 3.483 ( 2.513 4.420 -1.748) 5.376 3.575 ( -5.965 2.853 -4.035) 7.747 3.682 ( -3.258 7.913 -0.130) 8.559 3.979 ( 2.304 3.520 -1.294) 4.401 4.040 ( 7.551 1.503 -1.724) 7.889 4.300 ( 3.090 2.346 1.351) 4.108 4.359 ( -1.356 0.463 -1.778) 2.283 4.811 ( 3.793 -5.863 3.937) 8.016 4.903 ( 1.130 2.996 -2.536) 4.084 5.495 ( -7.147 -0.377 0.495) 7.174 5.765 ( 3.213 3.687 -1.261) 5.050 6.147 ( -4.991 -13.458 -0.054) 14.354 6.172 ( -6.320 -4.897 0.160) 7.997 6.683 ( -2.623 4.829 3.818) 6.691 6.888 ( -0.116 0.004 -1.150) 1.156 7.733 ( -1.669 10.280 -1.180) 10.482 7.957 ( 12.957 9.382 1.280) 16.048 8.481 ( -1.033 -6.428 -2.272) 6.895 9.029 ( -6.423 -6.526 4.415) 10.165 9.259 ( -1.398 -5.350 5.931) 8.109 9.658 ( 1.217 -7.496 -2.924) 8.138 10.416 ( 0.937 0.663 -2.137) 2.425 10.506 ( 0.908 4.583 -1.127) 4.806 12.011 ( 2.218 11.943 -0.791) 12.173 12.427 ( -4.347 12.735 -3.968) 14.029 15.054 ( 0.435 3.383 -0.362) 3.430 15.345 ( 3.563 2.327 0.702) 4.313 16.403 ( 3.005 4.786 0.167) 5.654 16.728 ( 2.621 -0.537 -1.070) 2.882 21.976 ( -0.174 6.481 -0.004) 6.483 22.131 ( 0.520 -4.153 -0.297) 4.196 ======================= Grid point 414 (196/322) ======================= q-point: ( 0.38 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 10.963 0.000 8.828) 14.075 1.902 ( 19.590 0.000 2.128) 19.706 2.312 ( -18.203 -0.000 4.743) 18.811 2.328 ( -3.215 -0.000 -2.516) 4.082 2.605 ( -3.052 -0.000 -2.256) 3.795 2.764 ( -3.957 -0.000 0.514) 3.990 2.879 ( 23.419 0.000 0.318) 23.421 3.367 ( -2.418 -0.000 6.418) 6.859 3.601 ( 3.181 0.000 1.226) 3.409 3.753 ( 1.554 0.000 -3.755) 4.063 3.967 ( -2.365 -0.000 3.344) 4.095 4.149 ( 11.339 0.000 -3.439) 11.849 4.222 ( 10.445 0.000 6.022) 12.057 4.518 ( 2.951 0.000 -2.291) 3.736 4.662 ( -6.566 -0.000 1.553) 6.747 4.976 ( -18.909 -0.000 -3.610) 19.250 5.258 ( -12.023 -0.000 -4.957) 13.005 5.499 ( -1.527 -0.000 3.007) 3.373 6.754 ( 1.185 0.000 21.845) 21.877 6.994 ( -7.434 -0.000 1.278) 7.543 7.982 ( -4.419 -0.000 9.682) 10.643 8.685 ( 1.237 0.000 0.204) 1.253 8.780 ( 3.670 0.000 -0.293) 3.681 9.279 ( -1.617 -0.000 -10.958) 11.077 9.657 ( 0.444 0.000 -0.494) 0.665 10.292 ( 8.354 0.000 1.720) 8.529 10.536 ( 0.068 0.000 -0.132) 0.148 10.617 ( -6.112 -0.000 0.879) 6.175 10.809 ( -4.652 -0.000 1.582) 4.913 11.724 ( -4.826 -0.000 -5.165) 7.069 15.482 ( 13.396 0.000 7.177) 15.197 15.941 ( -1.160 -0.000 -2.586) 2.834 17.290 ( 7.273 0.000 -3.770) 8.192 17.567 ( 10.998 0.000 -15.438) 18.955 20.546 ( -0.067 -0.000 0.162) 0.176 20.810 ( 0.025 0.000 -0.066) 0.070 ======================= Grid point 415 (197/322) ======================= q-point: ( 0.46 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.858 ( 11.881 -4.684 7.445) 14.782 2.133 ( 14.507 -9.320 1.276) 17.290 2.242 ( -18.083 -4.120 5.713) 19.406 2.367 ( -8.161 -7.928 -1.004) 11.422 2.728 ( 0.792 -10.130 -0.564) 10.176 2.858 ( -1.971 -11.158 -0.018) 11.330 3.042 ( 18.293 -3.396 1.306) 18.652 3.467 ( -3.109 -3.508 4.669) 6.616 3.575 ( 6.931 -5.133 -1.593) 8.770 3.995 ( -2.109 -4.374 1.697) 5.144 4.077 ( -4.505 -20.182 1.010) 20.703 4.320 ( 13.295 -7.922 -3.032) 15.770 4.368 ( 0.412 -16.940 3.186) 17.242 4.540 ( -0.668 -1.779 -5.262) 5.595 4.638 ( -6.712 -2.272 0.977) 7.153 4.907 ( -4.249 -2.625 1.056) 5.105 5.180 ( -9.102 0.226 -5.019) 10.397 5.476 ( -3.047 1.050 2.085) 3.839 6.643 ( -1.416 14.342 18.844) 23.723 6.922 ( -3.312 4.350 2.501) 6.013 7.959 ( -1.464 1.226 7.634) 7.870 8.408 ( -0.678 17.357 0.038) 17.370 8.982 ( 0.351 -5.754 -3.515) 6.752 9.185 ( 0.411 1.488 -7.548) 7.704 9.805 ( 2.173 -10.029 0.887) 10.300 10.278 ( 2.730 8.307 2.715) 9.156 10.389 ( 3.819 4.026 -0.485) 5.570 10.706 ( -10.166 0.709 1.655) 10.324 10.849 ( 1.017 -11.608 0.080) 11.653 11.614 ( -3.331 7.536 -5.136) 9.709 15.509 ( 9.905 4.988 6.647) 12.930 15.881 ( -0.377 4.766 -1.995) 5.181 17.247 ( 3.178 7.255 -4.822) 9.272 17.298 ( 9.577 24.351 -7.432) 27.202 20.712 ( -0.554 -15.409 1.163) 15.462 21.149 ( 0.241 -28.259 -3.225) 28.443 ======================= Grid point 416 (198/322) ======================= q-point: (-0.46 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 6.437 -5.043 6.462) 10.422 2.277 ( -9.624 -8.093 6.116) 13.983 2.353 ( 0.100 -7.750 2.334) 8.095 2.572 ( 0.670 -13.488 -0.560) 13.516 2.935 ( 0.180 -10.612 0.871) 10.649 3.118 ( 0.607 -13.503 0.841) 13.543 3.226 ( 10.440 -6.198 1.666) 12.255 3.447 ( -1.083 2.084 0.331) 2.372 3.790 ( 9.705 -8.183 -0.639) 12.710 4.072 ( -0.608 -3.884 3.682) 5.387 4.233 ( -11.480 -2.148 0.155) 11.680 4.493 ( -5.082 -5.134 -6.858) 9.961 4.557 ( 2.149 0.634 -4.040) 4.620 4.699 ( -7.118 -9.039 -0.899) 11.540 4.885 ( 5.065 -16.589 5.437) 18.177 5.184 ( 11.990 -15.168 -1.210) 19.372 5.286 ( -8.774 -31.547 -2.733) 32.858 5.473 ( -3.528 -7.193 1.583) 8.167 6.287 ( -2.229 20.765 11.900) 24.036 6.788 ( -0.580 7.988 1.337) 8.120 7.952 ( 5.455 2.827 4.012) 7.338 8.084 ( -8.019 10.835 3.354) 13.891 8.853 ( -0.583 11.324 -10.241) 15.279 9.342 ( 2.674 -9.787 1.415) 10.244 9.919 ( 5.162 2.800 1.010) 5.959 10.030 ( -1.224 14.854 2.315) 15.083 10.463 ( 5.031 -2.013 1.710) 5.682 10.607 ( -8.822 -2.806 0.044) 9.258 11.158 ( 0.560 -17.588 0.043) 17.597 11.403 ( -2.337 9.839 -4.151) 10.931 15.449 ( 6.075 5.951 5.320) 10.031 15.765 ( -0.288 6.100 -1.963) 6.415 16.856 ( 3.071 18.897 -2.696) 19.333 17.113 ( 1.259 7.815 -2.887) 8.426 21.084 ( -0.855 -20.841 2.333) 20.989 21.695 ( 1.764 -23.907 -4.937) 24.476 ======================= Grid point 417 (199/322) ======================= q-point: (-0.38 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( -3.236 0.067 7.227) 7.918 2.423 ( 0.717 -6.691 6.764) 9.541 2.502 ( -3.018 -7.795 2.376) 8.690 2.827 ( 1.874 -10.678 0.717) 10.865 3.141 ( -0.298 -9.544 0.787) 9.581 3.331 ( -1.066 -3.770 2.879) 4.862 3.383 ( 2.414 -7.353 -1.913) 7.972 3.468 ( 6.411 -5.942 -0.473) 8.754 3.980 ( 6.368 -5.136 -0.086) 8.182 4.095 ( -7.429 0.146 6.007) 9.554 4.235 ( -0.196 -4.039 -1.711) 4.391 4.511 ( 4.026 3.289 -3.270) 6.141 4.535 ( -9.405 -5.236 -7.733) 13.254 4.719 ( -8.748 0.981 -2.540) 9.162 5.110 ( 11.503 -5.850 2.686) 13.181 5.376 ( -2.054 -4.101 0.310) 4.597 5.807 ( -3.733 8.579 3.980) 10.168 5.861 ( 2.346 -25.945 -0.613) 26.058 6.239 ( 2.632 -37.044 0.831) 37.147 6.643 ( -0.007 4.838 -0.421) 4.856 7.776 ( -1.296 11.712 4.993) 12.798 8.057 ( -3.689 -5.711 3.541) 7.666 8.590 ( 2.580 13.691 -8.387) 16.262 9.471 ( 1.966 0.479 4.608) 5.033 9.714 ( -1.462 14.042 1.851) 14.239 9.826 ( 3.249 8.328 -1.235) 9.024 10.367 ( -3.748 5.313 1.981) 6.797 10.740 ( 2.529 -0.111 -2.987) 3.916 11.330 ( -2.348 -10.162 -0.726) 10.455 11.521 ( 1.225 -17.965 -0.360) 18.010 15.387 ( 3.065 3.647 4.636) 6.647 15.641 ( -2.203 5.259 -2.308) 6.151 16.611 ( -0.606 6.638 -0.857) 6.720 16.971 ( -0.086 6.319 -2.218) 6.698 21.480 ( -0.497 -18.452 2.169) 18.586 22.045 ( 1.918 -11.006 -4.025) 11.875 ======================= Grid point 418 (200/322) ======================= q-point: (-0.31 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( -5.545 11.873 8.001) 15.354 2.512 ( 1.303 0.307 7.284) 7.405 2.621 ( -1.930 -5.422 1.368) 5.916 3.006 ( -0.858 -6.976 2.892) 7.601 3.288 ( -0.557 -5.936 -0.834) 6.020 3.397 ( 1.996 -4.905 -0.960) 5.382 3.530 ( -0.899 -5.792 1.704) 6.105 3.657 ( 2.381 -8.997 -1.318) 9.399 3.990 ( -1.411 2.188 3.836) 4.636 4.149 ( 2.792 -3.840 -1.012) 4.854 4.292 ( -3.274 -0.628 0.121) 3.336 4.467 ( 6.282 1.677 -0.618) 6.531 4.577 ( 0.793 2.160 -2.812) 3.634 4.670 ( -9.213 -6.902 -6.855) 13.398 5.251 ( 4.196 -3.713 -1.334) 5.759 5.483 ( 2.657 -5.812 0.632) 6.421 5.593 ( 0.595 5.748 1.542) 5.981 6.176 ( 0.054 -2.876 -0.986) 3.041 6.683 ( 0.277 -8.092 -0.282) 8.102 6.982 ( 0.917 -29.673 -0.280) 29.689 7.586 ( -5.585 4.517 6.354) 9.590 8.182 ( -3.083 -8.131 2.210) 8.972 8.343 ( 6.798 12.331 -5.756) 15.212 9.313 ( -2.084 13.468 5.000) 14.516 9.507 ( 0.141 8.678 3.724) 9.444 9.682 ( 0.958 6.904 -3.047) 7.607 10.319 ( -1.130 -2.407 1.362) 2.987 10.610 ( 1.947 9.011 -3.742) 9.950 11.715 ( -0.981 -24.217 -0.668) 24.246 11.862 ( 2.890 -15.206 -0.935) 15.506 15.350 ( 0.721 2.361 4.345) 4.998 15.528 ( -3.922 3.765 -2.652) 6.049 16.555 ( -2.293 -0.977 -0.628) 2.570 16.856 ( -0.126 5.113 -2.108) 5.532 21.791 ( -0.037 -12.671 1.152) 12.723 22.160 ( 0.749 -1.166 -2.216) 2.614 ======================= Grid point 419 (201/322) ======================= q-point: (-0.23 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( -5.438 21.548 7.618) 23.493 2.458 ( -0.779 5.224 7.072) 8.827 2.692 ( 0.548 -1.755 0.466) 1.896 3.109 ( -3.812 -4.377 4.188) 7.157 3.396 ( 2.010 -4.743 -2.092) 5.560 3.505 ( -1.949 -5.146 -0.226) 5.507 3.607 ( -2.624 -2.810 3.251) 5.035 3.823 ( -0.437 -6.966 -1.986) 7.257 3.965 ( 2.838 1.115 2.993) 4.273 4.161 ( 1.216 4.333 -2.639) 5.217 4.280 ( -2.389 -2.627 -1.178) 3.741 4.485 ( 0.066 3.953 -0.981) 4.073 4.531 ( 6.973 -1.500 2.989) 7.733 4.803 ( -0.551 -8.023 -8.054) 11.382 5.358 ( 3.258 -6.069 -2.668) 7.387 5.508 ( -4.696 -1.362 0.289) 4.898 5.675 ( 8.660 -5.108 0.802) 10.086 6.143 ( -1.143 2.829 -0.774) 3.148 6.799 ( 0.028 -2.264 0.050) 2.264 7.191 ( -8.747 3.256 3.268) 9.889 7.708 ( -1.630 -14.366 1.710) 14.559 8.172 ( 9.332 7.900 -4.609) 13.067 8.359 ( -1.963 -9.873 3.836) 10.772 9.028 ( -4.705 13.307 4.513) 14.819 9.342 ( 1.047 8.535 4.247) 9.590 9.556 ( 0.528 5.599 -3.024) 6.385 10.403 ( 0.045 -2.737 -1.358) 3.056 10.523 ( 1.752 -2.202 -1.379) 3.133 12.091 ( -1.630 -12.075 -2.232) 12.387 12.197 ( 4.791 -17.565 -1.751) 18.291 15.297 ( -1.538 3.538 3.382) 5.131 15.448 ( -3.313 1.753 -2.100) 4.296 16.584 ( -3.470 -2.926 -0.713) 4.594 16.759 ( 1.227 4.569 -2.074) 5.166 21.981 ( 0.097 -6.491 0.009) 6.492 22.132 ( -0.248 2.814 -0.429) 2.858 ======================= Grid point 420 (202/322) ======================= q-point: (-0.15 -0.62 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( -4.213 17.078 7.775) 19.232 2.371 ( -1.325 2.984 6.677) 7.433 2.698 ( 2.207 1.752 0.078) 2.819 3.147 ( -4.573 -1.467 3.684) 6.052 3.477 ( 2.742 -1.721 -0.483) 3.273 3.558 ( -8.481 -3.146 0.082) 9.047 3.626 ( 1.406 0.784 2.700) 3.143 3.882 ( -2.908 0.069 -0.432) 2.941 3.995 ( 4.837 -0.541 -0.185) 4.871 4.084 ( 1.211 1.904 -1.318) 2.613 4.319 ( -0.205 -1.615 -1.963) 2.550 4.411 ( 2.408 3.437 -1.168) 4.356 4.625 ( 3.370 -3.745 3.387) 6.070 4.918 ( 3.328 -3.659 -7.222) 8.753 5.451 ( -6.090 -2.615 -1.331) 6.761 5.604 ( 5.099 -9.373 0.609) 10.688 5.800 ( 6.373 -2.626 -0.227) 6.896 6.091 ( -2.030 1.022 -0.428) 2.313 6.807 ( -1.918 0.006 0.593) 2.007 7.016 ( -10.408 7.086 2.793) 12.897 7.885 ( -0.495 -3.429 -0.518) 3.503 8.130 ( 10.166 1.891 -2.692) 10.685 8.518 ( 1.536 -2.266 4.539) 5.301 8.800 ( -9.156 3.299 5.031) 10.955 9.218 ( 0.718 4.651 4.064) 6.218 9.480 ( 1.151 1.377 -3.206) 3.674 10.418 ( 0.644 -0.488 -3.117) 3.220 10.630 ( 1.043 -3.902 -0.018) 4.039 12.229 ( 1.433 -2.688 -2.869) 4.184 12.490 ( 1.048 -9.406 -2.910) 9.902 15.211 ( -1.985 4.179 1.738) 4.942 15.407 ( -1.531 0.929 -0.738) 1.937 16.589 ( -2.436 1.389 -0.683) 2.886 16.704 ( 2.337 1.049 -1.844) 3.156 22.048 ( -0.269 -0.453 -0.167) 0.553 22.089 ( -0.000 0.520 0.191) 0.554 ======================= Grid point 421 (203/322) ======================= q-point: (-0.08 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.052 ( -0.047 -4.962 8.007) 9.420 2.364 ( -2.024 -2.085 5.946) 6.619 2.661 ( 3.936 3.649 0.457) 5.386 3.135 ( -2.412 0.717 2.370) 3.457 3.463 ( -4.772 3.331 4.446) 7.324 3.545 ( -3.342 0.093 -2.777) 4.346 3.604 ( 3.325 3.180 0.704) 4.655 3.806 ( -1.680 5.619 0.028) 5.865 4.014 ( 3.617 0.113 -1.252) 3.829 4.095 ( 2.942 0.077 -0.553) 2.995 4.335 ( 0.177 -0.515 -1.197) 1.315 4.376 ( 2.921 1.905 -1.321) 3.729 4.718 ( -1.371 -4.539 1.005) 4.847 4.960 ( 4.568 0.702 -4.713) 6.601 5.446 ( -4.684 -0.890 0.793) 4.834 5.828 ( 4.352 -1.574 -0.408) 4.646 5.861 ( -1.932 -9.096 -0.761) 9.330 6.089 ( -1.902 -2.065 0.340) 2.828 6.751 ( -7.845 3.781 2.691) 9.115 6.884 ( -0.622 1.125 -0.173) 1.297 7.876 ( 0.064 4.032 -0.760) 4.104 8.162 ( 11.534 2.070 -1.568) 11.823 8.441 ( -0.499 5.714 1.837) 6.022 8.846 ( -8.959 -8.376 6.631) 13.942 9.193 ( -0.140 -1.212 4.498) 4.661 9.523 ( 1.216 -5.312 -3.194) 6.316 10.417 ( 0.543 0.415 -3.324) 3.394 10.631 ( 0.800 4.326 0.041) 4.399 12.205 ( 2.275 5.667 -2.953) 6.783 12.550 ( -2.273 2.589 -3.235) 4.726 15.126 ( -0.233 3.687 0.819) 3.784 15.388 ( 0.963 0.683 -0.073) 1.183 16.518 ( 1.775 4.559 -0.390) 4.907 16.721 ( 1.657 -1.121 -1.586) 2.553 22.052 ( 0.276 0.444 -0.130) 0.539 22.080 ( -0.014 -0.066 0.241) 0.250 ======================= Grid point 428 (204/322) ======================= q-point: (-0.54 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.897 ( 12.491 0.000 6.878) 14.259 2.091 ( -20.279 -0.000 6.738) 21.369 2.115 ( 14.587 0.000 0.461) 14.594 2.217 ( -13.304 -0.000 0.162) 13.305 2.612 ( 4.861 0.000 -3.166) 5.801 2.726 ( -2.433 -0.000 -0.212) 2.443 3.130 ( 17.328 0.000 3.229) 17.626 3.362 ( -1.962 -0.000 7.192) 7.455 3.620 ( -0.261 -0.000 -1.295) 1.321 3.754 ( 0.578 0.000 -4.092) 4.133 3.951 ( -3.453 -0.000 6.451) 7.317 4.211 ( 4.982 0.000 -3.348) 6.002 4.307 ( -4.876 -0.000 2.296) 5.390 4.445 ( -15.677 -0.000 -5.072) 16.477 4.619 ( 4.899 0.000 -2.558) 5.526 4.914 ( 6.748 0.000 1.798) 6.984 5.155 ( -0.613 -0.000 -2.451) 2.527 5.471 ( -4.292 -0.000 0.938) 4.393 6.842 ( 1.390 0.000 24.592) 24.631 6.940 ( -2.445 -0.000 1.325) 2.782 7.964 ( -3.263 -0.000 8.483) 9.089 8.703 ( 1.474 0.000 0.633) 1.604 8.807 ( 1.087 0.000 -0.338) 1.138 9.221 ( -1.898 -0.000 -12.683) 12.824 9.657 ( -0.152 -0.000 -0.536) 0.558 10.385 ( 6.900 0.000 0.594) 6.926 10.538 ( 0.318 0.000 -0.086) 0.330 10.554 ( -5.271 -0.000 2.050) 5.656 10.769 ( -2.533 -0.000 1.163) 2.787 11.667 ( -2.105 -0.000 -5.443) 5.836 15.625 ( 6.094 0.000 7.828) 9.920 15.928 ( 0.427 0.000 -1.298) 1.367 17.324 ( 1.063 0.000 -5.522) 5.624 17.652 ( 10.323 0.000 -12.307) 16.063 20.546 ( -0.024 -0.000 0.168) 0.169 20.810 ( 0.019 0.000 -0.065) 0.068 ======================= Grid point 429 (205/322) ======================= q-point: (-0.46 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.958 ( -10.856 -3.295 6.356) 13.004 2.098 ( 4.003 -6.201 7.063) 10.216 2.206 ( -12.675 -6.276 1.125) 14.188 2.319 ( 9.575 -11.499 -0.533) 14.973 2.754 ( 3.187 -8.142 0.315) 8.749 2.848 ( 0.787 -13.097 -1.544) 13.211 3.214 ( 9.322 -0.955 2.720) 9.757 3.447 ( -2.539 -2.493 3.761) 5.178 3.658 ( 7.199 -9.334 -0.941) 11.826 3.968 ( -4.327 -11.749 -4.449) 13.287 3.993 ( -10.847 -7.313 7.774) 15.217 4.322 ( -18.321 -7.955 -2.777) 20.165 4.355 ( -8.187 -12.133 1.172) 14.684 4.438 ( 7.124 -12.061 -4.320) 14.659 4.663 ( 11.391 -0.795 -0.313) 11.423 4.957 ( 3.260 -2.177 -3.501) 5.256 5.180 ( 11.788 -0.068 1.823) 11.928 5.427 ( -5.455 1.194 -0.477) 5.604 6.686 ( -0.768 16.376 18.296) 24.566 6.927 ( 2.050 4.047 4.600) 6.461 7.958 ( -2.647 0.013 7.343) 7.805 8.398 ( -0.967 19.132 -0.351) 19.159 8.967 ( -0.219 -1.385 -5.216) 5.401 9.171 ( 0.374 -3.991 -6.070) 7.274 9.831 ( 1.812 -12.403 0.425) 12.542 10.301 ( 0.621 11.612 2.663) 11.929 10.440 ( 3.981 0.490 -1.537) 4.296 10.608 ( -6.514 2.533 2.832) 7.541 10.862 ( 1.175 -11.723 0.066) 11.781 11.573 ( -0.998 7.429 -5.218) 9.133 15.604 ( 2.318 5.117 6.893) 8.892 15.876 ( 0.575 5.212 -1.456) 5.442 17.244 ( -0.926 7.316 -4.422) 8.599 17.360 ( 4.448 25.718 -8.080) 27.321 20.710 ( -0.273 -15.270 1.117) 15.313 21.155 ( 2.519 -28.544 -3.060) 28.818 ======================= Grid point 430 (206/322) ======================= q-point: (-0.38 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( -15.735 -6.606 7.018) 18.452 2.300 ( -3.389 -8.492 3.499) 9.790 2.310 ( 3.863 -8.885 4.938) 10.874 2.610 ( 5.022 -12.670 -0.953) 13.663 2.949 ( 1.671 -9.937 1.065) 10.132 3.133 ( 1.389 -13.316 0.638) 13.404 3.292 ( -0.086 -3.354 0.961) 3.490 3.466 ( 4.245 -0.494 0.057) 4.274 3.888 ( 5.408 -7.688 0.509) 9.413 4.035 ( -17.779 -4.542 3.614) 18.703 4.113 ( 1.293 -6.404 -1.346) 6.671 4.303 ( -15.776 -4.495 -3.640) 16.803 4.582 ( -0.288 -3.143 -2.627) 4.107 4.679 ( 4.818 -5.408 0.752) 7.282 5.020 ( 13.260 -15.860 1.344) 20.717 5.170 ( -4.952 -24.056 -3.570) 24.819 5.339 ( 5.405 -9.386 -0.053) 10.831 5.465 ( 5.787 -17.348 -0.340) 18.291 6.318 ( 1.036 21.430 13.070) 25.123 6.808 ( 3.480 9.216 0.396) 9.859 7.946 ( -9.988 1.143 4.991) 11.224 8.053 ( 2.678 12.593 2.571) 13.129 8.830 ( 1.674 10.204 -9.448) 14.007 9.364 ( 0.470 -10.604 0.677) 10.636 9.978 ( 4.687 2.162 -0.325) 5.172 10.027 ( -0.616 16.044 3.033) 16.340 10.469 ( -7.064 5.879 2.186) 9.447 10.567 ( 4.725 -11.307 0.326) 12.259 11.162 ( 0.088 -16.623 -0.239) 16.625 11.379 ( 0.221 9.252 -3.979) 10.074 15.503 ( 0.063 6.049 5.758) 8.352 15.742 ( -2.639 6.934 -2.609) 7.865 16.852 ( -2.362 19.526 -2.719) 19.856 17.100 ( -1.872 7.430 -2.833) 8.169 21.084 ( -0.470 -20.858 2.303) 20.990 21.720 ( 4.990 -23.403 -5.256) 24.500 ======================= Grid point 431 (207/322) ======================= q-point: (-0.31 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( -13.915 -2.960 7.670) 16.162 2.451 ( -6.526 -9.671 1.931) 11.825 2.499 ( 6.467 -4.413 6.423) 10.127 2.852 ( 2.175 -9.331 0.243) 9.584 3.146 ( 0.752 -8.533 0.963) 8.620 3.309 ( -3.764 -4.412 2.161) 6.189 3.408 ( 2.445 -8.900 -2.103) 9.466 3.528 ( 4.010 -3.018 -0.606) 5.055 4.000 ( -4.601 -1.961 -0.147) 5.004 4.062 ( 0.091 -5.411 4.666) 7.146 4.237 ( -2.104 -6.107 -1.339) 6.597 4.335 ( -12.124 -7.720 -3.820) 14.872 4.559 ( 2.488 2.959 -3.169) 4.999 4.715 ( 6.877 3.416 -0.030) 7.679 5.197 ( 1.278 -3.201 -2.247) 4.114 5.391 ( 6.136 -6.235 0.565) 8.766 5.798 ( 0.736 -5.128 2.384) 5.703 5.905 ( 4.933 -10.941 2.371) 12.234 6.291 ( 5.458 -35.275 0.147) 35.695 6.655 ( 2.571 6.114 -1.067) 6.718 7.715 ( -10.735 10.391 5.287) 15.849 8.045 ( -0.775 -4.034 3.308) 5.274 8.610 ( 4.449 11.955 -7.917) 15.014 9.502 ( 0.542 -0.948 3.819) 3.972 9.685 ( -3.479 15.792 2.024) 16.297 9.868 ( 4.149 9.708 -1.493) 10.662 10.335 ( -2.654 4.005 2.193) 5.281 10.766 ( 3.356 1.187 -2.821) 4.542 11.307 ( -1.226 -11.828 -0.479) 11.901 11.542 ( 2.581 -17.769 -0.432) 17.961 15.409 ( -1.773 3.523 5.031) 6.392 15.584 ( -6.225 5.560 -3.275) 8.965 16.581 ( -3.808 6.351 -0.518) 7.423 16.953 ( -1.855 5.831 -1.990) 6.434 21.483 ( -0.244 -18.511 2.217) 18.645 22.065 ( 3.739 -9.823 -4.427) 11.404 ======================= Grid point 432 (208/322) ======================= q-point: (-0.23 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( -11.097 9.207 7.831) 16.408 2.543 ( -0.876 1.351 5.670) 5.894 2.604 ( -1.356 -6.411 1.831) 6.804 2.996 ( -1.517 -5.156 2.480) 5.919 3.297 ( 2.116 -6.490 -1.134) 6.920 3.388 ( -2.781 -5.274 1.281) 6.098 3.538 ( 1.835 -3.542 0.252) 3.997 3.656 ( -0.964 -8.676 -2.066) 8.970 4.003 ( 1.108 0.484 4.294) 4.461 4.180 ( -0.445 -5.463 -0.417) 5.497 4.259 ( -0.703 3.083 -1.277) 3.410 4.436 ( -7.232 -7.299 -2.738) 10.633 4.554 ( -0.754 -1.943 -4.513) 4.971 4.694 ( 9.371 1.091 0.759) 9.465 5.270 ( 0.846 -4.573 -3.770) 5.987 5.526 ( 6.164 -0.119 0.669) 6.201 5.654 ( 7.043 2.720 2.139) 7.847 6.181 ( 1.259 -1.813 -0.571) 2.280 6.688 ( 0.464 -7.827 -0.237) 7.844 6.997 ( 1.692 -25.203 -0.275) 25.261 7.507 ( -10.053 1.893 5.138) 11.448 8.151 ( -3.223 -7.307 2.148) 8.270 8.409 ( 6.205 10.037 -5.867) 13.179 9.312 ( -0.767 15.852 6.281) 17.068 9.498 ( -2.955 5.565 2.814) 6.901 9.696 ( 2.724 8.648 -2.995) 9.549 10.317 ( -0.071 -2.874 1.297) 3.154 10.621 ( 1.780 9.082 -3.556) 9.915 11.698 ( -1.485 -22.532 -0.704) 22.592 11.909 ( 5.410 -16.971 -1.110) 17.847 15.350 ( -2.755 2.418 4.769) 6.015 15.453 ( -7.178 2.689 -3.643) 8.487 16.515 ( -3.958 -0.960 -0.025) 4.073 16.842 ( -1.266 4.292 -1.966) 4.887 21.795 ( 0.005 -12.610 1.190) 12.666 22.165 ( 1.283 -0.272 -2.364) 2.704 ======================= Grid point 433 (209/322) ======================= q-point: (-0.15 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( -7.979 19.658 7.523) 22.510 2.466 ( -1.357 5.432 6.193) 8.349 2.698 ( -0.354 -3.091 0.567) 3.162 3.067 ( -3.660 -3.544 2.491) 5.671 3.425 ( 0.272 -5.271 -2.181) 5.711 3.462 ( -1.663 -3.024 2.886) 4.499 3.611 ( 1.077 -2.840 1.954) 3.611 3.801 ( -1.664 -6.323 -2.142) 6.881 4.012 ( 2.957 0.194 3.480) 4.571 4.155 ( -2.160 4.131 -1.180) 4.808 4.272 ( 2.391 -2.635 -2.061) 4.112 4.488 ( 0.616 1.657 0.160) 1.775 4.555 ( -3.607 -3.221 -2.781) 5.578 4.820 ( 5.480 -6.769 -3.868) 9.529 5.363 ( 0.157 -4.002 -2.216) 4.577 5.541 ( 9.874 -1.071 1.218) 10.006 5.757 ( 4.616 -4.652 -0.813) 6.604 6.135 ( 0.104 3.785 0.162) 3.790 6.795 ( -1.052 -1.701 0.585) 2.084 7.084 ( -9.996 5.312 2.886) 11.681 7.694 ( -1.139 -14.834 0.306) 14.880 8.243 ( 5.429 3.601 -5.191) 8.330 8.346 ( -3.674 -8.386 3.454) 9.785 9.016 ( 0.349 14.915 6.691) 16.351 9.353 ( -1.301 7.587 4.125) 8.733 9.559 ( 1.518 5.949 -3.497) 7.065 10.399 ( 0.087 -2.495 -1.592) 2.961 10.540 ( 1.703 -2.354 -1.135) 3.120 12.052 ( -3.234 -14.198 -2.708) 14.812 12.267 ( 7.415 -14.684 -1.734) 16.541 15.275 ( -3.651 3.615 2.662) 5.786 15.394 ( -4.573 -0.234 -1.752) 4.903 16.537 ( -4.059 -2.940 -0.120) 5.014 16.762 ( 0.133 3.141 -2.031) 3.743 21.981 ( 0.035 -6.287 -0.033) 6.287 22.128 ( -0.228 2.924 -0.340) 2.953 ======================= Grid point 434 (210/322) ======================= q-point: (-0.08 -0.54 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( -4.190 14.691 8.170) 17.324 2.374 ( -1.484 3.142 6.329) 7.220 2.725 ( 1.460 0.536 0.360) 1.596 3.106 ( -2.278 -1.942 1.204) 3.226 3.450 ( -9.295 -0.729 3.291) 9.887 3.528 ( 4.968 -1.545 -0.805) 5.265 3.658 ( 2.275 -0.287 2.351) 3.284 3.858 ( -1.017 -0.318 -0.534) 1.191 4.033 ( 1.339 0.217 -0.647) 1.503 4.103 ( 2.621 0.334 1.200) 2.902 4.315 ( 0.823 -1.209 -2.268) 2.698 4.435 ( 1.508 2.765 -0.963) 3.293 4.610 ( -6.058 -4.432 -1.423) 7.640 4.949 ( 4.089 -3.701 -5.520) 7.803 5.412 ( 0.587 -1.448 0.987) 1.849 5.692 ( 8.870 -6.603 0.392) 11.065 5.836 ( -0.015 -1.802 -2.019) 2.706 6.080 ( 0.358 1.534 0.788) 1.761 6.764 ( -5.781 2.161 2.015) 6.492 6.930 ( -4.392 4.322 0.869) 6.223 7.872 ( -1.047 -4.060 -0.508) 4.223 8.202 ( 3.319 1.022 -5.094) 6.165 8.539 ( -3.036 -9.306 5.580) 11.268 8.759 ( 1.642 11.633 6.704) 13.526 9.228 ( -1.131 4.283 4.159) 6.076 9.484 ( 1.042 1.297 -3.429) 3.812 10.416 ( 0.633 -0.480 -3.124) 3.223 10.641 ( 0.774 -3.671 -0.009) 3.751 12.218 ( -1.442 -4.664 -3.819) 6.198 12.512 ( 3.969 -6.014 -2.330) 7.572 15.192 ( -1.941 3.222 1.509) 4.053 15.385 ( -1.748 -0.748 -0.587) 1.990 16.560 ( -2.195 -0.835 -0.394) 2.381 16.720 ( 1.202 0.955 -1.889) 2.435 22.044 ( -0.248 -0.577 -0.102) 0.636 22.090 ( -0.071 0.360 0.170) 0.405 ======================= Grid point 442 (211/322) ======================= q-point: (-0.46 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( -22.482 -0.000 7.870) 23.820 2.002 ( -20.141 -0.000 1.245) 20.179 2.124 ( 15.639 0.000 6.488) 16.932 2.279 ( 10.053 0.000 -0.480) 10.065 2.676 ( 6.899 0.000 -3.230) 7.618 2.711 ( 0.520 0.000 -0.455) 0.691 3.289 ( 6.620 0.000 3.821) 7.644 3.365 ( -1.370 -0.000 7.645) 7.767 3.574 ( -8.513 -0.000 -4.646) 9.698 3.742 ( -0.337 -0.000 -4.264) 4.277 3.870 ( -17.070 -0.000 8.287) 18.975 4.090 ( -11.680 -0.000 -1.915) 11.836 4.263 ( -2.661 -0.000 1.574) 3.092 4.379 ( 4.374 0.000 -2.422) 5.000 4.735 ( 13.043 0.000 -0.063) 13.043 4.963 ( 4.236 0.000 -7.103) 8.270 5.258 ( 11.843 0.000 2.304) 12.066 5.416 ( -2.507 -0.000 -0.754) 2.618 6.930 ( -0.163 -0.000 25.752) 25.752 6.946 ( 2.828 0.000 1.267) 3.099 7.965 ( -0.539 -0.000 8.154) 8.172 8.721 ( 0.916 0.000 1.348) 1.630 8.804 ( -1.392 -0.000 -0.315) 1.428 9.160 ( -1.135 -0.000 -14.403) 14.447 9.649 ( -0.838 -0.000 -0.459) 0.955 10.458 ( 5.343 0.000 -1.372) 5.516 10.509 ( -3.410 -0.000 4.481) 5.630 10.543 ( 0.542 0.000 -0.136) 0.559 10.762 ( 0.646 0.000 1.247) 1.405 11.637 ( -0.314 -0.000 -5.495) 5.504 15.666 ( -2.364 -0.000 7.174) 7.554 15.947 ( 2.691 0.000 -0.707) 2.782 17.292 ( -3.292 -0.000 -4.622) 5.675 17.716 ( 6.694 0.000 -14.836) 16.276 20.546 ( 0.018 0.000 0.163) 0.164 20.810 ( 0.013 0.000 -0.066) 0.067 ======================= Grid point 443 (212/322) ======================= q-point: (-0.38 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -21.530 -5.516 8.577) 23.823 2.014 ( -18.743 -11.155 1.822) 21.887 2.266 ( 14.597 -4.100 5.817) 16.239 2.424 ( 7.249 -8.878 -1.262) 11.530 2.796 ( 3.459 -6.698 0.832) 7.584 2.870 ( 3.926 -13.574 -2.117) 14.288 3.266 ( -2.817 1.334 -0.151) 3.121 3.422 ( -4.545 -4.311 1.794) 6.516 3.650 ( -16.631 -13.717 -0.776) 21.573 3.825 ( -3.989 -4.619 5.729) 8.371 3.951 ( -1.643 -13.669 -0.537) 13.778 4.130 ( -8.863 -6.282 1.487) 10.964 4.320 ( -2.033 -10.893 1.287) 11.156 4.498 ( 3.470 -11.564 -1.636) 12.184 4.825 ( 14.602 -2.225 0.630) 14.784 4.994 ( 8.352 -1.617 -6.724) 10.844 5.296 ( -2.758 -0.360 -2.461) 3.714 5.419 ( 11.845 0.896 1.181) 11.937 6.740 ( 0.445 16.458 17.543) 24.059 6.988 ( 5.226 4.162 5.236) 8.488 7.948 ( -2.236 2.689 7.282) 8.078 8.383 ( -1.377 19.323 -0.202) 19.373 8.950 ( 0.143 0.102 -5.266) 5.269 9.149 ( -1.152 -7.036 -5.904) 9.257 9.849 ( 1.206 -14.854 -0.547) 14.913 10.319 ( 1.014 12.401 3.062) 12.814 10.447 ( -1.447 1.904 -1.436) 2.790 10.596 ( 2.459 2.130 3.922) 5.096 10.877 ( 1.492 -11.362 -0.156) 11.461 11.554 ( 0.223 7.257 -5.191) 8.925 15.611 ( -3.952 4.290 6.762) 8.930 15.877 ( -0.243 7.450 -2.432) 7.841 17.203 ( -3.821 5.831 -2.958) 7.573 17.341 ( -3.336 29.122 -10.571) 31.161 20.712 ( -0.037 -15.257 1.164) 15.302 21.190 ( 5.121 -30.360 -4.067) 31.056 ======================= Grid point 444 (213/322) ======================= q-point: (-0.31 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( -18.636 -8.890 8.586) 22.362 2.168 ( -14.168 -13.100 2.242) 19.426 2.456 ( 11.052 -5.602 5.270) 13.465 2.664 ( 4.505 -11.181 -1.675) 12.170 2.979 ( 2.541 -9.038 1.411) 9.494 3.151 ( 0.936 -11.568 0.976) 11.646 3.243 ( -7.899 -4.260 -2.780) 9.395 3.520 ( 3.284 -4.511 0.238) 5.584 3.752 ( -20.879 -10.712 -3.707) 23.758 3.944 ( -1.118 -6.572 6.173) 9.085 4.112 ( -5.090 -1.094 2.466) 5.761 4.217 ( 2.447 -7.225 0.706) 7.661 4.554 ( -1.320 -6.629 -1.629) 6.953 4.771 ( 7.660 -5.821 1.490) 9.736 5.107 ( -3.016 -10.987 -4.137) 12.121 5.188 ( 13.230 -19.023 -0.732) 23.183 5.340 ( 0.637 -12.392 -2.534) 12.664 5.602 ( 13.721 -17.209 -0.993) 22.031 6.388 ( 3.429 21.161 13.907) 25.553 6.870 ( 7.168 10.837 -0.865) 13.022 7.825 ( -11.672 7.125 3.806) 14.195 8.093 ( 1.604 8.583 4.134) 9.661 8.828 ( 2.265 8.984 -8.501) 12.574 9.354 ( -2.302 -11.362 -0.375) 11.599 10.009 ( 0.151 8.522 -0.669) 8.550 10.052 ( 4.009 10.217 2.044) 11.165 10.389 ( -6.476 2.134 2.044) 7.119 10.651 ( 7.834 -7.782 2.690) 11.365 11.155 ( -1.056 -13.947 -1.377) 14.054 11.381 ( 1.907 6.699 -3.091) 7.620 15.491 ( -4.661 5.668 5.843) 9.381 15.676 ( -7.199 8.832 -4.297) 12.177 16.784 ( -7.656 18.355 -2.557) 20.052 17.057 ( -3.958 6.469 -2.044) 7.854 21.087 ( -0.181 -20.879 2.439) 21.021 21.779 ( 8.084 -22.430 -6.768) 24.784 ======================= Grid point 445 (214/322) ======================= q-point: (-0.23 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -15.709 -5.112 8.261) 18.470 2.351 ( -11.314 -12.294 1.983) 16.825 2.591 ( 5.468 -1.708 4.733) 7.431 2.882 ( 2.902 -8.095 -0.361) 8.607 3.160 ( 0.175 -7.861 1.915) 8.093 3.260 ( -4.612 -5.920 0.529) 7.523 3.421 ( 0.804 -10.817 -2.096) 11.047 3.567 ( 3.503 0.810 -1.444) 3.874 3.909 ( -9.931 -13.511 -4.194) 17.285 4.066 ( -2.742 -3.765 7.424) 8.764 4.118 ( -8.454 -6.659 -1.023) 10.810 4.330 ( 3.162 -2.588 1.689) 4.421 4.569 ( 2.174 2.396 -3.276) 4.605 4.816 ( 7.213 3.762 1.318) 8.241 5.177 ( 0.367 -4.474 -4.263) 6.191 5.488 ( 8.271 -5.709 -0.452) 10.060 5.829 ( 3.252 -18.204 0.399) 18.497 6.001 ( 9.343 4.172 5.678) 11.702 6.362 ( 6.864 -34.003 -1.479) 34.720 6.698 ( 5.334 7.945 -1.228) 9.648 7.582 ( -13.597 9.259 4.398) 17.028 8.045 ( -1.554 -1.508 4.051) 4.594 8.634 ( 3.295 10.564 -7.414) 13.320 9.494 ( -3.393 -3.650 1.060) 5.095 9.666 ( -0.984 18.564 4.757) 19.189 9.911 ( 4.196 10.366 -2.724) 11.510 10.315 ( -2.135 1.981 2.390) 3.767 10.800 ( 3.581 4.393 -2.822) 6.331 11.299 ( -0.042 -13.868 0.203) 13.870 11.578 ( 3.577 -17.965 -0.481) 18.324 15.379 ( -5.692 2.830 4.424) 7.745 15.474 ( -10.210 5.411 -3.679) 12.127 16.525 ( -5.429 5.158 0.096) 7.489 16.917 ( -3.428 5.103 -1.524) 6.334 21.488 ( -0.098 -18.471 2.378) 18.624 22.104 ( 5.222 -7.907 -5.338) 10.876 ======================= Grid point 446 (215/322) ======================= q-point: (-0.15 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.785 ( -12.630 6.741 7.608) 16.213 2.498 ( -7.971 -6.290 2.389) 10.432 2.614 ( 0.756 0.003 3.592) 3.670 3.003 ( 1.903 -3.164 1.613) 4.029 3.293 ( -4.380 -6.497 1.115) 7.914 3.381 ( 2.368 -6.226 0.872) 6.718 3.567 ( 2.955 -2.256 -0.987) 3.847 3.633 ( -1.319 -8.618 -3.111) 9.257 4.038 ( 2.089 -0.698 5.203) 5.650 4.107 ( -8.241 -5.156 -3.117) 10.208 4.251 ( -3.853 -6.800 -0.345) 7.824 4.381 ( -0.265 -3.033 -1.086) 3.233 4.533 ( -0.904 1.066 -2.985) 3.296 4.793 ( 6.260 0.992 0.977) 6.413 5.290 ( 5.510 -4.844 -2.365) 7.708 5.622 ( 7.839 -2.794 -0.706) 8.352 5.757 ( 10.325 6.971 2.195) 12.650 6.204 ( 2.849 -0.742 -0.103) 2.946 6.691 ( 0.008 -6.974 0.133) 6.976 7.020 ( 2.050 -16.702 0.179) 16.829 7.398 ( -9.591 -4.418 2.456) 10.841 8.117 ( -4.346 -6.868 3.214) 8.740 8.441 ( 2.500 9.509 -6.250) 11.651 9.332 ( 0.292 15.495 6.263) 16.715 9.468 ( -3.197 4.000 3.302) 6.093 9.723 ( 3.305 9.762 -3.521) 10.891 10.320 ( -0.218 -3.073 1.231) 3.318 10.628 ( 1.210 9.018 -3.475) 9.740 11.679 ( -1.235 -20.160 -0.481) 20.203 11.978 ( 6.822 -18.863 -1.487) 20.114 15.319 ( -5.014 2.952 3.866) 6.985 15.342 ( -8.969 -0.219 -3.313) 9.564 16.465 ( -4.535 -1.110 0.502) 4.696 16.813 ( -2.570 3.301 -1.619) 4.485 21.798 ( -0.021 -12.463 1.260) 12.526 22.175 ( 1.705 0.979 -2.620) 3.276 ======================= Grid point 447 (216/322) ======================= q-point: (-0.08 -0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( -8.850 17.129 7.167) 20.569 2.464 ( -1.799 4.759 5.055) 7.172 2.674 ( -4.147 -4.742 0.962) 6.372 3.066 ( 2.960 -2.071 1.020) 3.753 3.362 ( -7.412 -3.682 2.297) 8.589 3.507 ( 4.734 -3.869 0.031) 6.115 3.635 ( 1.998 -2.990 1.389) 3.855 3.779 ( -0.493 -6.419 -2.942) 7.078 4.036 ( -1.522 0.505 1.930) 2.509 4.133 ( 0.481 -0.403 0.653) 0.906 4.305 ( 2.695 -0.500 0.058) 2.742 4.448 ( -10.691 -4.569 -6.168) 13.161 4.494 ( -0.027 0.683 0.339) 0.763 4.872 ( 4.430 -4.599 -2.191) 6.751 5.396 ( 5.891 -2.374 0.837) 6.407 5.707 ( 16.138 -0.313 0.508) 16.149 5.776 ( 0.219 -2.633 -2.184) 3.428 6.148 ( 1.571 4.420 0.765) 4.753 6.770 ( -4.056 -0.049 1.965) 4.508 6.992 ( -6.290 4.895 1.272) 8.071 7.688 ( 0.371 -14.731 -0.859) 14.761 8.269 ( -9.824 -2.960 0.298) 10.264 8.286 ( 3.849 -2.235 -1.741) 4.780 9.073 ( 4.804 13.697 7.367) 16.278 9.341 ( -2.715 6.804 4.252) 8.470 9.568 ( 1.895 6.686 -3.976) 8.006 10.395 ( 0.152 -2.345 -1.715) 2.909 10.552 ( 0.777 -2.555 -1.080) 2.881 12.005 ( -3.137 -13.984 -2.415) 14.534 12.353 ( 7.947 -13.657 -2.434) 15.987 15.230 ( -4.669 2.380 0.583) 5.273 15.337 ( -4.223 -2.090 0.014) 4.712 16.489 ( -4.143 -3.309 0.216) 5.307 16.750 ( -1.096 1.838 -1.730) 2.752 21.981 ( 0.007 -6.093 -0.064) 6.093 22.125 ( -0.174 3.148 -0.257) 3.163 ======================= Grid point 456 (217/322) ======================= q-point: (-0.38 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( -22.356 -0.000 10.257) 24.597 1.749 ( -23.416 -0.000 2.737) 23.575 2.335 ( 16.351 0.000 5.524) 17.259 2.353 ( 3.290 0.000 -1.799) 3.750 2.723 ( 4.158 0.000 -3.600) 5.500 2.764 ( 6.940 0.000 0.173) 6.942 3.186 ( -33.970 -0.000 -6.070) 34.508 3.376 ( -0.734 -0.000 7.616) 7.651 3.388 ( -8.616 -0.000 3.530) 9.311 3.721 ( -1.013 -0.000 -4.231) 4.350 3.788 ( 1.482 0.000 7.239) 7.389 4.045 ( -0.861 -0.000 4.122) 4.211 4.222 ( -3.412 -0.000 0.295) 3.425 4.423 ( 1.799 0.000 -1.008) 2.062 4.897 ( 13.225 0.000 -0.616) 13.239 5.030 ( 11.107 0.000 -5.192) 12.261 5.265 ( -5.233 -0.000 -4.517) 6.913 5.519 ( 14.691 0.000 1.057) 14.729 6.983 ( -4.212 -0.000 23.761) 24.132 7.012 ( 7.661 0.000 1.112) 7.741 8.014 ( 4.563 0.000 9.983) 10.977 8.730 ( -0.214 -0.000 1.805) 1.817 8.772 ( -3.854 -0.000 -0.230) 3.860 9.108 ( 0.074 0.000 -15.308) 15.308 9.635 ( -1.321 -0.000 -0.278) 1.350 10.474 ( -0.207 -0.000 -1.330) 1.346 10.539 ( 4.715 0.000 4.942) 6.831 10.549 ( 0.670 0.000 -0.268) 0.722 10.790 ( 3.167 0.000 1.998) 3.744 11.622 ( 0.354 0.000 -5.434) 5.445 15.634 ( -6.114 -0.000 7.123) 9.387 15.964 ( 0.323 0.000 -2.706) 2.726 17.226 ( -5.689 -0.000 -3.016) 6.439 17.697 ( -1.398 -0.000 -21.281) 21.327 20.547 ( 0.048 0.000 0.149) 0.157 20.810 ( 0.008 0.000 -0.066) 0.066 ======================= Grid point 457 (218/322) ======================= q-point: (-0.31 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( -20.263 -6.633 10.970) 23.977 1.786 ( -20.809 -14.476 3.044) 25.531 2.427 ( 7.251 -5.053 1.788) 9.017 2.499 ( 8.910 -6.758 0.537) 11.196 2.838 ( 2.731 -6.810 -0.028) 7.337 2.920 ( 4.275 -11.620 -1.178) 12.438 3.026 ( -34.583 -7.192 -5.392) 35.732 3.347 ( -5.017 -3.562 1.454) 6.322 3.530 ( -2.305 -9.811 4.905) 11.208 3.822 ( -3.873 -5.515 4.208) 7.945 3.987 ( 8.150 -16.199 0.431) 18.139 4.075 ( -3.593 -1.726 5.355) 6.676 4.310 ( -0.124 -12.063 1.054) 12.110 4.504 ( -1.388 -10.642 -2.053) 10.927 4.976 ( 9.929 -1.822 -2.924) 10.510 5.122 ( 13.899 -2.926 -0.525) 14.213 5.223 ( -2.319 0.090 -5.915) 6.354 5.586 ( 13.183 0.880 -0.771) 13.235 6.796 ( -0.695 15.177 17.415) 23.111 7.075 ( 7.498 3.296 2.921) 8.695 7.962 ( 1.036 9.538 7.966) 12.470 8.364 ( -1.958 17.898 0.545) 18.013 8.936 ( -0.192 -0.311 -4.115) 4.131 9.107 ( -2.783 -7.834 -6.432) 10.512 9.853 ( -0.033 -16.220 -1.723) 16.311 10.347 ( 2.213 12.519 3.200) 13.110 10.426 ( -0.940 4.477 -1.546) 4.828 10.667 ( 6.645 -0.049 6.250) 9.123 10.894 ( 1.322 -9.895 -0.744) 10.011 11.544 ( 0.696 6.926 -4.767) 8.436 15.567 ( -6.664 3.830 6.862) 10.304 15.835 ( -5.654 10.681 -5.876) 13.438 17.138 ( -5.882 4.515 -2.130) 7.715 17.211 ( -12.670 30.704 -12.202) 35.386 20.716 ( 0.112 -15.347 1.293) 15.401 21.250 ( 7.848 -33.448 -6.468) 34.960 ======================= Grid point 458 (219/322) ======================= q-point: (-0.23 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( -16.873 -10.045 10.340) 22.193 1.992 ( -16.847 -15.801 2.925) 23.282 2.578 ( 6.636 -4.000 2.986) 8.304 2.706 ( 3.903 -10.286 -2.052) 11.191 2.987 ( -9.876 -9.964 0.444) 14.037 3.064 ( -9.694 -10.204 -3.356) 14.469 3.183 ( 1.500 -12.380 -0.226) 12.473 3.486 ( -7.281 -13.617 0.219) 15.443 3.634 ( 0.820 -0.578 0.125) 1.010 3.928 ( -3.894 -6.699 3.715) 8.593 4.070 ( -3.235 0.085 5.551) 6.426 4.264 ( 2.921 -6.386 0.799) 7.068 4.566 ( 4.400 -7.719 0.363) 8.892 4.819 ( -1.900 -11.757 1.285) 11.979 5.078 ( 2.117 -5.177 -5.022) 7.517 5.300 ( 6.213 -18.619 -3.556) 19.947 5.403 ( 10.259 -10.543 -0.522) 14.720 5.753 ( 12.788 -17.634 -2.674) 21.947 6.475 ( 3.721 19.473 13.743) 24.123 6.970 ( 10.253 12.186 -1.768) 16.023 7.708 ( -9.558 11.783 3.016) 15.469 8.113 ( -0.721 8.027 5.483) 9.748 8.826 ( 1.533 8.192 -7.516) 11.222 9.312 ( -4.188 -11.729 -1.001) 12.494 9.994 ( -2.133 8.519 -0.250) 8.786 10.110 ( 5.049 9.466 -0.648) 10.748 10.334 ( -3.970 2.130 2.007) 4.932 10.765 ( 9.360 -6.120 5.022) 12.260 11.128 ( -2.315 -11.043 -2.417) 11.539 11.403 ( 2.904 3.359 -1.606) 4.722 15.432 ( -8.486 6.133 4.310) 11.322 15.540 ( -12.953 9.227 -5.061) 16.689 16.667 ( -10.412 14.395 -1.689) 17.846 16.998 ( -5.146 5.696 -1.136) 7.760 21.094 ( -0.036 -20.901 2.713) 21.076 21.865 ( 10.430 -20.952 -9.400) 25.222 ======================= Grid point 459 (220/322) ======================= q-point: (-0.15 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( -13.962 -5.981 9.004) 17.658 2.205 ( -13.998 -14.594 2.412) 20.365 2.648 ( 2.176 -0.220 2.236) 3.128 2.914 ( 2.708 -8.173 -1.068) 8.676 3.121 ( -8.309 -8.429 2.399) 12.077 3.241 ( 1.866 -9.420 -0.767) 9.633 3.415 ( -0.524 -10.946 -2.265) 11.190 3.601 ( 3.179 2.515 -2.303) 4.662 3.773 ( -9.497 -18.355 -3.374) 20.940 4.043 ( -6.032 -7.176 1.457) 9.487 4.064 ( -1.122 0.205 7.118) 7.209 4.354 ( -0.043 -3.111 0.871) 3.231 4.603 ( 4.513 4.451 -1.162) 6.445 4.862 ( 0.948 1.575 1.217) 2.204 5.223 ( 8.695 -5.954 -2.746) 10.890 5.560 ( 4.145 -4.538 -2.032) 6.473 5.866 ( 2.870 -24.873 -0.782) 25.050 6.154 ( 12.607 12.292 7.452) 19.120 6.445 ( 8.767 -33.358 -3.002) 34.621 6.773 ( 7.870 9.778 -1.193) 12.608 7.434 ( -13.074 9.755 3.094) 16.603 8.028 ( -3.912 0.298 4.947) 6.314 8.641 ( 1.708 10.045 -6.641) 12.162 9.440 ( -5.364 -3.212 -0.045) 6.252 9.681 ( 0.034 17.065 5.723) 17.999 9.949 ( 4.022 10.658 -4.363) 12.199 10.296 ( -2.435 0.258 2.522) 3.515 10.826 ( 2.131 8.145 -3.635) 9.170 11.312 ( 2.018 -15.323 1.860) 15.567 11.622 ( 4.128 -18.667 -0.410) 19.123 15.279 ( -12.567 1.551 -2.157) 12.845 15.357 ( -7.662 4.085 2.236) 8.966 16.459 ( -5.771 3.617 0.515) 6.830 16.866 ( -4.414 4.417 -0.978) 6.321 21.495 ( -0.094 -18.346 2.620) 18.533 22.153 ( 6.003 -5.603 -6.615) 10.545 ======================= Grid point 460 (221/322) ======================= q-point: (-0.08 -0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( -11.518 5.373 7.438) 14.726 2.397 ( -9.284 -10.715 1.930) 14.308 2.629 ( 0.026 2.636 2.731) 3.795 3.044 ( 3.948 -3.497 0.596) 5.307 3.221 ( -8.046 -6.267 2.892) 10.601 3.428 ( 4.410 -6.943 0.438) 8.237 3.597 ( 2.841 -1.948 -1.911) 3.939 3.609 ( -0.783 -9.005 -4.780) 10.225 4.006 ( -6.439 -6.286 -3.060) 9.504 4.080 ( 2.100 -2.859 4.401) 5.652 4.145 ( -12.368 -9.217 -1.455) 15.493 4.399 ( 1.469 -0.468 1.898) 2.445 4.522 ( 0.810 3.743 -1.254) 4.030 4.858 ( 4.872 0.198 1.228) 5.028 5.379 ( 9.143 -4.237 -0.353) 10.083 5.668 ( 1.147 -4.985 -2.622) 5.748 5.930 ( 16.760 8.555 2.516) 18.984 6.245 ( 4.150 0.495 0.012) 4.179 6.687 ( -0.873 -4.683 1.075) 4.884 7.035 ( -0.578 -2.679 1.073) 2.943 7.317 ( -3.470 -16.808 -1.074) 17.196 8.057 ( -8.194 -5.773 3.703) 10.685 8.444 ( 1.913 9.534 -5.295) 11.073 9.341 ( -1.908 10.158 3.968) 11.072 9.454 ( -1.348 6.472 5.395) 8.533 9.751 ( 3.474 10.431 -4.327) 11.815 10.318 ( -0.826 -3.388 1.206) 3.691 10.626 ( 0.224 8.797 -3.640) 9.523 11.669 ( -0.291 -17.602 0.217) 17.605 12.055 ( 6.891 -20.280 -2.061) 21.518 15.212 ( -9.378 -0.693 -4.001) 10.220 15.282 ( -4.740 0.084 4.292) 6.395 16.413 ( -4.651 -1.320 0.653) 4.879 16.774 ( -3.241 2.373 -1.114) 4.169 21.802 ( -0.121 -12.276 1.351) 12.351 22.188 ( 1.914 2.331 -2.940) 4.212 ======================= Grid point 470 (222/322) ======================= q-point: (-0.31 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( -19.702 -0.000 13.261) 23.749 1.473 ( -25.108 -0.000 4.614) 25.529 2.356 ( -0.896 -0.000 -3.313) 3.432 2.532 ( 14.096 0.000 4.265) 14.727 2.655 ( -48.596 -0.000 -2.787) 48.676 2.767 ( 4.558 0.000 -2.617) 5.256 2.847 ( 6.940 0.000 0.016) 6.940 3.324 ( -5.811 -0.000 1.144) 5.922 3.394 ( -0.223 -0.000 7.066) 7.070 3.694 ( -1.319 -0.000 -3.986) 4.198 3.870 ( 6.029 0.000 8.819) 10.683 4.060 ( 0.259 0.000 5.493) 5.499 4.202 ( 0.642 0.000 0.447) 0.783 4.405 ( -3.525 -0.000 -3.255) 4.798 5.001 ( 4.539 0.000 -3.934) 6.006 5.182 ( 13.954 0.000 1.789) 14.068 5.225 ( 3.428 0.000 -5.737) 6.684 5.680 ( 12.140 0.000 -2.197) 12.338 6.971 ( -8.790 -0.000 19.225) 21.139 7.129 ( 11.397 0.000 0.896) 11.433 8.137 ( 10.025 0.000 13.134) 16.523 8.712 ( -6.312 -0.000 -0.126) 6.314 8.727 ( -1.160 -0.000 1.790) 2.133 9.067 ( 0.783 0.000 -15.058) 15.078 9.618 ( -1.373 -0.000 -0.003) 1.373 10.471 ( 0.777 0.000 -3.697) 3.778 10.556 ( 0.661 0.000 -0.454) 0.801 10.628 ( 7.658 0.000 6.332) 9.936 10.848 ( 5.318 0.000 4.150) 6.745 11.612 ( 0.767 0.000 -4.569) 4.633 15.575 ( -7.424 -0.000 7.330) 10.433 15.922 ( -5.570 -0.000 -8.025) 9.768 17.144 ( -6.901 -0.000 -2.014) 7.189 17.532 ( -14.330 -0.000 -28.457) 31.861 20.548 ( 0.060 0.000 0.129) 0.142 20.810 ( 0.005 0.000 -0.066) 0.066 ======================= Grid point 471 (223/322) ======================= q-point: (-0.23 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( -16.949 -7.425 13.846) 23.111 1.549 ( -21.290 -17.407 4.628) 27.887 2.449 ( -1.815 -10.058 -2.102) 10.434 2.508 ( -40.794 -12.859 -3.178) 42.891 2.638 ( 9.312 -3.082 2.745) 10.186 2.883 ( 2.626 -7.564 -0.712) 8.039 2.987 ( 5.393 -9.171 -0.209) 10.641 3.303 ( -3.863 -3.088 0.704) 4.995 3.540 ( 0.253 -10.033 4.498) 10.998 3.782 ( -3.093 -6.628 0.487) 7.331 4.064 ( -1.879 -0.702 7.932) 8.182 4.097 ( 7.988 -13.252 1.365) 15.534 4.332 ( 3.583 -12.819 2.283) 13.505 4.455 ( -4.849 -11.268 -4.500) 13.066 5.017 ( 1.144 -0.832 -4.151) 4.385 5.230 ( 7.561 0.503 -2.991) 8.147 5.313 ( 14.040 -4.673 0.587) 14.809 5.709 ( 8.804 1.617 -3.668) 9.673 6.816 ( -4.730 11.729 16.005) 20.398 7.186 ( 10.513 3.083 0.506) 10.967 8.025 ( 5.215 18.911 8.341) 21.316 8.341 ( -2.804 15.407 2.177) 15.811 8.917 ( -1.487 -2.185 -2.333) 3.525 9.050 ( -3.052 -6.907 -7.088) 10.357 9.838 ( -1.375 -15.568 -2.280) 15.794 10.387 ( 2.967 11.974 1.428) 12.418 10.413 ( -0.347 5.479 -3.385) 6.449 10.799 ( 11.603 -1.253 11.289) 16.237 10.896 ( -0.752 -6.967 -1.981) 7.282 11.543 ( 1.511 6.446 -3.112) 7.316 15.501 ( -8.127 4.085 6.391) 11.116 15.686 ( -15.977 14.561 -11.428) 24.451 16.966 ( -20.148 24.318 -11.431) 33.585 17.067 ( -6.713 5.621 -0.778) 8.790 20.722 ( 0.151 -15.508 1.490) 15.580 21.332 ( 10.134 -37.249 -10.481) 40.000 ======================= Grid point 472 (224/322) ======================= q-point: (-0.15 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -13.124 -10.562 12.380) 20.906 1.794 ( -18.330 -17.608 4.159) 25.755 2.586 ( -9.855 -8.382 -3.380) 13.371 2.721 ( -6.340 -17.565 -2.080) 18.789 2.782 ( -3.397 -10.510 1.172) 11.108 3.057 ( 1.163 -8.990 0.343) 9.072 3.207 ( 2.140 -10.007 0.284) 10.238 3.421 ( -4.976 -11.067 0.560) 12.147 3.658 ( 1.843 -0.321 0.202) 1.881 3.889 ( -3.045 -5.772 -0.084) 6.527 4.073 ( 0.390 -0.166 8.030) 8.041 4.275 ( -0.709 -4.166 -0.888) 4.318 4.654 ( 6.623 -7.535 4.515) 11.001 4.761 ( -3.666 -13.567 -1.651) 14.150 5.120 ( 5.849 -10.809 -3.567) 12.798 5.348 ( 3.725 -14.038 -2.874) 14.806 5.509 ( 6.937 -4.968 -1.908) 8.744 5.890 ( 11.898 -21.315 -3.486) 24.659 6.552 ( 2.303 15.593 12.656) 20.214 7.097 ( 11.966 12.709 -1.934) 17.563 7.628 ( -4.989 17.700 2.400) 18.546 8.108 ( -3.583 8.590 6.554) 11.384 8.818 ( 0.972 7.668 -6.426) 10.051 9.258 ( -4.092 -11.740 -1.061) 12.478 9.958 ( -3.838 5.807 -0.218) 6.964 10.159 ( 3.926 10.618 -2.699) 11.638 10.302 ( -2.500 3.132 0.918) 4.111 10.881 ( 5.823 -2.759 2.862) 7.051 11.105 ( 0.867 -10.618 1.220) 10.723 11.438 ( 3.278 1.120 0.070) 3.465 15.269 ( -19.063 7.815 -4.727) 21.138 15.401 ( -9.001 4.808 2.744) 10.567 16.542 ( -9.802 9.336 -0.483) 13.546 16.932 ( -5.485 5.145 -0.542) 7.540 21.102 ( -0.052 -20.915 3.080) 21.141 21.960 ( 11.260 -19.115 -12.850) 25.638 ======================= Grid point 473 (225/322) ======================= q-point: (-0.08 -0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( -10.485 -5.849 9.961) 15.601 2.048 ( -13.515 -17.226 3.233) 22.133 2.654 ( -1.498 -1.797 -0.720) 2.448 2.933 ( 0.870 -8.535 -1.456) 8.702 3.020 ( -8.200 -11.481 2.017) 14.252 3.272 ( 3.145 -11.546 -0.582) 11.981 3.399 ( -0.965 -9.342 -2.240) 9.655 3.627 ( 2.430 2.690 -2.685) 4.511 3.663 ( -8.878 -16.775 -1.689) 19.055 3.971 ( -5.230 -4.963 -1.227) 7.314 4.091 ( 1.677 0.431 7.610) 7.804 4.342 ( -1.780 -3.969 0.421) 4.370 4.651 ( 2.498 5.743 2.302) 6.672 4.892 ( 4.633 -1.103 1.444) 4.977 5.327 ( 8.899 -6.231 -1.855) 11.021 5.572 ( -0.537 -4.609 -2.799) 5.419 5.889 ( 1.382 -26.557 -1.221) 26.621 6.317 ( 9.836 10.869 6.890) 16.198 6.556 ( 11.629 -30.409 -2.683) 32.668 6.875 ( 10.129 11.617 -1.460) 15.482 7.302 ( -10.228 11.883 1.952) 15.800 7.977 ( -7.464 2.026 5.137) 9.285 8.643 ( 2.158 9.721 -5.254) 11.258 9.378 ( -4.886 -2.585 -0.016) 5.528 9.690 ( -1.649 14.822 5.290) 15.824 9.976 ( 3.168 10.472 -5.779) 12.374 10.273 ( -2.609 -0.830 2.383) 3.629 10.822 ( -0.483 9.666 -5.039) 10.912 11.360 ( 4.472 -14.089 4.058) 15.329 11.669 ( 3.866 -19.637 -0.201) 20.015 15.114 ( -12.608 -1.118 -3.131) 13.039 15.285 ( -6.619 2.591 3.253) 7.817 16.395 ( -5.242 2.387 0.599) 5.791 16.811 ( -4.366 3.820 -0.496) 5.822 21.501 ( -0.231 -18.158 2.894) 18.389 22.201 ( 5.793 -3.426 -8.003) 10.457 ======================= Grid point 484 (226/322) ======================= q-point: (-0.23 -0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.193 ( -25.087 -0.000 7.139) 26.083 1.202 ( -15.885 -0.000 16.595) 22.973 2.068 ( -49.641 -0.000 2.364) 49.697 2.324 ( -2.103 -0.000 -4.813) 5.253 2.685 ( 9.972 0.000 2.036) 10.178 2.807 ( 3.120 0.000 -1.199) 3.343 2.924 ( 5.998 0.000 -0.353) 6.008 3.254 ( -6.575 -0.000 0.744) 6.617 3.413 ( -0.020 -0.000 6.146) 6.146 3.667 ( -1.174 -0.000 -3.558) 3.747 3.953 ( 3.315 0.000 5.355) 6.298 4.062 ( -3.193 -0.000 6.030) 6.824 4.265 ( 9.167 0.000 2.457) 9.490 4.332 ( -5.161 -0.000 -5.965) 7.888 5.025 ( 4.083 0.000 -1.611) 4.389 5.272 ( 5.449 0.000 -3.733) 6.605 5.355 ( 12.565 0.000 2.097) 12.739 5.784 ( 7.351 0.000 -5.151) 8.976 6.906 ( -10.495 -0.000 15.082) 18.374 7.280 ( 13.458 0.000 0.668) 13.474 8.317 ( 12.704 0.000 14.044) 18.937 8.624 ( -8.440 -0.000 -0.047) 8.440 8.716 ( -1.583 -0.000 1.693) 2.318 9.031 ( 0.525 0.000 -13.908) 13.917 9.605 ( -0.993 -0.000 0.334) 1.048 10.460 ( -0.159 -0.000 -7.540) 7.541 10.561 ( 0.517 0.000 -0.658) 0.837 10.738 ( 6.318 0.000 2.543) 6.810 10.966 ( 13.121 0.000 10.633) 16.888 11.620 ( 2.742 0.000 -1.392) 3.075 15.504 ( -8.436 -0.000 6.792) 10.830 15.754 ( -18.082 -0.000 -18.322) 25.742 17.046 ( -9.738 -0.000 -4.982) 10.939 17.192 ( -26.012 -0.000 -25.192) 36.212 20.550 ( 0.051 0.000 0.108) 0.119 20.810 ( 0.004 0.000 -0.066) 0.067 ======================= Grid point 485 (227/322) ======================= q-point: (-0.15 -0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.224 ( -12.730 -8.263 16.699) 22.565 1.319 ( -20.405 -19.307 6.836) 28.911 2.008 ( -39.320 -21.713 2.243) 44.973 2.431 ( -1.239 -10.834 -3.870) 11.571 2.741 ( 6.238 -0.978 0.594) 6.343 2.907 ( 1.612 -6.846 -0.184) 7.035 3.044 ( 4.110 -7.808 -0.542) 8.841 3.249 ( -5.799 -4.022 0.707) 7.093 3.555 ( 0.151 -9.940 3.688) 10.603 3.764 ( 0.340 -6.917 -1.934) 7.190 4.068 ( -2.007 -1.919 7.334) 7.842 4.161 ( 2.686 -11.880 -0.208) 12.181 4.352 ( -4.693 -10.916 -2.903) 12.232 4.443 ( 9.130 -12.972 -0.095) 15.863 5.050 ( 7.152 0.355 -0.167) 7.163 5.294 ( 3.456 -0.527 -3.136) 4.696 5.459 ( 9.909 -3.736 0.664) 10.611 5.770 ( 3.638 1.324 -4.943) 6.279 6.790 ( -6.608 7.626 13.473) 16.832 7.322 ( 12.137 4.261 0.029) 12.863 8.120 ( 6.277 27.399 5.566) 28.654 8.310 ( -4.263 12.760 5.185) 14.418 8.886 ( -2.747 -5.183 -0.789) 5.919 9.002 ( -0.774 -5.284 -6.830) 8.670 9.810 ( -2.044 -13.657 -2.175) 13.979 10.387 ( -1.803 5.060 -6.563) 8.481 10.420 ( 2.044 11.460 -0.033) 11.641 10.851 ( -5.679 -3.913 -3.585) 7.773 11.013 ( 17.578 1.024 14.756) 22.973 11.566 ( 3.176 6.614 0.268) 7.342 15.347 ( -27.708 14.249 -12.008) 33.391 15.440 ( -11.564 4.578 2.144) 12.621 16.696 ( -19.159 14.472 -5.622) 24.660 16.990 ( -6.080 3.979 -0.366) 7.276 20.729 ( 0.073 -15.714 1.726) 15.809 21.418 ( 10.930 -40.905 -15.811) 45.196 ======================= Grid point 486 (228/322) ======================= q-point: (-0.08 -0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( -8.244 -10.656 14.497) 19.791 1.595 ( -17.301 -19.481 6.168) 26.775 2.368 ( -17.560 -25.270 -4.341) 31.077 2.681 ( -1.131 -15.385 0.319) 15.429 2.810 ( 2.702 -3.586 -0.203) 4.494 3.066 ( 0.301 -9.051 0.501) 9.070 3.228 ( 0.996 -8.637 -0.688) 8.721 3.348 ( -7.545 -9.728 -0.080) 12.312 3.673 ( 0.793 -0.798 0.155) 1.136 3.858 ( -1.867 -3.964 -3.171) 5.409 4.129 ( 4.257 -0.710 9.350) 10.298 4.258 ( -0.702 -2.801 -1.828) 3.418 4.633 ( -6.417 -11.220 1.347) 12.996 4.847 ( 12.164 -12.197 2.361) 17.387 5.179 ( 5.897 -13.768 -2.930) 15.262 5.357 ( -1.047 -7.968 -2.524) 8.423 5.556 ( 2.695 -3.093 -2.305) 4.706 5.995 ( 7.020 -23.764 -3.971) 25.095 6.609 ( 1.590 9.833 11.155) 14.955 7.230 ( 10.962 12.199 -1.282) 16.451 7.610 ( 0.795 23.853 1.660) 23.924 8.065 ( -7.231 9.740 6.889) 13.950 8.816 ( 1.862 6.768 -4.985) 8.609 9.216 ( -2.139 -11.019 -1.046) 11.273 9.904 ( -5.307 4.095 0.306) 6.711 10.183 ( 1.909 11.353 -4.147) 12.237 10.275 ( -2.414 3.156 -0.791) 4.051 10.871 ( -5.464 -3.501 -4.366) 7.822 11.201 ( 10.947 -7.136 9.518) 16.166 11.476 ( 2.490 0.442 1.476) 2.928 15.025 ( -17.641 1.759 -3.589) 18.088 15.310 ( -8.362 3.789 2.777) 9.591 16.441 ( -7.179 5.545 0.288) 9.076 16.869 ( -4.705 4.675 -0.255) 6.638 21.111 ( -0.227 -20.909 3.474) 21.197 22.042 ( 9.915 -17.406 -16.381) 25.876 ======================= Grid point 498 (229/322) ======================= q-point: (-0.15 -0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.938 ( -22.087 -0.000 10.513) 24.462 1.080 ( -15.774 -0.000 17.876) 23.840 1.542 ( -39.763 -0.000 11.467) 41.383 2.283 ( -1.782 -0.000 -6.122) 6.377 2.776 ( 4.971 0.000 -0.926) 5.056 2.832 ( 1.315 0.000 0.245) 1.338 2.984 ( 4.402 0.000 -0.832) 4.480 3.177 ( -6.784 -0.000 1.508) 6.950 3.429 ( -0.206 -0.000 5.133) 5.137 3.646 ( -0.544 -0.000 -3.024) 3.073 3.940 ( -6.407 -0.000 -4.331) 7.734 4.056 ( -0.631 -0.000 8.540) 8.564 4.266 ( -1.094 -0.000 -4.664) 4.791 4.421 ( 13.728 0.000 1.609) 13.822 5.123 ( 12.370 0.000 3.417) 12.833 5.288 ( -1.417 -0.000 -3.640) 3.906 5.484 ( 8.254 0.000 0.996) 8.314 5.816 ( 0.902 0.000 -6.318) 6.383 6.834 ( -8.275 -0.000 12.912) 15.337 7.441 ( 13.074 0.000 0.480) 13.083 8.497 ( 10.287 0.000 9.337) 13.892 8.518 ( -9.291 -0.000 -0.007) 9.291 8.701 ( -1.742 -0.000 1.814) 2.516 8.996 ( 0.417 0.000 -10.852) 10.860 9.598 ( -0.395 -0.000 0.656) 0.766 10.410 ( -4.297 -0.000 -10.711) 11.541 10.564 ( 0.286 0.000 -0.840) 0.887 10.756 ( -2.976 -0.000 -2.473) 3.869 11.233 ( 24.179 0.000 9.554) 25.998 11.688 ( 8.486 0.000 5.393) 10.055 15.321 ( -40.517 -0.000 -25.044) 47.632 15.424 ( -11.226 -0.000 3.761) 11.839 16.738 ( -26.270 -0.000 -12.902) 29.267 16.999 ( -6.618 -0.000 -0.900) 6.679 20.550 ( 0.023 0.000 0.090) 0.093 20.810 ( 0.007 0.000 -0.067) 0.067 ======================= Grid point 499 (230/322) ======================= q-point: (-0.08 -0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.106 ( -17.629 -16.136 11.352) 26.458 1.162 ( -8.884 -14.672 16.663) 23.914 1.641 ( -23.627 -28.293 8.236) 37.770 2.404 ( -0.926 -12.016 -4.537) 12.877 2.787 ( 1.893 -0.605 -1.134) 2.288 2.921 ( 0.792 -6.292 -0.430) 6.356 3.070 ( 0.382 -6.139 -1.896) 6.437 3.180 ( -5.601 -4.101 1.764) 7.163 3.567 ( 0.274 -9.637 2.930) 10.076 3.761 ( -0.183 -5.699 -4.596) 7.324 4.056 ( -2.275 -10.427 3.662) 11.283 4.173 ( -0.163 -12.139 -0.596) 12.155 4.310 ( 0.278 -6.590 -1.209) 6.706 4.561 ( 8.842 -10.232 -2.160) 13.695 5.188 ( 14.431 2.335 3.190) 14.963 5.281 ( -3.254 -1.706 -2.721) 4.572 5.547 ( 4.909 -1.284 -0.327) 5.084 5.762 ( -2.788 -1.069 -4.105) 5.076 6.760 ( -4.743 4.912 11.889) 13.711 7.459 ( 10.378 5.668 0.225) 11.827 8.181 ( 1.627 27.366 -0.729) 27.424 8.273 ( -5.608 15.003 9.088) 18.415 8.851 ( -2.709 -6.945 -0.544) 7.474 9.003 ( 4.441 -5.040 -4.523) 8.098 9.779 ( -2.089 -11.296 -1.858) 11.637 10.314 ( -7.359 3.440 -8.733) 11.927 10.436 ( 0.898 11.065 -0.906) 11.138 10.746 ( -9.238 -1.438 -2.962) 9.808 11.277 ( 18.494 5.024 12.631) 22.952 11.611 ( 2.434 8.935 3.366) 9.854 14.952 ( -26.057 3.821 -6.707) 27.176 15.333 ( -10.090 3.135 3.016) 10.988 16.507 ( -11.019 5.816 -0.692) 12.478 16.925 ( -4.541 3.435 -0.335) 5.704 20.734 ( -0.111 -15.934 1.952) 16.054 21.482 ( 9.052 -43.440 -20.879) 49.040 ======================= Grid point 512 (231/322) ======================= q-point: (-0.08 -0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.760 ( -13.382 -0.000 14.137) 19.466 0.886 ( -22.144 -0.000 15.980) 27.308 1.307 ( -10.057 -0.000 24.910) 26.864 2.248 ( -0.638 -0.000 -7.129) 7.157 2.795 ( 0.050 0.000 -5.560) 5.560 2.840 ( -0.263 -0.000 1.433) 1.457 3.020 ( 2.272 0.000 -1.274) 2.605 3.118 ( -3.846 -0.000 3.810) 5.414 3.438 ( -0.724 -0.000 4.294) 4.355 3.637 ( 0.511 0.000 -2.520) 2.571 3.821 ( -9.371 -0.000 -6.566) 11.442 4.076 ( 0.069 0.000 4.823) 4.824 4.276 ( 4.001 0.000 -1.425) 4.247 4.552 ( 5.610 0.000 -2.400) 6.102 5.230 ( -4.370 -0.000 -3.305) 5.479 5.321 ( 17.259 0.000 4.498) 17.835 5.553 ( 3.264 0.000 -0.196) 3.269 5.770 ( -4.974 -0.000 -4.811) 6.920 6.798 ( -4.634 -0.000 12.147) 13.001 7.575 ( 8.677 0.000 0.381) 8.686 8.418 ( -6.884 -0.000 -0.003) 6.884 8.555 ( -5.574 -0.000 -0.767) 5.627 8.687 ( -1.736 -0.000 2.244) 2.837 9.010 ( 7.508 0.000 -3.799) 8.415 9.599 ( 0.174 0.000 0.866) 0.883 10.269 ( -14.552 -0.000 -10.707) 18.066 10.563 ( 0.031 0.000 -0.954) 0.955 10.687 ( -5.500 -0.000 -2.206) 5.926 11.507 ( 18.111 0.000 -0.203) 18.112 11.805 ( 1.972 0.000 3.938) 4.404 14.829 ( -17.319 -0.000 -2.101) 17.446 15.307 ( -11.238 -0.000 2.367) 11.484 16.501 ( -10.612 -0.000 -0.636) 10.631 16.937 ( -3.787 -0.000 -0.512) 3.822 20.551 ( -0.018 -0.000 0.080) 0.082 20.809 ( 0.012 0.000 -0.067) 0.068 ======================= Grid point 513 (232/322) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.959 ( 0.521 0.000 6.545) 6.566 1.080 ( 2.759 0.000 6.997) 7.521 1.774 ( 1.977 0.000 11.816) 11.980 2.097 ( 0.274 0.000 -4.122) 4.131 2.605 ( -0.766 -0.000 -4.962) 5.021 2.878 ( -0.499 -0.000 1.634) 1.709 2.994 ( -0.131 -0.000 -1.421) 1.427 3.190 ( -0.939 -0.000 1.886) 2.107 3.516 ( -1.876 -0.000 3.796) 4.234 3.590 ( 2.003 0.000 -3.121) 3.708 3.608 ( -2.748 -0.000 -2.499) 3.714 4.111 ( -0.458 -0.000 0.309) 0.553 4.319 ( 1.034 0.000 -0.939) 1.396 4.480 ( -2.415 -0.000 0.073) 2.416 5.206 ( 0.454 0.000 0.264) 0.525 5.481 ( 2.434 0.000 -0.088) 2.436 5.533 ( -1.687 -0.000 -0.904) 1.914 5.682 ( 1.330 0.000 -1.450) 1.968 6.974 ( -2.541 -0.000 5.750) 6.286 7.633 ( -0.418 -0.000 0.189) 0.459 8.375 ( 0.193 0.000 -0.028) 0.195 8.419 ( -6.285 -0.000 0.910) 6.350 8.727 ( -0.887 -0.000 1.912) 2.108 9.052 ( 5.355 0.000 -2.783) 6.035 9.621 ( 0.261 0.000 0.418) 0.493 10.010 ( -4.331 -0.000 -1.180) 4.489 10.544 ( -0.088 -0.000 -0.449) 0.458 10.618 ( -0.230 -0.000 -0.778) 0.811 11.640 ( -4.605 -0.000 0.370) 4.619 11.724 ( 1.541 0.000 0.186) 1.552 15.061 ( 10.233 0.000 0.192) 10.235 15.191 ( 0.442 0.000 -0.176) 0.476 16.482 ( 1.682 0.000 0.340) 1.716 16.901 ( -0.275 -0.000 -0.233) 0.360 20.552 ( -0.028 -0.000 0.036) 0.045 20.808 ( 0.008 0.000 -0.030) 0.031 ======================= Grid point 514 (233/322) ======================= q-point: ( 0.08 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( 7.535 -14.484 3.647) 16.729 1.392 ( 8.240 -28.953 5.221) 30.552 1.776 ( -0.520 -0.766 3.234) 3.364 2.323 ( -0.495 -18.382 -0.928) 18.412 2.665 ( 6.923 -4.454 -2.999) 8.761 2.925 ( -0.449 -5.170 1.327) 5.356 3.004 ( -0.194 -0.681 -1.033) 1.252 3.187 ( -2.018 -3.067 2.625) 4.513 3.541 ( -1.138 -4.643 -1.457) 4.997 3.665 ( -1.364 -8.233 2.326) 8.664 4.022 ( 0.170 -28.244 -2.484) 28.354 4.155 ( -1.050 -3.921 0.767) 4.131 4.412 ( -6.277 -13.621 -1.412) 15.064 4.484 ( 5.523 -1.607 1.997) 6.089 5.189 ( -3.812 0.529 -0.398) 3.869 5.483 ( -2.000 0.030 -1.490) 2.494 5.577 ( 1.048 5.326 -0.361) 5.440 5.613 ( 1.022 -5.675 -0.486) 5.787 6.911 ( -3.715 4.828 6.120) 8.636 7.548 ( -5.200 6.809 0.202) 8.569 8.116 ( -3.782 19.566 1.947) 20.023 8.305 ( 2.854 11.494 1.403) 11.926 8.863 ( -1.193 -9.788 3.875) 10.594 9.047 ( 5.322 1.725 -7.226) 9.139 9.718 ( -0.312 -6.904 0.057) 6.911 10.011 ( -1.082 -2.104 1.247) 2.674 10.420 ( -0.308 11.004 -0.217) 11.010 10.626 ( 2.080 -1.333 -0.262) 2.485 11.528 ( -15.830 2.027 2.974) 16.234 11.719 ( 10.775 5.585 -0.507) 12.147 15.002 ( -6.878 2.165 -3.003) 7.811 15.220 ( 20.217 5.842 0.165) 21.045 16.458 ( 4.390 4.075 -0.241) 5.995 16.875 ( 1.563 2.733 -0.048) 3.148 20.778 ( -0.622 -19.653 1.455) 19.717 21.191 ( 0.169 -31.494 -6.105) 32.081 ======================= Grid point 515 (234/322) ======================= q-point: ( 0.15 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 10.536 -18.025 0.967) 20.901 1.743 ( -0.064 -1.535 7.168) 7.331 2.072 ( 7.161 -25.913 -4.572) 27.270 2.662 ( -3.045 -15.448 0.156) 15.746 2.804 ( 3.968 -5.486 -0.802) 6.818 3.038 ( 0.478 -4.102 -0.014) 4.130 3.115 ( 5.908 -11.600 0.778) 13.041 3.302 ( 0.080 -8.251 2.598) 8.651 3.668 ( -2.610 -3.823 0.249) 4.636 3.711 ( 0.365 -2.147 0.899) 2.356 4.220 ( -2.554 -3.963 0.817) 4.785 4.386 ( -1.803 -0.859 -0.893) 2.188 4.584 ( 3.326 -16.103 0.545) 16.452 4.960 ( 0.293 -25.891 1.592) 25.942 5.184 ( -4.601 -9.544 -1.799) 10.747 5.413 ( -4.375 2.355 -2.398) 5.517 5.522 ( 0.896 -1.502 -0.238) 1.765 5.910 ( -0.899 -22.438 0.224) 22.457 6.785 ( -7.101 4.872 5.508) 10.222 7.312 ( -8.584 12.788 0.078) 15.402 7.657 ( -2.238 23.404 -0.019) 23.511 8.081 ( 7.308 12.740 2.363) 14.876 8.912 ( 2.170 5.541 -3.395) 6.851 9.129 ( 1.079 -7.648 -1.995) 7.977 9.777 ( -2.239 1.356 3.837) 4.645 10.053 ( 1.848 4.292 -0.883) 4.756 10.215 ( 1.170 3.143 0.370) 3.374 10.702 ( 2.591 -2.792 0.143) 3.812 11.458 ( -8.425 -3.981 1.497) 9.438 11.647 ( 2.043 4.121 -0.752) 4.661 14.949 ( -0.850 0.454 -2.077) 2.290 15.223 ( 14.047 3.256 0.829) 14.443 16.393 ( 3.965 4.364 -0.019) 5.896 16.821 ( 2.861 3.748 -0.062) 4.715 21.199 ( -1.475 -21.170 2.972) 21.429 21.756 ( -0.721 -23.605 -7.102) 24.661 ======================= Grid point 516 (235/322) ======================= q-point: ( 0.23 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( 2.596 2.598 3.208) 4.877 2.057 ( 8.677 -15.851 -0.182) 18.071 2.510 ( 3.585 -13.160 0.202) 13.641 2.873 ( 0.691 -8.445 0.069) 8.473 2.978 ( 0.365 -11.448 1.013) 11.498 3.171 ( 2.321 -8.014 1.347) 8.452 3.339 ( -1.057 -7.935 1.092) 8.079 3.548 ( 6.734 -12.428 0.861) 14.162 3.577 ( -1.465 3.966 -1.121) 4.374 3.882 ( 3.245 -8.031 0.310) 8.668 4.269 ( -2.664 -1.698 -0.355) 3.179 4.348 ( 0.657 1.434 0.998) 1.867 4.794 ( -1.138 -3.495 -0.064) 3.676 5.037 ( -2.379 1.853 -0.825) 3.126 5.409 ( -3.606 -4.036 -1.798) 5.703 5.513 ( -0.610 -5.900 -1.385) 6.091 5.826 ( -0.761 -29.212 0.986) 29.238 6.332 ( -5.038 -11.095 3.749) 12.749 6.763 ( -12.737 -15.251 0.194) 19.871 6.970 ( -10.547 13.378 -0.407) 17.041 7.242 ( 5.709 18.335 -0.072) 19.203 7.945 ( 10.781 6.167 1.824) 12.553 8.750 ( -1.267 9.489 -6.343) 11.484 9.240 ( 2.898 -1.786 1.944) 3.920 9.678 ( -3.176 6.944 7.535) 10.727 9.856 ( 0.116 10.004 -2.726) 10.370 10.305 ( 4.946 -4.219 -0.862) 6.558 10.664 ( 1.038 7.540 -0.551) 7.631 11.602 ( -4.799 -7.452 -1.908) 9.066 11.680 ( -2.452 -14.405 1.520) 14.691 14.960 ( 2.651 -0.984 -0.266) 2.840 15.268 ( 9.685 -0.454 0.054) 9.696 16.349 ( 3.753 2.035 0.244) 4.276 16.772 ( 3.472 2.979 -0.408) 4.593 21.565 ( -1.347 -16.023 2.187) 16.227 22.064 ( -0.801 -9.628 -3.879) 10.411 ======================= Grid point 517 (236/322) ======================= q-point: ( 0.31 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 5.638 9.645 3.537) 11.718 2.362 ( 5.898 -10.222 0.348) 11.806 2.624 ( -0.239 -0.001 2.028) 2.042 3.053 ( 0.086 -7.027 0.852) 7.079 3.228 ( 3.910 -11.993 2.683) 12.897 3.348 ( 0.855 -6.947 0.917) 7.059 3.444 ( 0.002 -3.383 0.280) 3.395 3.532 ( -4.218 -4.916 0.447) 6.493 3.838 ( 5.799 -10.178 -0.099) 11.714 4.025 ( 9.124 -2.675 -1.802) 9.677 4.261 ( -2.119 -0.622 -2.272) 3.168 4.363 ( 1.322 -0.922 3.074) 3.470 4.765 ( -6.817 1.992 -4.761) 8.550 4.986 ( -0.118 2.436 -0.083) 2.440 5.467 ( -3.513 -2.993 0.364) 4.630 5.616 ( -2.163 -6.268 -1.407) 6.779 6.149 ( -10.358 -1.499 0.560) 10.481 6.285 ( -10.433 3.154 1.110) 10.955 6.734 ( -0.664 0.144 0.267) 0.730 6.977 ( 7.677 9.788 1.974) 12.596 7.276 ( -7.011 -26.780 -1.245) 27.710 7.975 ( 14.062 -1.585 1.352) 14.216 8.532 ( -4.652 9.236 -5.707) 11.812 9.234 ( 2.421 4.303 4.484) 6.670 9.522 ( -3.090 7.667 7.648) 11.262 9.703 ( 0.352 5.658 -4.470) 7.219 10.389 ( 2.963 -3.087 -0.250) 4.286 10.491 ( 0.798 8.431 -1.586) 8.616 11.754 ( -2.173 -11.497 -1.473) 11.793 12.033 ( -4.179 -19.220 0.432) 19.673 15.014 ( 3.818 -2.325 0.979) 4.576 15.337 ( 6.540 -1.279 -0.898) 6.724 16.368 ( 4.202 -1.518 0.332) 4.481 16.744 ( 3.180 1.823 -0.934) 3.782 21.821 ( -0.697 -10.377 1.045) 10.453 22.151 ( -0.077 -0.881 -1.681) 1.899 ======================= Grid point 518 (237/322) ======================= q-point: ( 0.38 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( 6.420 15.118 4.657) 17.072 2.491 ( 0.525 0.398 2.389) 2.478 2.638 ( 4.347 -2.513 1.008) 5.121 3.125 ( -2.942 -1.852 0.490) 3.511 3.419 ( -4.997 -3.342 -1.064) 6.105 3.455 ( 2.732 -7.070 3.677) 8.425 3.563 ( 5.071 -6.287 2.161) 8.361 3.668 ( -1.950 -8.461 0.973) 8.737 3.990 ( 3.456 -2.502 -0.432) 4.288 4.105 ( 7.689 -1.206 0.187) 7.785 4.282 ( 0.950 -1.787 -3.546) 4.083 4.389 ( 1.938 -0.143 2.941) 3.525 4.661 ( -7.789 2.697 -7.285) 11.000 4.939 ( -1.650 1.580 -1.204) 2.582 5.483 ( -1.015 -0.345 1.680) 1.993 5.716 ( -2.858 -5.100 -1.662) 6.078 5.973 ( -17.086 5.073 -1.481) 17.885 6.168 ( -0.278 4.950 0.792) 5.021 6.772 ( 3.574 0.959 1.544) 4.009 6.897 ( 3.490 2.266 1.383) 4.385 7.670 ( -3.200 -15.422 -0.458) 15.757 8.150 ( 14.136 -3.565 -0.796) 14.600 8.364 ( -5.643 0.251 -1.924) 5.967 9.125 ( -1.877 7.795 6.252) 10.167 9.371 ( -2.001 6.731 5.130) 8.696 9.579 ( 0.762 6.943 -4.984) 8.581 10.379 ( 0.412 2.790 -1.336) 3.121 10.505 ( 0.978 -7.289 -0.001) 7.355 11.984 ( 0.528 -11.120 -2.241) 11.356 12.334 ( -4.267 -13.115 0.249) 13.794 15.092 ( 3.500 -2.945 1.660) 4.866 15.381 ( 3.541 -0.295 -1.279) 3.777 16.449 ( 4.127 -3.668 0.027) 5.521 16.726 ( 1.885 1.517 -1.236) 2.717 21.976 ( -0.116 -5.608 0.115) 5.610 22.129 ( 0.377 2.341 -0.402) 2.405 ======================= Grid point 519 (238/322) ======================= q-point: ( 0.46 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( 2.973 7.997 4.471) 9.632 2.455 ( -0.680 1.486 2.871) 3.304 2.722 ( 3.206 -1.908 0.452) 3.758 3.123 ( -1.796 0.011 -0.026) 1.796 3.437 ( -5.318 -1.556 0.824) 5.602 3.555 ( 2.525 -1.853 0.985) 3.283 3.707 ( 3.308 -4.036 3.743) 6.422 3.795 ( -0.641 -4.248 -0.969) 4.404 4.014 ( 1.770 0.484 -0.984) 2.082 4.167 ( 3.860 -1.326 2.527) 4.801 4.308 ( 3.204 0.012 -0.594) 3.259 4.395 ( -1.378 0.374 -0.712) 1.596 4.560 ( -6.136 2.129 -4.925) 8.151 4.905 ( -0.705 0.768 -2.886) 3.069 5.487 ( 1.776 0.317 1.585) 2.402 5.754 ( -4.477 -0.793 -1.704) 4.856 5.837 ( -4.114 1.370 -0.437) 4.358 6.104 ( 0.520 1.654 0.554) 1.820 6.758 ( 0.903 1.169 1.254) 1.937 6.889 ( 1.039 0.222 0.710) 1.278 7.853 ( -0.498 -4.515 -0.270) 4.551 8.133 ( -0.694 2.761 -3.076) 4.191 8.575 ( 8.246 -13.903 2.457) 16.350 8.912 ( -6.638 11.724 5.019) 14.378 9.274 ( -0.777 2.334 2.717) 3.665 9.455 ( 0.618 4.277 -3.132) 5.337 10.363 ( 0.304 -0.318 -1.433) 1.499 10.637 ( 0.263 -4.183 -0.068) 4.192 12.144 ( 0.372 -4.241 -2.271) 4.825 12.494 ( -1.261 -4.869 -0.455) 5.051 15.163 ( 1.580 -2.093 1.396) 2.971 15.388 ( 0.966 0.693 -0.874) 1.476 16.534 ( 2.041 -2.246 -0.241) 3.045 16.701 ( 0.413 1.312 -1.054) 1.733 22.048 ( 0.122 -1.775 -0.292) 1.803 22.087 ( 0.126 1.438 0.236) 1.463 ======================= Grid point 520 (239/322) ======================= q-point: (-0.46 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -3.658 -9.454 2.533) 10.449 2.462 ( -0.899 -2.235 2.239) 3.288 2.725 ( -3.014 1.790 0.107) 3.507 3.123 ( 3.931 0.563 -0.027) 3.972 3.419 ( -3.992 0.890 2.174) 4.632 3.573 ( 1.972 1.282 -0.580) 2.423 3.746 ( 1.300 2.200 1.995) 3.242 3.801 ( 0.152 3.007 -3.393) 4.536 4.007 ( -2.183 -0.074 -0.230) 2.197 4.199 ( 1.568 0.521 0.328) 1.684 4.331 ( -10.612 2.251 -3.165) 11.301 4.351 ( 6.349 -2.021 3.228) 7.403 4.504 ( -1.445 0.915 0.200) 1.722 4.894 ( 2.862 0.562 -1.880) 3.470 5.495 ( 2.929 0.557 0.866) 3.105 5.747 ( 0.428 -0.180 -1.028) 1.128 5.823 ( 4.595 0.290 0.918) 4.695 6.109 ( 1.270 -1.493 0.039) 1.960 6.758 ( -1.347 -1.116 1.249) 2.149 6.901 ( -1.486 -1.477 -0.352) 2.124 7.854 ( 0.086 4.167 -0.313) 4.179 8.114 ( -2.181 -2.005 -1.238) 3.211 8.575 ( -7.080 13.644 2.378) 15.554 8.952 ( 8.598 -13.572 1.587) 16.144 9.284 ( -1.730 -3.814 1.980) 4.633 9.428 ( -0.056 -1.637 -1.124) 1.986 10.365 ( 0.435 0.206 -1.564) 1.636 10.640 ( -0.135 3.877 -0.344) 3.894 12.131 ( -1.325 4.845 -1.092) 5.140 12.510 ( 3.229 3.887 -1.892) 5.396 15.183 ( -1.741 0.306 -0.442) 1.822 15.371 ( -0.839 0.901 0.693) 1.413 16.531 ( -2.026 2.417 0.005) 3.154 16.696 ( 0.028 -0.815 -0.606) 1.016 22.043 ( -0.110 1.647 0.179) 1.661 22.090 ( -0.147 -1.126 -0.042) 1.136 ======================= Grid point 521 (240/322) ======================= q-point: (-0.38 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( -7.953 -14.803 1.304) 16.854 2.506 ( -1.997 -0.164 0.869) 2.184 2.642 ( -4.467 2.241 0.674) 5.043 3.131 ( 5.397 2.056 -0.105) 5.776 3.352 ( -5.341 3.908 3.708) 7.586 3.532 ( 1.979 3.556 -1.966) 4.519 3.642 ( -1.577 7.615 -4.407) 8.938 3.692 ( 2.553 7.657 -2.086) 8.337 3.991 ( -3.909 0.275 -0.327) 3.933 4.137 ( -10.254 4.747 -3.410) 11.803 4.216 ( -1.669 2.735 2.795) 4.251 4.446 ( 0.856 -1.856 -2.009) 2.866 4.508 ( 5.041 -2.054 7.149) 8.986 4.914 ( 4.478 -0.456 0.862) 4.583 5.500 ( 4.431 1.432 0.129) 4.659 5.706 ( -0.310 3.779 -0.751) 3.865 5.943 ( 17.216 -5.103 1.389) 18.010 6.177 ( 1.195 -4.763 -0.081) 4.911 6.772 ( -3.084 -0.401 1.456) 3.434 6.927 ( -4.258 -3.162 -1.253) 5.449 7.674 ( 2.200 14.997 -0.865) 15.182 8.130 ( -12.850 0.534 0.529) 12.872 8.339 ( 4.193 4.072 0.989) 5.928 9.206 ( 1.701 -8.006 -1.109) 8.259 9.422 ( 0.473 -9.480 3.642) 10.167 9.502 ( 0.177 -5.780 -1.511) 5.977 10.370 ( 0.083 -0.962 -0.455) 1.068 10.520 ( -0.728 5.764 -1.428) 5.983 11.955 ( -0.782 11.472 0.422) 11.507 12.367 ( 5.223 12.819 -2.815) 14.125 15.132 ( -4.488 2.349 -2.288) 5.558 15.345 ( -2.767 1.008 2.309) 3.742 16.447 ( -4.019 3.511 0.225) 5.341 16.714 ( -1.417 -1.234 -0.053) 1.880 21.979 ( 0.071 5.251 -0.171) 5.254 22.122 ( -0.207 -2.070 0.183) 2.088 ======================= Grid point 522 (241/322) ======================= q-point: (-0.31 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( -7.651 -7.692 2.593) 11.154 2.347 ( -6.393 11.947 1.695) 13.656 2.648 ( -0.867 -0.990 -0.178) 1.327 3.070 ( 1.690 7.288 -0.992) 7.547 3.209 ( -7.624 7.285 3.337) 11.060 3.446 ( -0.004 9.884 -6.974) 12.097 3.468 ( 1.220 3.899 -1.502) 4.353 3.561 ( 2.962 4.973 -2.604) 6.347 3.851 ( -8.316 11.294 -1.704) 14.129 3.997 ( -7.643 1.934 0.722) 7.917 4.201 ( 2.524 0.152 3.519) 4.333 4.416 ( -2.619 2.211 -1.522) 3.750 4.650 ( 7.887 -5.068 6.240) 11.262 4.959 ( 3.120 -1.267 2.084) 3.960 5.472 ( 5.281 4.698 -0.207) 7.071 5.614 ( 0.359 5.064 -1.186) 5.214 6.149 ( 11.352 -1.069 0.532) 11.414 6.304 ( 9.196 -4.847 -0.707) 10.419 6.722 ( 0.335 1.229 1.549) 2.006 7.004 ( -7.163 -8.412 -0.536) 11.062 7.278 ( 5.367 26.351 -1.399) 26.929 7.980 ( -13.895 1.811 0.797) 14.036 8.453 ( 5.872 -7.789 1.814) 9.922 9.308 ( -3.727 -3.606 -2.468) 5.743 9.592 ( -1.564 -7.555 6.576) 10.138 9.664 ( 3.310 -9.224 -6.419) 11.715 10.349 ( -1.942 2.667 2.605) 4.204 10.527 ( -0.780 -7.487 -3.920) 8.487 11.713 ( 2.251 12.480 2.263) 12.882 12.066 ( 4.396 19.434 -2.507) 20.082 15.046 ( -5.375 2.722 -2.286) 6.444 15.303 ( -5.252 1.119 2.463) 5.908 16.370 ( -4.241 1.448 0.161) 4.484 16.731 ( -2.647 -1.914 0.282) 3.279 21.826 ( 0.133 10.452 0.597) 10.470 22.149 ( 0.976 0.281 -1.499) 1.811 ======================= Grid point 523 (242/322) ======================= q-point: (-0.23 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -3.987 0.051 6.275) 7.435 2.012 ( -8.355 17.477 4.025) 19.785 2.549 ( -4.673 12.030 -3.192) 13.294 2.895 ( -0.737 7.413 -1.596) 7.619 2.986 ( -2.196 12.355 0.203) 12.551 3.233 ( -1.551 9.721 -4.529) 10.836 3.353 ( -0.074 8.513 -0.383) 8.522 3.537 ( -9.175 10.138 1.278) 13.733 3.596 ( 2.379 -2.507 -2.339) 4.173 3.893 ( -2.782 5.987 -0.970) 6.673 4.243 ( 3.314 -1.627 2.613) 4.523 4.346 ( -1.257 3.118 1.102) 3.538 4.760 ( 1.412 0.056 3.377) 3.661 5.007 ( 5.126 -1.415 1.857) 5.633 5.385 ( 4.700 6.271 0.219) 7.840 5.511 ( -0.172 5.899 -1.097) 6.003 5.856 ( -0.033 28.139 -1.835) 28.199 6.402 ( 2.370 10.516 -2.946) 11.176 6.737 ( 12.584 12.298 2.844) 17.824 6.974 ( 11.385 -12.930 -0.868) 17.250 7.233 ( -6.421 -16.909 0.829) 18.106 7.948 ( -11.145 -5.913 1.555) 12.712 8.656 ( 4.720 -8.603 2.424) 10.108 9.293 ( -3.854 2.630 -2.740) 5.411 9.758 ( -2.485 -8.572 2.494) 9.267 9.857 ( 1.878 -10.525 -5.581) 12.060 10.282 ( -3.696 3.052 1.345) 4.978 10.692 ( -1.664 -8.106 -3.411) 8.951 11.538 ( 5.828 7.911 4.373) 10.755 11.702 ( 2.523 16.419 -0.593) 16.623 14.964 ( -4.523 2.319 -0.661) 5.126 15.255 ( -7.946 -0.185 1.330) 8.058 16.350 ( -3.838 -1.811 0.201) 4.249 16.765 ( -3.059 -3.261 0.218) 4.476 21.565 ( 0.204 16.339 2.129) 16.478 22.080 ( 2.535 8.403 -5.302) 10.254 ======================= Grid point 524 (243/322) ======================= q-point: (-0.15 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( -7.731 18.770 6.758) 21.395 1.675 ( -1.165 4.569 11.431) 12.365 2.107 ( -7.562 25.694 -5.662) 27.375 2.681 ( 1.849 17.251 -0.609) 17.361 2.800 ( -2.611 4.189 -0.931) 5.024 3.049 ( -0.591 7.518 -1.346) 7.661 3.134 ( -6.653 8.933 -1.165) 11.199 3.321 ( -2.311 7.486 0.940) 7.891 3.679 ( 1.506 0.388 -0.586) 1.662 3.746 ( -2.520 4.272 -2.729) 5.661 4.233 ( 1.264 4.028 -0.472) 4.248 4.346 ( 4.465 -0.012 3.497) 5.671 4.584 ( -3.672 16.489 0.346) 16.897 4.970 ( 0.342 24.236 0.394) 24.242 5.188 ( 4.779 7.300 -1.948) 8.940 5.363 ( 4.859 0.469 2.305) 5.399 5.533 ( 0.262 2.113 -1.312) 2.501 5.943 ( 0.000 23.127 -3.057) 23.328 6.806 ( 2.339 -5.909 3.740) 7.374 7.321 ( 7.907 -12.747 -0.733) 15.018 7.654 ( 2.948 -25.265 0.149) 25.437 8.081 ( -8.579 -12.593 2.404) 15.426 8.834 ( 3.344 -6.129 2.947) 7.578 9.151 ( -1.207 9.470 -2.972) 9.998 9.836 ( -2.562 0.109 -1.591) 3.018 10.075 ( -2.215 -7.734 -3.345) 8.713 10.225 ( -1.902 -3.319 -0.634) 3.878 10.721 ( -3.949 3.296 -1.914) 5.488 11.470 ( 9.458 1.832 0.747) 9.663 11.582 ( -0.280 -1.965 5.392) 5.746 14.907 ( -0.529 1.596 1.992) 2.606 15.229 ( -11.198 -2.773 0.145) 11.537 16.389 ( -3.646 -3.920 0.448) 5.372 16.821 ( -2.758 -3.982 -0.063) 4.845 21.196 ( 0.146 21.260 3.177) 21.497 21.784 ( 2.969 22.939 -9.761) 25.106 ======================= Grid point 525 (244/322) ======================= q-point: (-0.08 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -4.296 14.495 7.712) 16.971 1.369 ( -6.540 29.041 7.207) 30.628 1.745 ( 1.949 2.973 6.512) 7.419 2.323 ( 0.559 18.104 -1.142) 18.149 2.681 ( -6.034 4.097 -4.231) 8.432 2.924 ( 0.098 4.714 1.052) 4.830 3.013 ( -0.824 1.544 -1.594) 2.367 3.199 ( -1.241 3.227 1.497) 3.767 3.568 ( -1.854 4.625 -3.439) 6.054 3.671 ( -0.724 8.061 1.221) 8.185 4.020 ( 1.011 27.460 -2.164) 27.563 4.164 ( -0.515 4.563 -0.053) 4.592 4.388 ( 5.692 9.583 1.614) 11.262 4.515 ( -5.290 4.850 -1.940) 7.434 5.193 ( 2.247 -0.186 -0.828) 2.402 5.445 ( 7.590 -1.172 2.209) 7.991 5.580 ( 1.007 -5.783 -0.071) 5.870 5.627 ( -3.891 7.372 -2.401) 8.675 6.925 ( -1.602 -4.832 4.944) 7.096 7.552 ( 4.538 -6.826 -0.120) 8.198 8.143 ( -0.714 -20.586 -0.841) 20.616 8.311 ( -4.414 -12.633 1.009) 13.420 8.874 ( -2.682 8.423 4.331) 9.844 8.995 ( 5.977 0.040 -3.780) 7.072 9.727 ( -0.991 7.944 -0.834) 8.049 10.058 ( -5.868 1.215 -3.568) 6.974 10.422 ( 0.066 -10.898 -0.460) 10.908 10.632 ( -2.920 1.293 -0.855) 3.306 11.562 ( 14.872 -1.711 -0.277) 14.973 11.680 ( -10.013 -8.083 3.379) 13.304 14.931 ( 11.314 -1.206 4.198) 12.128 15.220 ( -14.500 -3.411 0.047) 14.896 16.447 ( -2.706 -3.423 0.781) 4.433 16.878 ( -1.853 -2.835 -0.278) 3.398 20.778 ( -0.041 19.494 1.491) 19.551 21.203 ( 1.360 32.235 -7.357) 33.092 ======================= Grid point 527 (245/322) ======================= q-point: ( 0.08 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.042 ( 10.543 0.000 3.752) 11.190 1.263 ( 23.988 0.000 2.343) 24.102 1.775 ( -5.461 -0.000 4.274) 6.935 2.102 ( 2.560 0.000 -3.228) 4.120 2.683 ( 14.335 0.000 -1.981) 14.472 2.867 ( -2.334 -0.000 1.644) 2.855 2.977 ( -2.177 -0.000 -0.817) 2.325 3.175 ( -1.963 -0.000 2.884) 3.489 3.505 ( -1.860 -0.000 3.773) 4.207 3.589 ( -0.088 -0.000 1.484) 1.487 3.607 ( 2.511 0.000 -3.403) 4.229 4.109 ( -0.633 -0.000 0.690) 0.937 4.261 ( -6.551 -0.000 -0.463) 6.567 4.507 ( 2.987 0.000 0.975) 3.142 5.159 ( -7.357 -0.000 0.325) 7.364 5.468 ( -3.157 -0.000 -2.363) 3.944 5.553 ( 3.933 0.000 0.806) 4.015 5.668 ( -3.237 -0.000 -2.698) 4.214 6.953 ( -4.049 -0.000 7.231) 8.288 7.570 ( -9.624 -0.000 0.570) 9.641 8.353 ( -6.640 -0.000 7.045) 9.681 8.423 ( 7.250 0.000 -0.195) 7.253 8.719 ( -1.431 -0.000 2.038) 2.490 9.103 ( 5.540 0.000 -7.086) 8.994 9.625 ( 0.347 0.000 -0.015) 0.348 10.001 ( 1.937 0.000 3.525) 4.022 10.541 ( -0.142 -0.000 -0.209) 0.253 10.637 ( 3.340 0.000 -0.269) 3.351 11.432 ( -20.528 -0.000 2.696) 20.704 11.853 ( 9.153 0.000 0.492) 9.166 14.966 ( -6.504 -0.000 -4.334) 7.816 15.463 ( 27.297 0.000 -6.664) 28.098 16.562 ( 12.433 0.000 -2.952) 12.779 16.920 ( 3.530 0.000 0.070) 3.531 20.551 ( -0.058 -0.000 0.058) 0.082 20.808 ( 0.015 0.000 -0.031) 0.034 ======================= Grid point 528 (246/322) ======================= q-point: ( 0.15 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 11.731 -18.528 0.744) 21.942 1.601 ( 22.502 -17.903 5.872) 29.349 1.753 ( -1.741 -2.914 -3.856) 5.137 2.317 ( 0.825 -16.561 -1.427) 16.643 2.773 ( 7.632 -1.058 -1.001) 7.770 2.919 ( -1.613 -5.907 -0.184) 6.126 3.016 ( 3.061 -4.680 0.248) 5.598 3.184 ( 1.927 -2.955 4.392) 5.634 3.541 ( 1.623 -4.409 1.956) 5.089 3.652 ( -2.199 -7.569 2.627) 8.308 4.015 ( 0.307 -26.414 -2.016) 26.492 4.137 ( -2.688 -3.680 1.231) 4.721 4.358 ( -1.701 -14.346 0.241) 14.449 4.533 ( 0.768 -4.189 -0.195) 4.263 5.110 ( -8.645 0.244 1.051) 8.712 5.428 ( -4.490 1.684 -3.265) 5.802 5.569 ( -3.625 4.971 -1.911) 6.443 5.631 ( 1.417 -6.638 0.607) 6.815 6.881 ( -4.484 5.694 8.127) 10.890 7.444 ( -11.891 6.433 0.499) 13.529 8.080 ( -3.423 20.030 3.869) 20.685 8.364 ( 5.075 10.149 2.078) 11.535 8.870 ( 0.658 -11.044 2.659) 11.379 9.073 ( 3.478 3.523 -9.630) 10.828 9.721 ( 0.648 -6.581 0.880) 6.671 10.038 ( 3.567 -1.832 4.515) 6.039 10.414 ( -0.687 11.002 0.076) 11.023 10.673 ( 5.351 -1.596 0.381) 5.597 11.343 ( -16.443 -2.023 2.619) 16.773 11.800 ( 2.808 7.999 -1.662) 8.639 14.946 ( 1.689 -0.159 -3.029) 3.472 15.477 ( 21.040 9.859 -4.463) 23.660 16.548 ( 11.464 7.172 -2.117) 13.687 16.914 ( 4.803 2.992 0.039) 5.659 20.772 ( -1.098 -19.402 1.271) 19.475 21.171 ( -0.721 -30.164 -4.317) 30.480 ======================= Grid point 529 (247/322) ======================= q-point: ( 0.23 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 1.170 -3.330 2.012) 4.063 1.809 ( 13.736 -15.064 -0.385) 20.390 2.193 ( 14.816 -22.116 -1.144) 26.644 2.639 ( -1.172 -14.916 0.246) 14.964 2.828 ( 0.343 -3.852 0.142) 3.869 3.032 ( -1.422 -7.096 0.633) 7.265 3.187 ( 2.563 -8.179 0.632) 8.594 3.359 ( 8.918 -10.337 2.201) 13.828 3.649 ( -1.427 1.921 1.268) 2.708 3.732 ( 4.078 -7.871 2.577) 9.231 4.191 ( -2.698 -4.085 1.184) 5.037 4.355 ( -2.124 -3.138 -2.139) 4.351 4.640 ( 5.441 -14.699 1.138) 15.715 4.941 ( -5.450 -18.212 -0.039) 19.010 5.107 ( -6.752 -17.936 -1.353) 19.212 5.362 ( -2.715 -0.053 -2.086) 3.425 5.501 ( -3.945 -0.826 -0.765) 4.102 5.888 ( -3.873 -21.501 0.511) 21.853 6.704 ( -9.243 9.266 7.491) 15.080 7.180 ( -12.833 12.619 0.163) 17.999 7.652 ( 1.710 20.594 -0.107) 20.666 8.176 ( 6.693 10.924 2.546) 13.062 8.905 ( -0.623 7.346 -7.679) 10.645 9.151 ( 3.201 -9.016 0.197) 9.570 9.777 ( -0.056 2.338 5.326) 5.817 10.074 ( 1.422 8.240 0.463) 8.375 10.242 ( 3.090 -1.409 0.835) 3.497 10.745 ( 4.027 -0.539 1.057) 4.198 11.354 ( -9.469 -8.207 0.578) 12.544 11.635 ( -3.168 6.112 -2.797) 7.431 14.972 ( 6.182 -0.163 -0.644) 6.218 15.401 ( 14.994 6.867 -1.414) 16.552 16.460 ( 7.301 6.308 -0.419) 9.658 16.869 ( 5.049 4.176 -0.225) 6.557 21.187 ( -2.040 -21.222 2.508) 21.467 21.721 ( -1.887 -23.823 -4.983) 24.411 ======================= Grid point 530 (248/322) ======================= q-point: ( 0.31 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( 5.481 0.964 2.284) 6.016 2.176 ( 11.470 -13.327 -0.966) 17.610 2.561 ( 3.880 -7.917 1.978) 9.036 2.878 ( -0.077 -10.741 -0.330) 10.746 3.001 ( 2.972 -12.283 3.312) 13.065 3.196 ( 0.890 -9.220 1.393) 9.367 3.342 ( 0.788 -6.700 1.299) 6.870 3.522 ( -4.498 4.157 0.624) 6.157 3.654 ( 7.038 -11.010 -0.521) 13.078 3.966 ( 11.465 -8.719 0.007) 14.404 4.239 ( -1.856 -1.404 -0.718) 2.435 4.355 ( 0.055 -0.195 1.163) 1.181 4.758 ( -5.559 1.709 -1.325) 5.965 4.993 ( -3.406 -1.732 -2.194) 4.406 5.344 ( -6.787 -5.625 -2.966) 9.300 5.497 ( -1.372 -3.862 0.069) 4.099 5.818 ( -1.141 -30.251 1.415) 30.306 6.272 ( -7.525 -0.730 5.185) 9.168 6.583 ( -16.613 -21.664 -0.811) 27.313 6.854 ( -8.453 11.091 -0.207) 13.946 7.336 ( 9.909 15.129 0.674) 18.098 8.069 ( 8.764 4.170 1.703) 9.853 8.695 ( -4.102 10.426 -7.777) 13.638 9.296 ( 4.936 -2.060 2.679) 5.983 9.676 ( -1.242 7.720 8.124) 11.275 9.845 ( -0.731 10.409 -1.952) 10.616 10.363 ( 5.031 -3.399 -1.227) 6.195 10.677 ( 1.150 8.321 0.276) 8.405 11.530 ( -5.830 -9.080 -2.991) 11.197 11.643 ( -4.493 -14.408 1.289) 15.147 15.018 ( 7.123 -0.507 1.144) 7.232 15.388 ( 10.450 2.143 -1.305) 10.747 16.405 ( 5.441 2.680 0.200) 6.069 16.818 ( 4.512 3.567 -0.748) 5.800 21.554 ( -1.583 -16.368 1.968) 16.562 22.040 ( -1.405 -10.591 -3.002) 11.098 ======================= Grid point 531 (249/322) ======================= q-point: ( 0.38 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( 8.640 9.150 3.864) 13.164 2.446 ( 7.631 -7.414 0.601) 10.656 2.631 ( 0.348 -0.610 2.241) 2.349 3.048 ( -0.646 -5.957 -0.634) 6.025 3.265 ( -1.884 -9.563 8.395) 12.864 3.363 ( 4.149 -4.934 -3.550) 7.359 3.476 ( 2.827 -5.846 1.263) 6.615 3.486 ( -2.802 -6.744 1.416) 7.439 3.895 ( 4.504 -8.952 0.749) 10.049 4.158 ( 12.607 -0.988 -1.397) 12.723 4.232 ( -1.013 -1.813 -3.212) 3.825 4.388 ( 1.127 -1.701 3.843) 4.351 4.649 ( -9.834 2.595 -6.187) 11.905 4.957 ( -3.744 2.190 -1.922) 4.744 5.414 ( -6.509 -5.170 -1.753) 8.495 5.584 ( -2.032 -5.874 0.616) 6.246 5.969 ( -17.263 8.038 0.677) 19.055 6.223 ( -2.886 -2.978 0.936) 4.251 6.721 ( -1.387 -3.929 -0.112) 4.168 7.052 ( 1.401 -4.643 0.715) 4.902 7.247 ( 4.877 -13.842 1.531) 14.755 8.126 ( 10.331 -3.953 1.158) 11.122 8.446 ( -6.476 9.990 -5.753) 13.223 9.284 ( 3.266 6.228 4.729) 8.475 9.515 ( -1.913 8.127 7.143) 10.988 9.689 ( -0.549 5.348 -4.163) 6.800 10.415 ( 1.491 -1.899 -0.779) 2.537 10.498 ( 0.942 8.771 -1.002) 8.878 11.724 ( -1.789 -13.854 -1.870) 14.094 11.980 ( -5.105 -18.823 0.810) 19.520 15.081 ( 6.759 -1.378 2.144) 7.224 15.412 ( 6.696 0.805 -1.862) 6.997 16.424 ( 5.036 -1.309 0.236) 5.209 16.779 ( 3.129 2.653 -1.276) 4.297 21.816 ( -0.672 -10.679 1.021) 10.749 22.144 ( -0.266 -1.673 -1.547) 2.294 ======================= Grid point 532 (250/322) ======================= q-point: ( 0.46 0.08 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 7.670 16.731 4.734) 19.005 2.507 ( 0.634 2.533 3.173) 4.109 2.692 ( 3.799 -3.292 0.481) 5.050 3.111 ( 1.554 -1.389 -1.215) 2.413 3.342 ( -7.266 -3.942 4.033) 9.197 3.503 ( 2.205 -5.191 0.656) 5.678 3.624 ( 3.976 -6.715 2.455) 8.181 3.665 ( 1.607 -8.445 0.068) 8.597 4.039 ( 4.995 -1.412 -0.026) 5.191 4.153 ( 0.030 -0.195 0.768) 0.793 4.314 ( 4.767 -2.117 -0.593) 5.250 4.405 ( -1.553 1.276 -0.272) 2.028 4.551 ( -5.585 1.297 -5.246) 7.771 4.896 ( -3.639 0.541 -3.144) 4.839 5.461 ( -4.433 -3.221 -1.584) 5.704 5.684 ( -1.245 -4.005 1.123) 4.342 5.765 ( -16.301 0.583 -1.343) 16.367 6.168 ( -0.160 4.043 -0.004) 4.046 6.804 ( 0.909 -1.384 0.180) 1.666 6.988 ( 10.693 7.195 2.433) 13.116 7.645 ( -0.623 -16.691 0.493) 16.710 8.215 ( -4.539 7.518 -3.179) 9.340 8.357 ( 6.959 -12.068 1.163) 13.979 9.122 ( -1.489 11.068 5.105) 12.279 9.366 ( -1.433 6.611 4.473) 8.110 9.567 ( -0.259 6.404 -4.361) 7.752 10.381 ( 0.633 3.051 -1.251) 3.358 10.509 ( -0.266 -7.096 0.027) 7.101 11.988 ( 1.399 -11.590 -1.932) 11.832 12.281 ( -4.657 -14.211 0.239) 14.957 15.151 ( 5.316 -1.403 2.394) 5.997 15.419 ( 3.462 1.345 -1.852) 4.150 16.500 ( 4.379 -2.877 -0.143) 5.241 16.740 ( 0.998 2.431 -1.416) 2.985 21.975 ( -0.000 -5.723 0.134) 5.725 22.131 ( 0.250 2.102 -0.454) 2.165 ======================= Grid point 533 (251/322) ======================= q-point: ( 0.54 0.08 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( 2.607 11.801 3.797) 12.668 2.457 ( -0.504 1.867 3.103) 3.656 2.733 ( -1.425 0.352 0.122) 1.473 3.155 ( 7.298 -0.743 -1.094) 7.416 3.377 ( -5.648 -2.601 4.099) 7.448 3.578 ( 0.896 -1.728 -0.421) 1.992 3.755 ( 2.995 -2.992 2.855) 5.106 3.796 ( 1.655 -3.559 -2.137) 4.469 4.020 ( -0.593 2.329 -0.555) 2.466 4.196 ( 0.670 -1.499 -0.120) 1.646 4.312 ( -8.406 2.223 -2.468) 9.038 4.371 ( 4.617 0.029 2.458) 5.231 4.508 ( -2.299 0.685 -0.548) 2.461 4.894 ( 0.722 -1.272 -3.518) 3.809 5.487 ( -2.022 -1.783 -1.745) 3.211 5.704 ( -4.210 -3.468 0.367) 5.467 5.773 ( -4.659 -3.461 0.195) 5.807 6.115 ( 0.981 1.247 -0.630) 1.707 6.799 ( 3.471 1.878 0.424) 3.969 6.931 ( 6.907 4.469 1.629) 8.386 7.858 ( 1.424 -4.488 0.050) 4.709 8.078 ( -6.886 1.605 -0.707) 7.106 8.659 ( 2.593 -10.299 1.811) 10.773 8.878 ( 0.636 9.448 2.230) 9.728 9.265 ( -2.291 2.743 2.913) 4.611 9.450 ( 0.083 3.911 -2.461) 4.622 10.364 ( 0.535 -0.274 -1.384) 1.509 10.634 ( -0.600 -4.196 -0.098) 4.240 12.143 ( 0.571 -3.226 -1.168) 3.478 12.480 ( -0.862 -7.295 -1.248) 7.451 15.191 ( 2.438 0.272 1.444) 2.847 15.398 ( 1.225 1.737 -0.970) 2.337 16.558 ( 2.089 -0.052 -0.276) 2.108 16.696 ( -0.688 1.320 -1.078) 1.838 22.049 ( 0.135 -1.717 -0.282) 1.745 22.089 ( 0.082 1.590 0.211) 1.606 ======================= Grid point 534 (252/322) ======================= q-point: (-0.38 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( -3.701 -5.787 1.839) 7.111 2.460 ( -0.556 -2.104 2.305) 3.169 2.677 ( -4.333 3.091 -0.090) 5.323 3.203 ( 8.450 1.074 -0.671) 8.544 3.378 ( -4.375 0.706 4.412) 6.253 3.583 ( -0.146 1.336 -1.222) 1.816 3.756 ( 1.047 4.156 -2.538) 4.981 3.817 ( 3.116 2.611 -1.486) 4.329 3.972 ( -3.337 0.958 0.339) 3.488 4.149 ( -9.942 3.131 -4.385) 11.308 4.248 ( -0.576 0.859 2.106) 2.346 4.417 ( 2.080 -1.352 -0.711) 2.580 4.506 ( 1.713 -1.324 6.063) 6.438 4.923 ( 2.165 -0.945 -1.979) 3.082 5.511 ( 1.202 -1.280 -1.581) 2.363 5.754 ( 0.112 0.734 1.671) 1.829 5.854 ( 0.528 -9.252 0.226) 9.270 6.127 ( 1.538 -1.671 -0.978) 2.472 6.793 ( 6.136 2.296 1.146) 6.651 6.895 ( 0.811 1.275 -0.088) 1.514 7.853 ( -1.143 4.029 0.069) 4.188 8.056 ( -6.281 -1.294 0.844) 6.468 8.514 ( -3.798 11.232 0.590) 11.872 9.055 ( 8.032 -10.850 -0.037) 13.499 9.259 ( -3.779 -4.698 3.069) 6.766 9.424 ( 0.086 -1.571 -1.224) 1.993 10.367 ( 0.608 0.256 -1.567) 1.700 10.632 ( -0.865 3.981 -0.352) 4.089 12.119 ( -0.374 5.235 -0.046) 5.248 12.537 ( 2.509 2.108 -2.684) 4.236 15.165 ( -0.986 2.753 -0.594) 2.984 15.367 ( -0.128 1.751 0.723) 1.898 16.509 ( -1.760 4.248 -0.009) 4.598 16.690 ( -0.557 -0.658 -0.516) 1.005 22.043 ( -0.002 1.651 0.192) 1.662 22.088 ( -0.199 -0.944 -0.055) 0.966 ======================= Grid point 535 (253/322) ======================= q-point: (-0.31 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -6.088 -13.723 1.187) 15.060 2.493 ( -0.474 3.156 0.679) 3.263 2.596 ( -3.724 -0.655 0.977) 3.906 3.199 ( 6.085 3.695 -0.805) 7.165 3.292 ( -6.322 5.505 4.743) 9.631 3.522 ( -3.118 3.602 -1.814) 5.097 3.623 ( 1.693 8.085 -6.343) 10.415 3.729 ( 4.115 7.764 -1.775) 8.965 3.955 ( -2.104 -0.144 -0.040) 2.110 3.987 ( -11.386 6.077 -1.048) 12.949 4.238 ( 2.060 1.151 2.701) 3.587 4.418 ( -2.508 0.243 -2.786) 3.757 4.612 ( 7.053 -4.528 8.118) 11.669 4.947 ( 0.368 -1.060 -0.565) 1.256 5.542 ( 4.236 0.126 -1.232) 4.413 5.704 ( -0.956 3.671 0.964) 3.914 6.117 ( 10.414 -12.891 1.093) 16.608 6.192 ( 1.672 -4.050 -0.550) 4.415 6.760 ( 1.239 3.224 1.383) 3.721 6.893 ( -1.357 -0.581 -1.315) 1.977 7.699 ( 1.530 11.778 -0.027) 11.877 7.969 ( -12.898 5.270 0.222) 13.935 8.399 ( 4.728 -0.423 1.062) 4.864 9.202 ( -1.276 -4.365 -1.842) 4.906 9.435 ( -1.457 -9.806 6.662) 11.944 9.507 ( 2.419 -6.875 -4.188) 8.406 10.372 ( 0.399 -0.966 -0.524) 1.169 10.502 ( -1.402 6.395 -1.388) 6.693 11.957 ( 0.564 10.581 0.988) 10.641 12.408 ( 3.197 12.253 -3.149) 13.049 15.084 ( -2.671 3.732 -1.669) 4.883 15.324 ( -1.740 2.407 1.692) 3.418 16.405 ( -3.047 4.146 0.136) 5.147 16.697 ( -1.209 -0.592 -0.010) 1.346 21.979 ( 0.075 5.224 -0.117) 5.226 22.121 ( -0.129 -2.328 0.101) 2.334 ======================= Grid point 536 (254/322) ======================= q-point: (-0.23 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( -4.313 -8.771 2.752) 10.154 2.297 ( -2.871 13.553 1.646) 13.951 2.637 ( -0.884 -0.714 0.160) 1.148 3.067 ( -1.902 10.769 -0.443) 10.944 3.156 ( -2.151 6.179 2.018) 6.847 3.380 ( -4.898 7.648 -4.516) 10.143 3.514 ( 4.678 3.962 -3.973) 7.305 3.587 ( 2.341 6.843 -1.031) 7.306 3.740 ( -8.439 11.533 0.302) 14.294 3.955 ( -1.137 1.110 -0.151) 1.596 4.242 ( 2.622 -0.064 3.337) 4.244 4.381 ( -2.461 1.583 -1.559) 3.315 4.752 ( 6.286 -3.416 5.957) 9.310 4.977 ( -0.850 -2.471 0.158) 2.618 5.523 ( 4.182 4.561 -0.628) 6.220 5.614 ( -0.581 4.827 -0.230) 4.867 6.217 ( 2.006 6.205 -0.327) 6.529 6.444 ( 11.475 -7.658 0.061) 13.796 6.725 ( -0.583 -4.447 1.884) 4.864 6.924 ( -4.977 -7.012 -1.275) 8.693 7.361 ( 8.023 25.627 -0.468) 26.858 7.816 ( -13.183 -0.390 0.135) 13.189 8.526 ( 5.197 -7.426 1.775) 9.236 9.257 ( -3.635 -2.724 -2.157) 5.028 9.584 ( -3.119 -7.418 6.791) 10.530 9.684 ( 3.248 -8.375 -6.178) 10.902 10.335 ( -1.354 3.964 1.828) 4.571 10.507 ( -0.564 -7.577 -3.429) 8.336 11.749 ( 2.339 10.554 2.325) 11.057 12.096 ( 1.946 19.595 -2.504) 19.850 14.997 ( -2.278 3.121 -1.261) 4.065 15.257 ( -3.288 2.988 1.513) 4.693 16.329 ( -2.565 1.563 0.114) 3.006 16.707 ( -1.467 -1.368 0.185) 2.014 21.829 ( -0.098 10.229 0.743) 10.257 22.155 ( 0.792 -0.136 -1.662) 1.846 ======================= Grid point 537 (255/322) ======================= q-point: (-0.15 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -1.118 -2.071 5.929) 6.379 1.960 ( -2.153 18.873 3.295) 19.279 2.497 ( -2.260 15.463 -2.618) 15.845 2.878 ( -1.099 5.778 -1.025) 5.970 2.976 ( -0.091 11.372 0.090) 11.372 3.182 ( -3.591 8.453 -4.094) 10.056 3.361 ( 0.764 14.284 0.390) 14.310 3.458 ( -3.988 7.746 1.487) 8.838 3.614 ( 1.199 -3.953 -1.437) 4.373 3.871 ( -0.870 6.793 -0.880) 6.905 4.288 ( 3.010 -0.911 1.442) 3.460 4.332 ( -1.732 0.596 1.222) 2.202 4.782 ( 1.060 4.498 2.534) 5.270 5.046 ( 1.041 -3.830 0.735) 4.037 5.433 ( 3.363 5.159 0.094) 6.159 5.509 ( 0.101 6.370 -0.742) 6.414 5.845 ( -0.934 28.259 -1.181) 28.299 6.399 ( -1.288 15.784 -1.402) 15.899 6.852 ( 5.159 10.374 2.509) 11.854 7.080 ( 4.346 -12.692 -0.921) 13.447 7.197 ( 0.395 -20.238 0.450) 20.247 7.836 ( -6.811 -7.294 1.180) 10.049 8.718 ( 4.444 -8.195 1.229) 9.403 9.246 ( -2.669 1.963 -2.353) 4.063 9.732 ( -3.605 -7.681 4.241) 9.486 9.860 ( 1.416 -9.868 -5.032) 11.167 10.254 ( -1.204 3.960 0.276) 4.148 10.668 ( -0.845 -7.207 -2.387) 7.639 11.609 ( 3.887 5.701 3.519) 7.746 11.713 ( -0.250 16.578 -0.805) 16.600 14.941 ( 0.063 1.566 0.209) 1.581 15.181 ( -4.192 2.298 0.443) 4.801 16.319 ( -1.442 -1.611 0.181) 2.169 16.741 ( -1.020 -2.859 0.092) 3.036 21.572 ( -0.319 16.012 2.290) 16.178 22.087 ( 1.429 8.357 -5.231) 9.962 ======================= Grid point 538 (256/322) ======================= q-point: (-0.08 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 1.788 19.715 4.115) 20.219 1.711 ( 0.585 2.682 10.884) 11.225 2.047 ( 0.072 26.322 -5.787) 26.951 2.698 ( -1.195 16.948 1.105) 17.026 2.766 ( 0.766 6.352 -3.020) 7.075 3.033 ( -0.519 4.171 -0.926) 4.304 3.088 ( -0.817 10.800 0.259) 10.834 3.306 ( -1.255 7.033 1.558) 7.312 3.694 ( 0.526 7.239 -1.028) 7.330 3.710 ( -2.187 -1.623 -0.240) 2.734 4.239 ( -0.593 3.875 0.389) 3.939 4.390 ( 1.466 -1.344 1.103) 2.274 4.563 ( -0.011 17.476 0.162) 17.476 4.958 ( -1.149 26.818 0.746) 26.853 5.215 ( 0.454 7.117 -1.605) 7.310 5.434 ( 3.735 -3.432 0.749) 5.127 5.515 ( -1.491 3.082 -1.069) 3.587 5.923 ( -1.310 23.314 -1.609) 23.406 6.824 ( -1.921 -3.763 4.464) 6.146 7.365 ( -0.319 -12.874 -0.108) 12.878 7.681 ( -0.010 -24.952 -0.249) 24.954 8.024 ( -0.607 -13.314 2.297) 13.524 8.881 ( 3.413 -5.175 0.965) 6.274 9.133 ( -0.180 7.845 -3.402) 8.553 9.802 ( -3.037 -0.368 1.264) 3.310 10.048 ( -0.368 -4.090 -2.514) 4.815 10.211 ( -0.413 -4.959 -0.169) 4.979 10.690 ( -0.579 3.894 -0.739) 4.006 11.528 ( -2.533 -0.398 1.170) 2.818 11.601 ( 3.833 -0.542 2.328) 4.517 14.950 ( 3.784 -1.623 1.220) 4.294 15.132 ( -2.158 0.276 -0.285) 2.194 16.369 ( 0.139 -3.574 0.251) 3.585 16.804 ( -0.006 -3.702 -0.051) 3.702 21.203 ( -0.661 21.185 3.232) 21.441 21.779 ( 1.022 23.267 -8.898) 24.932 ======================= Grid point 541 (257/322) ======================= q-point: ( 0.15 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( 16.977 0.000 1.060) 17.010 1.615 ( 33.033 0.000 1.891) 33.087 1.709 ( -4.632 -0.000 -1.927) 5.017 2.137 ( 4.560 0.000 -2.179) 5.054 2.825 ( 5.719 0.000 -3.182) 6.544 2.832 ( -4.315 -0.000 1.214) 4.482 2.940 ( -3.886 -0.000 0.071) 3.887 3.219 ( 10.152 0.000 4.123) 10.958 3.496 ( -1.718 -0.000 4.114) 4.458 3.625 ( 4.977 0.000 6.575) 8.246 3.626 ( 2.671 0.000 -3.908) 4.733 4.088 ( -3.252 -0.000 1.311) 3.506 4.219 ( -0.773 -0.000 1.029) 1.287 4.499 ( -4.036 -0.000 -2.776) 4.899 5.066 ( -9.298 -0.000 2.776) 9.703 5.418 ( -3.282 -0.000 -3.883) 5.084 5.568 ( -4.421 -0.000 -2.999) 5.342 5.604 ( -4.080 -0.000 0.762) 4.151 6.938 ( -2.191 -0.000 9.857) 10.098 7.431 ( -13.525 -0.000 0.827) 13.550 8.306 ( -6.146 -0.000 10.216) 11.922 8.524 ( 9.397 0.000 -0.259) 9.401 8.705 ( -1.908 -0.000 1.500) 2.427 9.133 ( 3.899 0.000 -9.640) 10.399 9.629 ( 0.456 0.000 -0.419) 0.619 10.064 ( 5.696 0.000 5.789) 8.121 10.539 ( -0.165 -0.000 0.023) 0.166 10.683 ( 3.783 0.000 0.294) 3.794 11.213 ( -17.801 -0.000 3.450) 18.132 11.897 ( -1.643 -0.000 -1.712) 2.373 14.973 ( 9.615 0.000 -0.989) 9.666 15.697 ( 16.392 0.000 -9.279) 18.836 16.744 ( 20.203 0.000 -7.564) 21.572 16.981 ( 6.715 0.000 -0.205) 6.718 20.551 ( -0.079 -0.000 0.079) 0.111 20.809 ( 0.020 0.000 -0.031) 0.037 ======================= Grid point 542 (258/322) ======================= q-point: ( 0.23 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( 15.152 -17.629 -0.556) 23.252 1.711 ( -0.938 -2.966 0.327) 3.128 1.948 ( 31.035 -13.081 -0.358) 33.681 2.337 ( 2.944 -14.551 -1.035) 14.882 2.793 ( -2.617 0.594 -0.490) 2.728 2.878 ( -4.644 -6.151 -0.015) 7.708 3.023 ( -3.055 -8.175 0.556) 8.745 3.296 ( 11.938 -2.202 0.616) 12.155 3.617 ( 7.735 -7.552 5.171) 11.984 3.633 ( 0.774 -3.886 2.913) 4.918 4.032 ( 3.457 -24.636 0.423) 24.881 4.106 ( -2.930 -3.741 1.725) 5.055 4.360 ( 0.767 -15.827 0.873) 15.869 4.499 ( -4.234 -6.087 -3.783) 8.324 4.996 ( -11.851 1.405 2.386) 12.170 5.364 ( -6.013 2.162 -4.179) 7.634 5.501 ( -5.336 2.150 -1.387) 5.918 5.615 ( -4.785 -4.883 0.178) 6.839 6.871 ( -1.898 7.639 11.075) 13.587 7.290 ( -13.903 6.309 0.775) 15.287 8.061 ( -2.083 19.132 4.490) 19.762 8.419 ( 2.793 9.935 2.181) 10.548 8.894 ( 2.176 -11.195 0.894) 11.440 9.071 ( 1.611 4.325 -10.187) 11.184 9.738 ( 1.603 -7.241 1.290) 7.528 10.110 ( 5.665 -0.852 5.607) 8.016 10.404 ( -1.120 10.940 0.341) 11.003 10.743 ( 5.645 -2.486 1.108) 6.267 11.164 ( -15.025 -4.272 2.041) 15.754 11.773 ( -5.181 8.523 -4.385) 10.895 15.038 ( 13.830 1.062 1.585) 13.961 15.663 ( 13.429 9.087 -6.459) 17.454 16.704 ( 15.980 11.592 -4.330) 20.211 16.984 ( 6.906 3.569 -0.317) 7.780 20.761 ( -1.310 -18.806 1.039) 18.880 21.149 ( -1.187 -28.602 -2.617) 28.746 ======================= Grid point 543 (259/322) ======================= q-point: ( 0.31 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( 4.321 -4.461 0.564) 6.236 1.973 ( 14.223 -15.117 -1.691) 20.825 2.394 ( 17.189 -13.652 2.328) 22.074 2.631 ( -0.313 -13.553 -0.027) 13.556 2.827 ( 0.263 -6.501 0.990) 6.581 3.013 ( -2.255 -9.029 1.305) 9.397 3.185 ( -2.016 -9.324 1.383) 9.639 3.462 ( 6.505 -8.194 -0.347) 10.468 3.625 ( -3.142 3.517 0.878) 4.797 3.865 ( 16.173 -8.862 2.628) 18.629 4.169 ( -1.548 -4.061 1.959) 4.767 4.337 ( 0.657 -3.318 -2.453) 4.178 4.719 ( 7.114 -13.685 2.246) 15.587 4.819 ( -13.548 -7.638 -3.090) 15.857 5.033 ( -5.254 -27.407 -0.630) 27.914 5.302 ( -8.749 -5.109 -1.610) 10.259 5.457 ( -1.954 -0.059 0.030) 1.955 5.807 ( -9.849 -21.740 -0.335) 23.869 6.626 ( -8.301 16.062 9.553) 20.449 7.031 ( -11.960 11.275 0.243) 16.439 7.696 ( 5.711 16.804 -0.195) 17.749 8.242 ( 3.084 8.880 2.393) 9.700 8.856 ( -3.061 8.939 -8.804) 12.915 9.201 ( 4.679 -10.145 0.939) 11.211 9.806 ( 1.993 2.881 5.405) 6.441 10.085 ( -0.050 12.141 1.135) 12.194 10.290 ( 4.467 -4.983 1.030) 6.771 10.791 ( 2.387 2.108 1.916) 3.717 11.247 ( -8.183 -12.202 -0.538) 14.701 11.562 ( -6.808 6.384 -4.276) 10.266 15.089 ( 12.630 1.855 2.426) 12.994 15.551 ( 11.513 7.721 -3.237) 14.235 16.558 ( 9.293 9.104 -0.956) 13.045 16.934 ( 5.934 4.937 -0.615) 7.744 21.168 ( -2.198 -21.300 2.024) 21.508 21.683 ( -2.313 -23.883 -3.178) 24.205 ======================= Grid point 544 (260/322) ======================= q-point: ( 0.38 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( 8.783 -0.809 2.134) 9.074 2.312 ( 11.604 -11.482 -1.004) 16.356 2.601 ( 1.268 -3.342 3.177) 4.782 2.868 ( -1.294 -10.953 -0.261) 11.032 3.070 ( 6.000 -12.183 5.416) 14.620 3.206 ( 1.022 -10.967 0.383) 11.021 3.360 ( 1.202 -8.209 1.358) 8.407 3.469 ( -4.832 5.418 0.962) 7.323 3.721 ( 5.505 -10.847 -0.512) 12.175 4.118 ( 10.623 -7.304 -2.289) 13.093 4.243 ( 5.593 -1.664 -0.299) 5.843 4.361 ( 0.160 -0.759 2.230) 2.361 4.644 ( -11.843 4.458 -3.503) 13.130 4.963 ( -0.771 -1.130 -1.484) 2.018 5.222 ( -11.977 -6.995 -3.912) 14.411 5.479 ( -2.427 -3.780 1.331) 4.685 5.811 ( -0.571 -30.065 1.206) 30.095 6.186 ( -10.067 14.067 5.427) 18.130 6.396 ( -13.226 -34.022 -1.153) 36.520 6.767 ( -6.442 7.983 -0.090) 10.258 7.476 ( 12.974 12.061 1.567) 17.783 8.152 ( 4.432 2.167 1.078) 5.050 8.614 ( -5.480 11.119 -6.768) 14.124 9.366 ( 5.436 -2.313 2.514) 6.420 9.697 ( 0.689 9.096 7.535) 11.832 9.826 ( -1.438 10.811 -1.683) 11.035 10.410 ( 3.412 -1.620 -1.511) 4.068 10.688 ( 0.309 8.432 0.731) 8.469 11.452 ( -5.465 -10.024 -3.364) 11.902 11.590 ( -4.769 -15.932 1.065) 16.664 15.131 ( 10.468 1.086 2.935) 10.926 15.496 ( 8.569 3.728 -2.505) 9.675 16.474 ( 5.948 3.611 -0.030) 6.958 16.868 ( 4.290 4.429 -1.076) 6.259 21.541 ( -1.546 -16.826 1.718) 16.984 22.015 ( -1.488 -11.501 -2.292) 11.821 ======================= Grid point 545 (261/322) ======================= q-point: ( 0.46 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( 10.273 9.268 4.038) 14.413 2.530 ( 5.260 -3.582 1.853) 6.628 2.647 ( 1.415 -2.403 1.514) 3.174 3.043 ( 0.448 -7.129 -0.733) 7.180 3.251 ( -2.863 -2.787 5.798) 7.041 3.396 ( -0.001 -4.487 -1.067) 4.612 3.468 ( 2.248 -10.839 1.795) 11.214 3.529 ( 3.516 -7.424 1.114) 8.290 3.961 ( 6.256 -9.083 1.371) 11.113 4.199 ( -0.636 2.557 -2.357) 3.536 4.290 ( 5.648 -1.503 0.566) 5.872 4.411 ( 0.052 -0.647 0.677) 0.938 4.520 ( -5.965 -0.083 -5.599) 8.181 4.898 ( -4.648 3.031 -2.816) 6.223 5.299 ( -10.377 -7.449 -3.130) 13.152 5.567 ( -2.554 -5.863 1.455) 6.559 5.791 ( -12.409 10.692 0.976) 16.409 6.198 ( -1.915 -3.927 0.217) 4.374 6.703 ( -1.445 -6.208 -0.227) 6.378 7.025 ( -3.550 -23.583 -0.368) 23.851 7.385 ( 14.296 2.351 3.719) 14.958 8.215 ( 4.207 -5.473 -0.128) 6.905 8.355 ( -6.107 10.136 -3.511) 12.343 9.334 ( 2.945 8.477 3.893) 9.783 9.520 ( -0.670 8.843 6.080) 10.753 9.667 ( -0.911 5.192 -3.855) 6.530 10.417 ( -0.853 -1.134 -0.610) 1.544 10.507 ( 1.064 8.961 -1.102) 9.091 11.705 ( -0.454 -16.612 -1.547) 16.690 11.922 ( -4.995 -18.165 0.695) 18.853 15.181 ( 8.515 0.062 3.234) 9.109 15.477 ( 5.174 2.382 -2.555) 6.243 16.483 ( 4.720 -1.046 -0.097) 4.835 16.807 ( 2.184 3.673 -1.413) 4.501 21.812 ( -0.538 -11.035 0.941) 11.088 22.136 ( -0.313 -2.392 -1.393) 2.786 ======================= Grid point 546 (262/322) ======================= q-point: ( 0.54 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 6.727 19.051 4.288) 20.654 2.524 ( 0.532 3.597 3.715) 5.198 2.718 ( 0.295 -1.734 0.033) 1.759 3.165 ( 8.155 -3.436 -2.204) 9.120 3.279 ( -5.485 -3.588 5.045) 8.271 3.507 ( -1.320 -5.420 0.569) 5.607 3.676 ( 3.737 -7.221 2.510) 8.510 3.696 ( 2.881 -7.057 -0.923) 7.678 4.090 ( 0.972 4.665 -0.252) 4.772 4.143 ( 0.715 -4.376 0.316) 4.445 4.308 ( -6.989 1.995 -1.904) 7.513 4.385 ( 2.472 -1.496 1.038) 3.070 4.517 ( -1.014 1.442 -1.542) 2.342 4.851 ( -2.060 -1.481 -4.367) 5.050 5.378 ( -6.629 -6.150 -2.968) 9.517 5.601 ( -10.125 -0.993 -0.984) 10.221 5.685 ( -0.738 -3.743 2.143) 4.376 6.162 ( -0.621 3.085 -0.803) 3.247 6.805 ( -0.409 -2.419 0.003) 2.453 7.136 ( 12.018 6.599 1.730) 13.819 7.664 ( 3.453 -15.875 1.670) 16.331 8.120 ( -8.408 7.225 -1.648) 11.208 8.434 ( 3.743 -12.094 0.951) 12.696 9.124 ( -0.087 12.980 2.552) 13.229 9.363 ( -1.349 7.300 4.119) 8.490 9.550 ( -0.561 5.914 -3.341) 6.816 10.386 ( 0.717 3.258 -1.054) 3.498 10.500 ( -1.191 -7.302 -0.145) 7.400 12.006 ( 2.476 -11.530 -1.105) 11.844 12.227 ( -4.419 -15.580 -0.321) 16.197 15.227 ( 5.977 0.500 2.897) 6.661 15.448 ( 2.319 2.417 -2.170) 3.991 16.549 ( 3.931 -2.339 -0.472) 4.599 16.740 ( -0.273 3.489 -1.328) 3.743 21.976 ( 0.103 -5.822 0.131) 5.824 22.132 ( 0.085 1.881 -0.446) 1.935 ======================= Grid point 547 (263/322) ======================= q-point: ( 0.62 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( 1.192 15.258 3.060) 15.607 2.462 ( -0.414 2.376 3.264) 4.059 2.706 ( -2.413 1.774 -0.140) 2.998 3.262 ( 9.398 -0.544 -0.809) 9.449 3.336 ( -2.704 -3.430 4.238) 6.086 3.573 ( -1.270 -1.937 -0.382) 2.347 3.794 ( 3.257 -1.560 -0.956) 3.736 3.813 ( 1.204 -3.713 0.285) 3.913 3.995 ( -3.173 3.017 -0.046) 4.378 4.148 ( -7.487 2.815 -4.787) 9.321 4.256 ( 0.859 -0.165 1.520) 1.754 4.425 ( 1.404 1.328 -0.301) 1.956 4.488 ( -0.082 -2.002 4.945) 5.336 4.887 ( -0.957 -2.668 -4.600) 5.403 5.461 ( 0.123 -4.590 -1.948) 4.987 5.646 ( -4.138 -7.969 -0.688) 9.006 5.741 ( -3.019 -2.024 1.915) 4.109 6.118 ( 0.122 0.726 -1.334) 1.524 6.819 ( 0.337 -0.367 -0.076) 0.504 7.061 ( 12.421 8.274 1.879) 15.042 7.879 ( 1.230 -1.464 -0.246) 1.928 7.989 ( -6.880 -1.275 1.599) 7.178 8.637 ( -5.216 -1.417 0.869) 5.474 8.939 ( 6.819 0.481 0.559) 6.859 9.240 ( -3.333 3.958 2.807) 5.887 9.444 ( -0.037 3.495 -1.692) 3.884 10.367 ( 0.644 -0.221 -1.374) 1.533 10.624 ( -0.915 -4.265 -0.149) 4.364 12.151 ( 1.043 -2.275 -0.223) 2.513 12.466 ( -0.642 -9.331 -1.989) 9.562 15.225 ( 2.306 2.759 1.305) 3.826 15.409 ( 0.976 2.114 -0.856) 2.481 16.582 ( 2.178 2.287 -0.424) 3.186 16.679 ( -1.664 0.712 -0.937) 2.038 22.049 ( 0.099 -1.574 -0.226) 1.593 22.090 ( 0.036 1.601 0.164) 1.610 ======================= Grid point 548 (264/322) ======================= q-point: (-0.31 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.177 ( -3.133 -3.184 1.747) 4.796 2.463 ( -0.308 -2.425 2.444) 3.457 2.634 ( -2.645 3.858 -0.112) 4.679 3.284 ( 2.886 1.855 2.464) 4.223 3.361 ( 1.567 1.945 1.162) 2.755 3.562 ( -2.507 2.007 -0.675) 3.282 3.759 ( 0.754 5.404 -4.700) 7.202 3.847 ( 2.016 1.203 0.281) 2.364 3.946 ( -0.272 1.457 -0.398) 1.535 4.019 ( -9.344 3.681 -1.888) 10.219 4.267 ( 1.846 0.321 2.109) 2.821 4.399 ( -2.319 0.028 -3.152) 3.914 4.581 ( 5.940 -3.772 8.283) 10.868 4.913 ( -2.579 -1.662 -3.961) 5.010 5.548 ( 6.241 -2.318 -0.818) 6.708 5.732 ( -5.109 0.388 1.332) 5.294 5.858 ( 0.479 -14.060 0.257) 14.070 6.132 ( -0.102 -2.262 -1.294) 2.608 6.847 ( 1.280 -1.775 -0.209) 2.198 6.955 ( 8.630 9.177 1.517) 12.688 7.803 ( -6.814 3.756 0.534) 7.799 8.014 ( -0.812 1.314 0.879) 1.777 8.484 ( -1.652 6.985 -0.192) 7.181 9.134 ( 5.198 -4.775 -1.051) 7.137 9.217 ( -4.926 -8.549 4.740) 10.946 9.424 ( 0.724 -1.837 -1.680) 2.593 10.369 ( 0.585 0.296 -1.577) 1.708 10.620 ( -0.799 4.160 -0.308) 4.248 12.122 ( 0.653 5.317 0.256) 5.363 12.550 ( 1.129 1.046 -2.843) 3.233 15.155 ( -0.580 4.481 -0.411) 4.537 15.370 ( 0.270 2.346 0.526) 2.419 16.492 ( -0.985 5.616 -0.099) 5.703 16.682 ( -0.439 -0.665 -0.479) 0.930 22.044 ( 0.086 1.593 0.147) 1.602 22.085 ( -0.186 -0.777 -0.032) 0.799 ======================= Grid point 549 (265/322) ======================= q-point: (-0.23 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( -3.264 -13.492 1.719) 13.987 2.498 ( 0.573 6.848 0.449) 6.887 2.562 ( -2.504 -4.288 1.577) 5.210 3.233 ( -4.473 4.536 5.515) 8.426 3.273 ( 5.158 7.621 -2.085) 9.435 3.469 ( -3.650 4.967 -1.841) 6.433 3.624 ( 0.333 6.686 -4.465) 8.046 3.764 ( 1.425 7.815 -1.435) 8.072 3.887 ( -3.881 6.632 -0.263) 7.688 3.940 ( -0.388 -1.206 -0.072) 1.269 4.273 ( 2.240 0.722 2.728) 3.603 4.380 ( -2.445 0.265 -2.587) 3.569 4.721 ( 7.463 -4.735 7.184) 11.390 4.917 ( -4.007 -1.652 -3.071) 5.312 5.605 ( 6.355 0.965 -0.487) 6.446 5.675 ( -4.219 2.382 0.642) 4.887 6.192 ( 3.208 -15.782 0.099) 16.105 6.205 ( -0.093 -7.198 -0.019) 7.199 6.799 ( 2.742 9.193 1.522) 9.713 6.880 ( -0.481 0.021 -0.869) 0.994 7.698 ( -1.248 3.622 0.606) 3.879 7.865 ( -3.944 12.776 -0.651) 13.387 8.447 ( 2.733 -2.636 0.518) 3.832 9.174 ( -2.563 -2.758 -0.612) 3.815 9.426 ( -3.597 -8.656 7.593) 12.063 9.532 ( 3.928 -8.033 -5.385) 10.438 10.376 ( 0.527 -1.352 -0.706) 1.614 10.484 ( -0.820 7.224 -1.143) 7.360 11.970 ( 1.093 9.971 0.710) 10.056 12.422 ( 0.753 11.985 -2.772) 12.324 15.058 ( -1.203 4.313 -0.886) 4.565 15.316 ( -0.301 3.344 0.955) 3.491 16.380 ( -1.151 4.563 0.084) 4.707 16.688 ( -0.247 -0.293 -0.172) 0.420 21.979 ( -0.005 5.284 -0.043) 5.284 22.120 ( 0.052 -2.536 -0.031) 2.537 ======================= Grid point 550 (266/322) ======================= q-point: (-0.15 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( -0.989 -9.748 2.961) 10.235 2.287 ( 0.196 13.784 1.245) 13.842 2.628 ( -0.775 -0.424 0.749) 1.158 3.043 ( -1.567 10.845 1.262) 11.030 3.159 ( 1.371 7.548 0.107) 7.672 3.325 ( -2.035 7.605 -2.355) 8.217 3.525 ( -1.589 2.483 -2.538) 3.890 3.601 ( -0.659 7.594 0.139) 7.624 3.693 ( 1.814 11.645 -0.494) 11.796 3.951 ( 0.381 1.231 -0.536) 1.395 4.280 ( 1.901 -0.254 2.784) 3.380 4.350 ( -1.920 1.228 -1.442) 2.697 4.834 ( 4.371 -0.474 3.703) 5.748 4.951 ( -2.211 -5.053 -0.682) 5.557 5.557 ( -0.335 5.163 -0.191) 5.177 5.604 ( 0.997 4.073 -0.729) 4.256 6.222 ( -0.512 7.261 -0.059) 7.279 6.517 ( -0.397 -3.777 0.423) 3.822 6.726 ( 0.046 -10.549 1.785) 10.699 6.886 ( -0.912 -4.242 -0.847) 4.420 7.429 ( 1.313 26.078 -0.825) 26.124 7.716 ( -1.037 -2.893 0.462) 3.107 8.577 ( 2.739 -7.842 -0.254) 8.311 9.216 ( -2.290 -2.513 -0.412) 3.425 9.564 ( -3.900 -7.455 7.322) 11.154 9.700 ( 2.499 -7.279 -5.666) 9.557 10.333 ( 0.568 4.576 1.006) 4.719 10.494 ( 0.012 -7.780 -2.797) 8.267 11.775 ( 0.978 9.611 1.409) 9.763 12.097 ( -0.570 19.669 -1.814) 19.761 14.980 ( -0.356 2.810 -0.557) 2.887 15.242 ( 0.397 4.041 0.753) 4.130 16.313 ( -0.125 1.605 0.169) 1.619 16.700 ( 0.354 -1.150 -0.103) 1.207 21.829 ( -0.366 10.136 0.891) 10.182 22.157 ( 0.517 -0.164 -1.757) 1.839 ======================= Grid point 551 (267/322) ======================= q-point: (-0.08 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( 0.682 -3.093 4.700) 5.668 1.979 ( 3.983 18.122 1.524) 18.617 2.484 ( 1.024 15.787 -1.453) 15.887 2.869 ( -0.062 6.287 -0.384) 6.299 2.976 ( -0.065 11.058 0.091) 11.059 3.151 ( 0.112 8.128 -0.885) 8.176 3.356 ( -1.803 12.399 0.863) 12.559 3.466 ( 4.553 9.996 0.667) 11.004 3.608 ( -1.588 -4.367 -0.955) 4.744 3.865 ( 0.211 7.500 -0.215) 7.506 4.300 ( -2.030 2.601 -0.063) 3.300 4.331 ( 1.458 -3.292 1.604) 3.941 4.797 ( 0.282 5.803 1.021) 5.899 5.050 ( -0.255 -3.932 0.480) 3.969 5.446 ( -1.377 4.181 -1.045) 4.524 5.513 ( 1.012 6.088 -1.136) 6.275 5.832 ( -0.748 28.798 -0.032) 28.807 6.372 ( -3.155 15.860 1.246) 16.219 6.864 ( -4.342 12.051 1.321) 12.877 7.071 ( -4.780 -13.966 -0.118) 14.762 7.207 ( 0.632 -19.955 -0.582) 19.973 7.832 ( 5.656 -7.445 1.532) 9.474 8.758 ( 2.274 -8.562 -2.377) 9.173 9.222 ( -0.290 1.660 -0.407) 1.734 9.701 ( -4.106 -7.031 6.133) 10.193 9.860 ( 0.888 -9.723 -3.923) 10.522 10.261 ( 2.504 4.377 -0.443) 5.062 10.659 ( 0.233 -7.015 -1.434) 7.164 11.640 ( -0.538 4.098 1.125) 4.283 11.698 ( -1.559 17.355 0.084) 17.425 14.947 ( 0.529 0.531 -0.380) 0.841 15.180 ( 4.105 2.982 0.590) 5.109 16.319 ( 1.291 -1.692 0.208) 2.139 16.743 ( 1.415 -2.747 -0.121) 3.092 21.572 ( -0.886 15.892 2.309) 16.083 22.081 ( 0.218 8.815 -4.703) 9.993 ======================= Grid point 555 (268/322) ======================= q-point: ( 0.23 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( 19.955 0.000 -0.892) 19.975 1.673 ( 0.112 0.000 -1.135) 1.141 2.031 ( 35.367 0.000 1.207) 35.387 2.194 ( 5.827 0.000 -1.230) 5.955 2.771 ( -6.621 -0.000 0.756) 6.664 2.791 ( -7.361 -0.000 -1.766) 7.569 2.889 ( -4.890 -0.000 0.815) 4.957 3.387 ( 13.875 0.000 -2.547) 14.107 3.491 ( -1.497 -0.000 4.735) 4.966 3.644 ( 2.488 0.000 -4.502) 5.143 3.773 ( 15.371 0.000 11.430) 19.155 4.059 ( -2.047 -0.000 2.856) 3.513 4.219 ( -1.061 -0.000 1.426) 1.777 4.427 ( -3.722 -0.000 -5.995) 7.057 4.948 ( -11.975 -0.000 2.989) 12.343 5.334 ( -10.703 -0.000 -5.006) 11.816 5.477 ( -7.771 -0.000 -3.378) 8.473 5.562 ( -3.928 -0.000 2.535) 4.675 6.973 ( 2.136 0.000 13.115) 13.288 7.271 ( -13.573 -0.000 0.967) 13.607 8.265 ( -6.487 -0.000 10.892) 12.678 8.631 ( 8.440 0.000 -0.284) 8.444 8.687 ( -1.541 -0.000 0.514) 1.624 9.133 ( 1.333 0.000 -11.092) 11.172 9.633 ( 0.614 0.000 -0.678) 0.915 10.158 ( 6.790 0.000 5.880) 8.982 10.538 ( -0.161 -0.000 0.186) 0.246 10.711 ( 0.307 0.000 0.525) 0.608 11.040 ( -13.139 -0.000 3.435) 13.581 11.818 ( -8.457 -0.000 -5.357) 10.011 15.166 ( 19.958 0.000 6.040) 20.852 15.809 ( 8.143 0.000 -8.115) 11.496 16.967 ( 21.270 0.000 -9.341) 23.230 17.068 ( 8.024 0.000 -1.285) 8.126 20.550 ( -0.084 -0.000 0.095) 0.127 20.809 ( 0.022 0.000 -0.031) 0.038 ======================= Grid point 556 (269/322) ======================= q-point: ( 0.31 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( 8.078 -6.610 -0.380) 10.445 1.748 ( 13.423 -13.047 -2.052) 18.831 2.311 ( 26.281 -7.655 3.434) 27.588 2.375 ( 4.699 -12.130 -1.023) 13.049 2.739 ( -4.329 -1.563 -0.200) 4.606 2.821 ( -5.286 -8.019 1.274) 9.688 2.972 ( -5.275 -9.219 1.149) 10.683 3.399 ( 6.640 -1.001 -2.621) 7.209 3.604 ( -2.954 -4.875 3.296) 6.585 3.818 ( 17.361 -8.078 -0.598) 19.158 4.070 ( -1.737 -12.447 0.672) 12.585 4.119 ( 7.272 -12.206 6.986) 15.832 4.359 ( -1.508 -17.236 0.510) 17.309 4.451 ( -0.399 -7.106 -5.726) 9.135 4.860 ( -11.417 2.182 3.399) 12.110 5.229 ( -14.154 1.647 -3.765) 14.738 5.425 ( -9.974 -1.205 -3.595) 10.671 5.551 ( -3.907 -1.411 2.014) 4.617 6.906 ( 1.020 10.889 13.990) 17.757 7.134 ( -12.551 6.172 0.846) 14.012 8.058 ( -0.771 16.262 4.184) 16.810 8.440 ( -0.161 10.254 1.434) 10.355 8.916 ( 1.206 -6.728 -2.203) 7.182 9.059 ( 1.652 0.625 -7.750) 7.949 9.764 ( 2.085 -8.597 1.231) 8.931 10.198 ( 6.106 0.321 5.123) 7.977 10.390 ( -1.416 10.694 0.483) 10.798 10.803 ( 3.743 -4.227 1.485) 5.838 11.002 ( -13.253 -4.723 1.123) 14.114 11.673 ( -7.843 7.710 -6.280) 12.665 15.252 ( 18.661 4.028 6.635) 20.211 15.763 ( 7.338 6.978 -6.078) 11.810 16.883 ( 16.269 15.348 -5.326) 22.992 17.067 ( 7.225 4.225 -0.999) 8.429 20.749 ( -1.234 -18.052 0.843) 18.113 21.128 ( -1.213 -27.118 -1.426) 27.182 ======================= Grid point 557 (270/322) ======================= q-point: ( 0.38 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 8.484 -5.970 0.498) 10.386 2.131 ( 13.473 -13.987 -1.675) 19.493 2.535 ( 2.263 -4.752 4.076) 6.657 2.628 ( -0.978 -11.994 -0.369) 12.039 2.894 ( 12.366 -10.898 2.791) 16.718 2.991 ( -2.029 -10.590 1.557) 10.895 3.161 ( -2.534 -11.455 1.487) 11.826 3.514 ( 1.994 -4.051 0.277) 4.524 3.598 ( 0.126 0.023 -0.265) 0.294 4.042 ( 9.042 -5.784 -2.329) 10.983 4.200 ( 8.194 -5.656 3.076) 10.420 4.358 ( 4.195 -2.290 -2.091) 5.217 4.627 ( -16.172 -3.126 -4.153) 16.987 4.823 ( 7.949 -12.610 4.725) 15.638 4.973 ( -3.925 -25.235 -2.798) 25.691 5.154 ( -14.159 -10.809 0.632) 17.824 5.434 ( -3.493 -4.940 -1.472) 6.226 5.671 ( -11.833 -20.739 0.184) 23.878 6.567 ( -6.923 22.635 10.386) 25.848 6.909 ( -8.690 9.444 0.068) 12.834 7.783 ( 8.822 12.638 0.185) 15.414 8.261 ( -1.093 7.166 1.948) 7.506 8.786 ( -4.053 9.913 -7.930) 13.326 9.262 ( 4.961 -10.738 1.049) 11.875 9.852 ( 3.003 2.876 4.371) 6.033 10.082 ( -0.950 14.204 1.334) 14.298 10.350 ( 5.159 -5.932 0.931) 7.916 10.795 ( -3.290 3.766 1.888) 5.346 11.170 ( -3.946 -15.399 -1.203) 15.942 11.463 ( -7.079 6.027 -4.456) 10.310 15.266 ( 14.382 4.678 5.006) 15.930 15.651 ( 7.303 7.074 -3.832) 10.866 16.665 ( 9.214 12.040 -1.387) 15.224 16.998 ( 5.265 5.844 -1.157) 7.950 21.149 ( -1.950 -21.357 1.653) 21.509 21.649 ( -1.968 -23.833 -2.064) 24.003 ======================= Grid point 558 (271/322) ======================= q-point: ( 0.46 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( 10.929 -1.905 2.362) 11.343 2.432 ( 8.587 -9.675 -0.378) 12.942 2.606 ( -2.065 -2.945 3.353) 4.918 2.848 ( -2.080 -11.282 0.572) 11.487 3.144 ( 2.429 -8.423 3.559) 9.461 3.253 ( 7.714 -12.896 1.478) 15.099 3.371 ( -0.358 -9.067 1.155) 9.147 3.420 ( -3.579 5.017 1.418) 6.324 3.796 ( 7.582 -11.020 -0.185) 13.378 4.162 ( 1.783 -4.347 -1.966) 5.093 4.366 ( 5.954 2.928 -1.367) 6.774 4.376 ( 4.458 -4.025 2.215) 6.401 4.485 ( -10.734 2.709 -5.259) 12.256 4.947 ( -3.392 4.266 -2.580) 6.030 5.062 ( -10.549 -9.464 -0.886) 14.200 5.448 ( -3.339 -5.610 0.993) 6.604 5.813 ( 0.388 -27.793 0.453) 27.800 6.067 ( -11.992 17.592 3.812) 21.629 6.284 ( -5.719 -38.807 0.571) 39.230 6.699 ( -4.985 5.919 -0.513) 7.755 7.642 ( 13.743 9.670 2.572) 17.000 8.179 ( -0.179 0.393 0.245) 0.497 8.531 ( -5.302 11.611 -4.970) 13.698 9.436 ( 5.009 -2.440 2.565) 6.134 9.733 ( 1.580 10.796 5.683) 12.302 9.803 ( -1.567 10.946 -1.627) 11.177 10.431 ( 0.942 1.323 -1.305) 2.083 10.687 ( -0.618 6.835 0.362) 6.872 11.386 ( -4.043 -11.101 -2.858) 12.155 11.544 ( -3.309 -17.146 0.853) 17.483 15.270 ( 10.821 2.844 4.257) 11.971 15.571 ( 5.368 4.485 -3.085) 7.645 16.540 ( 5.021 4.679 -0.384) 6.874 16.909 ( 3.069 5.336 -1.287) 6.289 21.529 ( -1.264 -17.275 1.494) 17.386 21.993 ( -1.050 -12.185 -1.883) 12.374 ======================= Grid point 559 (272/322) ======================= q-point: ( 0.54 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( 9.010 10.473 3.962) 14.372 2.575 ( 1.464 -0.817 3.439) 3.826 2.666 ( 0.697 -3.609 0.434) 3.701 3.051 ( 0.460 -9.686 0.819) 9.731 3.254 ( 2.096 0.362 1.140) 2.413 3.368 ( -3.378 -5.990 1.178) 6.977 3.528 ( 5.596 -10.331 1.684) 11.869 3.563 ( 1.771 -8.075 0.656) 8.293 4.032 ( 3.708 -7.965 0.767) 8.819 4.201 ( 0.868 4.779 0.091) 4.859 4.284 ( -4.212 -0.964 1.760) 4.666 4.369 ( -2.075 0.896 -3.932) 4.535 4.518 ( 2.663 -2.088 -2.380) 4.137 4.825 ( -6.954 2.461 -4.738) 8.767 5.194 ( -4.319 -8.019 -0.907) 9.153 5.523 ( -4.800 -3.652 0.885) 6.097 5.688 ( -6.269 8.136 0.706) 10.295 6.178 ( -1.390 -3.797 -0.432) 4.066 6.688 ( -0.990 -7.581 -0.209) 7.648 6.990 ( -2.056 -29.006 -0.149) 29.079 7.568 ( 13.596 5.011 4.247) 15.100 8.218 ( -1.997 1.230 -3.581) 4.281 8.295 ( -3.365 2.749 0.795) 4.417 9.374 ( 1.773 10.827 3.145) 11.413 9.535 ( 0.317 9.304 4.294) 10.252 9.646 ( -0.684 5.153 -3.201) 6.105 10.395 ( -2.475 -1.049 0.154) 2.693 10.516 ( 1.313 8.963 -1.728) 9.222 11.703 ( 0.688 -19.598 -0.984) 19.635 11.871 ( -3.773 -16.821 0.343) 17.242 15.292 ( 8.037 1.487 3.933) 9.071 15.514 ( 2.399 3.348 -2.898) 5.036 16.530 ( 3.220 -0.871 -0.496) 3.372 16.821 ( 1.049 4.658 -1.306) 4.950 21.809 ( -0.345 -11.361 0.827) 11.396 22.129 ( -0.197 -2.884 -1.249) 3.149 ======================= Grid point 560 (273/322) ======================= q-point: ( 0.62 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 3.572 21.398 3.683) 22.005 2.543 ( 0.544 4.242 3.874) 5.770 2.710 ( -1.127 -0.570 -0.091) 1.267 3.226 ( -1.551 -7.038 3.338) 7.942 3.286 ( 7.529 -1.799 -1.270) 7.845 3.487 ( -1.911 -5.766 0.558) 6.100 3.713 ( 0.217 -6.388 1.118) 6.489 3.730 ( 4.387 -6.790 -0.038) 8.084 4.045 ( -5.851 4.027 0.435) 7.116 4.146 ( -3.010 0.607 -2.947) 4.256 4.273 ( 3.300 1.100 -0.628) 3.535 4.428 ( 3.452 -4.758 5.299) 7.914 4.489 ( -2.300 3.950 -1.484) 4.806 4.796 ( -5.349 -3.472 -6.676) 9.233 5.319 ( -2.135 -7.215 -1.341) 7.643 5.535 ( -0.195 -2.552 -0.343) 2.582 5.660 ( -4.741 -3.622 1.069) 6.062 6.151 ( -0.650 2.522 -1.000) 2.790 6.799 ( -0.369 -2.563 0.002) 2.589 7.257 ( 7.025 1.778 1.005) 7.315 7.731 ( 5.939 -12.821 2.583) 14.364 8.027 ( -5.896 8.087 -1.139) 10.072 8.448 ( -1.282 -11.216 0.818) 11.319 9.133 ( 0.258 12.734 1.061) 12.780 9.362 ( -0.608 8.583 3.347) 9.232 9.535 ( -0.505 5.514 -2.172) 5.948 10.390 ( 0.426 3.193 -0.741) 3.306 10.486 ( -0.827 -7.514 -0.524) 7.578 12.038 ( 3.192 -10.652 -0.390) 11.127 12.177 ( -3.670 -17.298 -1.016) 17.712 15.302 ( 4.791 2.464 3.078) 6.205 15.457 ( 0.349 2.629 -2.262) 3.486 16.586 ( 2.481 -2.513 -0.754) 3.611 16.728 ( -0.816 4.710 -1.036) 4.891 21.978 ( 0.132 -5.873 0.094) 5.876 22.131 ( -0.042 1.718 -0.367) 1.757 ======================= Grid point 561 (274/322) ======================= q-point: (-0.31 -0.77 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.323 ( -0.441 17.490 2.827) 17.722 2.467 ( -0.462 2.848 3.199) 4.308 2.684 ( -0.978 2.202 -0.067) 2.410 3.300 ( -1.923 -1.513 6.054) 6.529 3.380 ( 6.269 -2.138 -3.545) 7.512 3.557 ( -0.761 -1.832 0.046) 1.985 3.795 ( -3.295 -1.590 -0.438) 3.685 3.843 ( 4.018 -2.080 0.142) 4.527 3.961 ( -2.248 1.183 0.223) 2.550 4.056 ( -4.620 4.199 -3.385) 7.102 4.290 ( 3.132 0.216 1.468) 3.466 4.396 ( -3.124 2.365 -2.474) 4.634 4.554 ( 6.047 -3.945 7.177) 10.181 4.833 ( -4.525 -3.571 -6.696) 8.835 5.478 ( 1.914 -8.881 -0.639) 9.107 5.634 ( 3.177 -5.546 -0.619) 6.421 5.691 ( -6.264 -2.908 1.290) 7.025 6.113 ( -0.417 0.634 -1.084) 1.324 6.818 ( -0.151 -0.790 -0.060) 0.806 7.188 ( 6.023 7.991 1.839) 10.174 7.859 ( -2.606 5.626 -0.631) 6.233 7.969 ( 1.616 -6.690 1.579) 7.061 8.578 ( -4.082 0.610 0.486) 4.156 9.000 ( 1.769 -2.995 1.497) 3.787 9.216 ( -1.079 5.641 1.758) 6.006 9.439 ( -0.008 3.101 -1.125) 3.299 10.370 ( 0.544 -0.167 -1.412) 1.522 10.615 ( -0.380 -4.307 -0.194) 4.328 12.165 ( 1.310 -1.668 -0.240) 2.134 12.453 ( -0.474 -10.498 -2.052) 10.707 15.249 ( 0.962 4.734 1.077) 4.950 15.414 ( 0.272 1.834 -0.610) 1.952 16.604 ( 1.590 5.156 -0.610) 5.430 16.656 ( -1.395 -1.319 -0.689) 2.039 22.050 ( 0.001 -1.429 -0.141) 1.436 22.091 ( 0.018 1.519 0.111) 1.523 ======================= Grid point 562 (275/322) ======================= q-point: (-0.23 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( -1.661 -2.104 2.508) 3.670 2.465 ( -0.739 -2.677 2.586) 3.795 2.617 ( -0.215 4.331 0.040) 4.337 3.287 ( -3.161 2.273 5.949) 7.110 3.404 ( 3.924 2.354 -3.708) 5.890 3.541 ( 0.205 3.277 0.213) 3.290 3.728 ( -4.369 4.637 -1.515) 6.548 3.868 ( 0.816 2.060 -0.867) 2.379 3.932 ( -3.831 1.857 1.024) 4.378 3.968 ( 4.068 2.330 -2.229) 5.191 4.300 ( 2.533 0.527 2.221) 3.410 4.360 ( -2.595 -0.220 -2.946) 3.932 4.682 ( 6.496 -4.378 6.369) 10.096 4.854 ( -3.406 -1.967 -5.611) 6.853 5.622 ( -0.495 -2.751 0.196) 2.802 5.670 ( 0.826 -0.505 0.160) 0.981 5.864 ( 0.323 -14.782 0.173) 14.786 6.122 ( -0.754 -2.282 -0.673) 2.495 6.850 ( -0.144 -2.202 -0.215) 2.217 7.023 ( -0.508 10.591 1.777) 10.751 7.757 ( 1.085 4.145 -0.188) 4.288 8.021 ( 0.945 2.688 0.165) 2.854 8.470 ( -0.755 4.350 0.054) 4.415 9.132 ( -5.825 -0.899 3.113) 6.666 9.214 ( 2.359 -10.491 2.387) 11.014 9.431 ( 1.542 -2.680 -2.474) 3.959 10.370 ( 0.380 0.326 -1.574) 1.652 10.614 ( -0.008 4.292 -0.228) 4.298 12.133 ( 1.152 5.312 -0.433) 5.452 12.547 ( -0.308 0.755 -2.229) 2.374 15.148 ( -0.510 5.253 0.051) 5.277 15.375 ( 0.296 2.416 0.184) 2.441 16.486 ( 0.154 6.138 -0.217) 6.144 16.679 ( 0.239 -0.789 -0.535) 0.983 22.046 ( 0.119 1.557 0.035) 1.562 22.083 ( -0.097 -0.733 0.041) 0.741 ======================= Grid point 563 (276/322) ======================= q-point: (-0.15 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( 0.188 -13.730 2.789) 14.011 2.495 ( -1.317 6.479 0.702) 6.648 2.559 ( 1.253 -3.964 1.820) 4.539 3.198 ( -4.033 5.374 4.948) 8.344 3.327 ( 4.884 7.177 -3.041) 9.198 3.450 ( 1.361 5.934 0.258) 6.094 3.591 ( -4.322 5.678 -2.010) 7.414 3.738 ( -4.059 7.554 0.983) 8.632 3.907 ( 6.005 6.787 -1.933) 9.267 3.946 ( 1.562 -1.254 -0.599) 2.091 4.304 ( 1.402 0.867 1.639) 2.324 4.348 ( -1.410 -0.070 -1.481) 2.046 4.822 ( 3.341 -5.852 2.692) 7.257 4.856 ( -0.897 -0.429 -2.431) 2.627 5.593 ( -7.231 1.019 0.638) 7.330 5.693 ( 5.680 2.495 -0.929) 6.273 6.187 ( -2.467 -9.673 0.285) 9.986 6.211 ( -0.379 -13.919 -0.293) 13.927 6.794 ( -4.490 9.620 1.969) 10.797 6.875 ( -0.044 0.267 -0.441) 0.517 7.709 ( 2.569 2.855 -0.382) 3.860 7.860 ( 3.729 14.130 -0.129) 14.615 8.461 ( -0.399 -3.709 -0.883) 3.833 9.145 ( -2.507 -2.892 2.096) 4.364 9.403 ( -3.794 -7.947 7.086) 11.304 9.560 ( 3.478 -7.979 -5.426) 10.257 10.379 ( 0.399 -2.026 -1.016) 2.301 10.479 ( 0.532 7.827 -0.686) 7.875 11.982 ( 0.783 9.920 -0.381) 9.958 12.410 ( -1.478 12.029 -1.723) 12.241 15.049 ( -0.012 4.333 -0.046) 4.333 15.323 ( 1.303 3.240 0.201) 3.498 16.380 ( 1.144 4.637 0.065) 4.777 16.691 ( 0.992 -0.367 -0.491) 1.166 21.979 ( -0.117 5.385 0.027) 5.386 22.122 ( 0.262 -2.614 -0.176) 2.633 ======================= Grid point 564 (277/322) ======================= q-point: (-0.08 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( 2.293 -10.037 3.210) 10.784 2.308 ( 2.963 12.477 0.670) 12.841 2.624 ( -0.568 -0.207 1.432) 1.555 3.043 ( 0.422 9.317 1.906) 9.519 3.183 ( 2.897 9.595 -0.320) 10.028 3.323 ( 1.833 8.082 0.488) 8.301 3.478 ( -4.519 3.456 -0.394) 5.703 3.576 ( -3.149 4.858 0.010) 5.789 3.756 ( 7.610 11.796 -1.117) 14.082 3.964 ( 2.634 1.669 -0.936) 3.256 4.289 ( -1.335 0.205 -0.424) 1.415 4.341 ( 0.861 0.768 1.362) 1.784 4.839 ( -3.563 0.025 -2.429) 4.312 4.961 ( 3.016 -4.909 1.864) 6.055 5.515 ( -4.734 3.421 0.019) 5.841 5.626 ( 1.369 5.585 -1.362) 5.909 6.207 ( -2.312 6.778 0.534) 7.181 6.438 ( -12.253 -4.302 0.742) 13.007 6.734 ( 0.257 -7.301 0.944) 7.366 6.902 ( 3.797 -6.766 0.705) 7.790 7.374 ( -7.697 25.804 -1.657) 26.979 7.805 ( 12.883 -0.759 1.243) 12.965 8.582 ( -1.121 -8.550 -3.478) 9.298 9.206 ( 0.230 -2.996 2.447) 3.875 9.540 ( -3.871 -7.499 7.687) 11.416 9.707 ( 1.465 -6.306 -5.006) 8.184 10.355 ( 2.561 4.163 0.356) 4.901 10.490 ( 0.481 -8.060 -2.215) 8.373 11.777 ( -1.016 9.940 -0.173) 9.993 12.074 ( -2.605 19.545 -0.594) 19.727 14.983 ( 1.214 2.627 0.066) 2.895 15.272 ( 4.334 3.283 0.026) 5.437 16.328 ( 2.357 1.603 0.268) 2.863 16.714 ( 2.134 -1.303 -0.506) 2.551 21.826 ( -0.587 10.187 1.001) 10.253 22.156 ( 0.206 0.209 -1.761) 1.786 ======================= Grid point 569 (278/322) ======================= q-point: ( 0.31 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( 20.451 0.000 -2.048) 20.553 1.710 ( 6.552 0.000 -0.728) 6.592 2.260 ( 5.456 0.000 -0.589) 5.488 2.405 ( 20.155 0.000 3.878) 20.525 2.683 ( -8.394 -0.000 0.868) 8.439 2.710 ( 0.620 0.000 0.076) 0.625 2.831 ( -5.201 -0.000 0.854) 5.271 3.490 ( -1.259 -0.000 5.468) 5.611 3.512 ( 9.781 0.000 -4.115) 10.611 3.656 ( 2.026 0.000 -5.042) 5.434 3.958 ( 6.098 0.000 1.331) 6.241 4.090 ( 4.807 0.000 7.854) 9.208 4.211 ( 3.056 0.000 2.393) 3.881 4.401 ( 1.901 0.000 -6.791) 7.052 4.823 ( -10.003 -0.000 3.864) 10.723 5.150 ( -16.841 -0.000 -2.585) 17.038 5.329 ( -14.301 -0.000 -5.113) 15.188 5.547 ( -1.321 -0.000 2.447) 2.781 7.064 ( 5.382 0.000 16.043) 16.922 7.126 ( -11.269 -0.000 0.998) 11.313 8.216 ( -7.249 -0.000 9.466) 11.923 8.677 ( -0.009 -0.000 -0.047) 0.048 8.717 ( 6.209 0.000 -0.301) 6.217 9.097 ( -1.302 -0.000 -11.966) 12.037 9.639 ( 0.708 0.000 -0.738) 1.023 10.254 ( 6.529 0.000 4.633) 8.006 10.537 ( -0.119 -0.000 0.244) 0.272 10.689 ( -4.085 -0.000 0.480) 4.113 10.924 ( -8.465 -0.000 2.729) 8.894 11.698 ( -7.770 -0.000 -6.662) 10.235 15.434 ( 19.572 0.000 10.438) 22.181 15.855 ( 3.883 0.000 -6.249) 7.357 17.151 ( 7.857 0.000 -4.648) 9.129 17.179 ( 17.725 0.000 -5.618) 18.594 20.549 ( -0.073 -0.000 0.102) 0.125 20.809 ( 0.020 0.000 -0.031) 0.037 ======================= Grid point 570 (279/322) ======================= q-point: ( 0.38 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( 9.645 -4.745 -0.071) 10.749 1.939 ( 17.160 -12.904 -2.133) 21.576 2.395 ( 0.466 -9.211 0.117) 9.224 2.471 ( -6.227 -2.471 3.053) 7.362 2.765 ( -4.472 -10.575 1.871) 11.633 2.828 ( 20.467 -5.775 2.592) 21.424 2.916 ( -3.808 -9.828 1.128) 10.601 3.462 ( 5.949 -0.727 -2.801) 6.616 3.581 ( -2.529 -3.381 3.678) 5.600 3.979 ( 11.567 -9.608 -5.346) 15.959 4.038 ( -2.781 -15.833 -1.379) 16.134 4.223 ( 3.077 -10.213 5.802) 12.142 4.379 ( 6.602 -13.162 1.759) 14.829 4.430 ( -1.401 -6.443 -6.865) 9.518 4.778 ( -5.430 -0.478 5.678) 7.872 5.042 ( -13.889 0.321 -0.029) 13.893 5.243 ( -16.026 -1.869 -5.216) 16.957 5.527 ( -2.810 0.673 1.139) 3.106 6.961 ( -2.016 14.605 14.324) 20.556 7.017 ( -5.009 6.583 2.115) 8.538 8.066 ( -0.050 11.079 3.473) 11.610 8.430 ( -1.620 11.863 0.428) 11.980 8.899 ( -1.587 1.696 -6.042) 6.474 9.071 ( 3.068 -7.591 -3.411) 8.870 9.792 ( 1.998 -10.211 0.892) 10.443 10.280 ( 5.241 2.073 3.899) 6.853 10.376 ( -0.818 9.379 0.391) 9.423 10.836 ( -0.111 -1.638 1.637) 2.318 10.860 ( -9.819 -8.367 -0.061) 12.901 11.572 ( -5.625 7.091 -5.934) 10.823 15.485 ( 15.840 6.352 8.750) 19.178 15.809 ( 3.668 5.354 -4.840) 8.097 17.043 ( 13.077 17.446 -4.907) 22.349 17.142 ( 6.083 5.341 -1.626) 8.256 20.738 ( -0.950 -17.356 0.707) 17.397 21.113 ( -0.809 -25.963 -0.870) 25.991 ======================= Grid point 571 (280/322) ======================= q-point: ( 0.46 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( 11.228 -6.593 0.972) 13.057 2.274 ( 11.036 -11.567 -1.115) 16.026 2.499 ( -8.492 -5.163 3.342) 10.485 2.597 ( -3.480 -12.037 0.553) 12.542 2.967 ( -1.612 -10.426 1.730) 10.691 3.103 ( 16.642 -9.020 3.540) 19.258 3.139 ( -1.427 -13.029 1.188) 13.161 3.499 ( -3.760 2.587 1.507) 4.807 3.659 ( 9.642 -6.849 -0.653) 11.845 4.080 ( 1.571 -4.393 -1.109) 4.795 4.329 ( 8.583 -4.945 -1.289) 9.989 4.418 ( 3.375 0.038 -6.491) 7.316 4.430 ( -10.983 -4.852 -0.675) 12.025 4.818 ( -11.767 -7.516 0.848) 13.988 5.013 ( 12.037 -8.261 -0.549) 14.609 5.022 ( -7.870 -26.161 4.817) 27.741 5.345 ( -9.265 -20.649 -3.162) 22.852 5.557 ( -7.949 -13.190 0.862) 15.424 6.529 ( -4.727 26.660 10.347) 28.986 6.826 ( -5.153 8.909 -0.793) 10.322 7.898 ( 9.957 8.705 1.092) 13.271 8.229 ( -5.174 6.312 1.704) 8.337 8.719 ( -3.151 10.362 -6.743) 12.758 9.319 ( 4.077 -11.207 0.962) 11.965 9.899 ( 3.015 2.601 2.808) 4.872 10.074 ( -1.073 15.203 1.282) 15.294 10.418 ( 5.825 -5.284 0.815) 7.907 10.723 ( -8.942 2.333 0.648) 9.264 11.149 ( 0.389 -16.361 -0.588) 16.376 11.378 ( -5.011 6.437 -3.706) 8.960 15.439 ( 11.477 6.656 5.935) 14.535 15.702 ( 3.510 6.300 -3.580) 8.052 16.758 ( 6.977 14.547 -1.457) 16.199 17.046 ( 3.308 6.581 -1.608) 7.539 21.134 ( -1.417 -21.377 1.429) 21.472 21.626 ( -0.919 -23.729 -1.731) 23.809 ======================= Grid point 572 (281/322) ======================= q-point: ( 0.54 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 9.339 -1.746 2.592) 9.848 2.503 ( 3.047 -7.266 1.279) 7.982 2.578 ( -3.912 -5.652 2.534) 7.326 2.831 ( -0.858 -12.337 0.783) 12.392 3.160 ( 0.114 -9.383 1.096) 9.447 3.351 ( -0.530 -2.141 -1.177) 2.500 3.371 ( 7.737 -9.304 2.889) 12.441 3.403 ( -0.915 -3.403 2.274) 4.194 3.894 ( 8.367 -9.021 0.692) 12.323 4.190 ( 3.765 -5.391 -0.126) 6.577 4.290 ( -12.053 3.901 0.763) 12.692 4.412 ( 3.728 3.460 -2.083) 5.496 4.463 ( 1.095 -3.852 -5.602) 6.886 4.803 ( -14.170 0.597 -4.538) 14.891 5.062 ( 5.895 -4.334 3.818) 8.253 5.406 ( -3.983 -5.873 -0.430) 7.110 5.824 ( 1.601 -26.393 -0.379) 26.444 5.948 ( -9.105 11.067 2.815) 14.605 6.251 ( -1.108 -34.042 1.636) 34.099 6.648 ( -3.081 4.719 -0.999) 5.724 7.801 ( 10.673 8.718 3.761) 14.285 8.153 ( -4.132 -1.670 -0.032) 4.457 8.467 ( -2.690 12.074 -4.186) 13.059 9.497 ( 3.851 -2.801 2.681) 5.465 9.753 ( -0.986 14.146 1.314) 14.241 9.793 ( 1.085 9.460 0.432) 9.532 10.425 ( -1.378 4.443 -0.242) 4.658 10.681 ( -0.062 4.038 -0.744) 4.106 11.341 ( -2.323 -11.905 -1.655) 12.242 11.519 ( -1.299 -17.659 0.423) 17.712 15.398 ( 8.008 3.962 4.662) 10.077 15.602 ( 1.523 4.896 -3.176) 6.031 16.585 ( 2.737 5.636 -0.574) 6.291 16.932 ( 1.469 5.959 -1.283) 6.270 21.521 ( -0.817 -17.613 1.334) 17.682 21.980 ( -0.187 -12.510 -1.818) 12.643 ======================= Grid point 573 (282/322) ======================= q-point: (-0.38 -0.69 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 3.418 12.153 3.678) 13.149 2.599 ( 1.068 -0.765 3.934) 4.148 2.661 ( -1.454 -3.619 0.217) 3.906 3.054 ( -0.412 -10.054 1.698) 10.205 3.293 ( 2.361 0.508 -1.369) 2.776 3.339 ( -0.820 -8.127 0.879) 8.216 3.573 ( -0.258 -8.069 1.511) 8.214 3.598 ( 4.881 -8.910 0.095) 10.160 4.041 ( -1.259 -2.253 -0.297) 2.597 4.157 ( -4.637 2.875 0.893) 5.529 4.341 ( -2.047 1.353 -0.272) 2.468 4.352 ( 11.419 -3.714 2.162) 12.201 4.523 ( -0.290 -1.535 -3.160) 3.525 4.690 ( -11.806 0.283 -6.004) 13.248 5.199 ( 3.152 -4.997 0.546) 5.933 5.483 ( -1.621 -4.570 0.383) 4.864 5.630 ( -3.643 7.244 0.378) 8.117 6.164 ( -0.600 -3.437 -0.608) 3.541 6.680 ( -0.334 -8.326 -0.173) 8.334 6.976 ( -0.446 -30.832 -0.067) 30.835 7.702 ( 5.534 5.215 4.757) 8.969 8.184 ( -0.750 6.035 -4.254) 7.422 8.266 ( -1.933 -2.417 1.258) 3.341 9.395 ( 0.331 13.203 3.048) 13.554 9.550 ( 0.378 8.228 2.016) 8.480 9.633 ( -0.112 5.915 -2.136) 6.290 10.368 ( -2.159 -1.438 1.039) 2.794 10.527 ( 1.471 8.893 -2.371) 9.321 11.710 ( 0.497 -22.443 -0.493) 22.454 11.840 ( -1.232 -14.909 -0.132) 14.960 15.385 ( 5.266 2.427 4.158) 7.135 15.513 ( -1.181 3.779 -3.138) 5.052 16.553 ( 0.845 -0.803 -0.525) 1.279 16.825 ( 0.344 5.248 -1.094) 5.371 21.809 ( -0.143 -11.569 0.698) 11.591 22.124 ( 0.060 -3.058 -1.138) 3.263 ======================= Grid point 574 (283/322) ======================= q-point: (-0.31 -0.69 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( -0.619 22.544 3.280) 22.790 2.558 ( -0.028 4.891 3.391) 5.952 2.699 ( -0.469 -0.638 0.185) 0.814 3.218 ( -1.459 -6.415 4.076) 7.740 3.342 ( 1.539 -3.444 -2.720) 4.650 3.480 ( 1.084 -5.663 -0.237) 5.771 3.702 ( -2.671 -5.341 2.017) 6.304 3.775 ( 2.729 -6.725 -1.203) 7.356 3.998 ( -1.357 3.013 1.642) 3.690 4.104 ( -0.917 2.857 -2.692) 4.031 4.301 ( -0.242 0.095 0.017) 0.261 4.466 ( -0.374 5.274 -0.698) 5.333 4.516 ( 7.328 -4.698 5.538) 10.317 4.697 ( -5.783 -5.965 -7.915) 11.475 5.307 ( 0.378 -6.657 -0.826) 6.718 5.585 ( 0.145 -2.673 0.234) 2.687 5.587 ( -0.032 -4.441 0.165) 4.445 6.142 ( -0.476 2.401 -0.537) 2.506 6.797 ( 0.019 -2.524 -0.006) 2.524 7.297 ( -0.995 -1.185 1.289) 2.014 7.780 ( -0.844 -10.801 3.114) 11.272 8.003 ( 3.813 8.430 -3.407) 9.859 8.430 ( -1.504 -10.501 1.458) 10.708 9.129 ( -1.668 12.470 1.851) 12.717 9.373 ( 1.128 9.323 1.704) 9.544 9.524 ( -0.556 5.197 -1.178) 5.357 10.390 ( -0.138 2.531 -0.410) 2.568 10.482 ( 0.650 -7.058 -0.984) 7.155 12.069 ( 1.273 -8.705 -0.586) 8.817 12.144 ( -0.476 -19.547 -1.099) 19.583 15.350 ( 1.547 4.340 2.641) 5.310 15.443 ( -1.513 1.651 -1.955) 2.972 16.597 ( -0.376 -2.940 -0.512) 3.008 16.721 ( 0.274 5.387 -0.913) 5.471 21.980 ( 0.079 -5.847 0.019) 5.848 22.129 ( -0.100 1.629 -0.220) 1.647 ======================= Grid point 575 (284/322) ======================= q-point: (-0.23 -0.69 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( -1.617 17.922 3.140) 18.267 2.470 ( -0.614 3.093 2.927) 4.302 2.683 ( 0.673 2.190 0.112) 2.294 3.287 ( -4.444 -1.336 5.530) 7.219 3.407 ( 1.640 -2.429 -4.192) 5.115 3.564 ( 1.407 -1.936 -0.658) 2.482 3.741 ( -5.445 -0.189 3.539) 6.496 3.880 ( 1.106 -2.330 -2.475) 3.575 3.953 ( 1.831 1.861 1.328) 2.929 4.034 ( 1.894 3.028 -1.422) 3.845 4.314 ( -0.870 -1.232 -0.070) 1.510 4.370 ( 1.049 3.766 -0.825) 3.996 4.638 ( 3.065 -3.987 2.830) 5.771 4.777 ( 0.815 -4.215 -5.044) 6.623 5.480 ( -1.712 -9.187 -0.817) 9.381 5.617 ( -4.269 -4.809 1.042) 6.514 5.709 ( 7.490 -3.551 -0.484) 8.303 6.103 ( -0.814 0.751 -0.199) 1.125 6.817 ( -0.020 -0.733 0.047) 0.734 7.184 ( -7.329 7.752 2.068) 10.867 7.860 ( 2.617 3.491 -0.698) 4.418 8.001 ( 3.650 -4.358 -1.394) 5.853 8.561 ( 0.873 0.720 2.011) 2.308 8.978 ( -6.203 -2.161 3.485) 7.436 9.233 ( 2.881 5.311 0.352) 6.053 9.436 ( 0.011 2.655 -0.903) 2.805 10.370 ( 0.325 -0.129 -1.476) 1.517 10.616 ( 0.562 -4.243 -0.227) 4.286 12.176 ( 0.812 -1.708 -1.268) 2.277 12.445 ( 0.187 -10.383 -1.348) 10.472 15.252 ( -0.895 5.420 0.809) 5.553 15.411 ( -0.623 1.271 -0.321) 1.451 16.603 ( -1.468 4.710 -0.464) 4.955 16.656 ( 1.656 -1.095 -0.691) 2.102 22.049 ( -0.118 -1.377 -0.046) 1.382 22.091 ( 0.017 1.421 0.063) 1.423 ======================= Grid point 576 (285/322) ======================= q-point: (-0.15 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 0.382 -2.653 3.694) 4.564 2.461 ( -1.183 -2.067 2.634) 3.552 2.630 ( 2.330 3.867 0.312) 4.526 3.249 ( -6.104 2.169 4.233) 7.739 3.430 ( 3.566 1.345 -3.585) 5.232 3.565 ( 2.342 2.689 -0.687) 3.631 3.663 ( -5.898 4.828 3.709) 8.476 3.843 ( -3.117 4.684 0.490) 5.647 3.947 ( 3.722 0.351 -0.578) 3.783 4.021 ( 5.889 1.758 -1.505) 6.328 4.322 ( -1.830 -0.030 -3.064) 3.569 4.339 ( 2.594 0.436 2.454) 3.597 4.720 ( -2.151 -4.085 -3.252) 5.647 4.852 ( 5.183 -2.029 0.100) 5.566 5.535 ( -8.215 -1.832 0.420) 8.427 5.751 ( 7.085 -1.096 -0.474) 7.185 5.864 ( -0.455 -13.553 -0.317) 13.564 6.113 ( -0.784 -2.455 0.448) 2.616 6.843 ( -1.412 -1.701 0.176) 2.217 6.955 ( -9.468 9.413 1.419) 13.426 7.819 ( 7.037 3.927 -0.979) 8.118 8.039 ( 3.425 2.506 -1.258) 4.427 8.468 ( 0.304 5.380 1.076) 5.495 9.060 ( -7.989 -5.413 5.606) 11.160 9.247 ( 1.848 -5.316 1.927) 5.949 9.443 ( 1.867 -3.734 -3.186) 5.252 10.368 ( 0.172 0.346 -1.546) 1.593 10.619 ( 0.800 4.307 -0.145) 4.383 12.143 ( 1.024 5.265 -1.688) 5.623 12.532 ( -1.274 1.282 -1.150) 2.143 15.144 ( -0.296 5.044 0.622) 5.091 15.378 ( 0.273 1.819 -0.216) 1.852 16.494 ( 1.218 5.611 -0.285) 5.749 16.685 ( 0.924 -0.937 -0.694) 1.488 22.047 ( 0.107 1.614 -0.115) 1.622 22.083 ( 0.031 -0.885 0.142) 0.897 ======================= Grid point 577 (286/322) ======================= q-point: (-0.08 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.374 ( 3.670 -14.215 3.937) 15.200 2.485 ( -0.658 2.548 1.537) 3.048 2.591 ( 3.029 -0.108 1.470) 3.369 3.163 ( -3.960 3.801 2.786) 6.156 3.379 ( 5.852 6.260 -2.660) 8.972 3.494 ( 3.607 7.717 3.177) 9.092 3.518 ( -6.343 4.142 0.091) 7.576 3.697 ( -3.451 7.771 1.366) 8.612 3.957 ( 2.614 3.000 -0.701) 4.040 4.003 ( 8.864 2.311 -1.777) 9.331 4.298 ( -1.240 1.137 -2.770) 3.241 4.357 ( 1.790 -0.083 2.758) 3.289 4.762 ( -5.748 -3.220 -6.383) 9.174 4.923 ( 4.337 -2.146 2.095) 5.273 5.514 ( -5.538 -0.140 1.323) 5.696 5.733 ( 1.410 4.331 -1.747) 4.879 6.139 ( -8.442 -14.164 -0.885) 16.513 6.179 ( -2.778 -3.859 0.634) 4.797 6.749 ( -2.031 3.676 2.345) 4.810 6.876 ( 0.491 0.129 0.154) 0.531 7.709 ( -2.310 11.743 -0.981) 12.008 7.973 ( 14.207 7.163 0.142) 15.911 8.431 ( -3.887 -3.327 -2.206) 5.572 9.130 ( -2.027 -4.722 4.984) 7.159 9.383 ( -3.010 -7.306 6.139) 10.006 9.578 ( 2.215 -7.497 -5.280) 9.433 10.379 ( 0.291 -2.500 -1.270) 2.819 10.490 ( 1.393 7.726 -0.243) 7.854 11.986 ( 0.346 10.417 -1.637) 10.550 12.379 ( -3.182 12.388 -0.495) 12.800 15.059 ( 1.505 3.914 0.816) 4.272 15.347 ( 2.712 2.044 -0.555) 3.441 16.406 ( 3.056 4.321 0.064) 5.293 16.707 ( 1.865 -0.797 -0.885) 2.213 21.977 ( -0.167 5.494 0.080) 5.497 22.125 ( 0.390 -2.535 -0.306) 2.583 ======================= Grid point 583 (287/322) ======================= q-point: ( 0.38 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( 11.902 0.000 0.256) 11.905 1.899 ( 19.026 0.000 -2.487) 19.188 2.299 ( -0.113 -0.000 -0.113) 0.160 2.389 ( -14.942 -0.000 2.894) 15.219 2.596 ( -5.672 -0.000 1.257) 5.809 2.773 ( -4.940 -0.000 0.267) 4.947 2.938 ( 26.567 0.000 4.846) 27.005 3.494 ( -1.061 -0.000 6.128) 6.219 3.593 ( 4.656 0.000 -2.486) 5.278 3.660 ( 1.382 0.000 -5.408) 5.582 3.986 ( 3.740 0.000 -2.900) 4.733 4.112 ( -0.462 -0.000 1.870) 1.926 4.328 ( 5.779 0.000 2.550) 6.316 4.407 ( 3.628 0.000 -6.190) 7.174 4.718 ( -13.106 -0.000 3.254) 13.504 4.981 ( -8.747 -0.000 3.219) 9.321 5.155 ( -9.547 -0.000 -4.355) 10.493 5.520 ( -4.339 -0.000 0.053) 4.339 7.018 ( -7.378 -0.000 0.912) 7.434 7.187 ( 6.097 0.000 17.837) 18.850 8.154 ( -7.160 -0.000 6.469) 9.649 8.689 ( 1.905 0.000 0.456) 1.959 8.774 ( 3.638 0.000 -0.289) 3.650 9.032 ( -3.198 -0.000 -12.343) 12.750 9.645 ( 0.553 0.000 -0.616) 0.828 10.336 ( 5.464 0.000 2.820) 6.149 10.536 ( -0.024 -0.000 0.193) 0.194 10.634 ( -4.784 -0.000 0.609) 4.823 10.848 ( -5.790 -0.000 1.775) 6.056 11.609 ( -4.085 -0.000 -5.549) 6.891 15.662 ( 12.842 0.000 10.371) 16.507 15.872 ( 2.120 0.000 -4.398) 4.883 17.211 ( 4.563 0.000 -3.560) 5.787 17.351 ( 13.668 0.000 -5.290) 14.656 20.549 ( -0.049 -0.000 0.098) 0.110 20.809 ( 0.016 0.000 -0.031) 0.035 ======================= Grid point 584 (288/322) ======================= q-point: ( 0.46 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( 12.661 -4.491 0.683) 13.451 2.125 ( 15.126 -10.214 -2.026) 18.364 2.333 ( -15.047 -4.190 3.022) 15.909 2.363 ( -6.680 -7.935 0.818) 10.405 2.743 ( 0.066 -12.060 1.942) 12.215 2.854 ( -4.064 -11.421 -0.444) 12.131 3.113 ( 19.262 -2.347 5.142) 20.074 3.505 ( 0.674 1.442 -1.836) 2.430 3.591 ( 4.508 -6.843 3.914) 9.082 3.966 ( -6.599 -12.180 -3.376) 14.258 4.103 ( 9.392 -13.847 -1.875) 16.836 4.254 ( 3.495 -11.356 0.056) 11.882 4.376 ( -3.433 -5.931 -6.014) 9.118 4.460 ( 0.575 -7.832 -0.308) 7.859 4.672 ( -11.830 -3.450 4.084) 12.982 4.964 ( -7.391 -4.331 0.857) 8.609 5.108 ( 2.628 1.860 0.425) 3.248 5.473 ( -6.367 1.001 -1.447) 6.606 6.912 ( -5.306 7.839 3.573) 10.118 7.059 ( 2.599 17.623 12.298) 21.646 8.073 ( -0.577 4.665 2.936) 5.542 8.411 ( -1.477 15.134 -0.019) 15.206 8.856 ( -1.703 5.099 -6.879) 8.731 9.098 ( 2.231 -11.830 -1.571) 12.141 9.815 ( 1.484 -11.792 0.381) 11.891 10.332 ( 1.302 8.683 2.305) 9.078 10.386 ( 2.630 2.463 0.245) 3.612 10.735 ( -8.712 1.394 0.650) 8.847 10.855 ( 0.630 -10.937 0.583) 10.971 11.509 ( -2.489 6.967 -4.467) 8.642 15.660 ( 8.902 7.136 7.885) 13.868 15.827 ( 1.775 4.810 -3.582) 6.255 17.149 ( 6.566 13.594 -3.249) 15.442 17.200 ( 4.766 11.412 -2.885) 12.699 20.731 ( -0.560 -16.874 0.624) 16.895 21.105 ( -0.021 -25.355 -0.899) 25.371 ======================= Grid point 585 (289/322) ======================= q-point: (-0.46 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 7.550 -5.771 1.501) 9.621 2.362 ( 1.687 -8.288 1.452) 8.581 2.400 ( -6.291 -8.408 2.215) 10.732 2.564 ( -1.300 -13.961 0.093) 14.021 2.959 ( -0.320 -10.479 1.164) 10.548 3.126 ( -0.364 -14.465 0.202) 14.471 3.278 ( 9.484 -5.569 2.700) 11.325 3.457 ( -3.236 3.208 0.534) 4.588 3.800 ( 12.563 -7.378 2.035) 14.711 4.084 ( -2.008 -6.395 -2.411) 7.123 4.255 ( -9.978 -1.068 1.046) 10.089 4.361 ( -3.860 -3.405 -5.921) 7.845 4.492 ( 5.708 -0.208 -1.385) 5.877 4.686 ( -6.947 -5.651 -0.501) 8.969 4.988 ( -0.206 -21.888 4.580) 22.363 5.135 ( 3.537 -15.312 -3.106) 16.020 5.273 ( 2.563 -23.317 1.230) 23.489 5.470 ( -6.856 -12.263 -1.072) 14.091 6.523 ( -1.411 28.379 9.771) 30.047 6.782 ( -1.628 9.491 -2.082) 9.853 8.014 ( 8.242 4.676 2.246) 9.739 8.153 ( -8.403 7.642 1.989) 11.531 8.677 ( -0.519 10.245 -5.957) 11.862 9.359 ( 2.018 -11.721 0.516) 11.904 9.937 ( 2.408 2.343 0.956) 3.493 10.067 ( -0.566 15.798 1.155) 15.851 10.495 ( 6.946 -3.715 1.126) 7.957 10.609 ( -9.883 -0.268 0.043) 9.887 11.159 ( 0.851 -17.255 0.051) 17.276 11.325 ( -2.040 7.884 -2.886) 8.640 15.560 ( 5.866 7.344 5.363) 10.822 15.713 ( -0.018 6.175 -3.213) 6.961 16.813 ( 2.800 16.272 -1.297) 16.562 17.065 ( 0.878 6.805 -1.614) 7.049 21.125 ( -0.750 -21.378 1.345) 21.433 21.618 ( 0.658 -23.589 -2.109) 23.693 ======================= Grid point 586 (290/322) ======================= q-point: (-0.38 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -1.380 -1.142 2.969) 3.467 2.525 ( 0.626 -7.041 2.597) 7.531 2.547 ( -1.675 -7.274 1.774) 7.672 2.833 ( 0.735 -12.506 0.026) 12.528 3.162 ( -0.212 -9.620 0.873) 9.662 3.341 ( 0.250 0.649 -0.855) 1.102 3.396 ( -1.467 -7.852 1.812) 8.190 3.457 ( 4.810 -7.243 -0.571) 8.713 3.978 ( 3.882 -4.583 0.162) 6.009 4.164 ( -5.359 -1.035 -0.502) 5.481 4.258 ( 3.184 -4.963 5.114) 7.805 4.389 ( -8.686 -5.035 -5.972) 11.682 4.463 ( 4.283 4.097 -1.712) 6.169 4.677 ( -3.128 1.927 -1.374) 3.922 5.147 ( 4.530 -3.173 1.000) 5.620 5.363 ( -1.390 -5.699 -0.757) 5.914 5.835 ( -1.032 -28.615 -0.316) 28.635 5.895 ( 0.610 10.828 2.333) 11.093 6.258 ( 1.388 -31.308 0.808) 31.349 6.624 ( -0.375 4.318 -0.940) 4.435 7.887 ( -0.135 10.063 4.642) 11.083 8.102 ( -2.810 -4.151 0.664) 5.057 8.449 ( 1.919 11.874 -4.576) 12.869 9.537 ( 1.392 -4.163 1.758) 4.729 9.734 ( -1.595 16.308 0.285) 16.389 9.815 ( 1.851 9.704 0.012) 9.878 10.405 ( -2.021 5.578 1.405) 6.097 10.686 ( 1.562 2.793 -1.910) 3.727 11.319 ( -1.113 -12.589 -0.328) 12.642 11.515 ( 0.591 -17.672 -0.160) 17.683 15.478 ( 2.954 4.190 3.952) 6.472 15.586 ( -2.559 5.291 -2.886) 6.548 16.598 ( -0.290 6.097 -0.353) 6.114 16.936 ( -0.032 6.094 -1.046) 6.183 21.518 ( -0.305 -17.780 1.257) 17.827 21.978 ( 0.923 -12.397 -2.086) 12.605 ======================= Grid point 587 (291/322) ======================= q-point: (-0.31 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( -4.725 11.915 3.380) 13.255 2.621 ( -0.001 0.165 2.563) 2.569 2.645 ( -0.733 -4.641 1.126) 4.832 3.054 ( -0.756 -9.630 1.590) 9.790 3.279 ( -1.952 -2.297 -0.007) 3.014 3.367 ( 3.549 -5.949 -1.722) 7.138 3.565 ( -1.904 -7.520 1.503) 7.901 3.627 ( 0.201 -8.455 -1.777) 8.642 4.032 ( 0.325 -0.477 0.643) 0.864 4.153 ( 3.716 1.376 1.004) 4.088 4.308 ( -4.712 1.951 1.372) 5.281 4.460 ( -6.892 -6.251 -4.350) 10.272 4.479 ( 4.392 -4.491 -1.270) 6.408 4.615 ( 5.432 3.415 1.084) 6.507 5.220 ( -0.171 -3.518 -1.507) 3.831 5.486 ( 1.848 -5.255 0.000) 5.570 5.624 ( 2.714 7.476 1.091) 8.027 6.161 ( 0.432 -3.048 -0.356) 3.099 6.679 ( 0.291 -8.513 -0.123) 8.519 6.977 ( 0.706 -30.310 -0.195) 30.319 7.707 ( -6.855 5.212 4.368) 9.655 8.174 ( 0.432 1.447 -2.730) 3.120 8.276 ( 3.551 1.284 -0.368) 3.794 9.403 ( -0.430 15.140 2.882) 15.418 9.552 ( -0.857 5.174 0.889) 5.319 9.632 ( 0.849 7.941 -1.598) 8.145 10.355 ( -0.742 -1.693 1.938) 2.678 10.536 ( 1.585 8.797 -2.989) 9.425 11.706 ( -0.934 -22.787 -0.166) 22.807 11.845 ( 2.306 -14.817 -0.627) 15.009 15.436 ( 1.167 2.376 3.859) 4.679 15.466 ( -4.931 3.941 -3.279) 7.113 16.548 ( -1.498 -0.761 -0.034) 1.680 16.823 ( -0.190 5.166 -0.908) 5.248 21.810 ( 0.040 -11.595 0.578) 11.610 22.124 ( 0.393 -2.893 -1.078) 3.112 ======================= Grid point 588 (292/322) ======================= q-point: (-0.23 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( -4.550 21.759 3.010) 22.432 2.560 ( -1.110 4.951 2.381) 5.605 2.702 ( 0.726 -1.040 0.550) 1.383 3.192 ( -6.036 -5.466 3.899) 9.028 3.338 ( 1.777 -4.223 -3.652) 5.860 3.497 ( 1.241 -5.025 -0.450) 5.196 3.673 ( -3.023 -4.570 3.076) 6.284 3.777 ( -1.180 -7.006 -2.592) 7.563 4.026 ( 3.941 2.469 2.656) 5.355 4.118 ( 3.618 4.171 -0.977) 5.607 4.270 ( -4.042 -1.472 -0.099) 4.303 4.471 ( 1.385 4.362 -0.048) 4.577 4.546 ( -3.626 -5.652 -4.128) 7.883 4.700 ( 8.106 -4.825 0.937) 9.480 5.317 ( 1.437 -6.520 -1.133) 6.772 5.522 ( -1.915 -1.897 0.859) 2.829 5.677 ( 6.831 -4.428 -0.494) 8.156 6.138 ( 0.004 2.783 0.226) 2.792 6.800 ( 0.334 -2.461 0.017) 2.484 7.246 ( -8.001 1.467 1.933) 8.361 7.744 ( -4.941 -11.581 1.301) 12.658 8.068 ( 7.712 6.246 -4.832) 11.038 8.429 ( -0.268 -10.754 2.600) 11.067 9.113 ( -1.614 13.795 3.137) 14.239 9.393 ( 1.508 8.832 0.456) 8.972 9.515 ( -0.506 5.024 -0.565) 5.080 10.385 ( -0.457 1.770 -0.307) 1.853 10.494 ( 1.844 -6.242 -1.236) 6.625 12.050 ( -2.895 -11.446 -1.541) 11.907 12.172 ( 4.811 -16.547 -0.582) 17.243 15.344 ( -3.456 4.767 0.014) 5.888 15.419 ( -1.733 0.556 0.393) 1.862 16.577 ( -2.653 -2.609 0.078) 3.722 16.727 ( 0.950 4.530 -0.914) 4.717 21.980 ( 0.000 -5.733 -0.075) 5.733 22.127 ( -0.118 1.616 -0.043) 1.621 ======================= Grid point 589 (293/322) ======================= q-point: (-0.15 -0.62 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.305 ( -2.485 16.422 3.449) 16.963 2.470 ( -0.841 2.988 2.574) 4.033 2.702 ( 2.384 1.802 0.232) 2.998 3.217 ( -8.800 -1.496 3.114) 9.454 3.427 ( 3.698 -2.893 -4.007) 6.172 3.564 ( -1.420 -1.694 0.480) 2.262 3.710 ( -1.779 0.271 4.976) 5.292 3.859 ( -2.241 -1.990 -1.969) 3.586 3.997 ( 3.599 2.421 0.018) 4.337 4.079 ( 5.174 1.840 1.559) 5.708 4.288 ( -1.585 -1.573 -1.521) 2.702 4.401 ( 2.877 3.449 0.601) 4.531 4.618 ( -3.717 -4.317 -5.224) 7.730 4.829 ( 5.708 -3.630 0.062) 6.765 5.439 ( -3.039 -4.375 0.233) 5.332 5.625 ( 4.496 -8.608 1.271) 9.795 5.779 ( 4.065 -2.302 -1.685) 4.966 6.096 ( -0.432 0.985 0.812) 1.348 6.816 ( -0.637 -0.252 0.290) 0.744 7.063 ( -12.262 7.998 1.520) 14.718 7.877 ( -0.288 -2.007 -0.167) 2.034 8.053 ( 6.502 -0.742 -4.277) 7.818 8.607 ( 4.449 -1.065 3.611) 5.828 8.901 ( -7.650 1.804 4.157) 8.892 9.268 ( 2.401 4.359 0.425) 4.994 9.434 ( 0.071 2.182 -0.963) 2.386 10.369 ( 0.178 -0.124 -1.534) 1.549 10.626 ( 1.101 -4.079 -0.260) 4.233 12.173 ( -0.460 -2.654 -2.284) 3.532 12.452 ( 1.592 -8.734 -0.683) 8.904 15.235 ( -2.153 4.495 0.437) 5.003 15.398 ( -1.326 0.662 0.034) 1.482 16.580 ( -2.023 1.775 -0.206) 2.699 16.676 ( 1.905 0.655 -0.753) 2.151 22.047 ( -0.194 -1.441 0.046) 1.455 22.092 ( -0.007 1.345 0.023) 1.345 ======================= Grid point 590 (294/322) ======================= q-point: (-0.08 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( 2.135 -4.731 4.499) 6.869 2.456 ( -0.959 -1.468 2.710) 3.227 2.671 ( 4.263 3.114 0.482) 5.301 3.178 ( -6.728 0.755 1.780) 7.000 3.465 ( 2.931 0.619 -4.090) 5.070 3.548 ( -3.813 1.928 2.524) 4.963 3.659 ( 2.119 5.408 4.906) 7.603 3.813 ( -2.175 4.745 0.273) 5.227 3.987 ( 3.278 0.555 -1.163) 3.522 4.095 ( 6.569 1.142 1.020) 6.745 4.298 ( -0.314 -0.257 -2.646) 2.677 4.378 ( 2.530 0.853 1.785) 3.211 4.654 ( -5.562 -3.158 -6.844) 9.368 4.907 ( 2.379 -1.958 -0.494) 3.121 5.474 ( -2.025 -1.447 1.862) 3.108 5.797 ( 0.075 1.567 -2.264) 2.754 5.856 ( -0.208 -11.088 0.020) 11.090 6.105 ( -0.902 -2.066 1.092) 2.505 6.792 ( -6.525 2.216 1.146) 6.985 6.888 ( -1.535 2.423 0.511) 2.913 7.861 ( 0.439 4.049 -0.631) 4.121 8.103 ( 6.916 -0.744 -3.457) 7.767 8.493 ( 3.607 10.298 2.470) 11.187 8.983 ( -8.073 -8.940 6.193) 13.544 9.268 ( 0.557 -2.988 2.357) 3.846 9.453 ( 1.409 -4.314 -3.425) 5.685 10.365 ( 0.138 0.344 -1.495) 1.540 10.630 ( 0.921 4.241 -0.085) 4.341 12.146 ( 0.606 4.970 -2.543) 5.616 12.512 ( -1.537 2.696 -0.357) 3.123 15.147 ( 0.452 3.943 1.112) 4.122 15.381 ( 0.517 0.657 -0.595) 1.026 16.512 ( 1.847 4.197 -0.275) 4.594 16.695 ( 1.043 -1.116 -0.899) 1.772 22.048 ( 0.101 1.722 -0.238) 1.741 22.085 ( 0.118 -1.168 0.217) 1.194 ======================= Grid point 597 (295/322) ======================= q-point: (-0.54 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 12.934 0.000 1.053) 12.976 2.095 ( 14.383 0.000 -2.191) 14.549 2.199 ( -16.448 -0.000 3.522) 16.821 2.232 ( -10.372 -0.000 1.206) 10.442 2.581 ( 2.195 0.000 0.187) 2.203 2.722 ( -3.210 -0.000 -0.286) 3.223 3.231 ( 18.452 0.000 6.088) 19.430 3.502 ( -0.933 -0.000 6.554) 6.620 3.580 ( -5.042 -0.000 -2.801) 5.768 3.656 ( 0.682 0.000 -5.512) 5.554 4.070 ( 8.145 0.000 2.389) 8.488 4.130 ( 3.907 0.000 -1.481) 4.178 4.307 ( -5.065 -0.000 -3.514) 6.165 4.350 ( -15.949 -0.000 -3.300) 16.287 4.637 ( 4.876 0.000 4.746) 6.804 4.887 ( -8.657 -0.000 -4.147) 9.600 5.173 ( 10.164 0.000 3.946) 10.904 5.445 ( -7.282 -0.000 -2.536) 7.711 6.962 ( -2.506 -0.000 0.719) 2.608 7.303 ( 3.759 0.000 17.227) 17.632 8.097 ( -4.390 -0.000 3.856) 5.843 8.722 ( 2.823 0.000 1.666) 3.278 8.801 ( 1.134 0.000 -0.219) 1.155 8.953 ( -3.557 -0.000 -12.028) 12.543 9.647 ( 0.083 0.000 -0.372) 0.381 10.396 ( 3.616 0.000 0.730) 3.689 10.537 ( 0.118 0.000 0.050) 0.128 10.590 ( -2.782 -0.000 1.102) 2.993 10.802 ( -2.652 -0.000 1.494) 3.044 11.564 ( -1.352 -0.000 -3.953) 4.177 15.783 ( 2.795 0.000 7.017) 7.553 15.891 ( 3.270 0.000 -2.264) 3.978 17.236 ( 1.350 0.000 -2.699) 3.017 17.458 ( 6.995 0.000 -5.677) 9.009 20.549 ( -0.017 -0.000 0.084) 0.086 20.809 ( 0.010 0.000 -0.030) 0.032 ======================= Grid point 598 (296/322) ======================= q-point: (-0.46 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -4.103 -3.069 2.165) 5.562 2.203 ( 0.452 -6.501 2.819) 7.100 2.241 ( -9.124 -6.267 2.022) 11.252 2.295 ( 8.544 -11.282 -1.544) 14.237 2.774 ( 3.474 -9.458 1.483) 10.185 2.813 ( -1.683 -14.393 -1.781) 14.601 3.275 ( 5.007 0.898 2.443) 5.643 3.481 ( -2.512 1.354 -0.127) 2.856 3.692 ( 7.120 -11.165 3.806) 13.778 3.859 ( -7.437 -12.467 -5.182) 15.414 4.163 ( -3.690 -5.025 7.852) 10.026 4.280 ( -14.844 -4.517 -1.445) 15.583 4.337 ( -3.827 -13.235 -2.663) 14.032 4.353 ( 11.534 -14.458 -3.542) 18.831 4.707 ( 9.939 -2.814 4.236) 11.165 4.848 ( -5.432 -2.632 -6.017) 8.523 5.241 ( 10.583 -0.445 3.229) 11.074 5.378 ( -6.358 1.679 -3.115) 7.276 6.888 ( -0.283 6.982 2.549) 7.438 7.120 ( 1.412 21.151 10.168) 23.511 8.069 ( -1.484 1.295 3.113) 3.683 8.398 ( -0.816 17.496 0.303) 17.518 8.826 ( 0.193 5.491 -6.056) 8.177 9.108 ( 0.081 -13.584 -1.036) 13.624 9.828 ( 0.690 -13.066 -0.299) 13.088 10.342 ( 0.359 11.662 1.121) 11.721 10.416 ( 1.488 -1.049 -0.671) 1.940 10.669 ( -2.506 3.173 2.363) 4.683 10.863 ( 0.552 -11.433 0.038) 11.446 11.481 ( -0.481 6.927 -3.076) 7.594 15.738 ( 0.978 5.945 5.962) 8.476 15.831 ( 0.498 6.316 -3.265) 7.128 17.181 ( 0.620 6.106 -1.472) 6.311 17.224 ( 0.612 20.077 -4.414) 20.565 20.729 ( -0.144 -16.674 0.589) 16.685 21.107 ( 1.035 -25.452 -1.430) 25.513 ======================= Grid point 599 (297/322) ======================= q-point: (-0.38 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( -11.504 -6.427 3.434) 13.618 2.348 ( -8.155 -9.303 2.124) 12.553 2.403 ( 8.645 -8.331 2.525) 12.269 2.582 ( 3.880 -13.309 -1.488) 13.943 2.968 ( 1.381 -10.077 0.426) 10.180 3.132 ( 1.300 -14.613 -0.370) 14.676 3.308 ( -5.409 -3.575 -0.053) 6.484 3.464 ( 4.648 1.213 -0.213) 4.809 3.866 ( -9.388 -6.674 -3.477) 12.032 4.025 ( 1.320 -8.056 1.592) 8.317 4.227 ( -0.488 -1.926 7.325) 7.590 4.264 ( -6.266 -2.966 -0.363) 6.941 4.521 ( -0.770 -1.951 -3.119) 3.759 4.684 ( 6.799 -3.544 -0.164) 7.669 5.043 ( 7.616 -17.280 0.184) 18.885 5.106 ( -3.443 -27.262 -1.778) 27.536 5.313 ( -2.663 -8.539 -2.191) 9.209 5.456 ( 8.266 -18.536 0.020) 20.295 6.553 ( 1.663 29.060 8.082) 30.209 6.778 ( 2.414 9.971 -2.809) 10.637 8.022 ( -10.326 2.868 1.922) 10.888 8.126 ( 4.898 9.361 3.911) 11.266 8.671 ( 2.266 9.598 -5.228) 11.162 9.367 ( -0.825 -12.070 -0.260) 12.101 9.959 ( 1.312 2.112 -1.215) 2.767 10.069 ( 0.398 16.162 1.031) 16.200 10.501 ( -8.191 -0.145 0.567) 8.212 10.592 ( 8.763 -4.030 1.744) 9.802 11.159 ( -1.112 -16.292 -0.026) 16.330 11.314 ( 1.381 7.072 -1.835) 7.435 15.606 ( -0.509 7.440 3.526) 8.249 15.681 ( -3.826 6.556 -2.684) 8.051 16.811 ( -2.573 16.525 -1.125) 16.762 17.059 ( -1.190 6.568 -1.023) 6.752 21.125 ( -0.084 -21.383 1.393) 21.429 21.629 ( 2.467 -23.408 -3.096) 23.741 ======================= Grid point 600 (298/322) ======================= q-point: (-0.31 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -11.762 -2.907 3.692) 12.666 2.492 ( -6.191 -8.818 1.787) 10.921 2.590 ( 5.234 -4.892 2.016) 7.442 2.844 ( 1.437 -11.628 -0.682) 11.736 3.166 ( 0.850 -8.489 0.653) 8.557 3.332 ( -3.247 -1.739 0.449) 3.710 3.387 ( 0.269 -10.398 -0.113) 10.402 3.486 ( 1.957 -2.500 -3.706) 4.880 3.939 ( -7.903 -7.659 -3.657) 11.597 4.174 ( 1.157 -5.555 2.762) 6.310 4.230 ( -5.968 -1.440 2.963) 6.817 4.343 ( 1.815 -2.570 3.867) 4.985 4.480 ( 0.787 2.308 -4.552) 5.164 4.735 ( 10.529 2.532 2.214) 11.053 5.135 ( -4.106 -2.771 -3.586) 6.116 5.398 ( 6.096 -6.372 0.292) 8.823 5.819 ( -0.612 -23.776 0.273) 23.785 5.959 ( 8.015 7.173 1.721) 10.893 6.283 ( 2.806 -30.716 -1.103) 30.864 6.636 ( 2.797 4.742 -0.259) 5.512 7.814 ( -12.335 8.807 3.109) 15.472 8.108 ( 1.473 -1.831 3.111) 3.899 8.477 ( 4.682 10.765 -4.567) 12.596 9.533 ( -2.540 -5.000 -0.534) 5.634 9.730 ( 0.377 17.359 2.266) 17.511 9.831 ( 1.434 9.773 -2.142) 10.107 10.390 ( -1.704 4.374 2.850) 5.492 10.706 ( 2.915 4.342 -2.764) 5.915 11.313 ( -0.007 -13.521 0.997) 13.557 11.531 ( 2.225 -17.447 -0.678) 17.602 15.476 ( -5.215 3.999 -1.288) 6.697 15.538 ( -3.974 5.251 1.512) 6.757 16.577 ( -3.036 5.701 0.130) 6.460 16.925 ( -1.477 5.820 -0.655) 6.040 21.522 ( 0.172 -17.757 1.278) 17.804 21.989 ( 2.051 -11.841 -2.637) 12.303 ======================= Grid point 601 (299/322) ======================= q-point: (-0.23 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( -10.341 9.675 3.070) 14.490 2.600 ( -3.857 -3.005 0.669) 4.935 2.656 ( 0.547 -1.699 1.961) 2.652 3.039 ( -2.352 -7.595 1.664) 8.123 3.277 ( 2.086 -2.720 -1.014) 3.575 3.392 ( 1.206 -5.697 -0.801) 5.878 3.543 ( -1.879 -6.895 0.139) 7.148 3.604 ( -2.242 -8.569 -2.987) 9.347 4.045 ( 0.733 -4.423 0.013) 4.483 4.212 ( -10.215 0.570 -0.081) 10.231 4.237 ( 8.382 2.022 2.843) 9.079 4.381 ( -3.470 -5.294 -2.725) 6.891 4.498 ( -0.063 -1.950 -0.878) 2.139 4.737 ( 9.663 2.581 3.560) 10.616 5.208 ( 1.105 -5.719 -2.114) 6.197 5.533 ( 5.880 -2.370 -0.108) 6.341 5.686 ( 6.538 7.058 0.910) 9.664 6.174 ( 1.777 -2.635 -0.059) 3.178 6.685 ( 0.780 -8.190 0.024) 8.227 6.991 ( 1.890 -27.471 -0.231) 27.537 7.591 ( -13.449 4.087 2.247) 14.235 8.177 ( 0.541 -2.633 0.644) 2.764 8.323 ( 3.954 4.962 -2.318) 6.754 9.404 ( -0.692 14.635 1.446) 14.723 9.543 ( -1.066 4.056 2.357) 4.810 9.639 ( 1.318 8.981 -2.435) 9.398 10.359 ( -0.100 -1.517 2.687) 3.087 10.545 ( 1.624 8.577 -3.535) 9.418 11.691 ( -1.326 -20.542 0.129) 20.585 11.886 ( 4.754 -16.641 -1.075) 17.341 15.374 ( -8.136 2.210 -4.149) 9.396 15.442 ( -2.459 2.850 4.239) 5.669 16.520 ( -3.203 -0.803 0.456) 3.333 16.814 ( -1.072 4.531 -0.624) 4.698 21.813 ( 0.188 -11.431 0.490) 11.443 22.127 ( 0.712 -2.426 -1.085) 2.751 ======================= Grid point 602 (300/322) ======================= q-point: (-0.15 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( -7.398 19.475 2.541) 20.988 2.548 ( -1.767 4.361 1.545) 4.952 2.711 ( -0.103 -2.177 0.619) 2.266 3.118 ( -6.416 -3.458 2.544) 7.720 3.366 ( 3.743 -4.381 -3.636) 6.814 3.504 ( -0.003 -4.232 1.075) 4.367 3.656 ( -1.343 -5.068 2.262) 5.710 3.744 ( -2.561 -7.144 -3.281) 8.268 4.077 ( 1.697 3.481 2.010) 4.364 4.139 ( -0.806 0.114 -0.022) 0.814 4.261 ( 4.691 0.059 1.240) 4.853 4.462 ( -6.020 -2.979 -4.863) 8.292 4.497 ( 0.219 -0.686 0.088) 0.726 4.792 ( 5.787 -2.587 1.107) 6.435 5.343 ( 4.328 -5.542 0.395) 7.042 5.572 ( 9.421 -0.783 1.710) 9.607 5.727 ( 2.254 -4.014 -1.935) 4.994 6.145 ( 0.971 3.455 0.767) 3.670 6.803 ( 0.107 -2.205 0.202) 2.217 7.134 ( -11.206 5.537 1.679) 12.611 7.692 ( -3.478 -14.337 -0.724) 14.770 8.141 ( 6.994 5.326 -3.761) 9.562 8.415 ( -4.302 -11.561 2.680) 12.624 9.124 ( 1.945 14.586 3.088) 15.036 9.406 ( 0.468 7.931 0.472) 7.959 9.509 ( -0.191 5.169 -0.423) 5.190 10.378 ( -0.468 1.372 -0.365) 1.495 10.513 ( 1.845 -5.691 -1.314) 6.125 12.009 ( -3.126 -12.539 -1.330) 12.991 12.236 ( 6.138 -14.640 -1.148) 15.916 15.281 ( -5.957 2.366 -2.059) 6.732 15.399 ( -2.566 0.801 2.231) 3.493 16.540 ( -3.638 -2.491 0.360) 4.424 16.733 ( 0.250 3.277 -0.657) 3.351 21.979 ( -0.029 -5.556 -0.153) 5.558 22.126 ( -0.146 1.685 0.109) 1.695 ======================= Grid point 603 (301/322) ======================= q-point: (-0.08 -0.54 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.282 ( -3.219 13.334 3.235) 14.093 2.466 ( -0.999 2.615 2.309) 3.629 2.731 ( 1.726 0.501 0.246) 1.814 3.131 ( -5.423 -1.434 1.275) 5.752 3.446 ( 0.299 -2.318 -2.641) 3.527 3.554 ( 0.006 -0.886 2.031) 2.216 3.721 ( 0.928 -0.871 3.675) 3.890 3.825 ( -2.108 -2.415 -2.592) 4.122 4.020 ( 0.310 1.732 -0.484) 1.825 4.153 ( 5.081 0.825 3.366) 6.150 4.288 ( 2.623 -0.423 -0.382) 2.684 4.418 ( -1.376 1.838 -1.077) 2.536 4.545 ( -5.133 -3.638 -4.140) 7.532 4.872 ( 2.335 -2.518 -1.557) 3.770 5.445 ( 3.226 -2.255 2.143) 4.482 5.705 ( 7.304 -5.506 0.545) 9.163 5.793 ( 0.143 -2.146 -1.873) 2.852 6.099 ( 0.370 1.384 0.969) 1.729 6.794 ( -3.602 1.599 0.898) 4.042 6.945 ( -6.945 5.219 0.302) 8.693 7.863 ( -1.333 -3.944 -0.384) 4.181 8.108 ( 4.089 0.664 -3.620) 5.501 8.639 ( -3.114 -10.477 3.635) 11.519 8.869 ( 2.156 11.662 3.398) 12.337 9.287 ( 0.373 3.863 1.130) 4.042 9.431 ( 0.064 1.830 -1.092) 2.132 10.366 ( 0.229 -0.155 -1.561) 1.585 10.637 ( 0.775 -3.920 -0.302) 4.007 12.154 ( -1.441 -3.948 -2.146) 4.718 12.477 ( 2.893 -6.239 -0.968) 6.945 15.208 ( -2.340 2.348 -0.036) 3.316 15.382 ( -1.397 -0.054 0.425) 1.461 16.555 ( -2.022 -0.405 -0.059) 2.063 16.692 ( 1.031 0.965 -0.702) 1.577 22.045 ( -0.187 -1.561 0.125) 1.577 22.091 ( -0.070 1.260 -0.013) 1.262 ======================= Grid point 611 (302/322) ======================= q-point: (-0.46 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( -17.333 -0.000 4.174) 17.828 2.043 ( -17.500 -0.000 2.670) 17.703 2.214 ( 15.131 0.000 2.081) 15.273 2.259 ( 9.322 0.000 -1.346) 9.418 2.612 ( 2.710 0.000 -2.639) 3.783 2.715 ( 2.641 0.000 0.398) 2.671 3.329 ( -8.929 -0.000 -1.963) 9.142 3.512 ( -0.888 -0.000 6.637) 6.696 3.524 ( 0.046 0.000 1.205) 1.206 3.643 ( 0.064 0.000 -5.315) 5.316 4.004 ( -19.979 -0.000 4.772) 20.541 4.130 ( 0.653 0.000 4.395) 4.444 4.256 ( -2.816 -0.000 -1.177) 3.052 4.335 ( 11.994 0.000 -1.418) 12.078 4.744 ( 6.085 0.000 -1.951) 6.390 4.831 ( 7.146 0.000 -2.602) 7.605 5.256 ( -3.861 -0.000 -3.026) 4.905 5.403 ( 6.809 0.000 0.876) 6.865 6.964 ( 2.679 0.000 0.452) 2.717 7.361 ( -2.402 -0.000 12.647) 12.873 8.094 ( 2.390 0.000 4.001) 4.661 8.753 ( 0.893 0.000 1.446) 1.699 8.800 ( -1.271 -0.000 -0.096) 1.275 8.888 ( -1.015 -0.000 -9.344) 9.399 9.644 ( -0.525 -0.000 -0.063) 0.529 10.421 ( 0.583 0.000 -1.713) 1.809 10.540 ( 0.265 0.000 -0.150) 0.305 10.584 ( 1.122 0.000 2.034) 2.323 10.799 ( 1.395 0.000 1.811) 2.286 11.547 ( 0.087 0.000 -2.532) 2.534 15.794 ( -2.658 -0.000 5.067) 5.722 15.912 ( 0.232 0.000 -3.122) 3.130 17.226 ( -1.850 -0.000 -1.641) 2.472 17.473 ( -1.386 -0.000 -7.489) 7.616 20.549 ( 0.015 0.000 0.064) 0.066 20.809 ( 0.004 0.000 -0.029) 0.030 ======================= Grid point 612 (303/322) ======================= q-point: (-0.38 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( -16.765 -4.849 5.035) 18.164 2.068 ( -17.030 -11.001 3.250) 20.533 2.346 ( 13.150 -4.411 1.749) 13.980 2.394 ( 7.263 -8.098 -1.666) 11.005 2.789 ( 0.953 -10.131 -2.044) 10.379 2.844 ( 5.564 -12.918 0.151) 14.066 3.218 ( -15.000 -0.239 -4.578) 15.684 3.457 ( -3.635 -1.526 2.326) 4.578 3.650 ( -8.742 -6.696 -1.008) 11.058 3.892 ( 10.055 -12.507 3.092) 16.343 4.015 ( -15.842 -12.577 5.027) 20.843 4.222 ( -1.363 -2.350 7.241) 7.734 4.307 ( -0.893 -12.779 -2.398) 13.032 4.469 ( 4.893 -10.834 -1.034) 11.933 4.789 ( 7.421 -2.388 -5.902) 9.778 4.923 ( 16.655 -3.539 1.630) 17.104 5.200 ( -9.538 0.507 -6.122) 11.345 5.443 ( 11.074 1.054 1.326) 11.203 6.921 ( 4.452 6.867 2.224) 8.480 7.148 ( -0.993 20.305 5.477) 21.054 8.064 ( -0.830 5.312 3.620) 6.481 8.394 ( -0.225 16.082 1.284) 16.135 8.824 ( 2.042 5.180 -4.403) 7.099 9.092 ( -2.346 -14.166 -0.808) 14.382 9.829 ( -0.238 -13.653 -1.048) 13.696 10.353 ( 1.073 11.922 0.371) 11.976 10.407 ( -1.914 -0.131 -1.968) 2.748 10.699 ( 5.403 1.995 4.525) 7.325 10.869 ( 0.601 -10.590 -0.644) 10.626 11.476 ( 0.843 6.732 -1.631) 6.978 15.736 ( -3.507 4.735 5.500) 8.060 15.799 ( -4.500 8.406 -5.611) 11.063 17.154 ( -5.172 8.279 -2.878) 10.177 17.184 ( -4.365 17.563 -2.647) 18.290 20.732 ( 0.241 -16.761 0.609) 16.774 21.120 ( 2.156 -26.295 -2.412) 26.493 ======================= Grid point 613 (304/322) ======================= q-point: (-0.31 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.943 ( -14.847 -7.831 5.167) 17.563 2.226 ( -13.210 -12.614 3.191) 18.542 2.526 ( 9.526 -5.635 1.270) 11.141 2.623 ( 3.525 -11.641 -2.101) 12.343 2.992 ( 2.533 -9.863 -0.387) 10.190 3.151 ( 1.524 -13.615 -0.892) 13.729 3.182 ( -14.276 -5.931 -3.119) 15.771 3.519 ( 3.383 -2.212 -0.393) 4.061 3.680 ( -13.336 -5.957 -2.784) 14.869 4.041 ( -3.286 -5.442 2.967) 7.015 4.225 ( -3.677 -2.062 7.697) 8.776 4.271 ( 3.643 -6.282 5.020) 8.828 4.497 ( 1.201 -3.761 -3.876) 5.533 4.805 ( 11.162 -5.403 1.594) 12.503 5.033 ( -8.379 -15.697 -2.834) 18.017 5.135 ( 7.888 -14.430 -4.790) 17.129 5.308 ( 5.689 -19.804 0.140) 20.605 5.577 ( 10.755 -15.448 -1.260) 18.865 6.606 ( 3.503 28.455 5.258) 29.148 6.824 ( 6.711 10.267 -2.489) 12.515 7.890 ( -12.065 7.473 2.113) 14.348 8.191 ( 3.244 7.280 4.786) 9.297 8.692 ( 3.417 8.829 -3.927) 10.250 9.339 ( -3.358 -12.075 -0.976) 12.571 9.960 ( -0.092 1.849 -3.149) 3.653 10.083 ( 1.393 16.053 0.521) 16.122 10.419 ( -6.120 -1.663 0.724) 6.383 10.712 ( 10.166 -1.474 2.284) 10.523 11.137 ( -2.160 -13.386 0.049) 13.560 11.343 ( 3.753 3.697 -0.382) 5.282 15.551 ( -9.388 8.522 -3.888) 13.262 15.624 ( -5.189 5.780 3.095) 8.361 16.749 ( -7.080 14.681 -0.687) 16.313 17.032 ( -3.020 6.233 -0.327) 6.934 21.132 ( 0.480 -21.402 1.584) 21.466 21.656 ( 4.119 -23.183 -4.578) 23.987 ======================= Grid point 614 (305/322) ======================= q-point: (-0.23 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.997 ( -13.540 -3.877 4.335) 14.736 2.399 ( -10.626 -11.216 2.497) 15.650 2.645 ( 3.009 -2.180 0.218) 3.722 2.863 ( 2.038 -10.479 -1.078) 10.729 3.187 ( 2.367 -8.071 -0.151) 8.412 3.260 ( -8.578 -8.516 -0.016) 12.088 3.393 ( 0.212 -10.092 -0.922) 10.136 3.498 ( 2.946 2.939 -5.091) 6.576 3.821 ( -8.905 -13.403 -3.026) 16.374 4.124 ( -4.735 -4.665 1.422) 6.798 4.241 ( -3.235 -1.305 8.443) 9.136 4.378 ( 1.427 -2.673 3.239) 4.435 4.490 ( 5.477 3.832 -4.575) 8.100 4.868 ( 7.388 3.796 3.821) 9.143 5.098 ( 2.436 -6.099 -3.309) 7.354 5.470 ( 5.673 -5.667 -1.196) 8.107 5.824 ( 1.387 -26.151 -0.599) 26.194 6.087 ( 12.355 13.501 2.041) 18.415 6.320 ( 4.647 -32.694 -2.505) 33.118 6.686 ( 5.450 5.892 0.281) 8.031 7.654 ( -15.201 8.596 1.885) 17.564 8.130 ( -0.130 0.544 4.186) 4.223 8.519 ( 4.232 10.015 -3.399) 11.391 9.482 ( -4.867 -4.077 -1.802) 6.600 9.752 ( 1.410 15.727 3.416) 16.156 9.837 ( 1.338 9.708 -4.470) 10.771 10.378 ( -2.117 2.098 3.477) 4.580 10.731 ( 2.746 7.357 -3.484) 8.591 11.328 ( 1.895 -14.122 2.524) 14.470 11.563 ( 3.630 -17.253 -0.932) 17.656 15.361 ( -11.313 3.571 -4.531) 12.698 15.496 ( -5.416 4.281 4.179) 8.069 16.531 ( -4.862 4.598 0.452) 6.707 16.897 ( -2.924 5.290 -0.236) 6.049 21.530 ( 0.520 -17.555 1.401) 17.618 22.009 ( 2.946 -10.940 -3.389) 11.826 ======================= Grid point 615 (306/322) ======================= q-point: (-0.15 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( -11.819 7.819 2.755) 14.437 2.533 ( -7.860 -6.663 1.114) 10.364 2.662 ( -0.202 0.251 0.685) 0.757 3.027 ( 0.137 -5.084 0.884) 5.162 3.308 ( 2.201 -3.035 -0.002) 3.749 3.390 ( -0.759 -7.615 -0.153) 7.654 3.528 ( 0.293 -5.880 -3.127) 6.667 3.564 ( -2.782 -8.361 -2.918) 9.283 4.012 ( -5.679 -9.513 -3.646) 11.663 4.142 ( -1.294 1.583 3.207) 3.803 4.279 ( -8.464 -5.413 1.815) 10.209 4.388 ( 9.112 4.328 2.613) 10.421 4.484 ( -1.440 -2.033 -2.057) 3.231 4.834 ( 5.510 2.644 3.019) 6.816 5.266 ( 8.917 -6.447 0.175) 11.005 5.598 ( 4.293 -4.991 -1.564) 6.766 5.791 ( 11.619 10.901 0.968) 15.961 6.202 ( 2.891 -2.181 -0.135) 3.624 6.697 ( 0.996 -7.220 0.391) 7.299 7.021 ( 3.126 -21.491 0.058) 21.717 7.427 ( -14.014 0.355 -0.138) 14.019 8.178 ( -2.275 -5.593 2.759) 6.639 8.349 ( 2.469 8.563 -2.497) 9.256 9.390 ( -1.856 10.028 -0.811) 10.231 9.550 ( 0.611 6.521 4.592) 7.999 9.646 ( 1.346 9.066 -3.744) 9.901 10.364 ( -0.651 -1.279 3.058) 3.378 10.551 ( 1.104 8.160 -3.885) 9.105 11.681 ( -0.488 -17.809 0.700) 17.829 11.946 ( 5.949 -18.188 -1.573) 19.201 15.255 ( -9.452 0.636 -4.088) 10.318 15.411 ( -4.772 1.935 3.993) 6.516 16.477 ( -4.335 -0.983 0.531) 4.477 16.794 ( -2.143 3.636 -0.212) 4.225 21.818 ( 0.274 -11.127 0.457) 11.139 22.133 ( 0.940 -1.739 -1.168) 2.296 ======================= Grid point 616 (307/322) ======================= q-point: (-0.08 -0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( -8.531 16.843 1.868) 18.972 2.529 ( -2.181 2.954 1.106) 3.835 2.691 ( -3.630 -3.541 0.601) 5.106 3.088 ( 0.766 -1.639 1.121) 2.128 3.383 ( -0.451 -3.652 -0.315) 3.693 3.511 ( 1.341 -4.072 0.064) 4.288 3.654 ( 0.244 -6.038 0.422) 6.058 3.702 ( -2.170 -7.519 -4.121) 8.845 4.046 ( -4.986 1.296 -0.459) 5.172 4.155 ( 2.413 -2.464 0.744) 3.528 4.331 ( -9.500 -4.373 -1.427) 10.555 4.365 ( 6.242 2.997 1.922) 7.186 4.496 ( -1.038 -0.403 0.291) 1.151 4.854 ( 4.938 -0.755 0.675) 5.041 5.423 ( 7.483 -3.650 1.830) 8.524 5.719 ( 2.786 -4.865 -1.106) 5.715 5.739 ( 12.341 2.402 0.235) 12.575 6.162 ( 1.292 4.183 0.574) 4.416 6.798 ( -1.473 -1.132 0.797) 2.022 7.010 ( -9.486 6.465 0.231) 11.482 7.665 ( -0.354 -15.606 -1.291) 15.663 8.200 ( 2.827 6.630 -1.836) 7.438 8.345 ( -7.113 -12.500 2.325) 14.569 9.170 ( 3.968 12.406 1.222) 13.083 9.411 ( 0.024 7.948 1.572) 8.102 9.506 ( -0.132 5.459 -0.605) 5.494 10.373 ( -0.259 1.135 -0.421) 1.238 10.525 ( 0.709 -5.512 -1.373) 5.725 11.973 ( -2.248 -12.265 -0.535) 12.481 12.305 ( 6.251 -13.608 -2.030) 15.112 15.202 ( -5.916 -0.205 -2.536) 6.440 15.373 ( -3.125 0.223 2.594) 4.068 16.495 ( -4.103 -2.869 0.338) 5.018 16.728 ( -0.801 2.152 -0.298) 2.316 21.979 ( 0.011 -5.374 -0.187) 5.377 22.124 ( -0.192 1.841 0.189) 1.860 ======================= Grid point 625 (308/322) ======================= q-point: (-0.38 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( -16.933 -0.000 6.476) 18.129 1.824 ( -20.953 -0.000 4.348) 21.399 2.318 ( 1.130 0.000 -1.639) 1.991 2.408 ( 15.518 0.000 1.359) 15.578 2.646 ( 5.503 0.000 -3.510) 6.527 2.773 ( 5.979 0.000 0.298) 5.987 3.053 ( -31.408 -0.000 -6.573) 32.089 3.497 ( -8.668 -0.000 6.388) 10.768 3.521 ( -0.923 -0.000 6.346) 6.413 3.626 ( -0.350 -0.000 -4.845) 4.858 3.907 ( 0.984 0.000 4.495) 4.601 4.149 ( 0.937 0.000 2.007) 2.215 4.234 ( -1.506 -0.000 4.363) 4.616 4.399 ( -2.043 -0.000 -1.374) 2.462 4.817 ( 11.056 0.000 -6.245) 12.698 5.002 ( 16.976 0.000 1.419) 17.036 5.159 ( -5.013 -0.000 -4.850) 6.975 5.523 ( 9.800 0.000 -0.263) 9.803 7.026 ( 7.480 0.000 0.165) 7.482 7.321 ( -8.795 -0.000 6.399) 10.876 8.180 ( 9.317 0.000 4.901) 10.527 8.739 ( -2.132 -0.000 -3.429) 4.038 8.770 ( -3.718 -0.000 0.038) 3.718 8.884 ( 2.409 0.000 -1.288) 2.731 9.635 ( -0.950 -0.000 0.275) 0.989 10.403 ( -1.730 -0.000 -3.822) 4.195 10.542 ( 0.356 0.000 -0.368) 0.512 10.627 ( 4.731 0.000 1.953) 5.118 10.845 ( 5.308 0.000 2.434) 5.840 11.550 ( 1.482 0.000 -0.610) 1.603 15.767 ( -4.749 -0.000 6.004) 7.655 15.859 ( -6.848 -0.000 -8.123) 10.624 17.183 ( -4.854 -0.000 -0.921) 4.940 17.377 ( -10.507 -0.000 -8.706) 13.645 20.549 ( 0.041 0.000 0.042) 0.058 20.809 ( -0.002 -0.000 -0.029) 0.029 ======================= Grid point 626 (309/322) ======================= q-point: (-0.31 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( -14.831 -5.502 7.362) 17.449 1.866 ( -18.840 -13.680 4.471) 23.708 2.415 ( 0.728 -9.087 -1.505) 9.240 2.516 ( 10.865 -2.568 -0.515) 11.176 2.812 ( 3.694 -9.995 -2.321) 10.906 2.887 ( -14.478 -8.447 -2.865) 17.005 2.939 ( -10.352 -8.698 -2.075) 13.679 3.400 ( -6.088 -1.852 3.276) 7.157 3.608 ( -0.214 -4.145 1.701) 4.486 3.878 ( -10.300 -12.620 3.371) 16.635 4.014 ( 8.226 -12.011 1.443) 14.629 4.238 ( -0.675 -1.782 9.662) 9.848 4.303 ( 1.875 -12.460 -1.930) 12.748 4.451 ( -5.124 -12.477 -3.133) 13.847 4.885 ( 7.844 -1.653 -5.319) 9.620 5.101 ( 3.370 -0.438 -5.177) 6.193 5.155 ( 15.954 -2.071 3.237) 16.411 5.556 ( 7.838 1.008 -1.825) 8.111 6.999 ( 6.522 8.221 3.160) 10.959 7.132 ( -2.196 14.345 -0.048) 14.512 8.076 ( 1.192 15.070 2.650) 15.347 8.402 ( 0.510 12.275 2.894) 12.622 8.842 ( 2.412 4.803 -2.302) 5.847 9.050 ( -4.259 -14.050 -0.478) 14.689 9.817 ( -1.073 -13.327 -1.628) 13.469 10.355 ( -1.630 5.988 -3.030) 6.906 10.383 ( 0.350 7.005 -0.586) 7.038 10.812 ( 10.663 -1.588 5.605) 12.151 10.869 ( -0.084 -7.198 -1.568) 7.367 11.494 ( 2.741 6.446 0.725) 7.042 15.671 ( -12.460 9.661 -7.232) 17.346 15.703 ( -6.230 4.686 3.796) 8.670 17.028 ( -13.305 16.734 -3.896) 21.731 17.127 ( -5.190 6.454 -0.207) 8.284 20.738 ( 0.548 -17.107 0.703) 17.130 21.142 ( 3.077 -27.750 -3.784) 28.176 ======================= Grid point 627 (310/322) ======================= q-point: (-0.23 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -12.700 -7.955 6.935) 16.513 2.067 ( -15.367 -14.845 4.150) 21.765 2.601 ( 1.072 -4.409 -0.898) 4.626 2.652 ( 2.939 -10.942 -3.057) 11.735 2.951 ( -18.921 -13.333 -2.965) 23.336 3.021 ( 2.541 -9.528 -1.376) 9.956 3.179 ( 2.334 -11.634 -0.348) 11.871 3.503 ( -5.048 -10.468 1.102) 11.674 3.617 ( 2.035 3.482 -1.499) 4.302 3.985 ( -7.452 -6.300 2.880) 10.174 4.194 ( -3.351 -2.806 4.344) 6.162 4.301 ( -1.838 -3.827 2.935) 5.161 4.572 ( 12.087 -5.851 0.958) 13.463 4.856 ( -8.734 -14.841 1.841) 17.319 4.978 ( 6.772 -7.601 -4.188) 11.008 5.214 ( 8.708 -19.002 -4.393) 21.359 5.406 ( 7.841 -8.752 0.891) 11.784 5.699 ( 11.271 -18.812 -2.380) 22.059 6.663 ( 3.968 24.925 2.892) 25.404 6.918 ( 10.332 11.252 -2.118) 15.422 7.763 ( -10.147 11.889 2.149) 15.777 8.228 ( 0.429 7.834 4.903) 9.252 8.722 ( 2.988 8.308 -1.836) 9.018 9.287 ( -4.562 -11.901 -1.383) 12.821 9.940 ( -1.209 1.330 -4.213) 4.580 10.102 ( 1.628 15.597 -0.542) 15.691 10.358 ( -4.757 -2.099 0.318) 5.209 10.826 ( 7.045 1.744 -0.058) 7.258 11.127 ( 1.089 -12.721 2.390) 12.989 11.397 ( 5.210 1.907 1.433) 5.730 15.382 ( -15.836 7.516 -6.261) 18.614 15.564 ( -7.332 5.721 4.638) 10.392 16.650 ( -9.160 11.421 0.008) 14.641 16.986 ( -4.606 5.748 0.014) 7.366 21.145 ( 0.856 -21.419 1.924) 21.522 21.695 ( 5.203 -22.948 -6.371) 24.378 ======================= Grid point 628 (311/322) ======================= q-point: (-0.15 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -11.530 -3.522 5.056) 13.073 2.265 ( -12.993 -13.117 3.196) 18.737 2.656 ( -0.984 -1.877 -1.535) 2.617 2.883 ( 1.995 -10.028 -1.556) 10.343 3.145 ( -9.925 -13.483 -1.099) 16.778 3.217 ( 2.765 -8.780 -1.026) 9.262 3.383 ( -1.088 -8.617 -1.103) 8.755 3.526 ( 4.045 4.654 -4.321) 7.530 3.727 ( -6.167 -13.791 -1.208) 15.155 4.068 ( -7.701 -6.259 2.189) 10.162 4.199 ( -4.172 0.417 4.479) 6.135 4.377 ( -1.749 -4.777 0.878) 5.162 4.594 ( 11.049 6.864 0.814) 13.033 4.910 ( 0.130 0.655 3.196) 3.265 5.188 ( 11.116 -7.413 -0.369) 13.366 5.515 ( 2.696 -4.181 -2.245) 5.458 5.841 ( 1.852 -28.368 -1.574) 28.472 6.246 ( 12.573 19.605 0.628) 23.299 6.392 ( 9.799 -36.243 -1.417) 37.571 6.762 ( 7.134 7.813 0.148) 10.581 7.482 ( -14.304 10.211 1.219) 17.616 8.122 ( -3.700 2.062 3.825) 5.707 8.556 ( 3.377 9.844 -1.152) 10.471 9.416 ( -5.143 -3.516 -2.137) 6.587 9.774 ( 0.212 12.976 3.354) 13.405 9.840 ( 2.087 10.255 -6.205) 12.166 10.358 ( -3.160 -0.076 3.271) 4.549 10.741 ( 0.679 9.305 -4.119) 10.199 11.375 ( 4.429 -13.080 3.977) 14.371 11.609 ( 4.587 -17.128 -0.852) 17.752 15.202 ( -12.639 1.579 -4.124) 13.388 15.432 ( -7.452 3.434 3.840) 9.059 16.469 ( -5.658 3.351 0.450) 6.591 16.856 ( -3.979 4.600 0.079) 6.083 21.542 ( 0.663 -17.208 1.614) 17.296 22.035 ( 3.389 -9.893 -4.209) 11.273 ======================= Grid point 629 (312/322) ======================= q-point: (-0.08 -0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.771 ( -10.468 7.211 2.575) 12.970 2.434 ( -8.875 -9.625 1.505) 13.178 2.657 ( -0.651 1.012 -0.067) 1.205 3.045 ( 2.339 -5.108 -0.176) 5.621 3.289 ( -6.492 -5.620 3.681) 9.342 3.406 ( 4.676 -7.967 -4.067) 10.094 3.514 ( -2.963 -6.986 -3.455) 8.338 3.539 ( 1.908 -5.372 -3.449) 6.663 3.932 ( -5.392 -9.557 -3.086) 11.398 4.136 ( -14.183 -4.561 0.549) 14.908 4.163 ( 1.927 0.105 3.596) 4.081 4.450 ( -2.426 -3.033 -0.865) 3.979 4.526 ( 10.175 5.918 4.510) 12.605 4.902 ( 4.738 1.613 2.979) 5.824 5.384 ( 9.365 -5.758 0.922) 11.032 5.617 ( 0.558 -5.278 -2.335) 5.798 5.966 ( 16.642 9.889 1.002) 19.385 6.239 ( 3.792 -1.022 -0.595) 3.972 6.710 ( 0.891 -5.064 0.983) 5.235 7.052 ( 0.382 -6.816 0.520) 6.846 7.287 ( -7.300 -12.260 -1.955) 14.402 8.118 ( -9.393 -4.690 1.967) 10.682 8.386 ( 4.687 9.054 -0.058) 10.196 9.356 ( -3.083 5.723 -2.001) 6.802 9.577 ( 0.699 7.952 5.900) 9.926 9.650 ( 2.000 9.198 -5.388) 10.846 10.361 ( -1.489 -1.591 3.025) 3.728 10.545 ( -0.041 7.701 -4.038) 8.695 11.687 ( 0.994 -15.031 1.542) 15.142 12.011 ( 5.880 -19.060 -2.102) 20.057 15.137 ( -8.303 -1.284 -3.377) 9.055 15.360 ( -5.676 0.624 3.383) 6.637 16.424 ( -4.793 -1.235 0.338) 4.961 16.763 ( -2.832 2.709 0.141) 3.922 21.822 ( 0.264 -10.771 0.493) 10.786 22.141 ( 1.031 -0.966 -1.318) 1.932 ======================= Grid point 639 (313/322) ======================= q-point: (-0.31 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( -22.124 -0.000 5.852) 22.885 1.597 ( -13.214 -0.000 9.347) 16.186 2.291 ( -3.610 -0.000 -2.965) 4.671 2.517 ( -13.853 -0.000 -5.586) 14.936 2.668 ( -13.914 -0.000 3.539) 14.357 2.715 ( 6.963 0.000 -2.258) 7.320 2.845 ( 6.078 0.000 -0.407) 6.092 3.402 ( -9.511 -0.000 5.859) 11.171 3.529 ( -1.028 -0.000 5.760) 5.851 3.607 ( -0.469 -0.000 -4.210) 4.236 3.960 ( 3.151 0.000 1.207) 3.375 4.183 ( 5.278 0.000 -0.397) 5.292 4.237 ( -2.132 -0.000 8.243) 8.514 4.310 ( -9.214 -0.000 -6.115) 11.059 4.908 ( 6.778 0.000 -4.728) 8.264 5.142 ( 8.958 0.000 -1.971) 9.172 5.237 ( 15.428 0.000 3.822) 15.894 5.613 ( 6.523 0.000 -3.910) 7.605 7.138 ( 11.249 0.000 -0.084) 11.250 7.212 ( -11.183 -0.000 2.785) 11.525 8.321 ( 11.646 0.000 2.201) 11.852 8.705 ( -1.125 -0.000 -4.185) 4.334 8.712 ( -6.225 -0.000 0.136) 6.226 8.914 ( 1.662 0.000 3.513) 3.886 9.625 ( -0.978 -0.000 0.598) 1.146 10.361 ( -2.885 -0.000 -5.923) 6.588 10.545 ( 0.354 0.000 -0.561) 0.664 10.694 ( 5.270 0.000 0.486) 5.292 10.939 ( 9.489 0.000 2.437) 9.797 11.587 ( 4.571 0.000 2.867) 5.396 15.686 ( -16.478 -0.000 -12.381) 20.611 15.723 ( -6.902 -0.000 5.516) 8.836 17.096 ( -11.052 -0.000 -2.048) 11.240 17.193 ( -14.169 -0.000 -5.472) 15.189 20.550 ( 0.054 0.000 0.023) 0.059 20.809 ( -0.005 -0.000 -0.029) 0.029 ======================= Grid point 640 (314/322) ======================= q-point: (-0.23 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -10.883 -5.559 10.214) 15.927 1.658 ( -18.749 -16.145 5.701) 25.390 2.397 ( -3.779 -10.975 -2.608) 11.897 2.423 ( -29.740 -9.561 -5.733) 31.761 2.699 ( 3.365 -2.971 3.163) 5.491 2.854 ( 4.116 -8.346 -1.817) 9.482 2.984 ( 5.041 -9.423 -0.221) 10.689 3.345 ( -5.146 -2.393 2.778) 6.318 3.620 ( 0.668 -5.314 2.396) 5.868 3.780 ( -7.635 -10.612 0.813) 13.098 4.086 ( 3.978 -9.509 -0.707) 10.332 4.234 ( -5.282 -1.765 2.891) 6.275 4.339 ( 1.812 -13.033 -1.756) 13.275 4.376 ( -1.078 -16.409 0.234) 16.446 4.934 ( 6.527 0.820 -3.921) 7.658 5.187 ( 10.328 0.553 -0.130) 10.343 5.354 ( 13.491 -3.062 3.060) 14.169 5.621 ( 5.364 0.590 -4.610) 7.097 7.025 ( -5.012 11.601 3.480) 13.108 7.168 ( 10.550 5.728 -2.484) 12.259 8.103 ( 2.516 23.578 -0.127) 23.712 8.420 ( 0.344 9.885 3.937) 10.646 8.864 ( 1.872 4.163 -0.026) 4.564 8.994 ( -4.911 -13.562 0.113) 14.424 9.795 ( -1.590 -12.270 -1.892) 12.516 10.308 ( -3.449 2.425 -5.706) 7.094 10.398 ( 1.575 10.654 -0.258) 10.773 10.845 ( -2.827 -6.451 -2.555) 7.492 10.981 ( 14.584 -0.716 4.655) 15.326 11.551 ( 5.821 6.752 4.343) 9.917 15.435 ( -21.656 9.221 -11.418) 26.161 15.637 ( -8.311 4.908 6.290) 11.520 16.840 ( -16.315 13.636 -1.485) 21.315 17.058 ( -6.266 4.505 -0.073) 7.718 20.748 ( 0.722 -17.660 0.879) 17.697 21.167 ( 3.534 -29.503 -5.370) 30.195 ======================= Grid point 641 (315/322) ======================= q-point: (-0.15 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( -8.670 -7.350 8.924) 14.451 1.895 ( -15.988 -16.045 5.318) 23.267 2.489 ( -17.197 -12.435 -5.748) 21.986 2.666 ( 1.160 -14.075 -2.935) 14.424 2.817 ( -2.951 -9.168 1.673) 9.776 3.043 ( 1.716 -9.252 -1.457) 9.522 3.203 ( 1.584 -9.669 -0.475) 9.810 3.448 ( -5.398 -10.051 1.337) 11.487 3.647 ( 2.713 3.651 -1.107) 4.681 3.885 ( -9.335 -6.731 -0.087) 11.509 4.193 ( 1.634 -1.179 1.589) 2.566 4.273 ( -2.689 -4.285 2.303) 5.558 4.737 ( -7.373 -17.877 -0.537) 19.345 4.747 ( 12.606 -4.815 4.353) 14.179 5.055 ( 6.586 -16.046 -2.560) 17.533 5.302 ( 6.258 -12.382 -1.476) 13.952 5.471 ( 3.892 -1.943 -1.484) 4.597 5.828 ( 11.062 -21.933 -2.339) 24.675 6.714 ( 3.410 18.365 2.089) 18.795 7.049 ( 12.773 12.666 -2.029) 18.102 7.673 ( -5.916 17.291 1.928) 18.376 8.226 ( -3.317 9.297 4.136) 10.702 8.752 ( 2.505 7.880 0.712) 8.300 9.229 ( -4.210 -11.632 -1.655) 12.481 9.908 ( -1.861 0.657 -4.390) 4.813 10.113 ( 0.804 14.676 -1.761) 14.803 10.306 ( -4.095 -1.741 -0.421) 4.470 10.848 ( -2.023 1.594 -3.559) 4.393 11.201 ( 9.096 -10.155 4.786) 14.449 11.471 ( 5.707 2.077 3.633) 7.077 15.163 ( -17.237 3.945 -4.840) 18.333 15.478 ( -9.668 5.668 4.040) 11.913 16.543 ( -8.900 8.033 0.471) 11.998 16.926 ( -5.299 5.120 0.051) 7.368 21.163 ( 0.959 -21.407 2.377) 21.560 21.736 ( 5.395 -22.778 -8.151) 24.787 ======================= Grid point 642 (316/322) ======================= q-point: (-0.08 -0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -7.876 -2.157 5.814) 10.024 2.124 ( -12.287 -15.121 3.811) 19.853 2.615 ( -4.337 -6.079 -2.862) 7.997 2.898 ( 1.205 -9.455 -1.839) 9.707 3.039 ( -6.948 -13.995 -0.373) 15.630 3.240 ( 1.768 -10.099 -2.468) 10.546 3.365 ( -1.194 -6.869 -1.166) 7.069 3.561 ( 3.503 4.844 -3.106) 6.736 3.650 ( -7.590 -13.306 -0.108) 15.319 3.960 ( -8.748 -6.099 0.131) 10.666 4.201 ( 1.704 1.328 3.410) 4.037 4.359 ( -1.583 -4.648 0.715) 4.962 4.710 ( 6.305 5.934 3.155) 9.215 4.937 ( 3.853 -2.101 2.909) 5.265 5.309 ( 8.487 -7.023 0.328) 11.021 5.521 ( -0.200 -4.260 -2.090) 4.749 5.855 ( 1.268 -28.730 -2.004) 28.828 6.357 ( 6.889 2.622 -2.645) 7.831 6.554 ( 16.004 -20.969 1.957) 26.452 6.855 ( 8.914 10.698 -0.413) 13.931 7.334 ( -11.016 13.130 0.972) 17.166 8.061 ( -8.388 3.910 2.614) 9.617 8.598 ( 3.910 9.374 1.310) 10.241 9.351 ( -4.611 -3.187 -2.431) 6.110 9.774 ( -1.454 10.100 2.205) 10.439 9.849 ( 2.463 10.971 -5.999) 12.745 10.324 ( -4.030 -1.769 2.473) 5.049 10.723 ( -1.304 9.185 -4.145) 10.161 11.452 ( 6.017 -10.504 4.616) 12.956 11.661 ( 4.389 -16.842 -0.617) 17.415 15.055 ( -9.951 -0.919 -2.508) 10.303 15.347 ( -8.472 2.166 2.732) 9.161 16.404 ( -5.333 2.378 0.303) 5.847 16.808 ( -4.110 3.877 0.227) 5.655 21.554 ( 0.555 -16.774 1.879) 16.888 22.061 ( 3.248 -8.964 -4.915) 10.727 ======================= Grid point 653 (317/322) ======================= q-point: (-0.23 -0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( -21.300 -0.000 7.222) 22.491 1.499 ( -9.595 -0.000 12.977) 16.139 2.094 ( -38.384 -0.000 -1.457) 38.411 2.230 ( -4.434 -0.000 -4.074) 6.021 2.729 ( 6.075 0.000 3.098) 6.819 2.785 ( 5.563 0.000 -0.858) 5.629 2.910 ( 5.210 0.000 -1.039) 5.313 3.313 ( -8.487 -0.000 4.287) 9.509 3.532 ( -1.207 -0.000 5.083) 5.225 3.590 ( -0.233 -0.000 -3.611) 3.619 3.942 ( -6.612 -0.000 -4.401) 7.942 4.160 ( -6.558 -0.000 -5.622) 8.638 4.235 ( -0.331 -0.000 1.391) 1.430 4.301 ( 9.381 0.000 3.936) 10.173 4.997 ( 10.878 0.000 -1.707) 11.011 5.250 ( 7.380 0.000 2.140) 7.684 5.408 ( 10.707 0.000 3.188) 11.172 5.660 ( 4.582 0.000 -6.494) 7.948 7.093 ( -9.621 -0.000 2.104) 9.848 7.284 ( 13.402 0.000 -0.247) 13.404 8.445 ( 8.994 0.000 -3.924) 9.813 8.626 ( -8.420 -0.000 0.186) 8.422 8.694 ( 1.047 0.000 -1.765) 2.052 8.940 ( 0.344 0.000 6.021) 6.031 9.617 ( -0.659 -0.000 0.834) 1.063 10.299 ( -4.181 -0.000 -7.982) 9.011 10.547 ( 0.267 0.000 -0.689) 0.739 10.733 ( 0.969 0.000 -1.382) 1.688 11.085 ( 14.426 0.000 0.282) 14.428 11.685 ( 9.474 0.000 6.902) 11.722 15.377 ( -27.223 -0.000 -15.617) 31.384 15.651 ( -9.478 -0.000 7.535) 12.108 16.883 ( -20.498 -0.000 -1.933) 20.589 17.068 ( -7.556 -0.000 -0.768) 7.595 20.551 ( 0.052 0.000 0.011) 0.053 20.809 ( -0.006 -0.000 -0.029) 0.029 ======================= Grid point 654 (318/322) ======================= q-point: (-0.15 -0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -16.894 -17.300 6.854) 25.133 1.530 ( -7.663 -6.743 13.586) 16.993 2.019 ( -30.666 -14.224 -2.443) 33.892 2.362 ( -2.403 -14.065 -2.850) 14.551 2.758 ( 3.030 -0.782 1.774) 3.597 2.892 ( 2.815 -6.640 -0.997) 7.281 3.031 ( 2.796 -8.162 -0.557) 8.645 3.284 ( -6.498 -3.174 1.733) 7.437 3.628 ( -1.280 -6.061 2.983) 6.876 3.706 ( -3.594 -7.564 -3.640) 9.131 4.093 ( -3.963 -17.597 -3.302) 18.337 4.157 ( -1.851 -2.817 -3.251) 4.683 4.331 ( -0.907 -10.713 3.482) 11.301 4.447 ( 7.850 -12.686 0.458) 14.925 5.042 ( 12.104 2.128 -1.484) 12.379 5.284 ( 4.405 0.126 2.522) 5.077 5.478 ( 6.990 -0.794 1.135) 7.126 5.665 ( 4.367 -1.640 -4.669) 6.600 6.965 ( -5.236 8.007 2.547) 9.900 7.310 ( 13.201 5.747 -1.127) 14.441 8.129 ( 2.362 26.345 -2.368) 26.556 8.421 ( -2.449 10.321 2.941) 11.007 8.889 ( 2.077 3.797 2.214) 4.861 8.941 ( -3.893 -13.239 0.466) 13.807 9.769 ( -1.707 -10.839 -1.846) 11.127 10.241 ( -4.673 1.604 -7.295) 8.811 10.413 ( 1.089 10.781 -0.524) 10.848 10.783 ( -6.126 -3.149 -2.917) 7.480 11.177 ( 16.477 -1.384 1.987) 16.654 11.650 ( 7.054 8.723 7.009) 13.227 15.125 ( -23.552 4.596 -7.654) 25.187 15.540 ( -11.589 5.481 5.773) 14.059 16.653 ( -14.409 8.769 0.628) 16.879 16.984 ( -6.132 3.715 -0.220) 7.173 20.760 ( 0.703 -18.336 1.118) 18.384 21.190 ( 3.353 -31.107 -6.808) 32.020 ======================= Grid point 655 (319/322) ======================= q-point: (-0.08 -0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -4.849 -7.401 10.600) 13.808 1.733 ( -13.771 -15.865 6.645) 22.034 2.263 ( -15.714 -21.789 -5.820) 27.487 2.670 ( 0.881 -16.323 -1.792) 16.445 2.814 ( -0.153 -4.131 0.944) 4.240 3.052 ( 0.614 -8.736 -1.308) 8.855 3.202 ( -2.341 -8.537 -1.068) 8.917 3.373 ( -7.085 -9.216 0.899) 11.660 3.667 ( 1.201 2.341 -0.622) 2.703 3.794 ( -4.674 -5.773 -3.279) 8.119 4.219 ( 1.768 -2.759 -1.587) 3.641 4.282 ( 2.745 -2.624 5.387) 6.591 4.644 ( -6.524 -15.731 0.247) 17.033 4.909 ( 9.665 -14.648 3.001) 17.804 5.123 ( 6.523 -13.775 -2.372) 15.425 5.334 ( 0.471 -5.308 0.326) 5.339 5.511 ( 3.771 -2.046 -1.694) 4.613 5.922 ( 5.655 -22.675 -2.930) 23.552 6.760 ( 3.314 11.164 2.713) 11.958 7.197 ( 12.729 13.159 -1.590) 18.377 7.638 ( -0.950 22.395 1.184) 22.447 8.173 ( -7.452 11.094 3.036) 13.705 8.788 ( 2.813 7.183 2.684) 8.168 9.182 ( -2.777 -10.928 -2.146) 11.478 9.872 ( -2.190 0.095 -3.587) 4.204 10.106 ( -0.970 12.276 -2.873) 12.645 10.259 ( -3.370 0.050 -0.843) 3.475 10.787 ( -5.338 -1.169 -3.304) 6.386 11.339 ( 11.207 -5.884 3.030) 13.015 11.544 ( 3.844 2.854 5.279) 7.127 14.977 ( -11.357 -0.379 -1.232) 11.430 15.362 ( -11.474 4.887 2.347) 12.691 16.450 ( -6.870 5.417 0.559) 8.767 16.866 ( -4.671 4.491 -0.020) 6.480 21.181 ( 0.723 -21.349 2.845) 21.550 21.769 ( 4.584 -22.759 -9.441) 25.063 ======================= Grid point 667 (320/322) ======================= q-point: (-0.15 -0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.137 ( -17.662 -0.000 8.200) 19.473 1.403 ( -18.662 -0.000 14.797) 23.817 1.728 ( -18.573 -0.000 4.276) 19.059 2.168 ( -3.603 -0.000 -4.640) 5.874 2.767 ( -1.645 -0.000 1.316) 2.107 2.838 ( 3.478 0.000 0.298) 3.491 2.959 ( 3.778 0.000 -1.473) 4.055 3.231 ( -6.532 -0.000 2.405) 6.961 3.531 ( -1.471 -0.000 4.543) 4.775 3.580 ( 0.382 0.000 -3.255) 3.277 3.801 ( -10.701 -0.000 -9.331) 14.198 4.120 ( 0.026 0.000 -1.508) 1.508 4.233 ( 0.469 0.000 0.478) 0.669 4.438 ( 10.374 0.000 1.948) 10.555 5.128 ( 9.967 0.000 -2.794) 10.351 5.313 ( 3.138 0.000 5.398) 6.244 5.513 ( 6.241 0.000 2.086) 6.580 5.682 ( 2.077 0.000 -6.210) 6.548 7.011 ( -5.447 -0.000 3.215) 6.325 7.443 ( 13.170 0.000 -0.284) 13.173 8.498 ( 3.325 0.000 -8.070) 8.729 8.520 ( -9.337 -0.000 0.196) 9.339 8.713 ( 1.868 0.000 0.434) 1.918 8.964 ( 0.713 0.000 6.195) 6.236 9.615 ( -0.232 -0.000 0.901) 0.931 10.211 ( -6.336 -0.000 -8.893) 10.919 10.547 ( 0.135 0.000 -0.718) 0.731 10.707 ( -3.976 -0.000 -2.064) 4.480 11.273 ( 17.592 0.000 -2.101) 17.717 11.823 ( 8.159 0.000 5.841) 10.035 15.014 ( -24.064 -0.000 -6.572) 24.945 15.537 ( -13.819 -0.000 6.744) 15.377 16.658 ( -16.386 -0.000 1.259) 16.434 16.986 ( -6.036 -0.000 -0.522) 6.058 20.551 ( 0.035 0.000 0.010) 0.036 20.809 ( -0.004 -0.000 -0.029) 0.029 ======================= Grid point 668 (321/322) ======================= q-point: (-0.08 -0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( -13.195 -16.731 8.112) 22.800 1.467 ( -12.062 -16.011 13.277) 24.044 1.757 ( -10.493 -11.234 1.512) 15.446 2.331 ( -1.165 -16.154 -2.479) 16.384 2.760 ( -3.673 -1.725 -0.464) 4.085 2.914 ( 1.321 -5.384 0.075) 5.544 3.035 ( -1.431 -5.398 -1.481) 5.777 3.220 ( -3.822 -3.237 0.855) 5.081 3.603 ( -2.703 -4.844 -1.410) 5.723 3.678 ( -0.413 -7.421 -2.043) 7.708 4.031 ( -2.255 -23.681 -3.204) 24.003 4.161 ( 1.271 -4.464 -1.106) 4.772 4.340 ( 1.339 -9.939 2.463) 10.327 4.526 ( 4.213 -7.676 -0.598) 8.776 5.158 ( 6.380 1.083 -3.238) 7.237 5.338 ( 5.872 1.036 5.205) 7.915 5.547 ( 4.419 1.520 0.459) 4.695 5.675 ( -1.071 -3.998 -3.806) 5.623 6.931 ( -2.287 5.773 3.704) 7.230 7.455 ( 11.197 6.270 -0.543) 12.845 8.143 ( 1.311 24.381 -2.575) 24.551 8.376 ( -5.956 11.591 1.375) 13.104 8.898 ( -3.578 -5.654 4.774) 8.219 8.938 ( 4.721 -3.274 -1.706) 5.993 9.745 ( -1.472 -9.325 -1.501) 9.559 10.152 ( -6.432 0.358 -7.036) 9.540 10.421 ( 0.502 10.786 -0.587) 10.814 10.696 ( -6.641 -1.641 -1.949) 7.113 11.375 ( 16.566 -0.347 -0.072) 16.570 11.725 ( 0.563 10.501 5.811) 12.015 14.903 ( -9.461 -0.567 0.719) 9.506 15.397 ( -15.026 5.276 3.528) 16.312 16.515 ( -9.250 5.060 1.199) 10.612 16.918 ( -4.602 3.194 -0.350) 5.613 20.771 ( 0.443 -19.003 1.356) 19.057 21.203 ( 2.547 -32.112 -7.599) 33.097 ======================= Grid point 681 (322/322) ======================= q-point: (-0.08 -0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 3.35e-04 3.35e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( -10.160 -0.000 8.184) 13.046 1.168 ( -20.837 -0.000 10.912) 23.521 1.693 ( 2.605 0.000 12.394) 12.665 2.120 ( -1.903 -0.000 -4.640) 5.015 2.694 ( -8.893 -0.000 -3.132) 9.429 2.869 ( 1.415 0.000 1.156) 1.827 2.988 ( 1.933 0.000 -1.629) 2.528 3.192 ( -1.262 -0.000 1.901) 2.282 3.525 ( -1.740 -0.000 4.115) 4.468 3.580 ( 1.227 0.000 -3.104) 3.338 3.674 ( -6.261 -0.000 -6.848) 9.279 4.118 ( -0.523 -0.000 0.103) 0.533 4.265 ( 5.080 0.000 -0.431) 5.099 4.515 ( 1.006 0.000 -0.686) 1.218 5.180 ( 2.421 0.000 -1.665) 2.938 5.406 ( 8.482 0.000 3.787) 9.289 5.560 ( 0.030 0.000 0.557) 0.558 5.674 ( 0.394 0.000 -3.701) 3.721 6.982 ( -2.105 -0.000 4.676) 5.128 7.578 ( 9.002 0.000 -0.149) 9.003 8.419 ( -7.036 -0.000 0.140) 7.038 8.481 ( -2.320 -0.000 -5.692) 6.147 8.728 ( 0.060 0.000 1.300) 1.301 9.000 ( 3.200 0.000 2.605) 4.127 9.617 ( 0.093 0.000 0.754) 0.760 10.100 ( -7.848 -0.000 -6.565) 10.232 10.546 ( 0.007 0.000 -0.634) 0.634 10.648 ( -4.072 -0.000 -1.413) 4.310 11.479 ( 18.102 0.000 -2.039) 18.217 11.849 ( -7.005 -0.000 0.957) 7.070 14.878 ( 3.803 0.000 4.347) 5.776 15.364 ( -17.862 -0.000 3.615) 18.224 16.517 ( -8.050 -0.000 1.679) 8.223 16.926 ( -3.677 -0.000 -0.500) 3.711 20.552 ( 0.006 0.000 0.019) 0.020 20.808 ( 0.001 0.000 -0.030) 0.030 =================== 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 3/42588 10.0 1684.488 459.918 495.295 0.000 237.513 0.000 3/42588 20.0 378.920 182.202 112.949 0.000 34.263 0.000 3/42588 30.0 127.087 75.923 35.911 0.000 8.495 0.000 3/42588 40.0 64.256 41.886 17.130 0.000 3.468 0.000 3/42588 50.0 40.587 27.715 10.367 0.000 1.964 0.000 3/42588 60.0 29.050 20.449 7.215 0.000 1.342 0.000 3/42588 70.0 22.430 16.137 5.472 0.000 1.021 0.000 3/42588 80.0 18.198 13.309 4.389 0.000 0.827 0.000 3/42588 90.0 15.284 11.323 3.659 0.000 0.698 0.000 3/42588 100.0 13.166 9.858 3.137 0.000 0.606 0.000 3/42588 110.0 11.564 8.737 2.747 0.000 0.536 0.000 3/42588 120.0 10.313 7.856 2.446 0.000 0.482 0.000 3/42588 130.0 9.312 7.148 2.207 0.000 0.438 0.000 3/42588 140.0 8.494 6.569 2.012 0.000 0.402 0.000 3/42588 150.0 7.813 6.089 1.852 0.000 0.372 0.000 3/42588 160.0 7.238 5.686 1.717 0.000 0.346 0.000 3/42588 170.0 6.746 5.343 1.602 0.000 0.324 0.000 3/42588 180.0 6.321 5.048 1.503 0.000 0.304 0.000 3/42588 190.0 5.948 4.793 1.417 0.000 0.287 0.000 3/42588 200.0 5.620 4.569 1.341 0.000 0.272 0.000 3/42588 210.0 5.328 4.372 1.274 0.000 0.258 0.000 3/42588 220.0 5.067 4.197 1.214 0.000 0.246 0.000 3/42588 230.0 4.832 4.039 1.161 0.000 0.235 0.000 3/42588 240.0 4.618 3.897 1.112 0.000 0.225 0.000 3/42588 250.0 4.424 3.767 1.068 0.000 0.215 0.000 3/42588 260.0 4.246 3.649 1.027 0.000 0.207 0.000 3/42588 270.0 4.083 3.540 0.990 0.000 0.199 0.000 3/42588 280.0 3.932 3.439 0.956 0.000 0.192 0.000 3/42588 290.0 3.793 3.345 0.924 0.000 0.185 0.000 3/42588 300.0 3.663 3.257 0.894 0.000 0.178 0.000 3/42588 310.0 3.543 3.175 0.867 0.000 0.172 0.000 3/42588 320.0 3.430 3.097 0.841 0.000 0.167 0.000 3/42588 330.0 3.325 3.024 0.817 0.000 0.162 0.000 3/42588 340.0 3.226 2.955 0.794 0.000 0.157 0.000 3/42588 350.0 3.132 2.889 0.773 0.000 0.152 0.000 3/42588 360.0 3.045 2.826 0.753 0.000 0.148 0.000 3/42588 370.0 2.962 2.767 0.733 0.000 0.144 0.000 3/42588 380.0 2.884 2.710 0.715 0.000 0.140 0.000 3/42588 390.0 2.809 2.655 0.698 0.000 0.136 0.000 3/42588 400.0 2.739 2.603 0.682 0.000 0.133 0.000 3/42588 410.0 2.672 2.552 0.666 0.000 0.129 0.000 3/42588 420.0 2.608 2.504 0.651 0.000 0.126 0.000 3/42588 430.0 2.548 2.458 0.637 0.000 0.123 0.000 3/42588 440.0 2.490 2.413 0.623 0.000 0.120 0.000 3/42588 450.0 2.435 2.370 0.610 0.000 0.117 0.000 3/42588 460.0 2.382 2.328 0.598 0.000 0.115 0.000 3/42588 470.0 2.331 2.288 0.586 0.000 0.112 0.000 3/42588 480.0 2.283 2.249 0.575 0.000 0.110 0.000 3/42588 490.0 2.236 2.212 0.563 0.000 0.108 0.000 3/42588 500.0 2.192 2.175 0.553 0.000 0.105 0.000 3/42588 510.0 2.149 2.140 0.543 0.000 0.103 0.000 3/42588 520.0 2.108 2.106 0.533 0.000 0.101 0.000 3/42588 530.0 2.068 2.073 0.523 0.000 0.099 0.000 3/42588 540.0 2.030 2.041 0.514 0.000 0.097 0.000 3/42588 550.0 1.994 2.010 0.505 0.000 0.096 0.000 3/42588 560.0 1.958 1.979 0.497 0.000 0.094 0.000 3/42588 570.0 1.924 1.950 0.489 0.000 0.092 0.000 3/42588 580.0 1.891 1.922 0.481 0.000 0.091 0.000 3/42588 590.0 1.859 1.894 0.473 0.000 0.089 0.000 3/42588 600.0 1.828 1.867 0.465 0.000 0.087 0.000 3/42588 610.0 1.799 1.841 0.458 0.000 0.086 0.000 3/42588 620.0 1.770 1.815 0.451 0.000 0.085 0.000 3/42588 630.0 1.742 1.790 0.444 0.000 0.083 0.000 3/42588 640.0 1.715 1.766 0.438 0.000 0.082 0.000 3/42588 650.0 1.688 1.742 0.431 0.000 0.081 0.000 3/42588 660.0 1.663 1.719 0.425 0.000 0.079 0.000 3/42588 670.0 1.638 1.697 0.419 0.000 0.078 0.000 3/42588 680.0 1.614 1.675 0.413 0.000 0.077 0.000 3/42588 690.0 1.591 1.654 0.407 0.000 0.076 0.000 3/42588 700.0 1.569 1.633 0.402 0.000 0.075 0.000 3/42588 710.0 1.547 1.613 0.396 0.000 0.074 0.000 3/42588 720.0 1.525 1.593 0.391 0.000 0.073 0.000 3/42588 730.0 1.504 1.573 0.386 0.000 0.072 0.000 3/42588 740.0 1.484 1.555 0.381 0.000 0.071 0.000 3/42588 750.0 1.465 1.536 0.376 0.000 0.070 0.000 3/42588 760.0 1.445 1.518 0.371 0.000 0.069 0.000 3/42588 770.0 1.427 1.500 0.367 0.000 0.068 0.000 3/42588 780.0 1.409 1.483 0.362 0.000 0.067 0.000 3/42588 790.0 1.391 1.466 0.358 0.000 0.066 0.000 3/42588 800.0 1.374 1.450 0.353 0.000 0.065 0.000 3/42588 810.0 1.357 1.434 0.349 0.000 0.064 0.000 3/42588 820.0 1.340 1.418 0.345 0.000 0.064 0.000 3/42588 830.0 1.324 1.402 0.341 0.000 0.063 0.000 3/42588 840.0 1.309 1.387 0.337 0.000 0.062 0.000 3/42588 850.0 1.293 1.372 0.333 0.000 0.061 0.000 3/42588 860.0 1.278 1.358 0.330 0.000 0.061 0.000 3/42588 870.0 1.264 1.344 0.326 0.000 0.060 0.000 3/42588 880.0 1.249 1.330 0.322 0.000 0.059 0.000 3/42588 890.0 1.235 1.316 0.319 0.000 0.059 0.000 3/42588 900.0 1.222 1.303 0.315 0.000 0.058 0.000 3/42588 910.0 1.208 1.289 0.312 0.000 0.057 0.000 3/42588 920.0 1.195 1.277 0.309 0.000 0.057 0.000 3/42588 930.0 1.183 1.264 0.306 0.000 0.056 0.000 3/42588 940.0 1.170 1.251 0.302 0.000 0.055 0.000 3/42588 950.0 1.158 1.239 0.299 0.000 0.055 0.000 3/42588 960.0 1.146 1.227 0.296 0.000 0.054 0.000 3/42588 970.0 1.134 1.216 0.293 0.000 0.054 0.000 3/42588 980.0 1.122 1.204 0.290 0.000 0.053 0.000 3/42588 990.0 1.111 1.193 0.288 0.000 0.053 0.000 3/42588 1000.0 1.100 1.182 0.285 0.000 0.052 0.000 3/42588 Thermal conductivity related properties were written into "kappa-m13137.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:23:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|