----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:24:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.563433421293404 -5.569238910000001 0.000000000000000 b 3.563433421293404 5.569238910000001 0.000000000000000 c -3.365885073346374 0.000000000000000 3.871410988837138 Atomic positions (fractional): *1 O 0.27471051960322 0.21258883226821 0.70396000730309 15.999 2 O 0.78741116773179 0.72528948039678 0.79603999269691 15.999 3 O 0.72528948039678 0.78741116773179 0.29603999269691 15.999 4 O 0.21258883226821 0.27471051960322 0.20396000730309 15.999 *5 O 0.05431031059595 0.63490633833933 0.34051597293092 15.999 6 O 0.36509366166067 0.94568968940405 0.15948402706908 15.999 7 O 0.94568968940405 0.36509366166067 0.65948402706908 15.999 8 O 0.63490633833933 0.05431031059595 0.84051597293092 15.999 *9 Nb 0.10370818455894 0.89629181544106 0.25000000000000 92.906 10 Nb 0.89629181544106 0.10370818455894 0.75000000000000 92.906 *11 Sm 0.62948211247625 0.37051788752375 0.25000000000000 150.360 12 Sm 0.37051788752375 0.62948211247625 0.75000000000000 150.360 -------------------------------- unit cell --------------------------------- Lattice vectors: a 7.126866842586809 0.000000000000000 0.000000000000000 b 0.000000000000000 11.138477820000002 0.000000000000000 c -3.365885073346374 0.000000000000000 3.871410988837138 Atomic positions (fractional): *1 O 0.24364967593571 0.96893915633249 0.70396000730309 15.999 > 1 2 O 0.75635032406429 0.96893915633249 0.79603999269691 15.999 > 2 3 O 0.25635032406428 0.53106084366751 0.29603999269691 15.999 > 3 4 O 0.74364967593571 0.53106084366751 0.20396000730309 15.999 > 4 *5 O 0.84460832446764 0.79029801387169 0.34051597293092 15.999 > 5 6 O 0.15539167553236 0.79029801387169 0.15948402706908 15.999 > 6 7 O 0.65539167553236 0.70970198612831 0.65948402706908 15.999 > 7 8 O 0.34460832446764 0.70970198612831 0.84051597293092 15.999 > 8 9 O 0.74364967593571 0.46893915633249 0.70396000730309 15.999 > 1 10 O 0.25635032406428 0.46893915633249 0.79603999269691 15.999 > 2 11 O 0.75635032406429 0.03106084366751 0.29603999269691 15.999 > 3 12 O 0.24364967593571 0.03106084366751 0.20396000730309 15.999 > 4 13 O 0.34460832446764 0.29029801387169 0.34051597293092 15.999 > 5 14 O 0.65539167553236 0.29029801387169 0.15948402706908 15.999 > 6 15 O 0.15539167553236 0.20970198612831 0.65948402706908 15.999 > 7 16 O 0.84460832446764 0.20970198612831 0.84051597293092 15.999 > 8 *17 Nb 0.00000000000000 0.89629181544106 0.25000000000000 92.906 > 9 18 Nb 0.50000000000000 0.60370818455894 0.75000000000000 92.906 > 10 19 Nb 0.50000000000000 0.39629181544106 0.25000000000000 92.906 > 9 20 Nb 0.00000000000000 0.10370818455894 0.75000000000000 92.906 > 10 *21 Sm 0.50000000000000 0.87051788752375 0.25000000000000 150.360 > 11 22 Sm 0.00000000000000 0.62948211247625 0.75000000000000 150.360 > 12 23 Sm 0.00000000000000 0.37051788752375 0.25000000000000 150.360 > 11 24 Sm 0.50000000000000 0.12948211247625 0.75000000000000 150.360 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.253733685173618 0.000000000000000 0.000000000000000 b 0.000000000000000 11.138477820000002 0.000000000000000 c -10.097655220039123 0.000000000000000 11.614232966511414 Atomic positions (fractional): *1 O 0.12182483796786 0.96893915633249 0.23465333576770 15.999 > 1 2 O 0.62182483796786 0.96893915633249 0.23465333576770 15.999 > 1 3 O 0.12182483796786 0.96893915633249 0.56798666910103 15.999 > 1 4 O 0.62182483796786 0.96893915633249 0.56798666910103 15.999 > 1 5 O 0.12182483796786 0.96893915633249 0.90132000243436 15.999 > 1 6 O 0.62182483796786 0.96893915633249 0.90132000243436 15.999 > 1 7 O 0.37817516203214 0.96893915633249 0.26534666423230 15.999 > 2 8 O 0.87817516203214 0.96893915633249 0.26534666423230 15.999 > 2 9 O 0.37817516203214 0.96893915633249 0.59867999756564 15.999 > 2 10 O 0.87817516203214 0.96893915633249 0.59867999756564 15.999 > 2 11 O 0.37817516203214 0.96893915633249 0.93201333089897 15.999 > 2 12 O 0.87817516203214 0.96893915633249 0.93201333089897 15.999 > 2 13 O 0.12817516203214 0.53106084366751 0.09867999756564 15.999 > 3 14 O 0.62817516203214 0.53106084366751 0.09867999756564 15.999 > 3 15 O 0.12817516203214 0.53106084366751 0.43201333089897 15.999 > 3 16 O 0.62817516203214 0.53106084366751 0.43201333089897 15.999 > 3 17 O 0.12817516203214 0.53106084366751 0.76534666423230 15.999 > 3 18 O 0.62817516203214 0.53106084366751 0.76534666423230 15.999 > 3 19 O 0.37182483796786 0.53106084366751 0.06798666910103 15.999 > 4 20 O 0.87182483796786 0.53106084366751 0.06798666910103 15.999 > 4 21 O 0.37182483796786 0.53106084366751 0.40132000243436 15.999 > 4 22 O 0.87182483796786 0.53106084366751 0.40132000243436 15.999 > 4 23 O 0.37182483796786 0.53106084366751 0.73465333576770 15.999 > 4 24 O 0.87182483796786 0.53106084366751 0.73465333576770 15.999 > 4 *25 O 0.42230416223382 0.79029801387169 0.11350532431031 15.999 > 5 26 O 0.92230416223382 0.79029801387169 0.11350532431031 15.999 > 5 27 O 0.42230416223382 0.79029801387169 0.44683865764364 15.999 > 5 28 O 0.92230416223382 0.79029801387169 0.44683865764364 15.999 > 5 29 O 0.42230416223382 0.79029801387169 0.78017199097697 15.999 > 5 30 O 0.92230416223382 0.79029801387169 0.78017199097697 15.999 > 5 31 O 0.07769583776618 0.79029801387169 0.05316134235636 15.999 > 6 32 O 0.57769583776618 0.79029801387169 0.05316134235636 15.999 > 6 33 O 0.07769583776618 0.79029801387169 0.38649467568969 15.999 > 6 34 O 0.57769583776618 0.79029801387169 0.38649467568969 15.999 > 6 35 O 0.07769583776618 0.79029801387169 0.71982800902303 15.999 > 6 36 O 0.57769583776618 0.79029801387169 0.71982800902303 15.999 > 6 37 O 0.32769583776618 0.70970198612831 0.21982800902303 15.999 > 7 38 O 0.82769583776618 0.70970198612831 0.21982800902303 15.999 > 7 39 O 0.32769583776618 0.70970198612831 0.55316134235636 15.999 > 7 40 O 0.82769583776618 0.70970198612831 0.55316134235636 15.999 > 7 41 O 0.32769583776618 0.70970198612831 0.88649467568969 15.999 > 7 42 O 0.82769583776618 0.70970198612831 0.88649467568969 15.999 > 7 43 O 0.17230416223382 0.70970198612831 0.28017199097697 15.999 > 8 44 O 0.67230416223382 0.70970198612831 0.28017199097697 15.999 > 8 45 O 0.17230416223382 0.70970198612831 0.61350532431031 15.999 > 8 46 O 0.67230416223382 0.70970198612831 0.61350532431031 15.999 > 8 47 O 0.17230416223382 0.70970198612831 0.94683865764364 15.999 > 8 48 O 0.67230416223382 0.70970198612831 0.94683865764364 15.999 > 8 49 O 0.37182483796786 0.46893915633249 0.23465333576770 15.999 > 1 50 O 0.87182483796786 0.46893915633249 0.23465333576770 15.999 > 1 51 O 0.37182483796786 0.46893915633249 0.56798666910103 15.999 > 1 52 O 0.87182483796786 0.46893915633249 0.56798666910103 15.999 > 1 53 O 0.37182483796786 0.46893915633249 0.90132000243436 15.999 > 1 54 O 0.87182483796786 0.46893915633249 0.90132000243436 15.999 > 1 55 O 0.12817516203214 0.46893915633249 0.26534666423230 15.999 > 2 56 O 0.62817516203214 0.46893915633249 0.26534666423230 15.999 > 2 57 O 0.12817516203214 0.46893915633249 0.59867999756564 15.999 > 2 58 O 0.62817516203214 0.46893915633249 0.59867999756564 15.999 > 2 59 O 0.12817516203214 0.46893915633249 0.93201333089897 15.999 > 2 60 O 0.62817516203214 0.46893915633249 0.93201333089897 15.999 > 2 61 O 0.37817516203214 0.03106084366751 0.09867999756564 15.999 > 3 62 O 0.87817516203214 0.03106084366751 0.09867999756564 15.999 > 3 63 O 0.37817516203214 0.03106084366751 0.43201333089897 15.999 > 3 64 O 0.87817516203214 0.03106084366751 0.43201333089897 15.999 > 3 65 O 0.37817516203214 0.03106084366751 0.76534666423230 15.999 > 3 66 O 0.87817516203214 0.03106084366751 0.76534666423230 15.999 > 3 67 O 0.12182483796786 0.03106084366751 0.06798666910103 15.999 > 4 68 O 0.62182483796786 0.03106084366751 0.06798666910103 15.999 > 4 69 O 0.12182483796786 0.03106084366751 0.40132000243436 15.999 > 4 70 O 0.62182483796786 0.03106084366751 0.40132000243436 15.999 > 4 71 O 0.12182483796786 0.03106084366751 0.73465333576770 15.999 > 4 72 O 0.62182483796786 0.03106084366751 0.73465333576770 15.999 > 4 73 O 0.17230416223382 0.29029801387169 0.11350532431031 15.999 > 5 74 O 0.67230416223382 0.29029801387169 0.11350532431031 15.999 > 5 75 O 0.17230416223382 0.29029801387169 0.44683865764364 15.999 > 5 76 O 0.67230416223382 0.29029801387169 0.44683865764364 15.999 > 5 77 O 0.17230416223382 0.29029801387169 0.78017199097697 15.999 > 5 78 O 0.67230416223382 0.29029801387169 0.78017199097697 15.999 > 5 79 O 0.32769583776618 0.29029801387169 0.05316134235636 15.999 > 6 80 O 0.82769583776618 0.29029801387169 0.05316134235636 15.999 > 6 81 O 0.32769583776618 0.29029801387169 0.38649467568969 15.999 > 6 82 O 0.82769583776618 0.29029801387169 0.38649467568969 15.999 > 6 83 O 0.32769583776618 0.29029801387169 0.71982800902303 15.999 > 6 84 O 0.82769583776618 0.29029801387169 0.71982800902303 15.999 > 6 85 O 0.07769583776618 0.20970198612831 0.21982800902303 15.999 > 7 86 O 0.57769583776618 0.20970198612831 0.21982800902303 15.999 > 7 87 O 0.07769583776618 0.20970198612831 0.55316134235636 15.999 > 7 88 O 0.57769583776618 0.20970198612831 0.55316134235636 15.999 > 7 89 O 0.07769583776618 0.20970198612831 0.88649467568969 15.999 > 7 90 O 0.57769583776618 0.20970198612831 0.88649467568969 15.999 > 7 91 O 0.42230416223382 0.20970198612831 0.28017199097697 15.999 > 8 92 O 0.92230416223382 0.20970198612831 0.28017199097697 15.999 > 8 93 O 0.42230416223382 0.20970198612831 0.61350532431031 15.999 > 8 94 O 0.92230416223382 0.20970198612831 0.61350532431031 15.999 > 8 95 O 0.42230416223382 0.20970198612831 0.94683865764364 15.999 > 8 96 O 0.92230416223382 0.20970198612831 0.94683865764364 15.999 > 8 *97 Nb 0.00000000000000 0.89629181544106 0.08333333333333 92.906 > 9 98 Nb 0.50000000000000 0.89629181544106 0.08333333333333 92.906 > 9 99 Nb 0.00000000000000 0.89629181544106 0.41666666666667 92.906 > 9 100 Nb 0.50000000000000 0.89629181544106 0.41666666666667 92.906 > 9 101 Nb 0.00000000000000 0.89629181544106 0.75000000000000 92.906 > 9 102 Nb 0.50000000000000 0.89629181544106 0.75000000000000 92.906 > 9 103 Nb 0.25000000000000 0.60370818455894 0.25000000000000 92.906 > 10 104 Nb 0.75000000000000 0.60370818455894 0.25000000000000 92.906 > 10 105 Nb 0.25000000000000 0.60370818455894 0.58333333333333 92.906 > 10 106 Nb 0.75000000000000 0.60370818455894 0.58333333333333 92.906 > 10 107 Nb 0.25000000000000 0.60370818455894 0.91666666666667 92.906 > 10 108 Nb 0.75000000000000 0.60370818455894 0.91666666666667 92.906 > 10 109 Nb 0.25000000000000 0.39629181544106 0.08333333333333 92.906 > 9 110 Nb 0.75000000000000 0.39629181544106 0.08333333333333 92.906 > 9 111 Nb 0.25000000000000 0.39629181544106 0.41666666666667 92.906 > 9 112 Nb 0.75000000000000 0.39629181544106 0.41666666666667 92.906 > 9 113 Nb 0.25000000000000 0.39629181544106 0.75000000000000 92.906 > 9 114 Nb 0.75000000000000 0.39629181544106 0.75000000000000 92.906 > 9 115 Nb 0.00000000000000 0.10370818455894 0.25000000000000 92.906 > 10 116 Nb 0.50000000000000 0.10370818455894 0.25000000000000 92.906 > 10 117 Nb 0.00000000000000 0.10370818455894 0.58333333333333 92.906 > 10 118 Nb 0.50000000000000 0.10370818455894 0.58333333333333 92.906 > 10 119 Nb 0.00000000000000 0.10370818455894 0.91666666666667 92.906 > 10 120 Nb 0.50000000000000 0.10370818455894 0.91666666666667 92.906 > 10 *121 Sm 0.25000000000000 0.87051788752375 0.08333333333333 150.360 > 11 122 Sm 0.75000000000000 0.87051788752375 0.08333333333333 150.360 > 11 123 Sm 0.25000000000000 0.87051788752375 0.41666666666667 150.360 > 11 124 Sm 0.75000000000000 0.87051788752375 0.41666666666667 150.360 > 11 125 Sm 0.25000000000000 0.87051788752375 0.75000000000000 150.360 > 11 126 Sm 0.75000000000000 0.87051788752375 0.75000000000000 150.360 > 11 127 Sm 0.00000000000000 0.62948211247625 0.25000000000000 150.360 > 12 128 Sm 0.50000000000000 0.62948211247625 0.25000000000000 150.360 > 12 129 Sm 0.00000000000000 0.62948211247625 0.58333333333333 150.360 > 12 130 Sm 0.50000000000000 0.62948211247625 0.58333333333333 150.360 > 12 131 Sm 0.00000000000000 0.62948211247625 0.91666666666667 150.360 > 12 132 Sm 0.50000000000000 0.62948211247625 0.91666666666667 150.360 > 12 133 Sm 0.00000000000000 0.37051788752375 0.08333333333333 150.360 > 11 134 Sm 0.50000000000000 0.37051788752375 0.08333333333333 150.360 > 11 135 Sm 0.00000000000000 0.37051788752375 0.41666666666667 150.360 > 11 136 Sm 0.50000000000000 0.37051788752375 0.41666666666667 150.360 > 11 137 Sm 0.00000000000000 0.37051788752375 0.75000000000000 150.360 > 11 138 Sm 0.50000000000000 0.37051788752375 0.75000000000000 150.360 > 11 139 Sm 0.25000000000000 0.12948211247625 0.25000000000000 150.360 > 12 140 Sm 0.75000000000000 0.12948211247625 0.25000000000000 150.360 > 12 141 Sm 0.25000000000000 0.12948211247625 0.58333333333333 150.360 > 12 142 Sm 0.75000000000000 0.12948211247625 0.58333333333333 150.360 > 12 143 Sm 0.25000000000000 0.12948211247625 0.91666666666667 150.360 > 12 144 Sm 0.75000000000000 0.12948211247625 0.91666666666667 150.360 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.1837467 0.0000000 -0.3023925 0.0000000 4.8186436 0.0000000 -0.3023926 0.0000000 5.0834741 -------------------------- Born effective charges -------------------------- 1 O -1.8297372 0.1198936 0.0156101 0.0227283 -2.1062098 -0.6312587 -0.0199143 -0.6760754 -3.5266204 2 O -1.8297372 -0.1198936 0.0156101 -0.0227283 -2.1062098 0.6312587 -0.0199143 0.6760754 -3.5266204 3 O -1.8297372 0.1198936 0.0156101 0.0227283 -2.1062098 -0.6312587 -0.0199143 -0.6760754 -3.5266204 4 O -1.8297372 -0.1198936 0.0156101 -0.0227283 -2.1062098 0.6312587 -0.0199143 0.6760754 -3.5266204 5 O -3.3516786 -1.0401686 0.4001055 -1.0051979 -2.5652957 0.6242764 0.4461849 0.5379636 -1.4971029 6 O -3.3516786 1.0401686 0.4001055 1.0051979 -2.5652957 -0.6242764 0.4461849 -0.5379636 -1.4971029 7 O -3.3516786 -1.0401686 0.4001055 -1.0051979 -2.5652957 0.6242764 0.4461849 0.5379636 -1.4971029 8 O -3.3516786 1.0401686 0.4001055 1.0051979 -2.5652957 -0.6242764 0.4461849 -0.5379636 -1.4971029 9 Nb 5.6744065 0.0000000 -0.7569569 0.0000000 5.2944830 0.0000000 -1.3273880 0.0000000 5.5088523 10 Nb 5.6744065 0.0000000 -0.7569569 0.0000000 5.2944830 0.0000000 -1.3273880 0.0000000 5.5088523 11 Sm 4.6884250 0.0000000 -0.0744743 0.0000000 4.0485280 0.0000000 0.4748469 0.0000000 4.5385943 12 Sm 4.6884250 0.0000000 -0.0744743 0.0000000 4.0485280 0.0000000 0.4748469 0.0000000 4.5385943 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 400 - Time: 0.835 Solver_block: 200 / 400 - Time: 0.808 Solver_block: 300 / 400 - Time: 0.808 Solver_block: 400 / 400 - Time: 0.802 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.341 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True Max drift after symmetrization by symfc projector: -0.00000000 (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 00:24:59]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:24:59]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.563433421293404 -5.569238910000001 0.000000000000000 b 3.563433421293404 5.569238910000001 0.000000000000000 c -3.365885073346374 0.000000000000000 3.871410988837138 Atomic positions (fractional): 1 O 0.27471051960322 0.21258883226821 0.70396000730309 15.999 2 O 0.78741116773179 0.72528948039678 0.79603999269691 15.999 3 O 0.72528948039678 0.78741116773179 0.29603999269691 15.999 4 O 0.21258883226821 0.27471051960322 0.20396000730309 15.999 5 O 0.05431031059595 0.63490633833933 0.34051597293092 15.999 6 O 0.36509366166067 0.94568968940405 0.15948402706908 15.999 7 O 0.94568968940405 0.36509366166067 0.65948402706908 15.999 8 O 0.63490633833933 0.05431031059595 0.84051597293092 15.999 9 Nb 0.10370818455894 0.89629181544106 0.25000000000000 92.906 10 Nb 0.89629181544106 0.10370818455894 0.75000000000000 92.906 11 Sm 0.62948211247625 0.37051788752375 0.25000000000000 150.360 12 Sm 0.37051788752375 0.62948211247625 0.75000000000000 150.360 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.253733685173618 0.000000000000000 0.000000000000000 b 0.000000000000000 11.138477820000002 0.000000000000000 c -10.097655220039123 0.000000000000000 11.614232966511414 Atomic positions (fractional): 1 O 0.12182483796786 0.96893915633249 0.23465333576770 15.999 > 1 2 O 0.62182483796786 0.96893915633249 0.23465333576770 15.999 > 1 3 O 0.12182483796786 0.96893915633249 0.56798666910103 15.999 > 1 4 O 0.62182483796786 0.96893915633249 0.56798666910103 15.999 > 1 5 O 0.12182483796786 0.96893915633249 0.90132000243436 15.999 > 1 6 O 0.62182483796786 0.96893915633249 0.90132000243436 15.999 > 1 7 O 0.37817516203214 0.96893915633249 0.26534666423230 15.999 > 7 8 O 0.87817516203214 0.96893915633249 0.26534666423230 15.999 > 7 9 O 0.37817516203214 0.96893915633249 0.59867999756564 15.999 > 7 10 O 0.87817516203214 0.96893915633249 0.59867999756564 15.999 > 7 11 O 0.37817516203214 0.96893915633249 0.93201333089897 15.999 > 7 12 O 0.87817516203214 0.96893915633249 0.93201333089897 15.999 > 7 13 O 0.12817516203214 0.53106084366751 0.09867999756564 15.999 > 13 14 O 0.62817516203214 0.53106084366751 0.09867999756564 15.999 > 13 15 O 0.12817516203214 0.53106084366751 0.43201333089897 15.999 > 13 16 O 0.62817516203214 0.53106084366751 0.43201333089897 15.999 > 13 17 O 0.12817516203214 0.53106084366751 0.76534666423230 15.999 > 13 18 O 0.62817516203214 0.53106084366751 0.76534666423230 15.999 > 13 19 O 0.37182483796786 0.53106084366751 0.06798666910103 15.999 > 19 20 O 0.87182483796786 0.53106084366751 0.06798666910103 15.999 > 19 21 O 0.37182483796786 0.53106084366751 0.40132000243436 15.999 > 19 22 O 0.87182483796786 0.53106084366751 0.40132000243436 15.999 > 19 23 O 0.37182483796786 0.53106084366751 0.73465333576770 15.999 > 19 24 O 0.87182483796786 0.53106084366751 0.73465333576770 15.999 > 19 25 O 0.42230416223382 0.79029801387169 0.11350532431031 15.999 > 25 26 O 0.92230416223382 0.79029801387169 0.11350532431031 15.999 > 25 27 O 0.42230416223382 0.79029801387169 0.44683865764364 15.999 > 25 28 O 0.92230416223382 0.79029801387169 0.44683865764364 15.999 > 25 29 O 0.42230416223382 0.79029801387169 0.78017199097697 15.999 > 25 30 O 0.92230416223382 0.79029801387169 0.78017199097697 15.999 > 25 31 O 0.07769583776618 0.79029801387169 0.05316134235636 15.999 > 31 32 O 0.57769583776618 0.79029801387169 0.05316134235636 15.999 > 31 33 O 0.07769583776618 0.79029801387169 0.38649467568969 15.999 > 31 34 O 0.57769583776618 0.79029801387169 0.38649467568969 15.999 > 31 35 O 0.07769583776618 0.79029801387169 0.71982800902303 15.999 > 31 36 O 0.57769583776618 0.79029801387169 0.71982800902303 15.999 > 31 37 O 0.32769583776618 0.70970198612831 0.21982800902303 15.999 > 37 38 O 0.82769583776618 0.70970198612831 0.21982800902303 15.999 > 37 39 O 0.32769583776618 0.70970198612831 0.55316134235636 15.999 > 37 40 O 0.82769583776618 0.70970198612831 0.55316134235636 15.999 > 37 41 O 0.32769583776618 0.70970198612831 0.88649467568969 15.999 > 37 42 O 0.82769583776618 0.70970198612831 0.88649467568969 15.999 > 37 43 O 0.17230416223382 0.70970198612831 0.28017199097697 15.999 > 43 44 O 0.67230416223382 0.70970198612831 0.28017199097697 15.999 > 43 45 O 0.17230416223382 0.70970198612831 0.61350532431031 15.999 > 43 46 O 0.67230416223382 0.70970198612831 0.61350532431031 15.999 > 43 47 O 0.17230416223382 0.70970198612831 0.94683865764364 15.999 > 43 48 O 0.67230416223382 0.70970198612831 0.94683865764364 15.999 > 43 49 O 0.37182483796786 0.46893915633249 0.23465333576770 15.999 > 1 50 O 0.87182483796786 0.46893915633249 0.23465333576770 15.999 > 1 51 O 0.37182483796786 0.46893915633249 0.56798666910103 15.999 > 1 52 O 0.87182483796786 0.46893915633249 0.56798666910103 15.999 > 1 53 O 0.37182483796786 0.46893915633249 0.90132000243436 15.999 > 1 54 O 0.87182483796786 0.46893915633249 0.90132000243436 15.999 > 1 55 O 0.12817516203214 0.46893915633249 0.26534666423230 15.999 > 7 56 O 0.62817516203214 0.46893915633249 0.26534666423230 15.999 > 7 57 O 0.12817516203214 0.46893915633249 0.59867999756564 15.999 > 7 58 O 0.62817516203214 0.46893915633249 0.59867999756564 15.999 > 7 59 O 0.12817516203214 0.46893915633249 0.93201333089897 15.999 > 7 60 O 0.62817516203214 0.46893915633249 0.93201333089897 15.999 > 7 61 O 0.37817516203214 0.03106084366751 0.09867999756564 15.999 > 13 62 O 0.87817516203214 0.03106084366751 0.09867999756564 15.999 > 13 63 O 0.37817516203214 0.03106084366751 0.43201333089897 15.999 > 13 64 O 0.87817516203214 0.03106084366751 0.43201333089897 15.999 > 13 65 O 0.37817516203214 0.03106084366751 0.76534666423230 15.999 > 13 66 O 0.87817516203214 0.03106084366751 0.76534666423230 15.999 > 13 67 O 0.12182483796786 0.03106084366751 0.06798666910103 15.999 > 19 68 O 0.62182483796786 0.03106084366751 0.06798666910103 15.999 > 19 69 O 0.12182483796786 0.03106084366751 0.40132000243436 15.999 > 19 70 O 0.62182483796786 0.03106084366751 0.40132000243436 15.999 > 19 71 O 0.12182483796786 0.03106084366751 0.73465333576770 15.999 > 19 72 O 0.62182483796786 0.03106084366751 0.73465333576770 15.999 > 19 73 O 0.17230416223382 0.29029801387169 0.11350532431031 15.999 > 25 74 O 0.67230416223382 0.29029801387169 0.11350532431031 15.999 > 25 75 O 0.17230416223382 0.29029801387169 0.44683865764364 15.999 > 25 76 O 0.67230416223382 0.29029801387169 0.44683865764364 15.999 > 25 77 O 0.17230416223382 0.29029801387169 0.78017199097697 15.999 > 25 78 O 0.67230416223382 0.29029801387169 0.78017199097697 15.999 > 25 79 O 0.32769583776618 0.29029801387169 0.05316134235636 15.999 > 31 80 O 0.82769583776618 0.29029801387169 0.05316134235636 15.999 > 31 81 O 0.32769583776618 0.29029801387169 0.38649467568969 15.999 > 31 82 O 0.82769583776618 0.29029801387169 0.38649467568969 15.999 > 31 83 O 0.32769583776618 0.29029801387169 0.71982800902303 15.999 > 31 84 O 0.82769583776618 0.29029801387169 0.71982800902303 15.999 > 31 85 O 0.07769583776618 0.20970198612831 0.21982800902303 15.999 > 37 86 O 0.57769583776618 0.20970198612831 0.21982800902303 15.999 > 37 87 O 0.07769583776618 0.20970198612831 0.55316134235636 15.999 > 37 88 O 0.57769583776618 0.20970198612831 0.55316134235636 15.999 > 37 89 O 0.07769583776618 0.20970198612831 0.88649467568969 15.999 > 37 90 O 0.57769583776618 0.20970198612831 0.88649467568969 15.999 > 37 91 O 0.42230416223382 0.20970198612831 0.28017199097697 15.999 > 43 92 O 0.92230416223382 0.20970198612831 0.28017199097697 15.999 > 43 93 O 0.42230416223382 0.20970198612831 0.61350532431031 15.999 > 43 94 O 0.92230416223382 0.20970198612831 0.61350532431031 15.999 > 43 95 O 0.42230416223382 0.20970198612831 0.94683865764364 15.999 > 43 96 O 0.92230416223382 0.20970198612831 0.94683865764364 15.999 > 43 97 Nb 0.00000000000000 0.89629181544106 0.08333333333333 92.906 > 97 98 Nb 0.50000000000000 0.89629181544106 0.08333333333333 92.906 > 97 99 Nb 0.00000000000000 0.89629181544106 0.41666666666667 92.906 > 97 100 Nb 0.50000000000000 0.89629181544106 0.41666666666667 92.906 > 97 101 Nb 0.00000000000000 0.89629181544106 0.75000000000000 92.906 > 97 102 Nb 0.50000000000000 0.89629181544106 0.75000000000000 92.906 > 97 103 Nb 0.25000000000000 0.60370818455894 0.25000000000000 92.906 > 103 104 Nb 0.75000000000000 0.60370818455894 0.25000000000000 92.906 > 103 105 Nb 0.25000000000000 0.60370818455894 0.58333333333333 92.906 > 103 106 Nb 0.75000000000000 0.60370818455894 0.58333333333333 92.906 > 103 107 Nb 0.25000000000000 0.60370818455894 0.91666666666667 92.906 > 103 108 Nb 0.75000000000000 0.60370818455894 0.91666666666667 92.906 > 103 109 Nb 0.25000000000000 0.39629181544106 0.08333333333333 92.906 > 97 110 Nb 0.75000000000000 0.39629181544106 0.08333333333333 92.906 > 97 111 Nb 0.25000000000000 0.39629181544106 0.41666666666667 92.906 > 97 112 Nb 0.75000000000000 0.39629181544106 0.41666666666667 92.906 > 97 113 Nb 0.25000000000000 0.39629181544106 0.75000000000000 92.906 > 97 114 Nb 0.75000000000000 0.39629181544106 0.75000000000000 92.906 > 97 115 Nb 0.00000000000000 0.10370818455894 0.25000000000000 92.906 > 103 116 Nb 0.50000000000000 0.10370818455894 0.25000000000000 92.906 > 103 117 Nb 0.00000000000000 0.10370818455894 0.58333333333333 92.906 > 103 118 Nb 0.50000000000000 0.10370818455894 0.58333333333333 92.906 > 103 119 Nb 0.00000000000000 0.10370818455894 0.91666666666667 92.906 > 103 120 Nb 0.50000000000000 0.10370818455894 0.91666666666667 92.906 > 103 121 Sm 0.25000000000000 0.87051788752375 0.08333333333333 150.360 > 121 122 Sm 0.75000000000000 0.87051788752375 0.08333333333333 150.360 > 121 123 Sm 0.25000000000000 0.87051788752375 0.41666666666667 150.360 > 121 124 Sm 0.75000000000000 0.87051788752375 0.41666666666667 150.360 > 121 125 Sm 0.25000000000000 0.87051788752375 0.75000000000000 150.360 > 121 126 Sm 0.75000000000000 0.87051788752375 0.75000000000000 150.360 > 121 127 Sm 0.00000000000000 0.62948211247625 0.25000000000000 150.360 > 127 128 Sm 0.50000000000000 0.62948211247625 0.25000000000000 150.360 > 127 129 Sm 0.00000000000000 0.62948211247625 0.58333333333333 150.360 > 127 130 Sm 0.50000000000000 0.62948211247625 0.58333333333333 150.360 > 127 131 Sm 0.00000000000000 0.62948211247625 0.91666666666667 150.360 > 127 132 Sm 0.50000000000000 0.62948211247625 0.91666666666667 150.360 > 127 133 Sm 0.00000000000000 0.37051788752375 0.08333333333333 150.360 > 121 134 Sm 0.50000000000000 0.37051788752375 0.08333333333333 150.360 > 121 135 Sm 0.00000000000000 0.37051788752375 0.41666666666667 150.360 > 121 136 Sm 0.50000000000000 0.37051788752375 0.41666666666667 150.360 > 121 137 Sm 0.00000000000000 0.37051788752375 0.75000000000000 150.360 > 121 138 Sm 0.50000000000000 0.37051788752375 0.75000000000000 150.360 > 121 139 Sm 0.25000000000000 0.12948211247625 0.25000000000000 150.360 > 127 140 Sm 0.75000000000000 0.12948211247625 0.25000000000000 150.360 > 127 141 Sm 0.25000000000000 0.12948211247625 0.58333333333333 150.360 > 127 142 Sm 0.75000000000000 0.12948211247625 0.58333333333333 150.360 > 127 143 Sm 0.25000000000000 0.12948211247625 0.91666666666667 150.360 > 127 144 Sm 0.75000000000000 0.12948211247625 0.91666666666667 150.360 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.1837467 0.0000000 -0.3023925 0.0000000 4.8186436 0.0000000 -0.3023926 0.0000000 5.0834741 -------------------------- Born effective charges -------------------------- 1 O -1.8297372 0.1198936 0.0156101 0.0227283 -2.1062098 -0.6312587 -0.0199143 -0.6760754 -3.5266204 2 O -1.8297372 -0.1198936 0.0156101 -0.0227283 -2.1062098 0.6312587 -0.0199143 0.6760754 -3.5266204 3 O -1.8297372 0.1198936 0.0156101 0.0227283 -2.1062098 -0.6312587 -0.0199143 -0.6760754 -3.5266204 4 O -1.8297372 -0.1198936 0.0156101 -0.0227283 -2.1062098 0.6312587 -0.0199143 0.6760754 -3.5266204 5 O -3.3516786 -1.0401686 0.4001055 -1.0051979 -2.5652957 0.6242764 0.4461849 0.5379636 -1.4971029 6 O -3.3516786 1.0401686 0.4001055 1.0051979 -2.5652957 -0.6242764 0.4461849 -0.5379636 -1.4971029 7 O -3.3516786 -1.0401686 0.4001055 -1.0051979 -2.5652957 0.6242764 0.4461849 0.5379636 -1.4971029 8 O -3.3516786 1.0401686 0.4001055 1.0051979 -2.5652957 -0.6242764 0.4461849 -0.5379636 -1.4971029 9 Nb 5.6744065 0.0000000 -0.7569569 0.0000000 5.2944830 0.0000000 -1.3273880 0.0000000 5.5088523 10 Nb 5.6744065 0.0000000 -0.7569569 0.0000000 5.2944830 0.0000000 -1.3273880 0.0000000 5.5088523 11 Sm 4.6884250 0.0000000 -0.0744743 0.0000000 4.0485280 0.0000000 0.4748469 0.0000000 4.5385943 12 Sm 4.6884250 0.0000000 -0.0744743 0.0000000 4.0485280 0.0000000 0.4748469 0.0000000 4.5385943 ---------------------------------------------------------------------------- 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] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] 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] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] Computing fc3[ 121, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xz) -0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:25:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:25:24]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.563433421293404 -5.569238910000001 0.000000000000000 b 3.563433421293404 5.569238910000001 0.000000000000000 c -3.365885073346374 0.000000000000000 3.871410988837138 Atomic positions (fractional): 1 O 0.27471051960322 0.21258883226821 0.70396000730309 15.999 2 O 0.78741116773179 0.72528948039678 0.79603999269691 15.999 3 O 0.72528948039678 0.78741116773179 0.29603999269691 15.999 4 O 0.21258883226821 0.27471051960322 0.20396000730309 15.999 5 O 0.05431031059595 0.63490633833933 0.34051597293092 15.999 6 O 0.36509366166067 0.94568968940405 0.15948402706908 15.999 7 O 0.94568968940405 0.36509366166067 0.65948402706908 15.999 8 O 0.63490633833933 0.05431031059595 0.84051597293092 15.999 9 Nb 0.10370818455894 0.89629181544106 0.25000000000000 92.906 10 Nb 0.89629181544106 0.10370818455894 0.75000000000000 92.906 11 Sm 0.62948211247625 0.37051788752375 0.25000000000000 150.360 12 Sm 0.37051788752375 0.62948211247625 0.75000000000000 150.360 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.253733685173618 0.000000000000000 0.000000000000000 b 0.000000000000000 11.138477820000002 0.000000000000000 c -10.097655220039123 0.000000000000000 11.614232966511414 Atomic positions (fractional): 1 O 0.12182483796786 0.96893915633249 0.23465333576770 15.999 > 1 2 O 0.62182483796786 0.96893915633249 0.23465333576770 15.999 > 1 3 O 0.12182483796786 0.96893915633249 0.56798666910103 15.999 > 1 4 O 0.62182483796786 0.96893915633249 0.56798666910103 15.999 > 1 5 O 0.12182483796786 0.96893915633249 0.90132000243436 15.999 > 1 6 O 0.62182483796786 0.96893915633249 0.90132000243436 15.999 > 1 7 O 0.37817516203214 0.96893915633249 0.26534666423230 15.999 > 7 8 O 0.87817516203214 0.96893915633249 0.26534666423230 15.999 > 7 9 O 0.37817516203214 0.96893915633249 0.59867999756564 15.999 > 7 10 O 0.87817516203214 0.96893915633249 0.59867999756564 15.999 > 7 11 O 0.37817516203214 0.96893915633249 0.93201333089897 15.999 > 7 12 O 0.87817516203214 0.96893915633249 0.93201333089897 15.999 > 7 13 O 0.12817516203214 0.53106084366751 0.09867999756564 15.999 > 13 14 O 0.62817516203214 0.53106084366751 0.09867999756564 15.999 > 13 15 O 0.12817516203214 0.53106084366751 0.43201333089897 15.999 > 13 16 O 0.62817516203214 0.53106084366751 0.43201333089897 15.999 > 13 17 O 0.12817516203214 0.53106084366751 0.76534666423230 15.999 > 13 18 O 0.62817516203214 0.53106084366751 0.76534666423230 15.999 > 13 19 O 0.37182483796786 0.53106084366751 0.06798666910103 15.999 > 19 20 O 0.87182483796786 0.53106084366751 0.06798666910103 15.999 > 19 21 O 0.37182483796786 0.53106084366751 0.40132000243436 15.999 > 19 22 O 0.87182483796786 0.53106084366751 0.40132000243436 15.999 > 19 23 O 0.37182483796786 0.53106084366751 0.73465333576770 15.999 > 19 24 O 0.87182483796786 0.53106084366751 0.73465333576770 15.999 > 19 25 O 0.42230416223382 0.79029801387169 0.11350532431031 15.999 > 25 26 O 0.92230416223382 0.79029801387169 0.11350532431031 15.999 > 25 27 O 0.42230416223382 0.79029801387169 0.44683865764364 15.999 > 25 28 O 0.92230416223382 0.79029801387169 0.44683865764364 15.999 > 25 29 O 0.42230416223382 0.79029801387169 0.78017199097697 15.999 > 25 30 O 0.92230416223382 0.79029801387169 0.78017199097697 15.999 > 25 31 O 0.07769583776618 0.79029801387169 0.05316134235636 15.999 > 31 32 O 0.57769583776618 0.79029801387169 0.05316134235636 15.999 > 31 33 O 0.07769583776618 0.79029801387169 0.38649467568969 15.999 > 31 34 O 0.57769583776618 0.79029801387169 0.38649467568969 15.999 > 31 35 O 0.07769583776618 0.79029801387169 0.71982800902303 15.999 > 31 36 O 0.57769583776618 0.79029801387169 0.71982800902303 15.999 > 31 37 O 0.32769583776618 0.70970198612831 0.21982800902303 15.999 > 37 38 O 0.82769583776618 0.70970198612831 0.21982800902303 15.999 > 37 39 O 0.32769583776618 0.70970198612831 0.55316134235636 15.999 > 37 40 O 0.82769583776618 0.70970198612831 0.55316134235636 15.999 > 37 41 O 0.32769583776618 0.70970198612831 0.88649467568969 15.999 > 37 42 O 0.82769583776618 0.70970198612831 0.88649467568969 15.999 > 37 43 O 0.17230416223382 0.70970198612831 0.28017199097697 15.999 > 43 44 O 0.67230416223382 0.70970198612831 0.28017199097697 15.999 > 43 45 O 0.17230416223382 0.70970198612831 0.61350532431031 15.999 > 43 46 O 0.67230416223382 0.70970198612831 0.61350532431031 15.999 > 43 47 O 0.17230416223382 0.70970198612831 0.94683865764364 15.999 > 43 48 O 0.67230416223382 0.70970198612831 0.94683865764364 15.999 > 43 49 O 0.37182483796786 0.46893915633249 0.23465333576770 15.999 > 1 50 O 0.87182483796786 0.46893915633249 0.23465333576770 15.999 > 1 51 O 0.37182483796786 0.46893915633249 0.56798666910103 15.999 > 1 52 O 0.87182483796786 0.46893915633249 0.56798666910103 15.999 > 1 53 O 0.37182483796786 0.46893915633249 0.90132000243436 15.999 > 1 54 O 0.87182483796786 0.46893915633249 0.90132000243436 15.999 > 1 55 O 0.12817516203214 0.46893915633249 0.26534666423230 15.999 > 7 56 O 0.62817516203214 0.46893915633249 0.26534666423230 15.999 > 7 57 O 0.12817516203214 0.46893915633249 0.59867999756564 15.999 > 7 58 O 0.62817516203214 0.46893915633249 0.59867999756564 15.999 > 7 59 O 0.12817516203214 0.46893915633249 0.93201333089897 15.999 > 7 60 O 0.62817516203214 0.46893915633249 0.93201333089897 15.999 > 7 61 O 0.37817516203214 0.03106084366751 0.09867999756564 15.999 > 13 62 O 0.87817516203214 0.03106084366751 0.09867999756564 15.999 > 13 63 O 0.37817516203214 0.03106084366751 0.43201333089897 15.999 > 13 64 O 0.87817516203214 0.03106084366751 0.43201333089897 15.999 > 13 65 O 0.37817516203214 0.03106084366751 0.76534666423230 15.999 > 13 66 O 0.87817516203214 0.03106084366751 0.76534666423230 15.999 > 13 67 O 0.12182483796786 0.03106084366751 0.06798666910103 15.999 > 19 68 O 0.62182483796786 0.03106084366751 0.06798666910103 15.999 > 19 69 O 0.12182483796786 0.03106084366751 0.40132000243436 15.999 > 19 70 O 0.62182483796786 0.03106084366751 0.40132000243436 15.999 > 19 71 O 0.12182483796786 0.03106084366751 0.73465333576770 15.999 > 19 72 O 0.62182483796786 0.03106084366751 0.73465333576770 15.999 > 19 73 O 0.17230416223382 0.29029801387169 0.11350532431031 15.999 > 25 74 O 0.67230416223382 0.29029801387169 0.11350532431031 15.999 > 25 75 O 0.17230416223382 0.29029801387169 0.44683865764364 15.999 > 25 76 O 0.67230416223382 0.29029801387169 0.44683865764364 15.999 > 25 77 O 0.17230416223382 0.29029801387169 0.78017199097697 15.999 > 25 78 O 0.67230416223382 0.29029801387169 0.78017199097697 15.999 > 25 79 O 0.32769583776618 0.29029801387169 0.05316134235636 15.999 > 31 80 O 0.82769583776618 0.29029801387169 0.05316134235636 15.999 > 31 81 O 0.32769583776618 0.29029801387169 0.38649467568969 15.999 > 31 82 O 0.82769583776618 0.29029801387169 0.38649467568969 15.999 > 31 83 O 0.32769583776618 0.29029801387169 0.71982800902303 15.999 > 31 84 O 0.82769583776618 0.29029801387169 0.71982800902303 15.999 > 31 85 O 0.07769583776618 0.20970198612831 0.21982800902303 15.999 > 37 86 O 0.57769583776618 0.20970198612831 0.21982800902303 15.999 > 37 87 O 0.07769583776618 0.20970198612831 0.55316134235636 15.999 > 37 88 O 0.57769583776618 0.20970198612831 0.55316134235636 15.999 > 37 89 O 0.07769583776618 0.20970198612831 0.88649467568969 15.999 > 37 90 O 0.57769583776618 0.20970198612831 0.88649467568969 15.999 > 37 91 O 0.42230416223382 0.20970198612831 0.28017199097697 15.999 > 43 92 O 0.92230416223382 0.20970198612831 0.28017199097697 15.999 > 43 93 O 0.42230416223382 0.20970198612831 0.61350532431031 15.999 > 43 94 O 0.92230416223382 0.20970198612831 0.61350532431031 15.999 > 43 95 O 0.42230416223382 0.20970198612831 0.94683865764364 15.999 > 43 96 O 0.92230416223382 0.20970198612831 0.94683865764364 15.999 > 43 97 Nb 0.00000000000000 0.89629181544106 0.08333333333333 92.906 > 97 98 Nb 0.50000000000000 0.89629181544106 0.08333333333333 92.906 > 97 99 Nb 0.00000000000000 0.89629181544106 0.41666666666667 92.906 > 97 100 Nb 0.50000000000000 0.89629181544106 0.41666666666667 92.906 > 97 101 Nb 0.00000000000000 0.89629181544106 0.75000000000000 92.906 > 97 102 Nb 0.50000000000000 0.89629181544106 0.75000000000000 92.906 > 97 103 Nb 0.25000000000000 0.60370818455894 0.25000000000000 92.906 > 103 104 Nb 0.75000000000000 0.60370818455894 0.25000000000000 92.906 > 103 105 Nb 0.25000000000000 0.60370818455894 0.58333333333333 92.906 > 103 106 Nb 0.75000000000000 0.60370818455894 0.58333333333333 92.906 > 103 107 Nb 0.25000000000000 0.60370818455894 0.91666666666667 92.906 > 103 108 Nb 0.75000000000000 0.60370818455894 0.91666666666667 92.906 > 103 109 Nb 0.25000000000000 0.39629181544106 0.08333333333333 92.906 > 97 110 Nb 0.75000000000000 0.39629181544106 0.08333333333333 92.906 > 97 111 Nb 0.25000000000000 0.39629181544106 0.41666666666667 92.906 > 97 112 Nb 0.75000000000000 0.39629181544106 0.41666666666667 92.906 > 97 113 Nb 0.25000000000000 0.39629181544106 0.75000000000000 92.906 > 97 114 Nb 0.75000000000000 0.39629181544106 0.75000000000000 92.906 > 97 115 Nb 0.00000000000000 0.10370818455894 0.25000000000000 92.906 > 103 116 Nb 0.50000000000000 0.10370818455894 0.25000000000000 92.906 > 103 117 Nb 0.00000000000000 0.10370818455894 0.58333333333333 92.906 > 103 118 Nb 0.50000000000000 0.10370818455894 0.58333333333333 92.906 > 103 119 Nb 0.00000000000000 0.10370818455894 0.91666666666667 92.906 > 103 120 Nb 0.50000000000000 0.10370818455894 0.91666666666667 92.906 > 103 121 Sm 0.25000000000000 0.87051788752375 0.08333333333333 150.360 > 121 122 Sm 0.75000000000000 0.87051788752375 0.08333333333333 150.360 > 121 123 Sm 0.25000000000000 0.87051788752375 0.41666666666667 150.360 > 121 124 Sm 0.75000000000000 0.87051788752375 0.41666666666667 150.360 > 121 125 Sm 0.25000000000000 0.87051788752375 0.75000000000000 150.360 > 121 126 Sm 0.75000000000000 0.87051788752375 0.75000000000000 150.360 > 121 127 Sm 0.00000000000000 0.62948211247625 0.25000000000000 150.360 > 127 128 Sm 0.50000000000000 0.62948211247625 0.25000000000000 150.360 > 127 129 Sm 0.00000000000000 0.62948211247625 0.58333333333333 150.360 > 127 130 Sm 0.50000000000000 0.62948211247625 0.58333333333333 150.360 > 127 131 Sm 0.00000000000000 0.62948211247625 0.91666666666667 150.360 > 127 132 Sm 0.50000000000000 0.62948211247625 0.91666666666667 150.360 > 127 133 Sm 0.00000000000000 0.37051788752375 0.08333333333333 150.360 > 121 134 Sm 0.50000000000000 0.37051788752375 0.08333333333333 150.360 > 121 135 Sm 0.00000000000000 0.37051788752375 0.41666666666667 150.360 > 121 136 Sm 0.50000000000000 0.37051788752375 0.41666666666667 150.360 > 121 137 Sm 0.00000000000000 0.37051788752375 0.75000000000000 150.360 > 121 138 Sm 0.50000000000000 0.37051788752375 0.75000000000000 150.360 > 121 139 Sm 0.25000000000000 0.12948211247625 0.25000000000000 150.360 > 127 140 Sm 0.75000000000000 0.12948211247625 0.25000000000000 150.360 > 127 141 Sm 0.25000000000000 0.12948211247625 0.58333333333333 150.360 > 127 142 Sm 0.75000000000000 0.12948211247625 0.58333333333333 150.360 > 127 143 Sm 0.25000000000000 0.12948211247625 0.91666666666667 150.360 > 127 144 Sm 0.75000000000000 0.12948211247625 0.91666666666667 150.360 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.1837467 0.0000000 -0.3023925 0.0000000 4.8186436 0.0000000 -0.3023926 0.0000000 5.0834741 -------------------------- Born effective charges -------------------------- 1 O -1.8297372 0.1198936 0.0156101 0.0227283 -2.1062098 -0.6312587 -0.0199143 -0.6760754 -3.5266204 2 O -1.8297372 -0.1198936 0.0156101 -0.0227283 -2.1062098 0.6312587 -0.0199143 0.6760754 -3.5266204 3 O -1.8297372 0.1198936 0.0156101 0.0227283 -2.1062098 -0.6312587 -0.0199143 -0.6760754 -3.5266204 4 O -1.8297372 -0.1198936 0.0156101 -0.0227283 -2.1062098 0.6312587 -0.0199143 0.6760754 -3.5266204 5 O -3.3516786 -1.0401686 0.4001055 -1.0051979 -2.5652957 0.6242764 0.4461849 0.5379636 -1.4971029 6 O -3.3516786 1.0401686 0.4001055 1.0051979 -2.5652957 -0.6242764 0.4461849 -0.5379636 -1.4971029 7 O -3.3516786 -1.0401686 0.4001055 -1.0051979 -2.5652957 0.6242764 0.4461849 0.5379636 -1.4971029 8 O -3.3516786 1.0401686 0.4001055 1.0051979 -2.5652957 -0.6242764 0.4461849 -0.5379636 -1.4971029 9 Nb 5.6744065 0.0000000 -0.7569569 0.0000000 5.2944830 0.0000000 -1.3273880 0.0000000 5.5088523 10 Nb 5.6744065 0.0000000 -0.7569569 0.0000000 5.2944830 0.0000000 -1.3273880 0.0000000 5.5088523 11 Sm 4.6884250 0.0000000 -0.0744743 0.0000000 4.0485280 0.0000000 0.4748469 0.0000000 4.5385943 12 Sm 4.6884250 0.0000000 -0.0744743 0.0000000 4.0485280 0.0000000 0.4748469 0.0000000 4.5385943 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) Max drift of fc2: -0.00000000 (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 ... [ 10 10 13 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.78, Number of G-points: 301, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/361) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 3.523 ( 0.000 0.000 0.000) 0.000 3.648 ( 0.000 0.000 0.000) 0.000 3.904 ( 0.000 0.000 0.000) 0.000 4.258 ( 0.000 0.000 0.000) 0.000 4.821 ( 0.000 0.000 0.000) 0.000 5.103 ( 0.000 0.000 0.000) 0.000 5.488 ( 0.000 0.000 0.000) 0.000 5.534 ( 0.000 0.000 0.000) 0.000 5.639 ( 0.000 0.000 0.000) 0.000 6.112 ( 0.000 0.000 0.000) 0.000 6.452 ( 0.000 0.000 0.000) 0.000 6.900 ( 0.000 0.000 0.000) 0.000 7.250 ( 0.000 0.000 0.000) 0.000 8.052 ( 0.000 0.000 0.000) 0.000 9.100 ( 0.000 0.000 0.000) 0.000 9.619 ( 0.000 0.000 0.000) 0.000 9.706 ( 0.000 0.000 0.000) 0.000 9.928 ( 0.000 0.000 0.000) 0.000 10.700 ( 0.000 0.000 0.000) 0.000 11.088 ( 0.000 0.000 0.000) 0.000 12.019 ( 0.000 0.000 0.000) 0.000 12.511 ( 0.000 0.000 0.000) 0.000 12.688 ( 0.000 0.000 0.000) 0.000 13.296 ( 0.000 0.000 0.000) 0.000 15.472 ( 0.000 0.000 0.000) 0.000 16.999 ( 0.000 0.000 0.000) 0.000 18.640 ( 0.000 0.000 0.000) 0.000 19.138 ( 0.000 0.000 0.000) 0.000 19.565 ( 0.000 0.000 0.000) 0.000 19.634 ( 0.000 0.000 0.000) 0.000 20.572 ( 0.000 0.000 0.000) 0.000 22.976 ( 0.000 0.000 0.000) 0.000 23.726 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/361) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.528 ( 5.377 -16.755 24.710) 30.335 0.628 ( 12.735 -29.703 15.287) 35.751 1.264 ( 47.451 -13.812 37.067) 61.776 3.548 ( 4.537 3.692 -0.529) 5.873 3.605 ( -0.832 -1.619 -3.254) 3.728 3.868 ( -3.691 3.251 1.981) 5.302 4.322 ( 3.268 1.680 4.328) 5.678 4.830 ( 1.645 0.678 -1.917) 2.616 5.390 ( -0.861 2.789 -2.744) 4.006 5.499 ( 15.777 7.618 -15.556) 23.429 5.579 ( -2.399 3.745 -2.152) 4.941 5.716 ( 2.829 2.599 4.830) 6.172 6.343 ( 3.490 15.155 -6.085) 16.699 6.551 ( 10.425 25.213 2.528) 27.400 7.037 ( 12.176 1.859 3.282) 12.747 7.624 ( -8.764 -31.847 -17.008) 37.153 8.104 ( -10.762 -25.936 -9.957) 29.793 9.122 ( 1.508 6.859 5.887) 9.164 9.601 ( -0.369 -4.516 -5.151) 6.860 9.668 ( -3.408 0.297 -1.762) 3.848 10.581 ( 13.177 23.236 -8.929) 28.165 10.994 ( 41.137 2.238 -28.466) 50.076 11.214 ( -15.073 10.332 33.476) 38.139 12.018 ( 0.793 -0.402 -0.985) 1.327 12.519 ( 1.839 -5.519 -4.684) 7.469 13.005 ( -10.049 -40.700 -17.056) 45.259 13.266 ( -3.063 -0.424 -1.807) 3.581 15.377 ( -6.915 0.043 -9.626) 11.852 17.995 ( -37.640 44.388 80.507) 99.340 18.917 ( -34.752 -31.335 13.338) 48.657 19.081 ( -7.741 -0.896 -1.024) 7.860 19.633 ( -3.492 -3.396 0.342) 4.883 20.619 ( 4.600 0.759 3.677) 5.938 22.431 ( 53.573 54.542 -18.158) 78.579 23.536 ( 0.666 -46.393 -38.151) 60.069 23.747 ( 1.940 -0.376 0.275) 1.996 ======================= Grid point 2 (3/361) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( 4.843 -17.543 24.124) 30.219 1.267 ( 14.860 -26.194 16.698) 34.436 2.458 ( 43.681 -12.101 33.410) 56.308 3.541 ( -0.481 2.100 1.361) 2.549 3.590 ( 5.113 5.953 -6.254) 10.034 3.854 ( 0.164 2.265 6.512) 6.896 4.393 ( -0.773 1.704 8.099) 8.312 4.787 ( 2.050 4.491 -6.332) 8.029 5.334 ( 2.177 6.000 -7.368) 9.748 5.419 ( 4.653 5.767 -5.715) 9.358 5.488 ( 1.107 1.115 -6.922) 7.098 5.806 ( -1.771 -2.475 8.065) 8.620 6.212 ( 3.716 7.264 -4.846) 9.490 6.491 ( 2.048 10.225 -0.298) 10.432 7.159 ( 5.888 4.068 -2.977) 7.751 7.575 ( -1.104 -10.845 -9.940) 14.752 8.101 ( -10.414 -22.778 -0.926) 25.063 9.132 ( 0.329 11.992 6.548) 13.667 9.563 ( -7.330 -4.921 -3.092) 9.354 9.609 ( 4.742 -0.644 -3.643) 6.014 10.475 ( 5.323 11.349 -4.244) 13.235 11.200 ( 20.141 -3.913 -11.030) 23.294 11.326 ( -9.087 1.101 20.216) 22.191 12.037 ( 2.878 -0.870 -0.704) 3.088 12.553 ( 3.492 -11.725 -8.558) 14.930 13.037 ( -2.905 -7.923 1.884) 8.646 13.172 ( -6.298 -0.012 -3.030) 6.989 15.082 ( -10.810 3.577 -14.522) 18.454 18.063 ( -15.087 18.622 36.794) 43.912 18.849 ( -1.932 0.548 -6.538) 6.839 18.946 ( -18.989 -10.853 4.598) 22.350 19.572 ( -6.762 -1.769 -3.114) 7.652 20.785 ( 7.802 -1.309 8.210) 11.401 22.477 ( 28.112 23.882 -11.139) 38.532 23.496 ( -1.743 -22.290 -17.091) 28.142 23.779 ( 0.733 1.081 2.129) 2.497 ======================= Grid point 3 (4/361) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( 4.901 -16.467 20.485) 26.736 1.921 ( 16.424 -21.578 19.127) 33.184 3.444 ( 8.115 2.080 12.113) 14.728 3.499 ( 25.543 -1.750 4.653) 26.022 3.547 ( 2.099 4.741 5.029) 7.223 3.935 ( 3.552 4.609 2.342) 6.272 4.508 ( 1.681 -3.040 9.238) 9.870 4.686 ( 5.930 3.942 -9.105) 11.559 5.132 ( -2.104 5.555 -12.852) 14.158 5.392 ( -1.425 5.942 -1.306) 6.248 5.427 ( -1.305 0.023 1.225) 1.790 5.899 ( -1.563 -2.183 7.845) 8.292 6.225 ( 4.684 -3.150 -0.798) 5.701 6.422 ( 3.135 8.915 -3.230) 9.987 7.052 ( -2.736 5.808 -8.457) 10.617 7.564 ( 5.888 -3.366 -7.275) 9.946 8.172 ( -11.801 -22.298 2.647) 25.367 9.068 ( -0.902 14.445 3.686) 14.935 9.456 ( -5.522 -1.012 -2.871) 6.305 9.718 ( 9.025 -2.174 2.625) 9.647 10.424 ( 1.007 -1.396 -3.538) 3.935 11.250 ( -3.174 9.324 2.631) 10.194 11.498 ( 7.733 -10.152 2.923) 13.092 12.094 ( 4.260 -0.975 -0.001) 4.370 12.609 ( 2.047 -14.488 -8.666) 17.006 12.992 ( -6.769 4.755 -4.584) 9.457 13.161 ( 0.803 -0.955 12.227) 12.291 14.685 ( -12.211 4.427 -17.056) 21.438 18.107 ( -8.030 8.936 15.985) 19.997 18.719 ( 0.542 8.194 -2.470) 8.575 18.889 ( -11.105 -10.089 3.241) 15.350 19.408 ( -7.911 0.347 -6.881) 10.491 21.021 ( 6.789 -2.278 8.989) 11.493 22.510 ( 17.376 12.390 -9.099) 23.200 23.481 ( -0.527 -13.815 -9.193) 16.602 23.794 ( -1.126 2.128 3.055) 3.890 ======================= Grid point 4 (5/361) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( 3.633 -11.047 12.815) 17.305 2.564 ( 15.842 -16.518 19.723) 30.213 3.335 ( -3.783 5.071 -3.168) 7.076 3.473 ( -0.997 5.359 -1.935) 5.784 3.815 ( -1.993 11.219 -8.165) 14.018 4.186 ( 21.363 -2.419 11.078) 24.186 4.688 ( 1.807 -4.634 6.532) 8.210 4.735 ( 11.260 0.424 -3.294) 11.739 4.938 ( -1.409 -0.660 -6.548) 6.731 5.289 ( -3.888 5.339 1.511) 6.775 5.437 ( -4.809 -1.086 6.506) 8.163 5.992 ( 2.652 0.185 4.670) 5.373 6.289 ( -4.778 -6.446 -7.393) 10.910 6.357 ( 6.853 7.022 1.619) 9.945 6.843 ( -3.822 4.861 -7.397) 9.641 7.628 ( 8.713 -0.578 -2.719) 9.145 8.193 ( -12.385 -15.504 0.438) 19.848 8.971 ( 0.093 10.902 1.541) 11.011 9.368 ( -3.219 -0.122 -1.882) 3.731 9.910 ( 8.855 2.475 4.999) 10.466 10.477 ( 2.034 -14.567 -1.062) 14.747 11.054 ( -9.280 14.353 -1.266) 17.138 11.741 ( 9.573 -8.484 1.340) 12.861 12.158 ( 3.083 -0.520 0.167) 3.131 12.631 ( -4.597 -8.303 -3.526) 10.124 12.794 ( -3.608 4.918 -5.025) 7.903 13.398 ( 6.201 -1.523 15.088) 16.383 14.271 ( -11.009 4.096 -16.511) 20.263 18.066 ( -3.968 4.027 2.354) 6.124 18.700 ( -0.860 3.481 7.302) 8.135 18.872 ( -2.141 -1.794 -0.019) 2.793 19.210 ( -6.337 -0.647 -7.586) 9.906 21.199 ( 3.272 -1.119 5.419) 6.429 22.523 ( 8.746 5.387 -5.525) 11.664 23.502 ( 0.988 -7.859 -4.278) 9.003 23.785 ( -1.857 2.226 2.392) 3.758 ======================= Grid point 5 (6/361) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 326 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( 0.000 -0.000 0.000) 0.000 3.069 ( -0.000 0.000 -0.000) 0.000 3.117 ( 0.000 -0.000 0.000) 0.000 3.419 ( 0.000 -0.000 0.000) 0.000 3.642 ( 0.000 -0.000 0.000) 0.000 4.428 ( 0.000 -0.000 0.000) 0.000 4.677 ( 0.000 -0.000 0.000) 0.000 4.851 ( 0.000 -0.000 0.000) 0.000 4.925 ( 0.000 0.000 0.000) 0.000 5.256 ( 0.000 -0.000 0.000) 0.000 5.464 ( 0.000 -0.000 0.000) 0.000 6.099 ( 0.000 -0.000 -0.000) 0.000 6.130 ( 0.000 -0.000 0.000) 0.000 6.414 ( 0.000 -0.000 0.000) 0.000 6.740 ( 0.000 -0.000 0.000) 0.000 7.695 ( 0.000 -0.000 0.000) 0.000 8.159 ( 0.000 -0.000 0.000) 0.000 8.932 ( 0.000 -0.000 0.000) 0.000 9.332 ( 0.000 -0.000 0.000) 0.000 9.991 ( 0.000 0.000 0.000) 0.000 10.678 ( 0.000 -0.000 0.000) 0.000 10.791 ( 0.000 -0.000 0.000) 0.000 11.878 ( 0.000 -0.000 0.000) 0.000 12.184 ( 0.000 -0.000 0.000) 0.000 12.571 ( 0.000 -0.000 0.000) 0.000 12.734 ( 0.000 0.000 0.000) 0.000 13.616 ( 0.000 -0.000 0.000) 0.000 14.001 ( 0.000 -0.000 0.000) 0.000 18.027 ( 0.000 -0.000 0.000) 0.000 18.745 ( -0.000 -0.000 0.000) 0.000 18.858 ( 0.000 0.000 0.000) 0.000 19.109 ( 0.000 0.000 0.000) 0.000 21.260 ( 0.000 -0.000 0.000) 0.000 22.527 ( 0.000 -0.000 0.000) 0.000 23.524 ( 0.000 -0.000 0.000) 0.000 23.774 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 12 (7/361) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.895 ( -0.317 -0.000 36.633) 36.634 0.962 ( 22.625 0.000 17.186) 28.412 2.354 ( 47.644 0.000 35.548) 59.444 3.558 ( 0.672 0.000 0.688) 0.962 3.646 ( 7.721 0.000 -5.292) 9.361 3.875 ( -2.484 -0.000 6.247) 6.723 4.407 ( -3.561 -0.000 7.831) 8.603 4.830 ( 0.920 0.000 -3.657) 3.771 5.392 ( 3.583 0.000 -5.817) 6.832 5.477 ( 8.908 0.000 -14.666) 17.159 5.486 ( -3.661 -0.000 -6.193) 7.194 5.786 ( -2.307 -0.000 8.130) 8.451 6.234 ( -7.689 -0.000 -4.318) 8.819 6.797 ( 9.933 0.000 -13.110) 16.448 7.200 ( 7.597 0.000 -2.227) 7.916 7.291 ( -1.069 -0.000 0.566) 1.210 7.892 ( -8.737 -0.000 2.354) 9.049 9.248 ( 1.430 0.000 5.323) 5.511 9.479 ( -4.964 -0.000 -3.070) 5.836 9.628 ( 2.965 0.000 -4.657) 5.521 10.607 ( -4.334 -0.000 -3.217) 5.397 11.124 ( 27.068 0.000 -18.879) 33.002 11.448 ( -8.318 -0.000 19.217) 20.940 12.027 ( 2.808 0.000 -0.577) 2.867 12.360 ( 3.023 0.000 -11.393) 11.787 12.943 ( 2.576 0.000 11.972) 12.246 13.184 ( -4.918 -0.000 -3.106) 5.817 15.112 ( -11.462 -0.000 -13.875) 17.997 18.308 ( -40.280 -0.000 45.778) 60.976 18.705 ( 4.706 0.000 -3.443) 5.832 18.936 ( -5.899 -0.000 -5.207) 7.869 19.555 ( -6.055 -0.000 -0.722) 6.098 20.777 ( 5.539 0.000 10.069) 11.492 22.922 ( 25.306 0.000 -37.722) 45.424 23.065 ( 3.724 0.000 1.770) 4.123 23.790 ( 1.387 0.000 2.322) 2.705 ======================= Grid point 13 (8/361) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( 2.836 -4.274 32.483) 32.886 1.576 ( 21.305 -13.501 20.244) 32.342 3.390 ( 41.333 -1.990 27.513) 49.692 3.592 ( 0.649 5.076 -0.780) 5.177 3.624 ( 1.454 2.151 -0.984) 2.776 3.962 ( 4.024 -0.415 3.383) 5.274 4.454 ( -1.818 -2.055 7.188) 7.694 4.745 ( -0.535 2.049 -7.946) 8.223 5.217 ( 2.388 3.577 -21.646) 22.069 5.376 ( -1.951 -2.731 -7.044) 7.803 5.495 ( -0.945 2.851 4.295) 5.241 5.883 ( -0.521 0.152 11.136) 11.150 6.116 ( -5.802 -4.690 -1.008) 7.528 6.705 ( 7.555 15.738 -6.228) 18.535 7.159 ( -0.576 7.006 -6.842) 9.810 7.393 ( 4.804 -16.349 -5.311) 17.849 7.848 ( -12.741 -9.418 7.159) 17.386 9.271 ( -0.942 7.558 2.454) 8.002 9.395 ( -6.519 -4.422 -0.551) 7.897 9.690 ( 12.001 -0.419 -0.828) 12.037 10.467 ( -5.051 2.634 -5.276) 7.764 11.323 ( 22.181 -3.620 -9.124) 24.256 11.502 ( -10.197 10.809 18.865) 24.015 12.081 ( 3.952 -0.447 0.679) 4.035 12.326 ( 3.271 -13.523 -11.970) 18.354 13.050 ( -6.772 1.644 -4.155) 8.113 13.143 ( 3.079 -0.665 13.279) 13.648 14.734 ( -13.612 1.215 -17.138) 21.920 18.266 ( -16.989 7.466 19.983) 27.271 18.644 ( -14.658 -8.716 -0.751) 17.070 18.898 ( 12.850 4.207 -6.240) 14.892 19.422 ( -8.408 0.721 -4.064) 9.366 21.006 ( 5.145 0.036 13.816) 14.743 22.739 ( 15.014 11.508 -21.593) 28.708 23.214 ( 3.384 -13.202 -3.288) 14.020 23.829 ( -0.387 1.181 3.464) 3.680 ======================= Grid point 14 (9/361) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( 5.204 -3.795 25.018) 25.834 2.253 ( 18.907 -16.113 21.247) 32.689 3.448 ( -6.289 6.338 -3.932) 9.756 3.588 ( -1.009 6.833 -1.709) 7.115 3.977 ( -0.164 5.128 -5.165) 7.281 4.154 ( 25.159 -0.679 11.816) 27.804 4.583 ( 3.215 -4.587 5.562) 7.894 4.703 ( 10.157 -4.708 -5.638) 12.535 4.951 ( -2.967 2.363 -14.251) 14.747 5.291 ( -2.595 -3.244 -6.698) 7.882 5.479 ( -9.637 3.735 12.372) 16.121 6.004 ( 2.528 1.157 6.008) 6.620 6.134 ( -2.310 -7.221 1.522) 7.733 6.580 ( 1.704 12.758 -3.695) 13.391 6.966 ( -1.987 9.564 -6.984) 12.008 7.557 ( 10.084 -9.520 -3.657) 14.342 7.848 ( -15.750 -17.250 5.729) 24.051 9.166 ( -3.752 8.803 -0.262) 9.572 9.353 ( -3.220 -1.232 0.164) 3.452 9.934 ( 15.660 0.099 4.605) 16.323 10.328 ( -3.333 -3.265 -5.266) 7.036 11.374 ( -3.135 20.015 3.234) 20.515 11.607 ( 12.181 -5.535 3.848) 13.922 12.145 ( 2.022 -0.970 1.450) 2.671 12.393 ( 1.960 -16.651 -6.513) 17.987 12.871 ( -7.152 3.221 -4.695) 9.142 13.376 ( 5.373 -0.878 14.253) 15.257 14.319 ( -13.043 1.428 -17.054) 21.518 18.169 ( -6.897 7.368 3.005) 10.530 18.555 ( -14.664 -12.285 5.433) 19.887 18.987 ( 16.114 7.520 -5.617) 18.649 19.225 ( -7.975 1.432 -5.839) 9.987 21.218 ( 2.068 2.386 12.948) 13.327 22.607 ( 8.575 3.806 -16.486) 18.968 23.330 ( 3.614 -9.377 -1.618) 10.179 23.840 ( -1.923 2.766 3.985) 5.218 ======================= Grid point 15 (10/361) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( 4.701 2.482 13.515) 14.523 2.877 ( 14.377 -13.814 18.576) 27.251 3.204 ( -11.481 4.721 -8.399) 14.988 3.464 ( -4.119 4.719 -1.637) 6.474 3.748 ( -5.717 8.768 -8.628) 13.565 4.387 ( 3.512 -3.611 -6.489) 8.215 4.682 ( 2.534 -1.909 -4.009) 5.113 4.824 ( 8.888 -0.077 -6.367) 10.934 4.886 ( 0.062 -4.184 4.564) 6.192 5.200 ( -2.895 -4.582 -7.452) 9.215 5.506 ( -7.982 3.073 15.799) 17.966 6.085 ( -2.332 -3.224 -2.763) 4.844 6.103 ( 0.986 0.175 -1.452) 1.764 6.509 ( 0.428 7.847 6.676) 10.312 6.804 ( -0.147 7.683 -3.482) 8.437 7.672 ( -3.842 -2.254 1.666) 4.756 7.942 ( 1.961 -20.427 2.315) 20.651 9.027 ( -4.111 7.687 -0.901) 8.764 9.332 ( -0.975 -0.154 0.561) 1.135 10.025 ( -0.628 3.472 -4.763) 5.928 10.475 ( 13.893 -10.666 5.252) 18.286 11.129 ( -4.976 24.800 1.217) 25.323 11.855 ( 9.782 -2.161 2.149) 10.246 12.180 ( -0.803 -0.646 1.330) 1.682 12.486 ( -0.903 -10.381 0.511) 10.432 12.726 ( -1.621 0.252 -3.598) 3.954 13.610 ( 3.675 -0.595 4.139) 5.566 13.990 ( -6.782 -1.096 -5.402) 8.740 18.059 ( -2.363 3.585 -0.699) 4.350 18.548 ( -11.396 -13.368 2.190) 17.702 18.990 ( 5.887 6.373 -9.092) 12.568 19.154 ( 7.524 4.337 1.141) 8.759 21.315 ( -1.718 5.627 8.242) 10.126 22.503 ( 1.202 -2.490 -10.937) 11.281 23.446 ( 3.884 -6.433 0.090) 7.515 23.827 ( -1.857 4.159 3.680) 5.856 ======================= Grid point 16 (11/361) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( 0.876 13.476 -1.995) 13.651 2.798 ( -16.210 9.176 -14.454) 23.577 3.274 ( 3.219 -2.995 6.495) 7.843 3.403 ( -1.227 -2.409 1.357) 3.025 3.632 ( -0.097 -7.275 3.327) 8.000 4.219 ( -15.721 0.236 -8.149) 17.709 4.677 ( -2.889 -1.739 -3.621) 4.948 4.764 ( 2.667 0.743 -15.476) 15.721 4.936 ( -7.309 -1.530 8.138) 11.045 5.156 ( 2.361 -7.426 -4.367) 8.933 5.488 ( -2.035 3.487 -1.100) 4.185 5.995 ( -1.503 0.472 -1.647) 2.279 6.174 ( -4.781 -6.876 3.370) 9.027 6.524 ( 1.658 12.531 5.291) 13.703 6.788 ( 3.242 -0.942 4.308) 5.473 7.607 ( -9.935 -2.404 3.794) 10.903 8.239 ( 12.434 -11.429 2.187) 17.030 8.898 ( -4.296 4.150 -1.439) 6.144 9.351 ( 0.536 -2.084 1.579) 2.669 9.878 ( -5.122 -0.146 -8.142) 9.620 10.827 ( 9.424 9.428 3.045) 13.674 10.881 ( 3.484 8.601 3.844) 10.044 11.887 ( -3.511 7.234 -0.177) 8.043 12.164 ( -3.518 0.158 0.962) 3.650 12.636 ( 7.026 -7.597 5.415) 11.679 12.738 ( 2.444 -1.245 1.440) 3.098 13.430 ( -7.197 1.886 -16.135) 17.768 14.174 ( 8.216 -6.401 15.796) 18.921 18.024 ( 1.321 -0.603 -3.148) 3.467 18.504 ( -9.515 -12.843 -2.523) 16.182 18.972 ( 11.143 4.523 -4.668) 12.900 19.270 ( 10.066 5.531 3.773) 12.089 21.273 ( -4.861 7.079 1.923) 8.800 22.410 ( -7.502 -7.326 -4.706) 11.494 23.549 ( 2.926 -2.333 2.331) 4.409 23.811 ( 0.022 4.711 2.494) 5.330 ======================= Grid point 17 (12/361) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -2.845 21.106 -13.523) 25.227 2.270 ( -16.967 16.093 -13.499) 27.002 3.337 ( -0.702 -5.946 2.420) 6.458 3.447 ( -0.729 -4.628 0.686) 4.735 3.693 ( -27.786 13.458 -18.536) 36.011 3.797 ( -0.185 -9.370 1.522) 9.495 4.509 ( -8.774 -3.935 -9.822) 13.746 4.631 ( -3.557 -1.752 -0.795) 4.044 5.020 ( -2.043 -6.859 9.432) 11.840 5.252 ( 3.123 -8.210 -1.157) 8.860 5.431 ( -0.078 -0.080 -2.691) 2.693 5.952 ( 2.342 3.191 -4.665) 6.118 6.124 ( -14.270 -7.407 0.926) 16.104 6.500 ( 2.547 10.044 4.260) 11.203 6.956 ( 3.870 -4.473 7.012) 9.173 7.576 ( -5.861 -1.019 7.773) 9.788 8.474 ( 11.745 4.929 0.976) 12.775 8.819 ( -3.304 -7.694 -3.729) 9.166 9.421 ( 1.005 -4.663 2.858) 5.561 9.718 ( -4.489 -1.237 -6.394) 7.910 10.638 ( -1.643 22.324 2.620) 22.537 11.134 ( 11.187 -4.088 0.005) 11.910 11.702 ( -7.507 11.492 -0.964) 13.761 12.111 ( -4.670 0.820 0.979) 4.842 12.791 ( -1.997 3.326 5.992) 7.139 12.892 ( 8.101 -4.210 4.972) 10.395 13.165 ( 0.498 -0.690 -12.028) 12.058 14.572 ( 10.068 -8.019 16.247) 20.728 17.963 ( 0.674 -6.845 -16.633) 17.999 18.540 ( -1.922 -9.558 7.195) 12.117 19.067 ( 17.953 7.768 -5.724) 20.382 19.429 ( 9.162 2.947 6.404) 11.561 21.102 ( -8.421 7.041 -3.820) 11.623 22.299 ( -16.728 -11.423 0.064) 20.256 23.637 ( 2.590 1.769 6.097) 6.856 23.803 ( 1.875 5.005 1.086) 5.454 ======================= Grid point 18 (13/361) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( -4.087 24.154 -18.205) 30.521 1.722 ( -16.406 22.173 -10.171) 29.398 2.804 ( -32.882 25.796 -24.784) 48.590 3.434 ( -5.213 -9.698 3.298) 11.493 3.493 ( 4.820 -4.439 -0.028) 6.553 3.796 ( -2.204 -3.970 -5.494) 7.128 4.334 ( -4.054 -5.130 -9.127) 11.228 4.686 ( -3.966 -6.201 9.020) 11.643 5.172 ( -4.788 -11.722 7.350) 14.641 5.307 ( -2.890 -5.826 0.042) 6.503 5.435 ( -0.826 -4.780 0.470) 4.874 5.865 ( -1.708 3.080 -7.543) 8.324 6.024 ( -7.497 -7.744 1.099) 10.834 6.517 ( 3.531 6.414 3.024) 7.922 7.076 ( -3.031 -4.435 3.226) 6.266 7.655 ( 0.711 0.808 10.296) 10.352 8.508 ( 7.023 18.819 5.446) 20.812 8.855 ( 0.636 -17.656 -8.715) 19.700 9.517 ( 0.402 -5.754 2.454) 6.269 9.656 ( -0.740 -2.536 0.288) 2.657 10.451 ( -5.552 14.144 1.025) 15.229 11.220 ( 3.714 1.786 -5.319) 6.729 11.482 ( -5.464 12.203 -1.847) 13.497 12.055 ( -3.586 0.985 1.026) 3.858 12.689 ( -6.895 4.868 -2.319) 8.753 13.035 ( 2.929 -6.162 3.433) 7.638 13.269 ( 13.334 6.260 8.679) 17.097 14.972 ( 9.062 -8.714 14.325) 19.059 17.767 ( -0.144 -13.318 -30.237) 33.040 18.768 ( 6.121 -4.898 12.146) 14.456 19.182 ( 22.688 11.862 -7.472) 26.670 19.613 ( 8.720 2.753 6.121) 11.004 20.840 ( -11.197 5.110 -5.935) 13.664 22.130 ( -27.097 -15.656 1.742) 31.343 23.739 ( 1.069 -0.325 4.695) 4.826 23.812 ( 5.137 10.683 7.251) 13.896 ======================= Grid point 19 (14/361) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.950 ( -3.590 26.722 -14.958) 30.833 1.135 ( -20.264 23.290 -12.422) 33.277 1.793 ( -24.152 41.900 -20.316) 52.457 3.443 ( -4.411 -8.076 -0.508) 9.216 3.625 ( 2.489 -0.257 4.265) 4.944 3.765 ( 1.530 -6.968 -3.873) 8.118 4.262 ( -2.149 -4.877 -4.343) 6.875 4.784 ( -2.757 -4.632 6.390) 8.360 5.225 ( -14.668 -15.190 1.664) 21.181 5.334 ( -2.163 -5.923 3.543) 7.232 5.478 ( -2.000 -7.345 -0.177) 7.614 5.705 ( -6.056 0.415 -4.205) 7.384 6.059 ( 0.517 -6.920 -1.519) 7.104 6.539 ( 3.039 5.369 0.889) 6.233 7.017 ( -8.590 -0.764 -1.744) 8.798 7.804 ( 4.820 2.003 8.091) 9.629 8.594 ( 11.523 18.365 19.019) 28.841 8.905 ( 1.606 -15.851 -9.755) 18.682 9.587 ( 0.514 -4.581 1.025) 4.722 9.719 ( -0.742 -4.567 3.179) 5.614 10.224 ( -15.299 2.875 -3.814) 16.027 11.082 ( -4.529 9.436 -6.399) 12.267 11.298 ( -1.016 10.894 -3.679) 11.544 12.025 ( -1.467 0.401 0.862) 1.748 12.552 ( -3.587 0.752 -2.802) 4.613 13.179 ( 2.501 -5.091 3.991) 6.935 13.565 ( 16.194 13.671 23.402) 31.571 15.317 ( 6.475 -7.709 12.060) 15.710 17.448 ( -0.108 -17.154 -46.212) 49.293 19.036 ( 7.892 -1.362 7.856) 11.219 19.335 ( 31.545 14.159 -7.991) 35.488 19.732 ( 5.805 6.921 2.104) 9.275 20.611 ( -8.694 0.411 -1.985) 8.927 21.834 ( -40.887 -18.595 1.153) 44.932 23.746 ( -0.407 0.114 -1.094) 1.173 23.990 ( 8.499 11.161 19.484) 24.009 ======================= Grid point 20 (15/361) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.519 ( -0.000 28.764 -0.000) 28.764 0.553 ( -0.000 30.464 -0.000) 30.464 1.030 ( -0.000 56.439 -0.000) 56.439 3.469 ( 0.000 -5.920 0.000) 5.920 3.660 ( -0.000 1.326 -0.000) 1.326 3.836 ( 0.000 -7.293 0.000) 7.293 4.241 ( 0.000 -2.037 0.000) 2.037 4.890 ( 0.000 -5.112 0.000) 5.112 5.066 ( 0.000 -4.286 0.000) 4.286 5.448 ( 0.000 -4.480 0.000) 4.480 5.471 ( 0.000 -6.630 0.000) 6.630 5.639 ( -0.000 0.035 -0.000) 0.035 6.078 ( 0.000 -2.647 0.000) 2.647 6.514 ( -0.000 5.723 -0.000) 5.723 6.912 ( -0.000 1.326 -0.000) 1.326 7.893 ( -0.000 0.797 -0.000) 0.797 8.957 ( 0.000 -0.820 0.000) 0.820 8.973 ( 0.000 -13.100 0.000) 13.100 9.637 ( 0.000 -1.066 0.000) 1.066 9.758 ( 0.000 -15.342 0.000) 15.342 9.849 ( -0.000 18.197 -0.000) 18.197 10.863 ( -0.000 14.494 -0.000) 14.494 11.176 ( -0.000 8.955 -0.000) 8.955 12.020 ( -0.000 0.063 -0.000) 0.063 12.508 ( 0.000 -0.245 0.000) 0.245 13.263 ( 0.000 -3.722 0.000) 3.722 13.980 ( 0.000 -2.992 0.000) 2.992 15.580 ( 0.000 -9.353 0.000) 9.353 17.010 ( -0.000 1.197 -0.000) 1.197 19.140 ( -0.000 0.236 -0.000) 0.236 19.589 ( -0.000 2.630 -0.000) 2.630 19.703 ( -0.000 7.413 -0.000) 7.413 20.560 ( 0.000 -1.261 0.000) 1.261 21.444 ( 0.000 -2.626 0.000) 2.626 23.730 ( -0.000 0.480 -0.000) 0.480 24.229 ( 0.000 -0.418 0.000) 0.418 ======================= Grid point 23 (16/361) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 1.823 0.000 34.249) 34.297 2.080 ( 24.546 0.000 17.999) 30.438 3.515 ( -7.705 -0.000 -4.892) 9.127 3.666 ( -0.160 -0.000 -0.880) 0.895 3.999 ( -0.039 -0.000 -3.108) 3.108 4.160 ( 30.924 0.000 10.162) 32.551 4.556 ( 2.750 0.000 12.193) 12.500 4.630 ( -0.345 -0.000 -8.259) 8.266 4.985 ( 4.263 0.000 -23.615) 23.997 5.248 ( -3.991 -0.000 -5.058) 6.442 5.517 ( -10.275 -0.000 11.553) 15.461 6.032 ( -3.299 -0.000 2.266) 4.003 6.049 ( 4.265 0.000 7.880) 8.961 6.711 ( -2.835 -0.000 -7.268) 7.802 7.186 ( -0.418 -0.000 -5.438) 5.454 7.296 ( 7.746 0.000 -0.197) 7.749 7.712 ( -12.665 -0.000 5.987) 14.009 9.252 ( -6.902 -0.000 -1.064) 6.983 9.337 ( -1.128 -0.000 1.887) 2.198 9.931 ( 19.249 0.000 4.356) 19.736 10.306 ( -6.790 -0.000 -7.539) 10.146 11.539 ( 21.149 0.000 -3.667) 21.464 11.654 ( -10.672 -0.000 19.632) 22.345 12.102 ( -1.831 -0.000 -3.153) 3.646 12.194 ( 9.217 0.000 -8.683) 12.663 12.901 ( -7.798 -0.000 -4.442) 8.974 13.368 ( 5.092 0.000 13.991) 14.889 14.330 ( -13.745 -0.000 -17.260) 22.065 18.302 ( -9.604 -0.000 10.112) 13.946 18.373 ( -11.784 -0.000 -3.779) 12.375 19.059 ( 16.982 0.000 -6.085) 18.039 19.240 ( -9.124 -0.000 -5.588) 10.699 21.247 ( 1.585 0.000 16.595) 16.671 22.646 ( 7.834 0.000 -23.429) 24.704 23.232 ( 5.188 0.000 1.892) 5.522 23.866 ( -1.821 -0.000 4.276) 4.648 ======================= Grid point 24 (17/361) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 3.987 2.952 24.658) 25.152 2.660 ( 20.235 -8.120 17.532) 27.978 3.273 ( -13.504 2.415 -7.805) 15.783 3.562 ( -6.054 4.628 -3.864) 8.544 3.856 ( -9.518 2.091 -7.522) 12.310 4.347 ( 6.222 -0.101 -15.735) 16.921 4.600 ( 6.022 -4.309 -6.771) 10.034 4.802 ( -0.576 -3.713 13.003) 13.535 4.874 ( 11.829 3.213 -9.974) 15.803 5.127 ( -4.934 -2.868 -6.745) 8.836 5.545 ( -10.246 1.143 17.938) 20.690 6.042 ( -0.429 -1.282 0.971) 1.665 6.106 ( -0.030 0.137 -5.191) 5.193 6.614 ( -2.197 3.010 5.172) 6.375 7.017 ( -2.908 13.779 -2.342) 14.276 7.554 ( 5.875 -18.910 4.052) 20.212 7.633 ( -5.330 -1.453 2.578) 6.097 9.137 ( -5.702 3.679 -0.310) 6.792 9.324 ( -2.889 -0.558 0.485) 2.982 10.097 ( -3.368 3.552 -8.380) 9.705 10.328 ( 19.866 -5.257 6.553) 21.570 11.589 ( -3.520 23.323 6.979) 24.598 11.821 ( 14.064 -0.889 4.372) 14.755 12.107 ( -4.057 -11.635 2.288) 12.533 12.267 ( 6.935 -7.205 -4.999) 11.180 12.742 ( -5.747 0.845 -3.649) 6.860 13.600 ( 5.287 -0.406 6.771) 8.601 13.972 ( -10.352 -0.624 -8.860) 13.640 18.155 ( -5.324 6.895 -0.772) 8.745 18.328 ( -7.690 -10.535 -0.424) 13.050 19.061 ( -4.361 1.963 -4.090) 6.293 19.220 ( 16.525 2.132 -5.081) 17.419 21.419 ( -3.020 4.221 15.083) 15.951 22.453 ( 2.208 -2.200 -20.289) 20.527 23.352 ( 5.574 -3.115 2.258) 6.773 23.884 ( -2.079 1.743 4.567) 5.312 ======================= Grid point 25 (18/361) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.401 ( 3.696 10.360 7.843) 13.510 2.909 ( -16.411 3.748 -10.188) 19.677 3.177 ( 11.104 -7.021 13.874) 19.107 3.388 ( -6.720 0.751 -2.002) 7.052 3.587 ( -10.313 0.449 -7.225) 12.600 4.180 ( -7.429 -3.535 -9.563) 12.615 4.638 ( 3.487 -3.494 -7.133) 8.675 4.797 ( 1.523 4.341 -14.599) 15.307 4.891 ( -9.868 -2.395 7.428) 12.582 5.045 ( 0.804 -5.450 -4.595) 7.174 5.544 ( -7.286 2.432 2.322) 8.024 6.006 ( -1.626 0.770 0.538) 1.878 6.081 ( -2.478 -3.665 0.121) 4.426 6.702 ( 2.392 4.975 10.012) 11.433 6.842 ( -3.351 7.904 -0.453) 8.597 7.569 ( -7.210 -0.646 4.713) 8.638 7.928 ( 11.700 -19.159 2.817) 22.625 9.016 ( -5.327 6.557 0.641) 8.473 9.297 ( -3.380 -3.533 0.094) 4.890 9.905 ( -2.907 2.377 -10.599) 11.245 10.744 ( 19.546 -4.159 6.870) 21.131 11.373 ( -1.637 29.912 4.946) 30.362 11.985 ( 3.173 3.481 0.948) 4.805 12.154 ( -4.719 -2.312 3.215) 6.161 12.423 ( 4.486 -14.931 1.721) 15.685 12.708 ( 5.358 -1.551 0.851) 5.643 13.460 ( -7.623 1.301 -16.881) 18.568 14.064 ( 5.866 -5.040 15.221) 17.073 18.043 ( -1.645 2.632 -5.358) 6.192 18.295 ( -6.201 -9.966 -0.794) 11.765 19.025 ( 4.687 1.839 1.026) 5.138 19.363 ( 15.389 3.851 -3.832) 16.320 21.435 ( -6.804 9.771 8.854) 14.838 22.265 ( -5.124 -8.210 -14.753) 17.644 23.487 ( 5.033 -3.204 2.730) 6.561 23.894 ( -0.624 3.627 4.434) 5.762 ======================= Grid point 26 (19/361) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.272 ( -0.378 19.283 -9.830) 21.648 2.492 ( -17.310 9.013 -8.278) 21.199 3.242 ( -7.107 -4.575 0.199) 8.454 3.382 ( -5.428 -3.154 -1.375) 6.427 3.591 ( 4.559 -10.547 2.994) 11.874 3.945 ( -15.924 9.202 -3.151) 18.659 4.442 ( -10.550 0.238 -15.198) 18.502 4.600 ( 0.736 -1.440 -10.317) 10.443 4.893 ( -10.064 -6.946 9.682) 15.597 5.102 ( 3.056 -8.974 -2.739) 9.868 5.434 ( -3.387 0.597 -4.192) 5.423 5.999 ( 0.292 1.497 -0.149) 1.532 6.033 ( -8.777 -2.655 -0.748) 9.200 6.674 ( -3.547 8.524 3.812) 9.989 6.906 ( 5.046 -0.975 6.001) 7.901 7.561 ( -4.044 0.349 7.543) 8.566 8.269 ( 10.030 -19.042 -1.424) 21.570 8.891 ( -5.108 8.254 2.039) 9.919 9.306 ( -3.509 -7.292 1.260) 8.190 9.727 ( -0.792 2.136 -10.200) 10.451 11.082 ( 15.057 -1.998 3.109) 15.504 11.144 ( -0.065 31.689 4.653) 32.029 11.887 ( -5.902 8.720 -1.336) 10.614 12.120 ( -5.091 0.050 1.944) 5.450 12.648 ( 2.184 -14.275 4.340) 15.079 12.913 ( 10.316 1.449 6.483) 12.270 13.145 ( -3.518 -0.913 -14.835) 15.274 14.416 ( 8.156 -8.437 14.770) 18.864 17.865 ( -4.511 -4.055 -17.492) 18.514 18.402 ( 2.497 -5.727 11.087) 12.726 19.160 ( 13.799 3.164 1.800) 14.271 19.496 ( 13.199 3.646 -1.063) 13.735 21.273 ( -9.733 11.644 -0.109) 15.176 22.090 ( -13.986 -12.058 -7.610) 19.973 23.612 ( 3.829 -2.443 3.222) 5.568 23.915 ( 1.873 5.515 4.424) 7.314 ======================= Grid point 27 (20/361) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( -3.717 23.094 -15.733) 28.190 2.058 ( -16.506 16.137 -7.258) 24.198 3.223 ( -11.349 -1.938 -0.955) 11.553 3.267 ( -15.771 0.060 -1.927) 15.889 3.461 ( 1.043 12.703 -11.627) 17.252 3.727 ( 0.372 -3.271 -1.458) 3.601 4.213 ( -6.300 -7.637 -9.331) 13.604 4.581 ( -3.463 -5.040 5.756) 8.398 4.950 ( -10.673 -12.105 8.059) 18.039 5.187 ( 1.019 -9.009 -2.814) 9.493 5.339 ( -3.763 -4.581 -5.246) 7.916 5.876 ( -11.384 -0.970 -2.817) 11.768 5.989 ( 3.921 2.059 -2.771) 5.224 6.631 ( -0.458 5.393 3.586) 6.493 7.024 ( 0.645 -0.886 3.849) 4.002 7.646 ( 0.039 -1.122 10.208) 10.270 8.497 ( 6.707 -18.546 -8.482) 21.468 8.789 ( -3.218 10.127 5.792) 12.102 9.356 ( -4.394 -10.783 2.264) 11.862 9.617 ( 1.660 0.011 -6.763) 6.964 10.903 ( -0.799 31.941 3.265) 32.117 11.261 ( 8.991 2.242 -1.822) 9.444 11.692 ( -6.048 10.469 -1.657) 12.204 12.069 ( -4.336 0.518 1.307) 4.559 12.756 ( -7.268 2.336 -5.972) 9.692 12.875 ( 2.007 -11.144 0.899) 11.359 13.319 ( 15.462 -0.186 9.930) 18.377 14.783 ( 7.214 -11.616 12.206) 18.329 17.590 ( -5.538 -6.709 -23.271) 24.844 18.696 ( 8.742 -3.032 15.588) 18.128 19.355 ( 20.421 7.569 -2.620) 21.936 19.661 ( 11.477 2.125 4.375) 12.465 20.973 ( -12.935 9.594 -6.024) 17.194 21.881 ( -22.453 -12.772 -3.812) 26.111 23.709 ( 1.943 -1.879 2.237) 3.509 23.970 ( 4.916 6.438 6.589) 10.441 ======================= Grid point 28 (21/361) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( -3.968 25.810 -11.063) 28.360 1.531 ( -17.261 22.078 -11.364) 30.242 2.590 ( -13.796 43.627 -7.265) 46.330 3.260 ( -5.348 -12.084 -1.289) 13.277 3.514 ( 4.175 -11.382 -0.282) 12.127 3.713 ( 0.396 0.914 -2.047) 2.277 4.153 ( -0.432 -6.977 -4.303) 8.208 4.679 ( -5.144 -6.371 9.775) 12.752 4.967 ( -11.389 -13.359 0.766) 17.571 5.220 ( -1.736 -7.095 -0.131) 7.306 5.311 ( -2.795 -11.041 -4.131) 12.115 5.708 ( -6.162 -0.037 -3.651) 7.162 6.014 ( 4.453 0.274 -1.579) 4.732 6.632 ( 1.336 4.349 1.977) 4.960 7.020 ( -4.209 1.587 0.787) 4.567 7.803 ( 2.774 -1.924 8.099) 8.775 8.590 ( 0.431 -17.064 -8.469) 19.054 8.813 ( 4.616 7.107 9.914) 13.042 9.415 ( -5.298 -13.566 0.078) 14.564 9.597 ( 1.045 -3.042 -3.256) 4.577 10.619 ( -2.099 32.055 0.615) 32.130 11.251 ( 2.398 8.474 -4.069) 9.701 11.507 ( -3.312 11.358 -1.366) 11.910 12.031 ( -2.237 0.199 0.770) 2.374 12.568 ( -4.118 1.149 -5.141) 6.686 13.044 ( 1.847 -10.030 3.159) 10.677 13.663 ( 12.309 0.028 13.463) 18.242 15.112 ( 4.638 -14.062 8.758) 17.203 17.272 ( -4.879 -4.705 -24.427) 25.350 19.016 ( 7.944 -0.783 11.474) 13.977 19.532 ( 22.664 8.812 -5.007) 24.827 19.859 ( 10.308 6.399 5.969) 13.521 20.645 ( -12.595 3.654 -4.939) 14.013 21.591 ( -26.720 -10.666 -3.292) 28.957 23.745 ( 0.195 -0.171 0.136) 0.292 24.104 ( 6.070 3.407 8.740) 11.173 ======================= Grid point 29 (22/361) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.029 ( -0.000 27.883 -0.000) 27.883 1.088 ( -0.000 29.003 -0.000) 29.003 2.009 ( -0.000 52.035 -0.000) 52.035 3.316 ( 0.000 -10.921 0.000) 10.921 3.656 ( 0.000 -12.377 0.000) 12.377 3.692 ( -0.000 2.137 -0.000) 2.137 4.181 ( 0.000 -4.669 0.000) 4.669 4.775 ( 0.000 -7.043 0.000) 7.043 4.945 ( 0.000 -8.966 0.000) 8.966 5.316 ( 0.000 -9.935 0.000) 9.935 5.327 ( 0.000 -9.057 0.000) 9.057 5.641 ( -0.000 0.169 -0.000) 0.169 6.044 ( 0.000 -0.936 0.000) 0.936 6.617 ( -0.000 5.002 -0.000) 5.002 6.952 ( -0.000 3.292 -0.000) 3.292 7.898 ( 0.000 -0.847 0.000) 0.847 8.685 ( 0.000 -17.318 0.000) 17.318 8.946 ( 0.000 -0.304 0.000) 0.304 9.472 ( 0.000 -15.121 0.000) 15.121 9.601 ( 0.000 -2.262 0.000) 2.262 10.308 ( -0.000 31.335 -0.000) 31.335 11.126 ( -0.000 13.522 -0.000) 13.522 11.370 ( -0.000 11.693 -0.000) 11.693 12.021 ( 0.000 -0.024 0.000) 0.024 12.505 ( -0.000 0.007 -0.000) 0.007 13.160 ( 0.000 -7.869 0.000) 7.869 13.907 ( 0.000 -4.994 0.000) 4.994 15.350 ( 0.000 -15.463 0.000) 15.463 17.039 ( -0.000 1.943 -0.000) 1.943 19.146 ( -0.000 0.437 -0.000) 0.437 19.655 ( -0.000 4.525 -0.000) 4.525 19.884 ( -0.000 12.152 -0.000) 12.152 20.527 ( 0.000 -2.368 0.000) 2.368 21.377 ( 0.000 -4.817 0.000) 4.817 23.741 ( -0.000 0.623 -0.000) 0.623 24.219 ( 0.000 -0.653 0.000) 0.653 ======================= Grid point 34 (23/361) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.506 ( 3.136 0.000 13.576) 13.934 2.940 ( -14.304 -0.000 -8.738) 16.762 3.100 ( 14.159 0.000 13.482) 19.551 3.405 ( -9.907 -0.000 -5.733) 11.446 3.590 ( -14.953 -0.000 -7.744) 16.840 4.142 ( -4.121 -0.000 -12.987) 13.625 4.597 ( 5.671 0.000 -5.905) 8.187 4.828 ( -5.725 -0.000 2.269) 6.159 4.935 ( -6.973 -0.000 -7.768) 10.438 4.943 ( 4.016 0.000 -5.389) 6.721 5.567 ( -9.015 -0.000 3.878) 9.814 6.020 ( -5.297 -0.000 2.472) 5.845 6.042 ( 2.207 0.000 -2.799) 3.564 6.736 ( 3.672 0.000 8.850) 9.582 6.950 ( -12.146 -0.000 0.603) 12.161 7.624 ( 1.362 0.000 1.046) 1.717 7.664 ( 9.337 0.000 7.263) 11.829 9.087 ( -5.038 -0.000 1.371) 5.222 9.253 ( -5.595 -0.000 -0.852) 5.660 9.932 ( -2.554 -0.000 -11.201) 11.488 10.705 ( 21.266 0.000 7.299) 22.484 11.802 ( -3.532 -0.000 10.900) 11.458 11.984 ( -0.770 -0.000 0.845) 1.143 12.034 ( 4.447 0.000 4.759) 6.514 12.264 ( 4.825 0.000 -4.945) 6.909 12.694 ( 4.196 0.000 0.960) 4.305 13.472 ( -7.701 -0.000 -17.174) 18.822 14.015 ( 4.998 0.000 15.029) 15.839 18.095 ( -5.921 -0.000 -12.505) 13.836 18.176 ( -1.471 -0.000 6.192) 6.364 19.042 ( 2.084 0.000 3.325) 3.924 19.397 ( 17.052 0.000 -6.573) 18.275 21.546 ( -8.477 -0.000 14.435) 16.740 22.172 ( -3.109 -0.000 -21.828) 22.049 23.456 ( 5.682 0.000 3.371) 6.607 23.928 ( -0.738 -0.000 4.754) 4.811 ======================= Grid point 35 (24/361) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.551 ( -0.303 10.043 -6.618) 12.031 2.602 ( -13.980 2.930 -5.040) 15.147 3.187 ( -10.632 -0.955 -3.869) 11.354 3.291 ( -12.921 -6.142 -7.982) 16.383 3.473 ( 9.822 -2.174 9.913) 14.123 3.982 ( -9.884 -1.669 1.451) 10.128 4.517 ( -6.619 2.347 -10.146) 12.340 4.658 ( 1.822 10.605 -16.090) 19.356 4.791 ( -14.172 -3.589 9.705) 17.547 4.913 ( -1.136 -11.899 -7.564) 14.145 5.446 ( -5.844 0.498 -4.050) 7.127 5.987 ( -10.016 -0.912 5.900) 11.661 6.034 ( 4.291 0.627 -5.586) 7.071 6.785 ( -10.136 3.415 3.284) 11.188 6.906 ( 5.789 0.287 7.035) 9.116 7.619 ( 0.614 5.807 2.643) 6.410 7.948 ( 8.594 -14.170 3.041) 16.850 9.016 ( -5.073 5.161 2.473) 7.647 9.187 ( -5.602 -5.169 -0.017) 7.622 9.767 ( -0.051 1.525 -11.414) 11.515 11.057 ( 17.234 -0.718 4.477) 17.821 11.706 ( -0.583 28.579 7.530) 29.560 12.000 ( -4.684 3.299 -1.278) 5.870 12.093 ( -6.176 -5.284 5.272) 9.688 12.343 ( 4.236 -16.288 -1.566) 16.903 12.915 ( 15.907 -0.449 7.922) 17.776 13.140 ( -8.145 0.036 -16.815) 18.684 14.301 ( 7.088 -3.609 13.603) 15.758 17.817 ( -6.951 -1.290 -17.642) 19.006 18.334 ( 5.263 -1.822 13.269) 14.390 19.196 ( 10.224 1.024 7.719) 12.851 19.540 ( 15.574 1.142 -6.380) 16.869 21.491 ( -12.139 10.711 6.269) 17.360 21.877 ( -10.026 -10.265 -17.010) 22.254 23.578 ( 4.558 -1.074 3.495) 5.843 23.982 ( 1.616 1.904 4.571) 5.209 ======================= Grid point 36 (25/361) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -8.438 14.561 -9.559) 19.354 2.334 ( -6.784 15.013 -8.671) 18.617 3.050 ( -8.690 -9.208 -3.049) 13.023 3.136 ( -8.134 -11.021 -4.547) 14.432 3.680 ( 4.508 -1.459 3.521) 5.903 3.850 ( -12.879 13.334 3.494) 18.865 4.143 ( -5.516 5.522 -15.762) 17.588 4.526 ( 0.586 -0.162 -2.408) 2.484 4.762 ( -16.962 -8.200 12.420) 22.566 4.959 ( 1.497 -15.914 -7.606) 17.702 5.291 ( -6.487 -1.165 -7.485) 9.973 5.868 ( -11.474 0.010 -0.120) 11.475 6.027 ( 5.111 1.561 -4.779) 7.170 6.697 ( -5.310 2.082 4.166) 7.063 7.047 ( 4.613 2.765 4.849) 7.241 7.635 ( -0.328 0.267 5.234) 5.251 8.185 ( 6.403 -14.744 -3.414) 16.433 8.933 ( -4.314 6.305 4.297) 8.766 9.182 ( -5.150 -8.016 1.257) 9.610 9.637 ( 1.987 1.500 -9.268) 9.597 11.291 ( 11.426 1.093 0.669) 11.498 11.506 ( 0.213 33.418 5.616) 33.887 11.844 ( -6.344 6.207 -2.145) 9.131 12.071 ( -4.832 -0.307 1.601) 5.100 12.577 ( 2.139 -19.344 3.506) 19.775 12.818 ( -7.239 1.668 -13.175) 15.125 13.293 ( 16.444 -1.870 9.970) 19.322 14.593 ( 6.042 -8.345 9.990) 14.351 17.511 ( -7.007 -2.473 -18.615) 20.043 18.657 ( 10.136 -1.349 17.738) 20.474 19.463 ( 16.969 4.576 6.310) 18.674 19.679 ( 13.630 -0.146 -1.758) 13.744 21.176 ( -13.580 12.711 -8.096) 20.287 21.654 ( -18.281 -12.801 -6.344) 23.201 23.681 ( 2.834 -1.206 2.864) 4.206 24.052 ( 3.730 2.909 4.479) 6.514 ======================= Grid point 37 (26/361) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -7.223 20.999 -7.066) 23.303 1.938 ( -7.384 22.603 -9.989) 25.792 3.018 ( -6.478 -14.236 -2.351) 15.816 3.152 ( -3.622 -0.634 6.138) 7.155 3.424 ( -6.172 19.453 -10.475) 22.940 3.751 ( 2.776 3.947 0.195) 4.830 4.031 ( 1.873 -5.778 -4.992) 7.862 4.575 ( -4.471 -4.686 9.029) 11.111 4.749 ( -12.560 -10.608 5.017) 17.189 5.031 ( 0.308 -15.271 -5.730) 16.313 5.144 ( -5.014 -5.843 -6.177) 9.870 5.710 ( -6.590 0.304 -2.755) 7.149 6.033 ( 3.928 1.269 -2.546) 4.850 6.683 ( -1.285 1.321 2.644) 3.223 7.084 ( 0.297 5.560 2.090) 5.947 7.736 ( 0.676 -5.376 5.967) 8.061 8.311 ( 3.244 -13.069 -6.554) 14.976 8.910 ( -1.001 4.267 6.375) 7.736 9.202 ( -4.890 -9.481 0.152) 10.669 9.574 ( 2.282 -0.197 -5.217) 5.698 11.245 ( -0.087 36.068 2.669) 36.167 11.372 ( 4.969 4.914 -1.467) 7.141 11.684 ( -3.684 8.054 -1.504) 8.983 12.030 ( -2.841 -0.288 0.621) 2.923 12.592 ( -4.354 1.364 -6.929) 8.296 12.808 ( 1.438 -16.685 2.633) 16.952 13.629 ( 10.793 -2.800 8.872) 14.249 14.856 ( 3.542 -13.122 5.928) 14.828 17.229 ( -5.191 -0.858 -14.847) 15.751 19.007 ( 8.253 -0.239 13.723) 16.015 19.671 ( 17.240 6.790 -3.065) 18.781 19.935 ( 14.521 1.837 10.561) 18.050 20.748 ( -15.209 7.585 -11.611) 20.583 21.415 ( -19.838 -9.311 -3.974) 22.272 23.740 ( 0.975 -0.344 1.218) 1.598 24.143 ( 3.975 1.363 4.224) 5.958 ======================= Grid point 38 (27/361) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.514 ( -0.000 25.809 -0.000) 25.809 1.589 ( -0.000 26.636 -0.000) 26.636 2.877 ( -0.000 43.744 -0.000) 43.744 3.086 ( 0.000 -14.340 0.000) 14.340 3.399 ( 0.000 -16.041 0.000) 16.041 3.737 ( -0.000 3.038 -0.000) 3.038 4.081 ( 0.000 -5.973 0.000) 5.973 4.656 ( 0.000 -5.871 0.000) 5.871 4.763 ( 0.000 -10.615 0.000) 10.615 5.123 ( 0.000 -13.629 0.000) 13.629 5.139 ( 0.000 -9.203 0.000) 9.203 5.643 ( -0.000 0.048 -0.000) 0.048 6.042 ( -0.000 0.472 -0.000) 0.472 6.680 ( -0.000 1.977 -0.000) 1.977 7.035 ( -0.000 6.132 -0.000) 6.132 7.843 ( 0.000 -5.635 0.000) 5.635 8.398 ( 0.000 -13.697 0.000) 13.697 8.949 ( -0.000 0.692 -0.000) 0.692 9.239 ( 0.000 -10.588 0.000) 10.588 9.568 ( 0.000 -1.326 0.000) 1.326 10.929 ( -0.000 36.734 -0.000) 36.734 11.328 ( -0.000 8.791 -0.000) 8.791 11.568 ( -0.000 9.777 -0.000) 9.777 12.017 ( 0.000 -0.369 0.000) 0.369 12.511 ( -0.000 0.615 -0.000) 0.615 12.972 ( 0.000 -13.402 0.000) 13.402 13.812 ( 0.000 -5.144 0.000) 5.144 15.057 ( 0.000 -16.250 0.000) 16.250 17.075 ( -0.000 1.951 -0.000) 1.951 19.155 ( -0.000 0.487 -0.000) 0.487 19.743 ( -0.000 5.081 -0.000) 5.081 20.116 ( -0.000 13.116 -0.000) 13.116 20.478 ( 0.000 -2.978 0.000) 2.978 21.276 ( 0.000 -6.142 0.000) 6.142 23.751 ( -0.000 0.420 -0.000) 0.420 24.207 ( 0.000 -0.612 0.000) 0.612 ======================= Grid point 45 (28/361) ======================= q-point: ( 0.40 -0.60 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -10.870 -0.000 -2.185) 11.088 2.510 ( 0.802 0.000 -13.165) 13.189 2.955 ( -10.785 -0.000 -7.036) 12.877 2.998 ( -10.068 -0.000 -5.346) 11.399 3.667 ( 4.481 0.000 5.050) 6.752 3.899 ( -8.878 -0.000 7.485) 11.613 4.301 ( -8.873 -0.000 -8.487) 12.278 4.631 ( 6.855 0.000 -15.706) 17.137 4.674 ( -0.422 -0.000 -7.746) 7.757 4.682 ( -21.658 -0.000 16.602) 27.289 5.282 ( -7.338 -0.000 -8.121) 10.945 5.869 ( -11.215 -0.000 0.529) 11.227 6.041 ( 5.282 0.000 -5.223) 7.428 6.714 ( -7.491 -0.000 4.502) 8.740 7.081 ( 6.237 0.000 6.379) 8.922 7.646 ( -0.502 -0.000 -2.113) 2.172 8.034 ( 6.604 0.000 2.808) 7.176 9.012 ( -4.414 -0.000 2.862) 5.261 9.087 ( -4.998 -0.000 1.441) 5.201 9.653 ( 1.489 0.000 -9.824) 9.936 11.300 ( 12.178 0.000 1.497) 12.270 11.900 ( -4.990 -0.000 -3.042) 5.844 12.000 ( -3.900 -0.000 10.857) 11.536 12.024 ( -4.532 -0.000 5.289) 6.965 12.259 ( 4.712 0.000 -4.845) 6.758 12.835 ( -7.302 -0.000 -13.944) 15.740 13.273 ( 16.787 0.000 10.182) 19.634 14.514 ( 5.649 0.000 9.108) 10.718 17.491 ( -7.267 -0.000 -17.086) 18.567 18.645 ( 10.561 0.000 18.461) 21.268 19.509 ( 15.090 0.000 12.957) 19.889 19.672 ( 14.791 0.000 -7.249) 16.472 21.397 ( -12.840 -0.000 -22.662) 26.047 21.435 ( -17.544 -0.000 6.375) 18.666 23.669 ( 3.145 0.000 3.143) 4.446 24.078 ( 3.246 0.000 3.808) 5.004 ======================= Grid point 47 (29/361) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( -6.423 12.664 -2.462) 14.411 2.289 ( -1.726 13.752 -10.273) 17.252 2.781 ( -7.418 -9.846 -4.895) 13.264 2.941 ( -1.641 -11.750 0.470) 11.873 3.683 ( -3.169 2.856 -2.993) 5.211 3.908 ( -2.891 2.174 8.211) 8.972 4.055 ( 0.413 14.896 -7.924) 16.878 4.532 ( 1.041 1.007 -0.737) 1.625 4.605 ( -18.499 -4.784 13.392) 23.333 4.722 ( 2.896 -16.987 -8.318) 19.135 5.078 ( -6.233 -1.781 -8.421) 10.627 5.716 ( -7.107 0.231 -2.574) 7.562 6.050 ( 3.478 0.491 -3.084) 4.674 6.691 ( -3.170 -0.064 3.389) 4.641 7.196 ( 3.511 5.174 3.315) 7.077 7.630 ( -0.798 -5.010 -0.352) 5.085 8.147 ( 3.713 -4.725 -0.606) 6.040 8.975 ( -2.514 2.796 2.970) 4.792 9.077 ( -3.360 -4.392 1.378) 5.699 9.576 ( 1.610 0.154 -5.971) 6.186 11.430 ( 6.017 1.539 -0.145) 6.213 11.786 ( -4.220 3.065 -1.377) 5.395 11.864 ( 0.051 30.804 4.543) 31.137 12.024 ( -2.942 0.137 0.314) 2.961 12.439 ( 1.637 -23.770 1.242) 23.859 12.611 ( -4.309 0.615 -8.018) 9.123 13.588 ( 10.421 -1.341 7.415) 12.860 14.683 ( 3.102 -5.332 4.570) 7.677 17.224 ( -5.048 -0.022 -11.379) 12.448 19.005 ( 8.398 -0.037 14.790) 17.008 19.770 ( 13.548 3.720 -4.130) 14.644 19.934 ( 17.163 -1.137 15.488) 23.146 20.887 ( -16.038 6.131 -19.652) 26.096 21.266 ( -16.495 -6.087 -0.304) 17.585 23.735 ( 1.473 -0.179 1.839) 2.363 24.159 ( 2.850 0.402 2.442) 3.775 ======================= Grid point 48 (30/361) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( -0.000 20.945 -0.000) 20.945 2.033 ( -0.000 21.994 -0.000) 21.994 2.816 ( 0.000 -14.933 0.000) 14.933 3.092 ( 0.000 -17.317 0.000) 17.317 3.504 ( -0.000 21.237 -0.000) 21.237 3.853 ( -0.000 13.888 -0.000) 13.888 3.988 ( 0.000 -3.837 0.000) 3.837 4.572 ( 0.000 -3.451 0.000) 3.451 4.592 ( 0.000 -7.603 0.000) 7.603 4.842 ( 0.000 -17.108 0.000) 17.108 5.005 ( 0.000 -5.323 0.000) 5.323 5.644 ( -0.000 0.050 -0.000) 0.050 6.052 ( -0.000 0.520 -0.000) 0.520 6.694 ( 0.000 -0.145 0.000) 0.145 7.170 ( -0.000 8.382 -0.000) 8.382 7.700 ( 0.000 -9.367 0.000) 9.367 8.213 ( 0.000 -6.733 0.000) 6.733 8.968 ( -0.000 1.200 -0.000) 1.200 9.096 ( 0.000 -5.280 0.000) 5.280 9.553 ( 0.000 -0.428 0.000) 0.428 11.443 ( -0.000 4.095 -0.000) 4.095 11.588 ( -0.000 35.636 -0.000) 35.636 11.708 ( -0.000 5.563 -0.000) 5.563 12.008 ( 0.000 -0.623 0.000) 0.623 12.524 ( -0.000 0.722 -0.000) 0.722 12.665 ( 0.000 -21.048 0.000) 21.048 13.735 ( 0.000 -3.209 0.000) 3.209 14.806 ( 0.000 -10.593 0.000) 10.593 17.105 ( -0.000 1.210 -0.000) 1.210 19.163 ( -0.000 0.320 -0.000) 0.320 19.825 ( -0.000 3.647 -0.000) 3.647 20.328 ( -0.000 9.557 -0.000) 9.557 20.428 ( 0.000 -2.368 0.000) 2.368 21.168 ( 0.000 -5.374 0.000) 5.374 23.756 ( -0.000 0.150 -0.000) 0.150 24.198 ( 0.000 -0.351 0.000) 0.351 ======================= Grid point 58 (31/361) ======================= q-point: (-0.50 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( 0.000 -0.000 0.000) 0.000 2.278 ( -0.000 0.000 -0.000) 0.000 2.636 ( 0.000 -0.000 0.000) 0.000 2.882 ( 0.000 -0.000 0.000) 0.000 3.642 ( 0.000 -0.000 0.000) 0.000 3.953 ( 0.000 -0.000 0.000) 0.000 4.115 ( -0.000 0.000 -0.000) 0.000 4.519 ( 0.000 -0.000 0.000) 0.000 4.521 ( 0.000 -0.000 0.000) 0.000 4.626 ( 0.000 -0.000 0.000) 0.000 4.956 ( 0.000 -0.000 0.000) 0.000 5.644 ( 0.000 -0.000 0.000) 0.000 6.057 ( 0.000 -0.000 0.000) 0.000 6.690 ( 0.000 -0.000 0.000) 0.000 7.276 ( 0.000 -0.000 0.000) 0.000 7.582 ( 0.000 -0.000 0.000) 0.000 8.154 ( 0.000 -0.000 0.000) 0.000 8.981 ( 0.000 -0.000 0.000) 0.000 9.049 ( 0.000 -0.000 0.000) 0.000 9.549 ( 0.000 -0.000 0.000) 0.000 11.479 ( 0.000 -0.000 0.000) 0.000 11.760 ( 0.000 -0.000 0.000) 0.000 12.001 ( 0.000 -0.000 0.000) 0.000 12.110 ( -0.000 0.000 -0.000) 0.000 12.279 ( 0.000 -0.000 0.000) 0.000 12.532 ( 0.000 -0.000 0.000) 0.000 13.705 ( 0.000 -0.000 0.000) 0.000 14.707 ( 0.000 -0.000 0.000) 0.000 17.116 ( 0.000 -0.000 0.000) 0.000 19.166 ( 0.000 -0.000 0.000) 0.000 19.860 ( 0.000 -0.000 0.000) 0.000 20.404 ( 0.000 -0.000 0.000) 0.000 20.422 ( 0.000 -0.000 0.000) 0.000 21.113 ( 0.000 -0.000 0.000) 0.000 23.757 ( 0.000 -0.000 0.000) 0.000 24.195 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 105 (32/361) ======================= q-point: ( 0.00 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.584 ( -7.853 -0.000 29.649) 30.671 0.669 ( 18.959 0.000 32.615) 37.725 1.250 ( -10.453 -0.000 60.632) 61.527 3.503 ( 0.504 0.000 -2.015) 2.077 3.710 ( -1.189 -0.000 5.992) 6.108 3.962 ( -3.417 -0.000 5.393) 6.385 4.775 ( 3.173 0.000 -4.421) 5.442 5.008 ( -28.114 -0.000 1.193) 28.140 5.313 ( 0.502 0.000 0.184) 0.534 5.542 ( -12.481 -0.000 5.775) 13.752 5.582 ( -0.965 -0.000 -5.812) 5.891 6.082 ( -37.407 -0.000 9.162) 38.512 6.420 ( -3.039 -0.000 -1.700) 3.482 6.667 ( -16.561 -0.000 -6.392) 17.752 6.995 ( -2.439 -0.000 5.890) 6.374 7.288 ( 1.042 0.000 1.378) 1.728 8.005 ( 1.333 0.000 -2.193) 2.567 9.189 ( 0.152 0.000 7.538) 7.539 9.538 ( -1.108 -0.000 -7.185) 7.270 9.685 ( -3.058 -0.000 -2.014) 3.662 10.088 ( 29.219 0.000 3.304) 29.406 10.698 ( -1.700 -0.000 -0.373) 1.740 11.812 ( -21.796 -0.000 9.041) 23.596 11.990 ( 0.751 0.000 -3.110) 3.199 12.358 ( 0.556 0.000 -10.457) 10.472 12.820 ( 2.338 0.000 8.434) 8.752 13.279 ( -0.798 -0.000 -1.692) 1.871 15.353 ( -0.765 -0.000 -11.645) 11.670 18.575 ( 2.590 0.000 -5.859) 6.406 19.164 ( -5.303 -0.000 1.854) 5.618 19.395 ( 44.138 0.000 -2.796) 44.226 19.618 ( 13.862 0.000 -1.472) 13.940 20.554 ( 7.933 0.000 -1.240) 8.030 23.004 (-106.225 -0.000 -3.873) 106.295 23.019 ( -1.932 -0.000 4.074) 4.509 23.723 ( 2.864 0.000 -0.421) 2.895 ======================= Grid point 106 (33/361) ======================= q-point: ( 0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( 6.082 -8.503 25.767) 27.807 1.267 ( 5.840 -9.622 32.092) 34.009 2.122 ( 25.228 -9.366 46.274) 53.530 3.499 ( 5.227 2.529 -4.190) 7.161 3.712 ( -9.877 0.855 9.676) 13.853 3.962 ( -3.943 2.637 5.838) 7.522 4.747 ( 3.117 3.850 -5.978) 7.764 4.764 ( -28.483 4.509 25.401) 38.430 5.273 ( -2.076 -0.337 -5.471) 5.862 5.346 ( 1.278 4.331 -5.639) 7.224 5.471 ( -3.137 -0.328 -7.746) 8.363 5.938 ( -6.772 2.615 16.489) 18.016 6.301 ( -4.914 7.597 1.670) 9.201 6.575 ( 2.267 12.038 2.346) 12.472 7.093 ( 5.184 1.550 1.658) 5.659 7.387 ( -1.947 -18.347 -9.684) 20.837 8.057 ( -3.008 -10.472 4.416) 11.756 9.260 ( -0.322 5.158 6.401) 8.227 9.472 ( 2.848 -4.352 -6.774) 8.540 9.597 ( -4.596 -1.428 -4.072) 6.304 10.403 ( 21.205 17.540 -4.698) 27.917 10.783 ( 7.022 -19.768 -2.925) 21.181 11.718 ( -10.585 11.566 18.966) 24.608 11.968 ( 3.026 -0.687 -4.260) 5.270 12.323 ( 0.925 -13.860 -10.359) 17.328 13.002 ( 3.402 -5.172 6.947) 9.305 13.219 ( -3.542 0.219 -2.820) 4.532 15.108 ( -6.279 2.871 -17.280) 18.609 18.503 ( 5.355 15.414 0.342) 16.322 18.970 ( -14.238 8.891 -5.437) 17.645 19.237 ( -25.853 -14.554 1.810) 29.723 19.714 ( -11.242 0.451 4.723) 12.202 20.697 ( 12.664 4.173 5.330) 14.360 22.296 ( 6.815 24.185 0.353) 25.130 23.218 ( -5.162 -27.959 -3.920) 28.701 23.768 ( 3.187 0.069 0.680) 3.259 ======================= Grid point 107 (34/361) ======================= q-point: ( 0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( 10.926 -8.456 21.168) 25.278 1.837 ( 5.468 -15.048 30.532) 34.475 3.076 ( 30.280 -8.688 27.911) 42.088 3.476 ( 4.862 6.058 -5.826) 9.710 3.706 ( -7.327 3.594 13.273) 15.581 3.953 ( -0.209 3.356 1.240) 3.584 4.607 ( -2.215 6.933 -4.181) 8.394 4.684 ( -11.961 0.167 9.155) 15.064 5.145 ( -7.222 -1.839 -4.829) 8.880 5.353 ( -0.092 -0.828 -5.733) 5.793 5.434 ( 10.451 3.222 4.533) 11.839 6.031 ( -7.167 0.060 12.071) 14.039 6.237 ( -3.386 1.244 6.692) 7.602 6.515 ( -1.012 13.177 4.866) 14.083 7.064 ( -1.057 4.174 -7.234) 8.418 7.393 ( 2.589 -8.016 -6.486) 10.631 8.184 ( -7.723 -15.234 7.816) 18.783 9.225 ( -1.864 10.366 2.049) 10.729 9.486 ( -2.404 0.120 -4.945) 5.500 9.564 ( 6.080 -8.287 0.845) 10.313 10.385 ( 5.096 8.756 -4.115) 10.934 11.062 ( 12.614 -13.819 -3.279) 18.996 11.677 ( -8.949 10.484 11.405) 17.890 11.995 ( 6.569 -0.640 -3.380) 7.416 12.383 ( 1.085 -17.145 -4.774) 17.830 13.082 ( -4.523 3.470 -2.764) 6.335 13.196 ( 2.838 -2.670 7.824) 8.741 14.733 ( -9.332 4.358 -19.603) 22.144 18.433 ( -6.112 15.031 6.278) 17.399 18.660 ( 1.879 6.585 -11.170) 13.102 19.090 ( -22.130 -18.107 3.258) 28.779 19.545 ( -14.482 3.700 1.323) 15.006 20.943 ( 13.698 3.725 8.319) 16.454 22.285 ( 15.984 9.774 -8.143) 20.429 23.307 ( -2.177 -16.155 -4.197) 16.832 23.816 ( 2.548 1.224 1.033) 3.010 ======================= Grid point 108 (35/361) ======================= q-point: ( 0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( 8.310 -5.160 16.386) 19.084 2.429 ( 9.582 -15.419 25.854) 31.591 3.383 ( 1.132 7.805 -5.550) 9.644 3.529 ( 1.503 4.346 2.080) 5.047 3.829 ( 2.737 6.568 -5.071) 8.738 3.994 ( 13.629 -1.868 16.349) 21.366 4.509 ( 6.637 -0.193 -9.712) 11.765 4.693 ( -4.089 -5.529 4.756) 8.361 5.033 ( -9.354 -3.050 4.076) 10.649 5.296 ( -1.329 -1.583 -4.569) 5.014 5.641 ( 1.325 4.402 19.974) 20.496 6.033 ( -3.516 2.289 5.301) 6.760 6.293 ( -7.779 -7.883 2.000) 11.254 6.447 ( 0.901 15.858 9.148) 18.330 6.873 ( -3.011 5.105 -9.263) 10.997 7.461 ( 7.673 -2.524 -1.953) 8.310 8.267 ( -13.499 -16.191 6.467) 22.049 9.101 ( -1.502 12.739 0.050) 12.828 9.394 ( -3.075 0.143 -3.158) 4.410 9.802 ( 11.019 -4.701 5.499) 13.182 10.348 ( 0.959 -4.574 -3.589) 5.893 11.198 ( 2.764 5.237 -4.610) 7.504 11.634 ( -0.189 -1.633 5.647) 5.881 12.068 ( 7.736 -0.108 -2.441) 8.113 12.520 ( -0.275 -15.869 0.450) 15.878 12.903 ( -7.896 5.464 -4.030) 10.414 13.396 ( 6.506 -1.503 9.798) 11.857 14.322 ( -9.675 4.606 -17.964) 20.917 18.216 ( -8.941 8.332 -1.399) 12.301 18.640 ( 12.744 8.300 -4.942) 15.992 19.006 ( -17.927 -18.251 2.088) 25.668 19.305 ( -13.064 5.040 -0.584) 14.015 21.164 ( 10.236 5.909 5.726) 13.133 22.344 ( 12.333 0.164 -7.346) 14.356 23.369 ( 0.902 -10.327 -3.032) 10.800 23.835 ( 1.040 3.031 0.923) 3.335 ======================= Grid point 109 (36/361) ======================= q-point: ( 0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 1.490 2.586 7.037) 7.644 2.970 ( 11.087 -10.352 17.192) 22.927 3.214 ( -6.764 7.189 -7.364) 12.315 3.466 ( -2.068 4.399 0.870) 4.938 3.632 ( 0.304 6.747 -8.453) 10.820 4.390 ( 4.608 -6.433 10.998) 13.549 4.549 ( 16.464 -3.086 -14.493) 22.151 4.709 ( -3.908 -4.558 0.129) 6.006 5.044 ( -7.542 -4.737 9.275) 12.858 5.225 ( -3.078 -2.333 -4.215) 5.717 5.777 ( -15.272 10.929 19.344) 26.960 6.078 ( 3.119 -1.541 2.678) 4.391 6.184 ( -7.069 -2.618 3.028) 8.124 6.484 ( -0.049 8.667 8.372) 12.051 6.736 ( 0.209 1.775 -2.568) 3.129 7.589 ( 10.853 0.891 -1.230) 10.959 8.261 ( -15.008 -11.233 6.483) 19.835 8.983 ( -1.016 9.080 0.117) 9.138 9.332 ( -0.451 0.675 -1.709) 1.892 9.979 ( 2.728 -0.158 1.383) 3.063 10.480 ( 6.926 -15.752 1.813) 17.303 10.971 ( -4.998 18.282 -6.402) 20.005 11.821 ( 6.001 -6.759 5.867) 10.776 12.137 ( 5.758 0.428 -2.121) 6.151 12.622 ( -5.649 -5.794 1.696) 8.268 12.721 ( -1.900 1.881 -1.698) 3.167 13.580 ( 3.243 -1.667 -1.351) 3.889 14.018 ( -2.756 2.481 -4.087) 5.518 18.057 ( -3.146 3.332 -1.925) 4.970 18.643 ( 7.822 6.521 -9.810) 14.140 18.964 ( -12.578 -14.649 1.888) 19.400 19.141 ( -5.667 2.771 3.840) 7.385 21.246 ( 6.289 8.204 -0.706) 10.362 22.447 ( 5.880 -6.629 -1.827) 9.047 23.447 ( 3.470 -6.367 -1.703) 7.448 23.814 ( -0.063 4.918 0.534) 4.948 ======================= Grid point 110 (37/361) ======================= q-point: (-0.50 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( -5.489 13.288 -4.665) 15.114 2.835 ( -17.200 13.647 -9.630) 23.976 3.263 ( 4.832 -1.807 3.376) 6.165 3.454 ( -0.215 -1.968 2.873) 3.489 3.693 ( 7.756 -9.689 2.961) 12.759 4.333 ( -6.715 2.720 -16.140) 17.692 4.642 ( 0.820 -3.483 -4.696) 5.904 4.792 ( -1.619 -10.009 10.647) 14.702 5.073 ( -5.823 -2.876 3.174) 7.229 5.181 ( -1.521 -4.841 -0.455) 5.095 5.547 ( -13.317 11.184 3.767) 17.793 6.021 ( -5.351 0.096 -2.757) 6.020 6.369 ( -0.679 -1.300 14.668) 14.742 6.469 ( -4.890 6.386 8.782) 11.908 6.800 ( 3.924 -3.642 6.333) 8.292 7.672 ( 5.109 1.705 -2.255) 5.838 8.245 ( -4.701 2.773 7.590) 9.349 8.918 ( -2.202 -1.080 -0.905) 2.614 9.335 ( 3.068 0.697 0.049) 3.147 9.947 ( -6.974 -5.265 -4.161) 9.679 10.658 ( -2.020 18.138 -2.063) 18.366 10.796 ( 11.152 -10.411 0.873) 15.281 11.936 ( -5.948 2.193 5.876) 8.644 12.162 ( 2.214 0.989 -2.084) 3.198 12.596 ( 4.919 1.529 2.676) 5.805 12.781 ( 0.685 -4.475 3.935) 5.998 13.386 ( -7.117 2.235 -16.193) 17.829 14.190 ( 10.999 -3.876 12.068) 16.782 17.992 ( -0.605 -0.931 -5.343) 5.458 18.543 ( 6.289 2.946 -10.925) 12.945 18.949 ( -10.548 -9.637 3.929) 14.818 19.192 ( 4.103 0.491 6.340) 7.568 21.190 ( 3.462 8.353 -7.136) 11.518 22.566 ( -2.591 -10.917 3.961) 11.899 23.534 ( 4.178 -2.110 0.919) 4.770 23.767 ( 0.506 5.883 -0.284) 5.912 ======================= Grid point 111 (38/361) ======================= q-point: (-0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( -10.080 19.566 -9.443) 23.950 2.305 ( -21.764 19.694 -6.333) 30.027 3.349 ( 2.297 -4.653 -1.614) 5.434 3.515 ( -1.580 -5.193 0.368) 5.440 3.851 ( -20.615 6.660 -18.362) 28.399 3.886 ( 0.056 -8.098 -0.028) 8.098 4.542 ( -6.527 -0.136 -4.571) 7.970 4.856 ( -12.789 -4.245 6.590) 15.000 5.138 ( 4.154 -5.995 6.189) 9.565 5.274 ( 3.082 -6.599 1.988) 7.550 5.450 ( -3.984 -1.009 7.829) 8.842 5.891 ( -3.405 2.743 -5.681) 7.169 6.410 ( -1.122 12.958 9.247) 15.958 6.490 ( -14.863 -10.997 9.231) 20.665 7.027 ( 3.246 -6.433 11.963) 13.965 7.680 ( -0.444 0.988 1.950) 2.230 8.232 ( 5.813 19.016 3.774) 20.239 8.924 ( -2.523 -11.848 -2.489) 12.367 9.397 ( 6.003 1.168 0.549) 6.140 9.809 ( -9.434 -4.246 -4.501) 11.282 10.494 ( 1.615 12.367 -0.249) 12.474 11.023 ( 9.476 -6.351 -3.090) 11.819 11.803 ( -15.045 7.343 7.799) 18.469 12.132 ( -0.535 1.820 -2.340) 3.012 12.765 ( 7.708 6.306 9.483) 13.751 12.902 ( 3.346 -4.781 5.450) 7.985 13.076 ( -4.330 0.594 -16.343) 16.918 14.565 ( 14.289 -5.636 11.626) 19.264 17.857 ( -0.239 -3.318 -19.825) 20.102 18.583 ( 10.395 0.296 0.655) 10.420 18.935 ( -7.696 -4.986 3.983) 9.998 19.355 ( 7.192 -0.405 6.291) 9.564 21.027 ( 0.625 7.768 -11.899) 14.224 22.653 ( -11.367 -14.682 7.076) 19.871 23.632 ( 3.062 3.233 8.272) 9.394 23.725 ( 2.771 4.329 -2.540) 5.733 ======================= Grid point 112 (39/361) ======================= q-point: (-0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.236 ( -14.427 20.747 -5.555) 25.874 1.739 ( -22.978 24.936 -1.578) 33.945 2.892 ( -32.772 14.029 -27.073) 44.764 3.578 ( 0.237 -7.146 5.295) 8.897 3.603 ( -6.261 -6.806 4.314) 10.204 3.860 ( -6.954 -3.185 -2.663) 8.099 4.417 ( -6.297 -1.385 0.253) 6.453 4.845 ( -3.863 -1.526 5.954) 7.259 5.315 ( 1.536 -6.820 2.572) 7.449 5.365 ( 4.319 -5.167 -0.726) 6.774 5.598 ( -6.016 -11.090 13.971) 18.825 5.770 ( 0.155 3.726 -4.002) 5.470 6.392 ( -10.323 3.986 13.947) 17.804 6.471 ( -9.315 -11.081 0.993) 14.510 7.226 ( -4.302 -6.749 9.490) 12.414 7.699 ( -0.679 3.213 5.031) 6.008 8.179 ( 11.989 26.311 3.220) 29.092 8.980 ( -2.816 -15.672 -3.171) 16.236 9.484 ( 8.216 1.544 -1.007) 8.420 9.699 ( -4.061 1.269 0.587) 4.295 10.452 ( 0.065 -2.016 -1.961) 2.813 11.077 ( 5.428 1.438 -8.738) 10.386 11.640 ( -18.947 3.056 13.757) 23.613 12.073 ( -1.078 1.924 -1.971) 2.958 12.736 ( -8.270 4.427 -2.273) 9.652 13.019 ( 9.923 6.511 4.240) 12.603 13.087 ( 8.816 -1.127 4.247) 9.850 14.950 ( 14.967 -5.774 8.436) 18.125 17.574 ( 0.843 -4.267 -32.402) 32.693 18.791 ( 11.647 0.810 6.208) 13.223 18.918 ( -3.978 0.068 2.879) 4.911 19.528 ( 6.985 0.872 4.935) 8.597 20.798 ( -1.313 5.970 -13.345) 14.678 22.682 ( -19.025 -19.847 7.621) 28.530 23.700 ( 3.831 5.759 -1.066) 6.998 23.788 ( 1.976 3.437 16.386) 16.859 ======================= Grid point 113 (40/361) ======================= q-point: (-0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.817 ( -19.911 17.339 5.764) 27.024 1.187 ( -25.040 25.835 3.931) 36.193 1.887 ( -45.023 21.017 -17.106) 52.549 3.587 ( -6.789 -6.762 1.387) 9.681 3.738 ( -7.512 -0.947 5.704) 9.479 3.780 ( 2.739 -4.516 1.604) 5.520 4.467 ( -2.679 -6.530 14.875) 16.465 4.864 ( -1.496 1.081 2.346) 2.985 5.373 ( -0.827 -4.731 2.802) 5.560 5.495 ( 3.751 -6.543 0.308) 7.548 5.671 ( -5.403 -2.559 0.104) 5.979 5.797 ( -4.504 -6.952 9.618) 12.693 6.425 ( -14.468 -12.126 15.344) 24.327 6.464 ( -5.714 -13.168 -3.207) 14.709 7.208 ( -14.648 -3.079 2.968) 15.260 7.748 ( 4.852 5.600 5.837) 9.433 8.216 ( 18.403 27.520 6.618) 33.761 9.045 ( -3.744 -12.274 1.126) 12.882 9.560 ( 7.804 -1.424 -5.766) 9.807 9.671 ( 2.169 8.363 2.808) 9.085 10.462 ( -4.186 -17.842 -8.174) 20.066 10.955 ( 0.329 8.374 -9.638) 12.772 11.582 ( -24.596 -12.664 21.947) 35.313 12.032 ( -0.351 0.973 -0.835) 1.329 12.578 ( -4.569 0.086 -4.239) 6.234 13.182 ( 8.986 6.582 7.431) 13.390 13.249 ( 15.448 17.727 7.441) 24.663 15.267 ( 13.556 -3.857 2.485) 14.311 17.178 ( -1.735 -1.411 -32.882) 32.958 18.875 ( 3.584 10.840 -0.938) 11.456 19.009 ( 7.527 -0.041 5.904) 9.566 19.635 ( 3.962 3.635 3.012) 6.163 20.599 ( 0.014 1.909 -10.646) 10.815 22.686 ( -25.291 -29.648 9.054) 40.008 23.694 ( 4.022 2.470 -2.842) 5.509 24.058 ( 1.060 3.494 30.838) 31.053 ======================= Grid point 114 (41/361) ======================= q-point: (-0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.551 ( -21.650 10.560 19.925) 31.261 0.601 ( -35.840 12.966 -3.357) 38.261 1.092 ( -37.688 27.793 36.608) 59.439 3.543 ( -5.198 -3.561 -1.332) 6.441 3.684 ( -3.274 1.111 1.926) 3.958 3.906 ( 0.107 -3.697 5.257) 6.428 4.753 ( 1.486 -9.127 2.612) 9.609 4.950 ( 8.093 1.338 19.875) 21.502 5.484 ( -0.339 -3.538 2.598) 4.402 5.492 ( -6.063 -3.700 -6.426) 9.578 5.619 ( 1.448 -0.335 -1.108) 1.854 5.970 ( 1.429 -11.665 15.640) 19.564 6.442 ( -3.631 -6.464 -3.432) 8.170 6.605 ( -32.010 -60.254 13.973) 69.645 7.044 ( -16.523 -4.036 5.310) 17.818 7.826 ( 4.549 5.011 -3.674) 7.701 8.254 ( 23.526 38.986 -15.645) 48.147 9.128 ( -0.878 -1.065 6.229) 6.380 9.571 ( 5.260 -0.513 -6.945) 8.727 9.661 ( 4.867 6.926 -0.795) 8.503 10.256 ( -30.698 -19.245 -25.882) 44.526 10.762 ( -1.405 11.245 -0.266) 11.335 11.775 ( -25.879 -48.009 19.632) 57.965 12.015 ( -0.689 -0.547 -1.309) 1.578 12.507 ( -0.590 0.206 -2.084) 2.176 13.193 ( 19.348 52.773 -27.642) 62.637 13.283 ( 3.322 3.431 -1.041) 4.888 15.414 ( 7.573 -0.582 -7.285) 10.524 17.303 ( 30.229 -15.076 69.970) 77.697 18.795 ( 14.999 27.331 -3.657) 31.390 19.140 ( 2.165 -0.070 4.278) 4.796 19.652 ( 0.252 3.758 0.666) 3.825 20.516 ( 3.544 -0.887 -6.594) 7.539 22.771 ( -27.614 -46.716 11.510) 55.475 23.700 ( 3.143 0.789 -1.986) 3.801 24.440 ( -7.306 -14.776 3.286) 16.808 ======================= Grid point 116 (42/361) ======================= q-point: ( 0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( 13.467 0.000 26.471) 29.700 1.666 ( 0.250 0.000 34.623) 34.624 2.998 ( 34.272 0.000 28.797) 44.765 3.534 ( 6.398 0.000 -6.044) 8.802 3.741 ( -6.108 -0.000 14.124) 15.388 3.981 ( -2.588 -0.000 2.514) 3.608 4.669 ( -18.956 -0.000 11.905) 22.385 4.711 ( 0.125 0.000 -7.868) 7.869 5.099 ( -6.523 -0.000 -9.768) 11.746 5.345 ( -1.561 -0.000 -5.958) 6.159 5.468 ( 11.569 0.000 4.188) 12.304 6.034 ( -6.725 -0.000 14.390) 15.884 6.228 ( -9.954 -0.000 3.357) 10.504 6.722 ( 0.672 0.000 4.397) 4.448 7.181 ( 2.544 0.000 1.493) 2.949 7.182 ( 1.341 0.000 -10.344) 10.431 8.032 ( -9.064 -0.000 10.357) 13.763 9.339 ( -0.479 -0.000 3.179) 3.215 9.443 ( -3.738 -0.000 -0.473) 3.767 9.503 ( 8.464 0.000 -6.407) 10.616 10.530 ( -6.377 -0.000 -4.605) 7.866 10.880 ( 27.220 0.000 -4.978) 27.672 11.879 ( -10.400 -0.000 20.208) 22.727 11.969 ( 7.488 0.000 -6.715) 10.058 12.142 ( 0.771 0.000 -8.776) 8.809 13.116 ( -5.669 -0.000 -3.550) 6.689 13.167 ( 5.634 0.000 9.963) 11.445 14.772 ( -10.596 -0.000 -19.252) 21.975 18.646 ( 9.536 0.000 -3.297) 10.090 18.774 ( -25.750 -0.000 5.086) 26.248 18.797 ( -11.911 -0.000 -7.247) 13.943 19.579 ( -14.438 -0.000 2.213) 14.606 20.989 ( 11.597 0.000 11.325) 16.209 22.411 ( 12.360 0.000 -17.092) 21.093 23.114 ( 2.044 0.000 2.796) 3.464 23.828 ( 3.345 0.000 1.058) 3.508 ======================= Grid point 117 (43/361) ======================= q-point: ( 0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( 12.777 4.887 24.288) 27.876 2.147 ( 4.308 -13.706 29.990) 33.253 3.502 ( 1.277 4.198 -6.128) 7.536 3.581 ( 12.165 1.455 3.851) 12.842 3.912 ( 5.595 3.685 4.848) 8.269 3.972 ( 5.953 -2.326 6.711) 9.267 4.554 ( 0.883 4.730 -10.531) 11.578 4.619 ( -3.100 -2.801 2.262) 4.751 4.928 ( -8.396 -6.266 -2.790) 10.841 5.277 ( -3.082 -0.436 -1.523) 3.466 5.696 ( 2.640 1.584 16.977) 17.254 6.079 ( -5.163 2.835 7.755) 9.738 6.173 ( -8.054 -5.004 4.741) 10.601 6.702 ( -3.027 8.705 3.586) 9.889 7.014 ( 1.272 11.176 -7.423) 13.477 7.336 ( 4.004 -11.022 3.832) 12.337 8.017 ( -15.318 -8.614 8.362) 19.462 9.287 ( -3.331 7.427 -0.768) 8.176 9.378 ( -2.613 -2.037 -1.189) 3.520 9.711 ( 16.896 -3.684 3.849) 17.717 10.347 ( -6.602 1.576 -6.746) 9.570 11.206 ( 21.482 -2.091 -1.939) 21.670 11.797 ( -4.778 17.610 3.801) 18.638 12.059 ( 7.277 -2.082 -1.382) 7.694 12.188 ( -2.426 -18.861 1.654) 19.088 12.971 ( -7.563 1.956 -3.545) 8.578 13.375 ( 6.826 -0.627 8.976) 11.294 14.375 ( -11.882 1.388 -17.589) 21.272 18.405 ( -12.688 12.704 -1.669) 18.032 18.661 ( -13.500 -13.824 -2.931) 19.543 18.775 ( 12.504 0.509 -3.999) 13.138 19.369 ( -14.536 1.825 -0.939) 14.680 21.273 ( 8.904 4.391 13.121) 16.454 22.344 ( 10.451 -0.000 -17.604) 20.473 23.211 ( 3.243 -5.617 1.295) 6.614 23.876 ( 2.174 1.290 1.138) 2.772 ======================= Grid point 118 (44/361) ======================= q-point: ( 0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 5.491 8.092 17.339) 19.906 2.723 ( 10.810 -15.737 22.288) 29.347 3.333 ( -7.447 5.670 -7.110) 11.754 3.563 ( -3.535 5.835 -1.330) 6.951 3.781 ( -0.571 7.263 -12.685) 14.628 4.273 ( 3.923 -5.913 5.993) 9.288 4.487 ( 11.174 -2.327 -9.907) 15.113 4.650 ( 4.480 -2.800 -5.036) 7.299 4.933 ( -4.044 -6.363 5.910) 9.580 5.197 ( -7.018 -0.858 -1.099) 7.155 5.908 ( -14.200 3.850 28.068) 31.690 6.063 ( 1.347 0.026 -2.825) 3.130 6.121 ( -7.362 -3.216 1.551) 8.182 6.649 ( -1.776 6.069 7.067) 9.484 6.861 ( 1.551 13.073 -2.611) 13.421 7.557 ( 8.601 -5.087 3.999) 10.763 7.978 ( -17.662 -15.944 7.257) 24.877 9.156 ( -4.197 7.917 -0.167) 8.962 9.348 ( -0.598 1.056 -0.743) 1.423 10.003 ( 7.218 2.513 0.475) 7.658 10.249 ( 4.869 -10.113 -0.582) 11.239 11.337 ( 7.234 19.656 -3.479) 21.232 11.740 ( 6.632 0.198 5.486) 8.609 12.143 ( 5.939 0.145 -1.768) 6.198 12.374 ( -2.267 -18.988 4.644) 19.678 12.794 ( -7.623 3.630 -2.811) 8.899 13.554 ( 5.486 -1.112 0.038) 5.597 14.045 ( -7.800 0.669 -6.877) 10.420 18.153 ( -5.982 7.480 -3.102) 10.068 18.565 ( -10.149 -13.476 -6.662) 18.138 18.886 ( 10.864 4.390 -2.849) 12.059 19.172 ( -8.440 0.494 0.574) 8.474 21.435 ( 4.460 11.332 8.179) 14.669 22.309 ( 6.016 -8.220 -12.560) 16.171 23.331 ( 4.777 -5.467 1.072) 7.339 23.891 ( 0.816 3.230 1.260) 3.562 ======================= Grid point 119 (45/361) ======================= q-point: (-0.60 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( -0.820 14.304 3.444) 14.735 3.023 ( -15.466 7.043 -7.523) 18.585 3.203 ( 8.978 -7.172 11.886) 16.533 3.452 ( -4.547 1.430 -0.839) 4.840 3.585 ( 0.426 -0.267 -6.766) 6.785 4.331 ( -5.536 -4.246 -2.439) 7.391 4.550 ( 5.055 -5.403 -8.310) 11.127 4.673 ( 0.389 -2.490 -1.203) 2.792 4.989 ( -0.459 -4.759 -1.495) 5.010 5.110 ( -5.755 -3.602 1.926) 7.057 5.724 ( -17.570 7.842 1.323) 19.286 6.025 ( -3.997 0.153 -1.051) 4.136 6.265 ( -6.297 -5.656 18.497) 20.342 6.696 ( -0.223 11.637 10.273) 15.525 6.779 ( 2.101 3.533 1.954) 4.551 7.681 ( 1.772 -0.604 -0.866) 2.062 8.066 ( -5.025 -17.942 9.032) 20.706 9.025 ( -4.520 9.014 1.166) 10.151 9.337 ( 0.691 -0.380 -0.013) 0.789 9.888 ( -6.285 -1.039 -8.474) 10.601 10.596 ( 16.288 -8.462 6.786) 19.570 11.116 ( 1.659 28.234 -1.783) 28.338 11.950 ( 4.409 -0.478 7.157) 8.419 12.176 ( 2.289 0.601 -1.683) 2.904 12.553 ( -0.062 -10.721 5.439) 12.022 12.687 ( -0.013 -1.701 -0.303) 1.727 13.419 ( -6.368 1.351 -15.864) 17.147 14.111 ( 7.433 -4.509 9.889) 13.167 18.002 ( -2.635 2.066 -7.204) 7.945 18.464 ( -5.332 -9.977 -6.473) 13.033 18.914 ( 3.191 4.624 0.571) 5.647 19.189 ( 5.655 -1.220 2.206) 6.192 21.395 ( 1.264 14.209 -1.336) 14.327 22.345 ( -1.785 -13.757 -3.765) 14.374 23.465 ( 5.617 -4.243 1.601) 7.219 23.877 ( 0.479 5.343 1.627) 5.606 ======================= Grid point 120 (46/361) ======================= q-point: (-0.50 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( -6.221 20.657 -6.785) 22.615 2.604 ( -19.501 12.793 -5.181) 23.891 3.305 ( 0.898 -0.442 -0.628) 1.181 3.441 ( -2.129 -2.654 0.866) 3.511 3.676 ( 2.001 -13.233 -0.826) 13.409 4.048 ( -16.286 12.848 -12.299) 24.116 4.495 ( -6.020 -5.016 -6.803) 10.377 4.694 ( -8.935 -10.972 5.823) 15.301 5.035 ( 3.268 -6.328 0.426) 7.135 5.157 ( 0.037 -6.118 3.249) 6.927 5.487 ( -9.623 4.172 1.898) 10.659 5.933 ( -1.884 1.727 -5.183) 5.779 6.348 ( -16.562 -5.246 12.897) 21.637 6.643 ( -2.443 12.694 6.817) 14.614 6.930 ( 3.218 -3.898 10.232) 11.412 7.679 ( -2.184 -1.073 2.589) 3.553 8.289 ( 5.190 -12.051 2.035) 13.278 8.898 ( -4.667 8.753 1.959) 10.111 9.379 ( 2.016 -3.006 0.957) 3.744 9.713 ( -6.554 -4.438 -7.867) 11.160 10.875 ( 2.430 27.621 0.894) 27.742 10.933 ( 12.994 -3.380 2.639) 13.683 11.944 ( -9.987 7.560 5.845) 13.822 12.160 ( -0.887 1.166 -1.210) 1.900 12.760 ( 5.322 -9.000 6.265) 12.189 12.817 ( 9.666 -2.322 6.306) 11.772 13.097 ( -7.870 1.619 -16.031) 17.932 14.437 ( 12.422 -8.125 9.211) 17.469 17.805 ( -3.464 -2.328 -18.862) 19.318 18.509 ( 2.184 -6.819 5.346) 8.935 18.948 ( 6.224 5.029 1.146) 8.083 19.343 ( 9.177 -1.216 3.232) 9.805 21.208 ( -1.400 12.361 -8.811) 15.244 22.382 ( -11.228 -15.646 2.098) 19.372 23.601 ( 5.170 -3.124 2.647) 6.595 23.860 ( 1.598 7.233 3.079) 8.022 ======================= Grid point 121 (47/361) ======================= q-point: (-0.40 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( -9.687 24.038 -7.055) 26.860 2.130 ( -20.926 17.789 -3.813) 27.729 3.234 ( -14.758 21.772 -17.153) 31.401 3.408 ( -0.911 -10.426 3.591) 11.065 3.512 ( -13.574 -3.620 -0.531) 14.058 3.779 ( -3.864 -4.554 -0.539) 5.996 4.356 ( -9.328 -5.441 -2.991) 11.206 4.770 ( -5.456 -7.349 8.811) 12.705 5.170 ( 0.951 -8.821 2.963) 9.354 5.260 ( 0.954 -6.679 0.731) 6.787 5.423 ( -6.436 -7.172 3.876) 10.387 5.838 ( 1.251 3.515 -4.735) 6.028 6.237 ( -22.885 -6.584 7.661) 25.016 6.597 ( -1.001 9.206 5.802) 10.928 7.112 ( -1.968 -5.266 9.241) 10.816 7.721 ( 0.181 -0.337 5.095) 5.110 8.446 ( 8.893 -4.183 -4.556) 10.832 8.804 ( -4.433 4.025 4.321) 7.384 9.455 ( 2.754 -4.074 -0.373) 4.932 9.629 ( -3.595 -7.929 -2.131) 8.963 10.657 ( 0.580 24.204 -1.428) 24.253 11.110 ( 8.158 1.987 -0.530) 8.413 11.765 ( -14.223 9.003 6.996) 18.229 12.108 ( -2.172 1.740 -1.096) 2.991 12.784 ( -8.582 1.828 -10.284) 13.518 12.950 ( 3.233 -8.509 4.156) 10.007 13.153 ( 17.780 2.125 10.295) 20.655 14.800 ( 13.800 -10.515 5.625) 18.239 17.504 ( -3.637 -3.202 -25.564) 26.019 18.735 ( 6.176 -4.306 11.514) 13.757 19.016 ( 10.987 8.086 -0.419) 13.649 19.535 ( 10.128 -0.265 4.305) 11.008 20.936 ( -4.040 9.252 -12.808) 16.308 22.346 ( -20.933 -17.558 4.249) 27.650 23.708 ( 3.246 -1.552 -0.038) 3.598 23.905 ( 3.993 6.586 10.304) 12.864 ======================= Grid point 122 (48/361) ======================= q-point: (-0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.228 ( -10.854 25.758 -0.205) 27.952 1.584 ( -25.046 19.043 -6.874) 32.205 2.442 ( -26.997 37.702 -6.894) 46.881 3.447 ( -8.112 -9.119 0.098) 12.205 3.605 ( 1.962 -11.040 6.169) 12.798 3.745 ( -4.543 -1.340 1.222) 4.891 4.331 ( -5.313 -8.376 7.931) 12.700 4.851 ( -3.527 -3.019 6.435) 7.935 5.238 ( -5.213 -10.118 1.176) 11.442 5.348 ( 0.501 -8.738 0.591) 8.772 5.475 ( -9.790 -14.330 4.000) 17.810 5.791 ( -2.173 2.779 0.410) 3.552 6.077 ( -17.531 -10.200 3.818) 20.639 6.583 ( 0.355 7.003 3.945) 8.046 7.150 ( -10.192 -2.716 4.507) 11.470 7.799 ( 4.054 0.861 2.656) 4.923 8.523 ( 12.557 1.536 -7.970) 14.952 8.849 ( -2.598 -3.129 12.337) 12.990 9.503 ( 3.006 -3.966 -3.730) 6.219 9.690 ( -2.307 -11.095 2.346) 11.573 10.403 ( -3.887 18.105 -6.065) 19.486 11.117 ( 2.297 8.897 -1.464) 9.305 11.579 ( -15.572 7.147 9.370) 19.529 12.054 ( -1.650 1.238 -0.893) 2.248 12.578 ( -4.494 0.125 -6.326) 7.760 13.108 ( 3.099 -7.106 2.370) 8.107 13.513 ( 19.234 6.222 11.282) 23.151 15.128 ( 13.362 -11.479 -0.459) 17.622 17.164 ( -3.766 -0.018 -21.153) 21.485 18.988 ( 7.784 0.397 9.466) 12.262 19.100 ( 15.214 10.640 -2.128) 18.687 19.711 ( 8.871 4.299 4.234) 10.728 20.652 ( -3.820 4.141 -12.726) 13.917 22.216 ( -31.689 -21.737 6.451) 38.965 23.725 ( 2.258 1.224 -2.127) 3.335 24.099 ( 3.890 1.300 15.894) 16.415 ======================= Grid point 123 (49/361) ======================= q-point: (-0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.913 ( -9.301 25.538 10.464) 29.124 0.946 ( -22.675 23.351 -2.865) 32.675 1.785 ( -21.923 44.015 19.288) 52.820 3.433 ( -4.557 -8.341 -0.484) 9.517 3.708 ( -3.250 1.291 2.011) 4.034 3.780 ( -0.282 -9.838 5.300) 11.178 4.536 ( -2.856 -13.007 13.785) 19.167 4.932 ( -0.024 -3.503 11.708) 12.221 5.257 ( -24.731 -21.284 5.135) 33.030 5.396 ( -0.733 -7.526 -0.246) 7.566 5.477 ( -10.991 -12.132 1.089) 16.406 5.702 ( -11.563 -1.763 5.014) 12.726 6.064 ( -2.374 -5.966 2.693) 6.963 6.568 ( 0.199 5.658 2.003) 6.005 7.032 ( -11.917 0.583 3.968) 12.574 7.857 ( 3.861 0.372 -3.089) 4.958 8.575 ( 15.025 2.283 -15.580) 21.765 9.052 ( -0.076 -6.699 11.153) 13.010 9.542 ( 5.165 -2.622 -1.662) 6.026 9.747 ( -8.739 -12.768 -0.127) 15.473 10.067 ( -7.699 17.540 -7.745) 20.661 11.013 ( -0.907 14.708 1.819) 14.848 11.461 ( -15.042 1.426 14.887) 21.211 12.018 ( -0.523 0.356 -1.503) 1.631 12.502 ( -0.269 -0.416 -1.456) 1.538 13.207 ( 1.387 -5.600 -1.149) 5.882 13.734 ( 15.717 10.044 -15.562) 24.292 15.326 ( 9.844 -9.780 -11.963) 18.322 17.115 ( 5.394 -5.055 25.691) 26.734 19.138 ( 1.884 0.213 2.223) 2.921 19.229 ( 29.440 17.257 -3.811) 34.337 19.776 ( 2.596 9.551 2.898) 10.313 20.490 ( 1.664 -1.786 -9.192) 9.511 22.024 ( -45.069 -28.649 14.935) 55.453 23.719 ( 1.986 1.324 -1.478) 2.807 24.285 ( -4.439 -4.268 5.008) 7.938 ======================= Grid point 124 (50/361) ======================= q-point: (-0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.807 ( -2.387 21.104 19.612) 28.908 0.845 ( 16.756 17.303 25.281) 34.918 1.585 ( -9.545 32.648 45.957) 57.175 3.456 ( 0.651 -5.234 -1.557) 5.499 3.706 ( -2.599 -0.136 5.334) 5.935 3.901 ( -2.957 -6.493 5.766) 9.174 4.691 ( -0.745 -8.419 1.788) 8.639 4.934 ( -33.873 -9.135 5.902) 35.576 5.245 ( -3.607 -10.366 12.904) 16.941 5.416 ( -13.418 -12.649 -0.653) 18.452 5.566 ( -9.530 -16.506 4.549) 19.594 5.694 ( 4.010 -3.798 11.550) 12.803 6.152 ( 1.007 -5.998 6.118) 8.627 6.536 ( -1.452 3.079 1.091) 3.574 6.988 ( -1.485 -0.066 6.084) 6.263 7.756 ( -3.945 6.918 -12.708) 14.998 8.320 ( 0.392 23.256 -22.096) 32.081 9.134 ( -3.783 -7.317 6.012) 10.197 9.583 ( -1.493 2.580 -4.833) 5.678 9.734 ( -6.806 -0.290 -2.622) 7.299 9.959 ( 22.198 -1.142 5.018) 22.787 10.901 ( 1.881 17.015 1.613) 17.194 11.529 ( -12.854 -9.745 21.112) 26.569 11.991 ( 0.878 0.158 -2.980) 3.111 12.499 ( 1.936 3.078 -3.427) 4.997 13.163 ( -1.246 9.175 -15.129) 17.738 13.335 ( -1.588 16.749 -13.100) 21.323 15.300 ( 0.730 -6.097 -14.259) 15.525 18.014 ( 11.048 -39.679 31.802) 52.037 19.114 ( -6.062 -3.958 -3.251) 7.936 19.508 ( 19.745 8.528 -4.905) 22.060 19.727 ( 5.140 8.290 0.558) 9.770 20.483 ( 4.602 -4.797 -2.301) 7.034 21.954 ( -34.150 -33.462 28.212) 55.515 23.727 ( 2.013 0.718 -0.553) 2.208 23.894 ( -24.727 23.391 -19.509) 39.232 ======================= Grid point 127 (51/361) ======================= q-point: ( 0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -0.752 -0.000 23.234) 23.246 2.484 ( 18.238 0.000 21.930) 28.523 3.390 ( -8.468 -0.000 -7.530) 11.331 3.631 ( -3.370 -0.000 -2.974) 4.494 3.842 ( 0.499 0.000 -12.357) 12.367 4.214 ( 3.596 0.000 3.742) 5.190 4.484 ( 1.712 0.000 -6.392) 6.617 4.605 ( 13.517 0.000 -12.341) 18.303 4.868 ( -2.115 -0.000 9.227) 9.466 5.190 ( -8.563 -0.000 -0.064) 8.563 5.937 ( -11.888 -0.000 30.121) 32.382 6.068 ( -2.423 -0.000 -4.390) 5.014 6.089 ( -5.511 -0.000 1.655) 5.754 6.697 ( -2.764 -0.000 2.915) 4.017 7.057 ( 4.882 0.000 -5.876) 7.640 7.449 ( 1.781 0.000 15.813) 15.913 7.822 ( -16.142 -0.000 4.099) 16.655 9.229 ( -5.089 -0.000 -0.738) 5.142 9.361 ( -1.562 -0.000 0.475) 1.633 10.048 ( 21.777 0.000 7.832) 23.142 10.135 ( -8.123 -0.000 -9.678) 12.635 11.508 ( 20.421 0.000 1.742) 20.495 11.904 ( 7.491 0.000 -11.844) 14.014 12.042 ( -9.932 -0.000 17.400) 20.035 12.148 ( 4.425 0.000 -0.638) 4.471 12.828 ( -8.391 -0.000 -2.657) 8.801 13.544 ( 6.143 0.000 0.331) 6.151 14.049 ( -9.604 -0.000 -7.673) 12.292 18.324 ( -8.567 -0.000 -7.592) 11.447 18.329 ( -9.758 -0.000 -0.766) 9.788 18.942 ( 16.379 0.000 -5.191) 17.182 19.171 ( -11.522 -0.000 -0.867) 11.554 21.563 ( 3.208 0.000 15.435) 15.764 22.213 ( 6.221 0.000 -20.761) 21.673 23.278 ( 5.455 0.000 2.589) 6.038 23.921 ( 1.183 0.000 1.307) 1.763 ======================= Grid point 128 (52/361) ======================= q-point: ( 0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( -0.737 10.343 9.463) 14.038 3.001 ( 8.417 -8.945 12.141) 17.270 3.129 ( -9.334 1.827 -2.709) 9.890 3.484 ( -7.406 1.486 -4.835) 8.969 3.635 ( -4.669 2.803 -13.179) 14.259 4.225 ( -7.078 -4.701 4.865) 9.791 4.488 ( 6.208 -1.314 -5.367) 8.311 4.653 ( 9.518 -1.022 -12.523) 15.763 4.950 ( -0.017 0.614 2.067) 2.156 5.045 ( -9.915 -3.233 -0.575) 10.445 5.820 ( -17.693 2.809 0.136) 17.915 6.023 ( -2.904 -0.276 -2.609) 3.913 6.194 ( -8.160 -2.002 22.800) 24.299 6.755 ( 2.119 0.697 7.080) 7.423 6.989 ( -1.323 11.056 -0.355) 11.141 7.665 ( -0.248 -0.515 2.273) 2.344 7.749 ( -5.513 -13.593 12.248) 19.110 9.150 ( -4.866 4.021 1.860) 6.581 9.324 ( -3.322 -0.793 -0.390) 3.437 9.898 ( -5.860 1.185 -11.121) 12.626 10.481 ( 20.772 -3.728 8.858) 22.888 11.629 ( 6.951 26.049 -0.052) 26.960 11.929 ( 10.214 -1.962 4.065) 11.167 12.184 ( 2.110 0.201 -1.327) 2.501 12.247 ( -1.816 -19.147 8.860) 21.175 12.698 ( -4.332 0.910 -0.645) 4.473 13.434 ( -5.351 0.421 -15.907) 16.788 14.047 ( 4.671 -2.043 8.642) 10.034 18.059 ( -5.667 3.434 -12.556) 14.197 18.292 ( -4.797 -7.137 1.805) 8.787 19.027 ( 3.616 6.530 -0.733) 7.500 19.139 ( 9.177 -4.312 -2.164) 10.368 21.669 ( -1.882 14.256 7.514) 16.224 22.086 ( 0.243 -13.576 -14.156) 19.616 23.407 ( 6.226 -1.818 3.194) 7.230 23.944 ( 0.826 1.910 1.731) 2.707 ======================= Grid point 129 (53/361) ======================= q-point: (-0.60 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( -4.578 17.123 -3.675) 18.102 2.760 ( -17.448 4.779 -4.837) 18.726 3.299 ( -6.624 -0.886 -3.987) 7.782 3.418 ( -6.202 -6.796 -8.787) 12.722 3.450 ( 7.793 -4.082 9.896) 13.241 4.228 ( -11.747 1.387 8.426) 14.523 4.421 ( -1.008 2.906 -16.957) 17.234 4.560 ( -5.143 -3.323 -2.407) 6.579 4.905 ( 0.196 -7.847 -3.757) 8.702 5.054 ( -2.150 -5.105 2.791) 6.203 5.563 ( -13.994 3.490 0.276) 14.425 5.951 ( -0.136 0.386 -5.358) 5.374 6.286 ( -17.475 -2.079 17.415) 24.759 6.849 ( -4.789 9.201 1.659) 10.504 6.897 ( 3.028 0.313 9.536) 10.011 7.652 ( -2.375 -1.457 2.341) 3.639 8.014 ( 3.562 -14.691 5.614) 16.126 9.061 ( -5.362 7.251 3.740) 9.763 9.302 ( -3.060 -4.851 0.389) 5.748 9.686 ( -3.214 0.876 -11.034) 11.526 10.873 ( 16.645 -2.430 6.657) 18.091 11.435 ( 3.779 32.222 1.556) 32.480 12.052 ( -4.526 3.842 5.334) 7.981 12.172 ( -1.071 0.233 -0.880) 1.406 12.500 ( 0.897 -19.076 4.902) 19.716 12.781 ( 12.531 -1.619 6.436) 14.180 13.123 ( -8.553 1.076 -15.895) 18.082 14.301 ( 10.410 -6.145 7.221) 14.081 17.775 ( -5.800 -1.057 -19.000) 19.894 18.400 ( 2.529 -4.491 10.230) 11.455 19.060 ( 9.088 6.581 1.377) 11.304 19.304 ( 12.171 -3.246 -1.642) 12.703 21.465 ( -3.747 15.850 -8.506) 18.375 22.090 ( -9.910 -16.778 -0.249) 19.488 23.552 ( 5.511 -2.084 3.725) 6.970 23.960 ( 1.715 3.769 2.508) 4.841 ======================= Grid point 130 (54/361) ======================= q-point: (-0.50 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( -7.709 21.950 -6.377) 24.122 2.387 ( -18.427 11.283 -4.554) 22.082 3.224 ( -4.853 -9.657 -0.460) 10.818 3.315 ( -6.986 -9.799 -4.502) 12.849 3.631 ( 3.071 4.488 0.928) 5.517 3.846 ( -16.515 20.282 -8.471) 27.493 4.232 ( -11.708 -7.796 -2.901) 14.362 4.610 ( -2.189 -8.714 7.072) 11.434 4.995 ( 1.084 -11.704 -0.511) 11.766 5.119 ( -2.922 -7.844 4.516) 9.511 5.360 ( -11.640 -0.598 -2.740) 11.973 5.892 ( 2.778 2.488 -4.731) 6.024 6.172 ( -22.925 -1.678 9.109) 24.726 6.739 ( -4.030 6.472 2.785) 8.116 7.054 ( 0.810 -1.158 9.238) 9.346 7.693 ( 0.286 -2.576 3.548) 4.394 8.217 ( 3.735 -14.060 -1.684) 14.645 8.972 ( -4.454 8.735 5.367) 11.178 9.330 ( -3.094 -8.748 0.766) 9.311 9.545 ( 0.125 -0.658 -7.563) 7.592 11.129 ( 10.522 4.185 1.568) 11.431 11.211 ( 3.371 30.640 2.881) 30.960 11.921 ( -11.852 7.762 4.427) 14.844 12.130 ( -3.100 0.590 -0.569) 3.206 12.729 ( 2.680 -15.336 1.009) 15.601 12.818 ( -8.347 0.761 -10.150) 13.163 13.147 ( 18.248 -1.878 11.103) 21.442 14.600 ( 12.061 -10.717 2.901) 16.393 17.463 ( -5.363 -1.493 -20.608) 21.346 18.672 ( 8.071 -2.572 15.248) 17.443 19.168 ( 15.035 8.497 -1.667) 17.351 19.510 ( 12.985 -2.716 2.658) 13.529 21.124 ( -6.511 11.425 -14.451) 19.539 22.050 ( -19.515 -15.350 3.071) 25.018 23.678 ( 3.414 -1.528 3.314) 4.997 24.001 ( 3.636 4.038 4.727) 7.202 ======================= Grid point 131 (55/361) ======================= q-point: (-0.40 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( -7.910 24.956 -1.587) 26.228 1.910 ( -20.505 17.658 -7.242) 28.013 3.115 ( -12.858 28.382 -6.696) 31.870 3.270 ( -12.914 -4.413 1.070) 13.689 3.379 ( 1.086 -13.018 3.264) 13.465 3.725 ( -1.076 -0.698 1.401) 1.899 4.172 ( -6.905 -8.937 4.426) 12.130 4.748 ( -2.694 -8.084 6.797) 10.900 5.064 ( -10.289 -8.444 2.506) 13.544 5.203 ( -0.404 -7.546 -4.422) 8.755 5.216 ( -10.097 -13.768 3.899) 17.513 5.842 ( -7.182 2.626 0.239) 7.651 5.985 ( -8.796 -1.879 1.965) 9.207 6.683 ( -1.594 4.138 1.767) 4.774 7.128 ( -5.101 0.474 6.282) 8.106 7.776 ( 3.425 -3.604 0.234) 4.977 8.352 ( 3.010 -12.755 -2.477) 13.338 8.932 ( -1.317 6.468 6.691) 9.398 9.373 ( -4.899 -11.727 -0.444) 12.717 9.519 ( 2.194 -3.105 -2.740) 4.686 10.916 ( 1.553 33.879 -2.263) 33.990 11.258 ( 4.855 6.697 2.828) 8.741 11.735 ( -11.946 8.839 5.468) 15.834 12.071 ( -3.002 0.538 -0.810) 3.156 12.584 ( -4.120 0.552 -7.970) 8.988 12.934 ( 2.103 -12.592 2.150) 12.946 13.540 ( 15.614 -1.588 9.984) 18.601 14.885 ( 11.610 -14.370 -2.669) 18.666 17.173 ( -3.794 0.784 -14.946) 15.440 18.990 ( 8.603 0.122 13.026) 15.611 19.280 ( 18.739 9.053 -4.973) 21.398 19.772 ( 14.573 2.147 6.775) 16.213 20.748 ( -8.133 6.400 -15.882) 18.956 21.891 ( -28.239 -14.978 4.136) 32.232 23.740 ( 1.239 0.515 0.947) 1.643 24.115 ( 4.125 0.656 7.589) 8.662 ======================= Grid point 132 (56/361) ======================= q-point: (-0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( -11.485 24.802 1.069) 27.353 1.408 ( -7.456 26.920 4.045) 28.225 2.574 ( -12.418 42.216 6.952) 44.550 3.250 ( -5.565 -11.789 0.554) 13.048 3.563 ( -0.930 -13.962 4.910) 14.830 3.731 ( -1.050 1.214 2.295) 2.800 4.315 ( -3.905 -11.528 13.712) 18.334 4.838 ( -4.599 -6.656 6.454) 10.349 4.928 ( -20.624 -14.543 -1.507) 25.280 5.232 ( -2.501 -10.453 -2.529) 11.042 5.293 ( -4.831 -9.808 5.522) 12.248 5.702 ( -8.138 0.237 3.575) 8.891 6.014 ( 3.410 -0.714 1.705) 3.878 6.650 ( -0.244 3.120 -0.290) 3.143 7.065 ( -8.151 3.299 3.627) 9.512 7.832 ( 3.641 -3.579 -5.608) 7.584 8.491 ( 4.890 -9.166 -0.175) 10.390 8.961 ( -1.388 -2.238 1.078) 2.845 9.397 ( -6.225 -13.650 0.523) 15.012 9.571 ( 1.996 -2.458 1.205) 3.388 10.584 ( 0.941 34.320 -3.508) 34.512 11.251 ( 0.602 11.316 4.156) 12.070 11.580 ( -9.586 9.025 7.917) 15.363 12.023 ( -1.349 0.118 -1.432) 1.971 12.498 ( 0.285 0.095 -1.589) 1.617 13.067 ( 1.032 -10.221 -1.160) 10.338 13.786 ( 7.927 -1.446 -3.561) 8.810 15.090 ( 8.998 -15.283 -10.630) 20.676 17.077 ( 1.996 -0.210 7.850) 8.103 19.142 ( 1.231 0.293 -0.261) 1.292 19.456 ( 24.317 9.261 -2.426) 26.134 19.973 ( 7.229 11.677 6.102) 15.028 20.458 ( -1.666 -1.620 -12.528) 12.742 21.665 ( -31.748 -14.127 9.301) 35.972 23.745 ( 0.596 1.462 -0.138) 1.585 24.231 ( -0.998 -2.270 3.138) 4.000 ======================= Grid point 133 (57/361) ======================= q-point: (-0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.212 ( 10.067 22.590 16.002) 29.457 1.252 ( 2.625 26.745 12.058) 29.454 2.258 ( -5.739 39.346 26.128) 47.579 3.319 ( 0.648 -9.748 -0.252) 9.773 3.684 ( -4.739 -5.697 4.180) 8.508 3.768 ( -0.624 -4.504 6.083) 7.595 4.515 ( -6.920 -10.300 14.044) 18.741 4.705 ( -25.133 -13.601 3.071) 28.742 5.000 ( 1.879 -12.605 7.265) 14.669 5.256 ( 0.056 -6.469 -3.288) 7.257 5.395 ( 0.684 -7.437 2.268) 7.805 5.718 ( -0.456 0.803 8.286) 8.338 6.081 ( -1.038 -2.174 3.580) 4.315 6.601 ( -1.057 3.317 -1.875) 3.954 6.999 ( -2.655 1.747 4.013) 5.120 7.780 ( -1.477 -1.800 -10.080) 10.346 8.562 ( 5.446 5.685 -10.243) 12.919 8.943 ( -6.795 -11.713 3.044) 13.880 9.490 ( -0.822 -14.753 -1.361) 14.839 9.637 ( 1.623 -0.204 3.603) 3.957 10.288 ( 4.156 29.066 -1.390) 29.394 11.195 ( 0.483 14.415 4.708) 15.172 11.519 ( -7.618 5.664 13.185) 16.247 11.994 ( 0.846 0.117 -2.691) 2.824 12.529 ( 3.585 1.274 1.524) 4.098 13.112 ( -0.706 -7.364 -4.999) 8.929 13.622 ( -4.004 8.890 -19.341) 21.660 15.133 ( 3.012 -12.111 -16.073) 20.349 17.500 ( 8.735 -18.009 30.230) 36.256 19.052 ( -6.250 -2.792 -9.031) 11.332 19.646 ( 11.115 6.375 -1.849) 12.946 19.878 ( -6.736 8.206 -1.570) 10.732 20.444 ( 8.789 0.930 -2.594) 9.211 21.603 ( -11.725 -11.643 16.877) 23.620 23.741 ( 0.806 0.824 -0.128) 1.159 24.109 ( -11.079 5.121 -9.223) 15.298 ======================= Grid point 134 (58/361) ======================= q-point: (-0.10 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( 7.417 21.358 14.920) 27.089 1.514 ( 13.522 15.395 23.735) 31.356 2.440 ( 15.556 24.556 39.608) 49.130 3.411 ( 4.336 -7.085 -3.610) 9.057 3.681 ( -10.105 -2.770 8.268) 13.347 3.880 ( -1.373 -5.693 5.412) 7.974 4.606 ( -12.227 -10.982 5.297) 17.267 4.659 ( -6.300 -6.046 11.490) 14.431 5.203 ( 0.135 -10.605 0.881) 10.642 5.273 ( 3.695 -2.172 -2.992) 5.227 5.439 ( -0.294 -2.918 -4.540) 5.405 5.891 ( 3.316 -1.777 15.054) 15.517 6.117 ( -4.843 -7.399 4.486) 9.916 6.519 ( -3.871 2.244 -0.946) 4.573 7.053 ( 2.936 -2.475 0.990) 3.966 7.583 ( -3.916 3.442 -12.569) 13.607 8.354 ( -0.882 17.729 -3.327) 18.060 9.090 ( -1.925 -13.324 6.842) 15.102 9.524 ( 0.732 -1.999 -4.037) 4.563 9.646 ( -1.823 2.100 -3.146) 4.199 10.235 ( 11.932 4.534 -0.697) 12.784 11.119 ( 3.933 16.393 0.517) 16.866 11.574 ( -8.609 -2.215 15.866) 18.187 11.978 ( 3.436 0.517 -4.086) 5.364 12.543 ( 3.952 8.725 -4.477) 10.572 13.073 ( -0.350 -1.635 -3.063) 3.490 13.276 ( -5.848 8.092 -5.710) 11.501 15.007 ( -3.957 -8.250 -18.378) 20.530 18.117 ( 4.535 -22.765 18.063) 29.412 18.836 ( -10.482 -6.426 -11.861) 17.084 19.496 ( -18.789 12.889 3.375) 23.033 19.698 ( -12.962 -1.254 0.477) 13.031 20.632 ( 17.318 -0.607 2.693) 17.536 21.937 ( 14.828 -14.054 7.936) 21.918 23.660 ( -9.819 16.097 -11.081) 21.870 23.775 ( 0.710 2.396 -0.131) 2.503 ======================= Grid point 138 (59/361) ======================= q-point: ( 0.30 -0.70 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( -4.631 -0.000 -0.584) 4.667 2.789 ( -15.789 -0.000 -5.836) 16.833 3.289 ( -9.826 -0.000 -6.572) 11.821 3.290 ( 0.674 0.000 -4.265) 4.318 3.464 ( 0.556 0.000 5.554) 5.582 4.186 ( -11.317 -0.000 11.951) 16.459 4.511 ( 1.967 0.000 -2.875) 3.484 4.549 ( 5.654 0.000 -18.648) 19.486 4.804 ( -11.436 -0.000 -5.642) 12.752 5.000 ( -1.238 -0.000 2.779) 3.042 5.596 ( -15.481 -0.000 -0.182) 15.482 5.953 ( 0.882 0.000 -5.249) 5.322 6.267 ( -17.938 -0.000 19.229) 26.297 6.896 ( 4.088 0.000 8.086) 9.060 6.953 ( -8.035 -0.000 -0.579) 8.056 7.639 ( -0.351 -0.000 0.202) 0.405 7.860 ( 2.474 0.000 11.091) 11.364 9.136 ( -4.905 -0.000 3.432) 5.986 9.242 ( -5.728 -0.000 -0.170) 5.731 9.702 ( -2.397 -0.000 -11.584) 11.829 10.850 ( 18.023 0.000 7.768) 19.626 11.933 ( 1.628 0.000 4.920) 5.182 11.989 ( 8.655 0.000 -1.170) 8.734 12.180 ( 0.760 0.000 -3.099) 3.191 12.216 ( -9.246 -0.000 10.656) 14.108 12.766 ( 11.438 0.000 6.319) 13.068 13.132 ( -8.434 -0.000 -16.055) 18.136 14.242 ( 9.557 0.000 6.476) 11.544 17.766 ( -6.671 -0.000 -19.217) 20.342 18.359 ( 3.597 0.000 11.998) 12.525 19.142 ( 6.081 0.000 6.243) 8.715 19.253 ( 16.423 0.000 -7.951) 18.246 21.724 ( -3.041 -0.000 -23.250) 23.448 21.824 ( -10.932 -0.000 13.568) 17.424 23.532 ( 5.673 0.000 4.301) 7.119 23.994 ( 1.716 0.000 2.218) 2.805 ======================= Grid point 140 (60/361) ======================= q-point: (-0.60 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( -7.356 13.983 -4.457) 16.416 2.527 ( -13.913 3.035 -2.623) 14.479 3.083 ( -9.937 -4.995 -5.492) 12.403 3.123 ( -8.836 -8.511 -7.192) 14.221 3.650 ( 4.517 0.309 7.116) 8.434 4.113 ( -11.427 -4.161 -2.092) 12.340 4.276 ( -9.761 22.102 -6.733) 25.082 4.499 ( 0.263 -3.540 2.533) 4.360 4.732 ( -0.582 -16.255 -5.738) 17.248 5.021 ( -5.614 -2.791 7.251) 9.586 5.364 ( -14.665 0.389 -3.899) 15.179 5.926 ( 4.083 1.081 -4.382) 6.087 6.154 ( -23.626 -0.493 10.509) 25.863 6.825 ( -6.665 2.752 0.374) 7.220 7.055 ( 3.766 0.574 8.299) 9.131 7.643 ( 0.163 -2.156 -0.695) 2.271 8.033 ( 2.609 -5.515 5.960) 8.529 9.084 ( -5.547 4.146 3.867) 7.932 9.196 ( -4.870 -5.368 0.435) 7.261 9.559 ( 0.939 1.021 -8.820) 8.928 11.148 ( 12.805 0.306 5.171) 13.813 11.797 ( 2.977 29.619 2.078) 29.840 12.033 ( -9.570 5.134 3.739) 11.486 12.129 ( -3.142 -0.367 -0.952) 3.303 12.367 ( 1.248 -24.223 3.051) 24.446 12.833 ( -7.888 0.458 -13.015) 15.226 13.115 ( 18.239 -1.130 11.322) 21.497 14.455 ( 10.909 -4.500 1.376) 11.881 17.447 ( -5.747 -0.384 -18.270) 19.156 18.642 ( 9.524 -0.802 17.051) 19.547 19.314 ( 15.857 7.576 -2.062) 17.694 19.435 ( 14.808 -5.552 1.693) 15.905 21.318 ( -7.733 8.349 -20.855) 23.758 21.813 ( -18.210 -9.413 7.720) 21.904 23.658 ( 3.579 -0.609 4.733) 5.965 24.050 ( 3.146 1.371 2.571) 4.288 ======================= Grid point 141 (61/361) ======================= q-point: (-0.50 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( -7.530 20.212 -1.316) 21.609 2.212 ( -13.499 15.081 -4.013) 20.634 2.988 ( -9.935 -13.610 -2.528) 17.039 3.107 ( -2.924 -14.325 2.531) 14.838 3.695 ( -7.140 4.989 -3.409) 9.353 3.796 ( -0.204 22.390 -6.605) 23.345 4.045 ( -7.858 -2.415 5.540) 9.913 4.605 ( -1.252 -6.533 5.443) 8.594 4.841 ( -1.212 -17.577 -0.088) 17.619 5.047 ( -21.549 -4.019 10.016) 24.101 5.104 ( -2.992 -3.632 -7.386) 8.757 5.883 ( -14.867 1.886 1.750) 15.088 5.970 ( -0.799 -0.422 -0.361) 0.972 6.735 ( -3.161 1.809 -0.676) 3.704 7.163 ( -0.144 3.023 6.672) 7.326 7.677 ( 1.557 -6.442 -2.120) 6.959 8.173 ( 1.477 -6.524 4.236) 7.918 9.022 ( -4.434 3.610 3.432) 6.669 9.186 ( -4.454 -7.764 -1.578) 9.089 9.508 ( 2.799 0.446 -2.678) 3.900 11.321 ( 7.552 4.187 2.453) 8.977 11.565 ( 1.840 32.864 0.999) 32.931 11.874 ( -11.048 6.664 4.575) 13.689 12.071 ( -3.659 -0.415 -0.994) 3.814 12.577 ( -0.685 -5.989 -7.501) 9.623 12.656 ( -1.729 -14.160 0.815) 14.289 13.498 ( 14.160 -2.221 9.643) 17.275 14.657 ( 10.456 -9.853 -3.782) 14.856 17.187 ( -3.421 0.640 -12.377) 12.857 18.993 ( 9.082 0.150 14.748) 17.321 19.418 ( 19.280 5.985 -8.725) 21.993 19.786 ( 18.654 -0.375 10.646) 21.481 20.868 ( -10.805 6.263 -20.196) 23.745 21.670 ( -24.801 -9.467 5.244) 27.059 23.745 ( 0.815 0.072 3.604) 3.696 24.125 ( 3.753 0.420 3.008) 4.828 ======================= Grid point 142 (62/361) ======================= q-point: (-0.40 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.801 ( -8.104 22.777 0.949) 24.194 1.876 ( -4.507 24.693 4.779) 25.552 2.985 ( -5.161 -12.597 0.045) 13.614 3.247 ( -7.165 4.365 -4.485) 9.513 3.321 ( -2.343 8.993 8.678) 12.715 3.761 ( 1.449 2.777 1.361) 3.415 4.132 ( -1.818 -8.004 10.939) 13.675 4.686 ( -2.227 -9.169 0.382) 9.444 4.750 ( -20.168 -5.852 -4.369) 21.450 5.013 ( -0.211 -14.104 3.409) 14.512 5.138 ( -7.733 -6.738 8.055) 13.042 5.702 ( -8.547 -0.119 2.327) 8.859 6.018 ( 4.178 0.669 1.070) 4.365 6.679 ( -0.511 0.397 -3.002) 3.071 7.150 ( -4.620 5.867 3.955) 8.450 7.731 ( 3.184 -7.168 -5.938) 9.838 8.319 ( 0.190 -8.719 7.328) 11.391 8.964 ( -2.467 1.776 -2.521) 3.949 9.179 ( -3.996 -9.611 -1.420) 10.505 9.555 ( 2.473 -0.240 3.639) 4.406 11.218 ( 2.783 33.488 -4.079) 33.851 11.421 ( 0.239 9.062 5.473) 10.589 11.736 ( -8.199 7.836 6.095) 12.875 12.020 ( -1.920 -0.490 -1.418) 2.437 12.506 ( 0.856 0.589 -1.517) 1.838 12.829 ( 0.522 -16.620 -0.864) 16.650 13.737 ( 5.143 -3.153 1.114) 6.134 14.819 ( 8.374 -13.691 -9.353) 18.575 17.085 ( 1.616 0.807 1.408) 2.291 19.148 ( 1.004 0.291 -1.910) 2.177 19.586 ( 21.098 5.429 -3.072) 22.000 20.165 ( 15.724 8.720 11.908) 21.566 20.442 ( -8.664 0.233 -17.562) 19.585 21.464 ( -24.337 -8.830 7.357) 26.915 23.768 ( -0.857 1.074 1.557) 2.077 24.198 ( 0.886 -1.460 1.157) 2.063 ======================= Grid point 143 (63/361) ======================= q-point: (-0.30 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( 5.360 22.566 10.063) 25.283 1.737 ( 2.863 26.642 10.396) 28.741 2.911 ( -1.846 29.376 9.216) 30.843 3.118 ( -0.067 -11.571 1.419) 11.658 3.496 ( -1.689 -10.738 8.359) 13.712 3.767 ( -1.288 1.553 2.716) 3.383 4.335 ( -9.759 -9.592 18.817) 23.266 4.500 ( -8.560 -8.758 -9.536) 15.521 4.782 ( -0.271 -11.568 3.005) 11.955 5.144 ( 2.112 -6.152 1.769) 6.741 5.240 ( -1.869 -9.919 6.861) 12.205 5.711 ( -0.580 -1.034 6.886) 6.988 6.071 ( 0.240 0.645 2.788) 2.871 6.634 ( 0.649 0.162 -4.575) 4.624 7.064 ( -4.183 5.570 2.514) 7.405 7.719 ( 0.330 -4.529 -9.578) 10.600 8.518 ( 1.196 -10.297 8.901) 13.664 8.837 ( -3.666 1.317 -7.726) 8.652 9.241 ( 1.153 -11.886 -1.112) 11.994 9.641 ( -0.244 0.248 6.650) 6.659 10.879 ( 1.870 35.164 -4.301) 35.475 11.398 ( -2.524 8.310 5.717) 10.397 11.658 ( -4.964 8.486 8.163) 12.778 11.993 ( 0.833 -0.245 -2.298) 2.457 12.556 ( 4.737 1.757 3.974) 6.427 12.931 ( -0.571 -12.861 -3.781) 13.418 13.689 ( -5.460 0.227 -10.345) 11.699 14.889 ( 4.345 -14.090 -14.926) 20.981 17.297 ( 7.540 -6.290 18.426) 20.879 19.014 ( -6.083 -1.561 -13.199) 14.617 19.739 ( 7.152 4.252 -0.617) 8.343 19.991 ( -11.545 3.717 -12.143) 17.162 20.527 ( 14.121 8.160 7.054) 17.770 21.434 ( -4.909 -8.288 12.401) 15.703 23.754 ( -1.164 0.642 0.271) 1.357 24.156 ( -5.152 1.040 -4.800) 7.118 ======================= Grid point 144 (64/361) ======================= q-point: (-0.20 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.688 ( 7.585 25.505 9.474) 28.245 1.789 ( 14.565 15.219 16.411) 26.704 2.918 ( 9.547 25.513 25.505) 37.317 3.253 ( 3.923 -10.194 -2.031) 11.110 3.607 ( -7.784 -4.787 8.223) 12.293 3.791 ( -0.930 -3.588 3.382) 5.018 4.401 ( -8.915 -11.028 6.125) 15.446 4.552 ( 1.217 -5.661 8.640) 10.401 4.964 ( 1.668 -14.393 3.733) 14.963 5.234 ( 3.368 -2.236 0.118) 4.044 5.369 ( 1.755 -5.514 1.224) 5.914 5.845 ( 2.634 -3.282 9.977) 10.828 6.071 ( -4.995 1.103 4.168) 6.598 6.571 ( -0.901 2.463 -3.804) 4.620 7.025 ( -0.893 0.057 0.663) 1.113 7.589 ( -2.686 -1.278 -11.748) 12.119 8.615 ( 2.692 11.226 -3.673) 12.114 8.805 ( -4.395 -17.511 6.504) 19.190 9.371 ( 4.199 -11.963 -2.968) 13.021 9.682 ( -2.147 2.516 4.791) 5.821 10.572 ( 3.217 28.436 -3.410) 28.820 11.339 ( -3.734 7.877 3.698) 9.469 11.633 ( -4.287 7.549 9.454) 12.835 11.987 ( 3.690 0.371 -3.918) 5.395 12.660 ( 6.397 4.926 2.190) 8.365 12.971 ( -0.686 -8.482 -2.275) 8.809 13.405 ( -9.775 4.586 -9.755) 14.551 14.822 ( -1.218 -11.812 -18.709) 22.159 17.774 ( 7.576 -14.772 21.568) 27.217 18.738 ( -9.677 -4.475 -15.602) 18.897 19.638 ( -19.003 0.579 3.688) 19.366 19.714 ( -6.315 5.428 -7.269) 11.053 20.709 ( 15.507 8.831 3.578) 18.201 21.746 ( 14.987 -8.651 9.701) 19.838 23.733 ( -1.759 -0.523 -1.411) 2.315 23.929 ( -7.153 8.453 -8.061) 13.697 ======================= Grid point 145 (65/361) ======================= q-point: (-0.10 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( 9.076 18.692 11.281) 23.644 2.104 ( 11.978 13.271 23.274) 29.348 3.280 ( 18.930 10.348 19.146) 28.844 3.345 ( 4.424 -6.578 -3.464) 8.651 3.640 ( -5.978 -1.658 13.819) 15.148 3.856 ( 0.334 -7.214 -1.409) 7.358 4.482 ( 3.712 -6.375 -2.542) 7.803 4.698 ( -6.272 1.005 14.123) 15.486 5.087 ( -5.538 -8.050 2.067) 9.987 5.326 ( 3.181 -4.410 1.952) 5.777 5.412 ( 4.550 0.978 -0.102) 4.655 6.031 ( -6.601 -1.659 4.301) 8.052 6.107 ( 5.555 -7.564 13.735) 16.635 6.467 ( -5.024 4.486 -1.468) 6.893 6.994 ( -3.249 -3.501 -6.132) 7.773 7.453 ( 2.597 0.155 -8.179) 8.583 8.474 ( -4.088 14.633 2.115) 15.340 8.983 ( -2.478 -16.209 3.052) 16.678 9.447 ( -0.125 -5.052 -3.292) 6.031 9.691 ( 3.000 4.882 3.621) 6.778 10.404 ( 5.101 13.369 -2.991) 14.618 11.248 ( -2.685 5.060 -0.976) 5.811 11.620 ( -4.273 4.985 7.699) 10.118 12.005 ( 6.771 0.437 -4.042) 7.898 12.643 ( 3.242 10.973 -3.333) 11.917 13.000 ( -4.552 -5.218 -2.261) 7.284 13.242 ( -0.811 1.815 5.377) 5.733 14.618 ( -6.485 -8.349 -20.186) 22.787 18.182 ( -0.731 -12.707 11.654) 17.257 18.524 ( -0.219 -7.803 -11.809) 14.156 19.388 ( -24.400 12.017 10.085) 29.008 19.467 ( -9.613 -2.228 -7.263) 12.253 20.915 ( 15.073 1.660 2.709) 15.404 22.133 ( 17.673 -7.062 1.173) 19.067 23.565 ( -4.739 10.712 -7.693) 14.014 23.798 ( 0.449 0.109 0.172) 0.493 ======================= Grid point 150 (66/361) ======================= q-point: ( 0.40 -0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( -10.451 -0.000 -0.789) 10.481 2.358 ( -5.866 -0.000 -0.815) 5.923 2.828 ( -11.147 -0.000 -4.284) 11.942 2.940 ( -5.104 -0.000 0.945) 5.191 3.709 ( -1.867 -0.000 -0.447) 1.920 3.929 ( -2.031 -0.000 -7.371) 7.646 4.226 ( -9.380 -0.000 -1.098) 9.444 4.555 ( 1.238 0.000 7.640) 7.740 4.563 ( -1.707 -0.000 -1.112) 2.037 5.014 ( -20.264 -0.000 15.495) 25.509 5.074 ( -6.572 -0.000 -11.510) 13.254 5.903 ( -21.430 -0.000 3.053) 21.647 5.964 ( 5.592 0.000 -1.918) 5.912 6.751 ( -4.180 -0.000 -1.465) 4.429 7.202 ( 3.516 0.000 5.599) 6.612 7.604 ( -0.815 -0.000 -1.758) 1.937 8.116 ( 1.239 0.000 6.106) 6.230 9.062 ( -5.314 -0.000 1.685) 5.574 9.108 ( -3.672 -0.000 -0.555) 3.714 9.514 ( 2.430 0.000 -3.037) 3.890 11.353 ( 7.922 0.000 4.070) 8.906 11.893 ( -8.280 -0.000 2.089) 8.539 12.061 ( -2.625 -0.000 -3.117) 4.075 12.156 ( -4.763 -0.000 4.988) 6.897 12.203 ( 5.403 0.000 0.566) 5.433 12.613 ( -4.660 -0.000 -7.948) 9.213 13.477 ( 13.819 0.000 9.606) 16.830 14.564 ( 10.071 0.000 -4.121) 10.882 17.193 ( -3.246 -0.000 -11.698) 12.140 18.995 ( 9.235 0.000 15.282) 17.856 19.476 ( 19.057 0.000 -11.771) 22.399 19.778 ( 20.195 0.000 13.736) 24.423 20.934 ( -11.502 -0.000 -23.430) 26.101 21.577 ( -23.601 -0.000 7.440) 24.746 23.745 ( 0.718 0.000 4.595) 4.651 24.129 ( 3.533 0.000 1.521) 3.847 ======================= Grid point 152 (67/361) ======================= q-point: (-0.50 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( -6.125 14.381 0.860) 15.654 2.257 ( -2.825 15.198 6.358) 16.715 2.741 ( -6.072 -11.286 1.663) 12.923 2.986 ( -3.394 -12.947 3.220) 13.767 3.631 ( -2.412 5.863 -1.329) 6.477 3.854 ( 4.333 4.202 -6.342) 8.756 4.097 ( -2.671 5.642 5.440) 8.280 4.572 ( -2.659 -2.552 3.865) 5.341 4.680 ( -18.663 -2.183 -9.250) 20.944 4.751 ( -0.016 -12.599 10.038) 16.109 5.058 ( -9.847 -2.209 10.419) 14.505 5.700 ( -8.812 -0.050 1.322) 8.910 6.028 ( 4.180 0.334 0.964) 4.303 6.678 ( -0.933 -0.229 -4.755) 4.851 7.255 ( -0.518 4.548 2.330) 5.136 7.608 ( 0.791 -5.134 -1.537) 5.417 8.205 ( -1.460 -3.448 6.466) 7.472 8.998 ( -3.528 1.307 -1.013) 3.896 9.063 ( -1.791 -3.292 -2.819) 4.690 9.552 ( 1.880 -0.064 3.903) 4.332 11.464 ( 2.892 2.520 3.455) 5.162 11.783 ( -3.789 10.517 0.388) 11.185 11.917 ( -2.959 20.275 0.317) 20.492 12.017 ( -2.677 2.827 0.317) 3.906 12.443 ( 1.848 -20.913 -0.913) 21.015 12.533 ( -0.514 -2.711 0.026) 2.759 13.693 ( 4.268 -1.387 2.716) 5.245 14.639 ( 8.136 -5.510 -8.761) 13.164 17.097 ( 1.668 0.404 -0.760) 1.877 19.151 ( 0.929 0.114 -2.804) 2.956 19.652 ( 20.094 1.920 -4.357) 20.650 20.260 ( 22.249 2.012 16.111) 27.543 20.469 ( -13.923 1.867 -20.995) 25.261 21.349 ( -21.952 -3.564 7.329) 23.416 23.781 ( -1.836 0.383 2.818) 3.385 24.180 ( 1.863 -0.521 -0.230) 1.948 ======================= Grid point 153 (68/361) ======================= q-point: (-0.40 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( 1.763 18.549 5.582) 19.451 2.191 ( 1.906 23.167 11.678) 26.014 2.864 ( 0.918 -13.195 4.508) 13.974 3.077 ( -3.945 -12.490 0.732) 13.119 3.560 ( 4.273 14.842 5.569) 16.418 3.806 ( -1.010 3.316 -0.101) 3.468 4.190 ( -6.260 -5.820 13.402) 15.896 4.392 ( -1.572 -3.819 -13.150) 13.783 4.622 ( -3.653 -4.295 6.429) 8.552 4.992 ( -0.821 -12.261 10.180) 15.957 5.093 ( -1.965 -4.312 6.800) 8.288 5.696 ( 0.514 -0.498 5.160) 5.209 6.087 ( 0.911 0.806 3.165) 3.391 6.619 ( 1.922 -1.254 -6.881) 7.254 7.181 ( -4.219 6.459 0.510) 7.732 7.639 ( 1.469 -3.804 -4.623) 6.164 8.311 ( -4.052 -10.312 7.802) 13.551 8.902 ( -1.130 4.241 -4.787) 6.495 9.075 ( 1.579 -6.643 -1.843) 7.073 9.644 ( -0.144 0.020 8.077) 8.078 11.457 ( 1.298 15.822 -1.034) 15.908 11.545 ( -3.433 19.713 -0.883) 20.029 11.795 ( -4.216 6.892 6.595) 10.429 11.987 ( 0.713 -0.280 -1.746) 1.906 12.576 ( 4.671 -2.660 2.822) 6.071 12.651 ( -0.030 -15.505 0.876) 15.530 13.671 ( -6.325 -1.440 -5.703) 8.637 14.667 ( 4.959 -9.567 -13.407) 17.201 17.232 ( 7.123 -1.750 11.677) 13.790 18.993 ( -5.750 -0.734 -15.923) 16.946 19.801 ( 6.886 2.599 -1.691) 7.552 20.020 ( -13.557 0.198 -18.020) 22.551 20.701 ( 17.739 9.776 15.289) 25.377 21.292 ( -5.022 -7.311 10.287) 13.582 23.763 ( -2.947 0.297 0.625) 3.027 24.164 ( -1.946 0.096 -3.395) 3.914 ======================= Grid point 154 (69/361) ======================= q-point: (-0.30 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( 10.715 13.717 11.034) 20.608 2.152 ( 5.403 24.630 7.888) 26.421 3.058 ( 4.685 -10.848 0.678) 11.836 3.170 ( 2.216 -2.070 8.798) 9.306 3.628 ( 4.766 8.821 10.349) 14.409 3.754 ( -5.295 0.165 1.599) 5.534 4.237 ( -4.803 -6.124 7.050) 10.501 4.465 ( 8.102 -4.152 2.996) 9.584 4.731 ( -1.781 -9.869 7.961) 12.804 5.168 ( -1.422 -7.501 5.789) 9.581 5.252 ( 6.487 -5.065 4.646) 9.451 5.802 ( 2.639 -1.285 6.205) 6.864 6.107 ( -2.993 2.027 4.431) 5.719 6.587 ( 3.480 -0.534 -6.117) 7.058 7.063 ( -4.942 3.605 -0.939) 6.188 7.576 ( -0.902 0.746 -8.210) 8.293 8.468 ( -5.276 -18.128 6.647) 20.016 8.794 ( 1.680 8.007 -3.639) 8.954 9.176 ( 4.908 -9.156 -1.383) 10.481 9.725 ( -2.265 2.011 9.027) 9.522 11.143 ( 1.562 33.149 -6.919) 33.899 11.428 ( -8.891 2.890 3.089) 9.846 11.783 ( -0.965 7.806 7.272) 10.712 11.990 ( 3.659 -0.109 -3.447) 5.028 12.683 ( 2.401 -7.204 -2.751) 8.076 12.820 ( 4.337 -3.698 8.675) 10.380 13.439 ( -12.615 -0.150 -8.821) 15.394 14.610 ( 0.632 -10.925 -17.804) 20.899 17.583 ( 9.060 -6.975 18.480) 21.731 18.674 ( -9.423 -2.603 -18.416) 20.850 19.621 ( -15.703 -1.133 -8.986) 18.128 19.799 ( -3.899 3.123 -2.009) 5.384 20.920 ( 11.510 13.765 7.086) 19.292 21.592 ( 13.998 -8.967 11.571) 20.254 23.718 ( -3.260 -0.873 -1.075) 3.542 24.035 ( -4.586 3.882 -6.530) 8.874 ======================= Grid point 155 (70/361) ======================= q-point: (-0.20 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( 6.435 21.941 4.487) 23.301 2.299 ( 14.395 8.710 16.723) 23.722 3.192 ( 5.282 -7.451 -3.180) 9.671 3.359 ( 4.521 -3.917 4.779) 7.657 3.711 ( -3.017 -7.998 -4.081) 9.472 3.767 ( 4.302 13.443 21.285) 25.540 4.386 ( 8.912 -4.014 1.573) 9.900 4.686 ( 1.633 -2.824 14.870) 15.223 4.907 ( -2.870 -10.329 8.877) 13.919 5.237 ( -2.151 -5.261 2.283) 6.125 5.415 ( 5.432 -0.767 3.352) 6.429 5.934 ( 3.099 -4.648 2.925) 6.306 6.098 ( -3.715 1.999 7.714) 8.792 6.556 ( 1.290 4.167 -3.061) 5.329 6.950 ( -5.488 -1.172 -5.070) 7.563 7.452 ( 1.352 1.193 -7.676) 7.885 8.578 ( -9.005 -13.375 0.018) 16.124 8.762 ( 4.216 2.809 2.662) 5.723 9.313 ( 3.988 -8.588 -1.219) 9.546 9.773 ( -0.841 4.569 8.462) 9.654 10.808 ( 2.403 28.489 -6.003) 29.213 11.277 ( -12.613 0.080 -0.809) 12.639 11.784 ( 0.325 10.553 6.524) 12.411 12.010 ( 6.741 -0.000 -4.744) 8.243 12.716 ( 1.333 -5.017 -4.122) 6.628 12.954 ( -3.141 2.360 1.406) 4.173 13.246 ( -3.350 -1.467 4.860) 6.082 14.447 ( -3.796 -10.052 -20.285) 22.955 17.986 ( 4.990 -8.900 15.231) 18.333 18.401 ( -3.856 -5.573 -13.356) 14.977 19.355 ( -14.415 -4.509 -3.693) 15.548 19.627 ( -12.895 9.021 1.695) 15.828 21.015 ( 12.075 9.147 -0.341) 15.152 22.016 ( 16.799 -6.428 8.285) 19.803 23.650 ( -3.838 -0.084 -3.734) 5.356 23.856 ( -2.298 5.448 -5.015) 7.753 ======================= Grid point 156 (71/361) ======================= q-point: (-0.10 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( 3.978 12.282 5.512) 14.037 2.652 ( 13.538 8.782 19.929) 25.643 3.258 ( 2.698 -5.634 -5.447) 8.288 3.437 ( -0.963 -4.993 0.239) 5.091 3.677 ( -2.367 -9.469 -8.150) 12.716 4.084 ( 13.026 7.700 21.816) 26.550 4.524 ( 12.836 0.592 -8.182) 15.233 4.796 ( -3.844 4.715 5.289) 8.061 5.028 ( -7.440 -2.554 12.728) 14.962 5.289 ( -1.978 -4.160 0.534) 4.637 5.559 ( -0.209 -3.381 15.556) 15.921 5.993 ( 0.262 -2.207 1.484) 2.672 6.220 ( -0.352 -8.137 7.126) 10.822 6.450 ( -4.320 8.977 0.056) 9.963 6.808 ( -3.814 -2.264 -7.749) 8.928 7.458 ( 8.455 -1.697 -3.601) 9.346 8.472 ( -12.631 2.023 1.764) 12.913 8.879 ( 2.143 -8.159 2.036) 8.678 9.368 ( -0.911 -2.976 -2.327) 3.886 9.860 ( 4.741 2.883 7.215) 9.102 10.578 ( 4.217 20.377 -2.965) 21.019 11.076 ( -12.573 -6.252 -5.740) 15.170 11.773 ( 2.912 10.782 4.958) 12.219 12.068 ( 7.805 -0.254 -3.197) 8.438 12.718 ( 1.303 3.052 -0.865) 3.429 12.792 ( -10.976 -3.918 -4.144) 12.370 13.426 ( 6.850 1.829 11.963) 13.906 14.209 ( -6.620 -7.756 -18.522) 21.143 18.104 ( -5.537 -4.228 -0.514) 6.986 18.466 ( 10.877 -10.285 -1.315) 15.027 19.201 ( -12.203 -5.670 1.159) 13.505 19.322 ( -16.533 15.570 1.030) 22.733 21.110 ( 10.374 0.553 -2.175) 10.614 22.334 ( 12.737 -1.107 2.963) 13.123 23.526 ( -0.817 5.711 -4.851) 7.537 23.788 ( -0.358 -1.204 -1.038) 1.629 ======================= Grid point 162 (72/361) ======================= q-point: (-0.50 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( -0.111 -0.000 2.512) 2.515 2.469 ( 0.824 0.000 15.374) 15.396 2.707 ( 1.776 0.000 6.625) 6.859 2.877 ( -2.863 -0.000 -0.190) 2.870 3.688 ( 2.140 -0.000 2.752) 3.486 3.864 ( 1.537 -0.000 -3.621) 3.933 4.139 ( -0.089 -0.000 5.905) 5.905 4.350 ( -3.501 -0.000 -13.801) 14.238 4.639 ( -1.406 -0.000 9.557) 9.659 4.816 ( -6.658 -0.000 16.141) 17.460 5.058 ( -0.796 -0.000 6.819) 6.866 5.692 ( 1.065 -0.000 4.675) 4.794 6.095 ( 1.081 -0.000 3.370) 3.539 6.605 ( 2.301 -0.000 -7.735) 8.070 7.250 ( -3.389 -0.000 -2.634) 4.292 7.600 ( 1.419 -0.000 1.377) 1.977 8.208 ( -5.589 -0.000 4.871) 7.414 8.958 ( -0.663 -0.000 -1.659) 1.787 9.002 ( 1.367 0.000 -3.505) 3.762 9.644 ( 0.062 -0.000 8.425) 8.425 11.519 ( -3.224 -0.000 3.771) 4.961 11.801 ( -1.224 -0.000 2.621) 2.893 11.940 ( 2.227 -0.000 -5.579) 6.007 12.050 ( -3.666 0.000 -4.605) 5.886 12.313 ( -0.256 -0.000 2.772) 2.783 12.610 ( 5.039 -0.000 7.534) 9.064 13.656 ( -6.612 -0.000 -4.448) 7.969 14.577 ( 5.147 -0.000 -12.799) 13.795 17.218 ( 7.023 -0.000 9.672) 11.953 18.987 ( -5.580 -0.000 -16.908) 17.805 19.826 ( 7.858 -0.000 -2.470) 8.237 20.019 ( -14.907 -0.000 -18.959) 24.118 20.809 ( 21.900 -0.000 18.958) 28.966 21.210 ( -8.520 -0.000 8.304) 11.897 23.765 ( -3.672 -0.000 0.769) 3.751 24.165 ( -0.850 -0.000 -3.097) 3.211 ======================= Grid point 164 (73/361) ======================= q-point: (-0.40 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 6.095 7.110 4.915) 10.576 2.553 ( 0.805 18.136 10.620) 21.032 2.894 ( 7.412 -5.693 5.078) 10.636 2.990 ( 3.605 -13.286 5.449) 14.806 3.692 ( -2.051 -0.128 -2.368) 3.135 3.827 ( -2.566 3.013 6.180) 7.338 4.228 ( 6.898 4.945 0.834) 8.528 4.361 ( 10.941 -7.635 0.784) 13.364 4.694 ( -3.916 5.600 11.566) 13.434 4.966 ( -7.280 -11.930 15.180) 20.634 5.212 ( 9.713 -0.695 4.476) 10.717 5.792 ( 3.363 -0.089 4.866) 5.916 6.132 ( -2.348 0.752 4.536) 5.163 6.571 ( 6.029 -0.725 -7.469) 9.626 7.119 ( -6.436 1.775 -4.803) 8.225 7.625 ( 1.215 3.572 -0.600) 3.820 8.193 ( -8.584 -10.234 2.984) 13.687 8.917 ( 2.016 5.519 -1.805) 6.147 9.044 ( 4.144 -5.638 -1.013) 7.070 9.750 ( -1.386 0.704 10.596) 10.710 11.459 ( -10.313 0.791 2.165) 10.567 11.691 ( 2.978 24.330 -10.384) 26.620 11.888 ( 0.701 3.689 4.283) 5.696 11.977 ( 1.738 -1.818 -2.741) 3.719 12.422 ( -1.462 -15.722 0.039) 15.790 12.829 ( 7.925 1.156 13.234) 15.468 13.426 ( -14.225 -0.699 -8.114) 16.391 14.464 ( 1.491 -4.473 -16.823) 17.471 17.506 ( 9.508 -1.925 15.879) 18.608 18.643 ( -9.166 -0.869 -20.029) 22.044 19.607 ( -14.114 -0.388 -14.480) 20.225 19.832 ( -3.031 0.775 -0.320) 3.145 21.171 ( 8.625 13.244 8.111) 17.765 21.413 ( 14.276 -10.862 14.038) 22.778 23.706 ( -4.329 -0.385 -1.153) 4.497 24.079 ( -2.904 1.131 -5.675) 6.475 ======================= Grid point 165 (74/361) ======================= q-point: (-0.30 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( 12.566 5.856 8.985) 16.521 2.477 ( 2.101 17.286 2.503) 17.593 3.084 ( 8.594 -3.935 0.132) 9.453 3.242 ( 7.165 -8.326 4.976) 12.058 3.584 ( -8.285 -5.223 -5.697) 11.330 3.953 ( 2.141 4.677 18.831) 19.521 4.357 ( 16.775 0.684 -4.151) 17.294 4.620 ( 5.986 -3.593 12.268) 14.116 4.777 ( -3.363 -2.278 13.649) 14.240 5.128 ( -5.444 -7.108 9.357) 12.951 5.400 ( 7.799 -0.482 4.776) 9.158 5.887 ( 3.368 -1.141 1.860) 4.013 6.130 ( -4.346 1.341 5.013) 6.768 6.601 ( 8.005 1.090 -4.563) 9.278 6.944 ( -7.042 0.012 -6.577) 9.635 7.535 ( -0.935 8.263 -3.681) 9.094 8.235 ( -9.392 -19.590 1.282) 21.763 8.886 ( 3.592 7.032 -0.144) 7.897 9.170 ( 5.146 -7.114 0.476) 8.793 9.844 ( -1.495 3.026 10.985) 11.492 11.252 ( -12.523 3.893 -6.395) 14.590 11.368 ( -0.806 25.308 -5.510) 25.913 11.944 ( 2.467 6.040 6.284) 9.058 11.997 ( 5.106 -1.641 -4.806) 7.202 12.524 ( -1.639 -13.756 -1.459) 13.930 13.033 ( -5.045 4.688 1.254) 7.000 13.197 ( -2.082 -3.607 7.262) 8.372 14.286 ( -2.162 -7.007 -19.901) 21.209 17.866 ( 8.035 -4.352 16.040) 18.461 18.327 ( -5.833 -2.702 -14.649) 15.997 19.292 ( -11.545 -2.390 -9.143) 14.919 19.736 ( -9.782 3.455 2.429) 10.655 21.208 ( 8.492 10.836 -2.139) 13.932 21.896 ( 15.597 -6.674 14.772) 22.495 23.629 ( -4.521 -1.349 -2.401) 5.294 23.940 ( -2.252 3.289 -6.943) 8.006 ======================= Grid point 166 (75/361) ======================= q-point: (-0.20 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( -1.952 11.877 -4.839) 12.972 2.751 ( 15.124 3.003 14.303) 21.032 3.189 ( 3.770 -1.621 -4.456) 6.058 3.376 ( -0.064 -2.116 -1.139) 2.403 3.513 ( 2.085 -8.174 -3.174) 9.013 4.221 ( 4.681 6.121 24.015) 25.221 4.521 ( 17.931 -0.918 -11.333) 21.232 4.829 ( -3.112 -0.857 10.796) 11.268 4.962 ( -2.738 -5.286 15.441) 16.549 5.179 ( -4.812 -4.644 6.630) 9.417 5.536 ( -0.240 0.012 6.804) 6.809 5.962 ( 3.999 -1.059 1.932) 4.565 6.138 ( -3.152 -2.062 5.095) 6.336 6.598 ( -0.028 6.999 -3.998) 8.061 6.787 ( -1.650 -0.480 -5.852) 6.099 7.449 ( 4.140 2.267 -3.114) 5.654 8.271 ( -12.316 -19.310 0.016) 22.903 8.894 ( 4.268 5.824 1.930) 7.474 9.292 ( 2.758 -5.073 -0.161) 5.776 9.929 ( 0.821 4.348 9.564) 10.538 10.951 ( -7.449 4.834 -10.750) 13.943 11.065 ( -6.816 19.463 -2.706) 20.798 11.960 ( 0.202 9.062 5.062) 10.382 12.054 ( 8.020 -1.617 -4.041) 9.125 12.583 ( -3.555 -11.181 -2.397) 11.974 12.817 ( -9.756 0.529 -2.253) 10.027 13.459 ( 8.070 1.721 14.884) 17.018 14.061 ( -4.160 -7.960 -19.238) 21.231 18.061 ( -2.218 -0.616 0.915) 2.478 18.291 ( 7.673 -8.849 0.978) 11.753 19.111 ( -7.544 -3.959 -2.967) 9.022 19.545 ( -15.082 8.901 3.647) 17.888 21.183 ( 8.582 6.804 -7.615) 13.339 22.299 ( 11.846 -2.697 11.874) 16.988 23.552 ( -3.420 -1.692 -2.830) 4.750 23.813 ( 0.062 3.067 -5.888) 6.639 ======================= Grid point 167 (76/361) ======================= q-point: (-0.10 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -5.194 -0.038 -5.349) 7.456 3.055 ( -3.168 -5.995 -7.778) 10.319 3.090 ( 2.822 -0.417 8.583) 9.045 3.416 ( 1.811 -0.587 2.427) 3.084 3.606 ( 9.512 3.309 -0.584) 10.088 4.481 ( 0.476 3.018 9.063) 9.564 4.586 ( 15.602 1.362 -10.413) 18.807 4.809 ( -5.746 6.144 4.729) 9.651 5.079 ( -7.548 -1.319 12.061) 14.289 5.260 ( -0.950 0.073 1.775) 2.015 5.556 ( -12.933 -10.859 6.829) 18.216 6.109 ( 3.232 1.716 6.967) 7.870 6.164 ( -4.088 -4.211 5.674) 8.163 6.445 ( -2.391 3.497 -1.056) 4.366 6.759 ( 1.515 3.992 1.175) 4.428 7.544 ( 11.366 -3.443 -2.597) 12.157 8.244 ( -13.953 -13.111 3.351) 19.437 8.933 ( 2.875 3.732 1.877) 5.071 9.319 ( 0.193 -0.956 -1.679) 1.941 10.015 ( 1.696 3.630 5.136) 6.514 10.713 ( -12.606 -10.486 -9.087) 18.747 10.820 ( 5.271 21.924 -1.349) 22.589 11.940 ( -1.606 5.786 4.766) 7.667 12.126 ( 5.768 -1.074 -2.624) 6.427 12.558 ( -4.523 -7.007 -2.315) 8.655 12.758 ( -0.867 0.854 2.992) 3.230 13.604 ( -0.846 0.630 -5.705) 5.801 13.960 ( 4.419 -3.489 1.945) 5.957 18.031 ( -0.675 0.315 -0.769) 1.071 18.482 ( 8.009 -9.822 -5.390) 13.772 19.084 ( -0.779 -2.844 2.765) 4.042 19.248 ( -17.953 14.430 4.118) 23.398 21.165 ( 6.987 -0.790 -8.278) 10.861 22.541 ( 5.458 3.828 7.859) 10.306 23.511 ( 0.309 -0.605 -1.537) 1.680 23.751 ( 0.799 -0.771 -3.447) 3.622 ======================= Grid point 174 (77/361) ======================= q-point: (-0.40 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.463 ( 12.297 0.000 7.564) 14.438 2.668 ( -4.642 -0.000 -2.600) 5.320 3.091 ( 14.537 0.000 2.888) 14.821 3.096 ( 8.832 0.000 8.297) 12.118 3.537 ( -9.978 -0.000 -6.723) 12.032 3.976 ( -0.143 -0.000 20.459) 20.460 4.368 ( 21.891 0.000 -14.830) 26.441 4.579 ( 3.237 0.000 18.526) 18.806 4.802 ( 0.078 0.000 4.226) 4.226 5.030 ( -7.159 -0.000 21.198) 22.375 5.398 ( 8.356 0.000 4.612) 9.544 5.879 ( 3.066 0.000 1.613) 3.465 6.142 ( -4.441 -0.000 4.335) 6.206 6.609 ( 10.788 0.000 -5.197) 11.975 6.944 ( -7.465 -0.000 -7.852) 10.834 7.670 ( 0.308 0.000 -0.073) 0.317 7.997 ( -12.388 -0.000 -0.236) 12.390 8.973 ( 3.037 0.000 -0.687) 3.113 9.082 ( 5.627 0.000 1.290) 5.773 9.872 ( -1.229 -0.000 11.678) 11.742 11.261 ( -16.277 -0.000 -3.890) 16.735 11.741 ( 4.758 0.000 -13.953) 14.742 11.898 ( 5.429 0.000 -6.856) 8.745 12.015 ( 0.228 0.000 8.321) 8.324 12.353 ( -2.620 -0.000 4.108) 4.872 13.094 ( -17.459 -0.000 -7.528) 19.013 13.144 ( 9.356 0.000 16.542) 19.004 14.220 ( -1.636 -0.000 -19.637) 19.705 17.828 ( 8.899 0.000 15.964) 18.277 18.303 ( -6.353 -0.000 -15.093) 16.375 19.270 ( -10.557 -0.000 -10.999) 15.246 19.765 ( -8.675 -0.000 2.449) 9.014 21.327 ( 6.944 0.000 -4.858) 8.475 21.819 ( 15.379 0.000 19.529) 24.857 23.616 ( -4.983 -0.000 -2.351) 5.510 23.969 ( -1.951 -0.000 -7.245) 7.503 ======================= Grid point 176 (78/361) ======================= q-point: (-0.30 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.452 ( -7.082 4.309 -13.132) 15.530 2.784 ( 16.321 0.973 11.205) 19.821 3.209 ( -4.875 2.982 -5.288) 7.786 3.336 ( 0.197 -2.268 1.062) 2.512 3.401 ( 15.935 -3.935 2.822) 16.654 4.286 ( -0.107 1.469 28.971) 29.008 4.498 ( 20.760 -1.029 -15.236) 25.771 4.763 ( -5.632 -4.690 10.365) 12.694 4.915 ( 4.699 0.764 10.880) 11.876 5.143 ( -8.043 -0.752 11.541) 14.087 5.540 ( 0.292 0.156 5.268) 5.279 5.952 ( 5.133 -0.142 4.323) 6.712 6.119 ( -4.862 -0.430 2.745) 5.600 6.699 ( 2.690 4.541 -6.606) 8.455 6.765 ( 3.961 -2.463 -5.820) 7.459 7.574 ( -2.668 10.984 -1.285) 11.377 7.915 ( -12.355 -17.938 0.435) 21.785 8.994 ( 4.072 4.214 0.216) 5.864 9.205 ( 5.006 -3.767 1.761) 6.507 9.991 ( -0.099 2.022 10.618) 10.809 10.935 ( -18.456 -0.963 -8.926) 20.524 11.515 ( 2.950 21.795 -10.564) 24.400 11.965 ( 6.959 -8.264 -5.838) 12.280 12.085 ( -2.198 3.541 6.176) 7.450 12.396 ( -3.532 -7.146 2.656) 8.402 12.805 ( -12.278 -0.870 -2.923) 12.651 13.482 ( 9.060 0.677 16.722) 19.030 13.953 ( -2.964 -3.372 -19.943) 20.442 18.079 ( 1.587 2.585 3.350) 4.519 18.158 ( 3.737 -5.799 0.329) 6.907 19.063 ( -4.850 -1.307 -5.246) 7.263 19.645 ( -12.940 2.498 4.115) 13.807 21.302 ( 7.203 4.634 -11.135) 14.048 22.250 ( 10.676 -2.035 18.651) 21.586 23.517 ( -5.266 -1.347 -2.605) 6.028 23.858 ( 0.706 1.465 -7.937) 8.102 ======================= Grid point 177 (79/361) ======================= q-point: (-0.20 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -10.128 -0.134 -15.722) 18.702 2.902 ( -19.031 -7.466 -11.761) 23.585 3.123 ( 13.266 1.981 9.822) 16.625 3.460 ( 6.900 5.131 4.895) 9.894 3.671 ( 16.957 1.943 1.381) 17.124 4.511 ( 2.201 1.458 -6.751) 7.249 4.596 ( 7.819 0.213 5.909) 9.802 4.871 ( -6.507 -5.327 15.364) 17.515 5.021 ( -4.412 1.446 5.744) 7.386 5.214 ( -2.899 -3.804 12.990) 13.842 5.468 ( -9.503 -0.470 -3.867) 10.271 6.091 ( -3.543 -3.039 3.171) 5.643 6.135 ( 2.030 0.908 7.517) 7.839 6.527 ( -0.355 4.206 -3.936) 5.772 6.861 ( 7.296 6.324 1.001) 9.707 7.504 ( 5.225 0.471 -1.571) 5.476 7.920 ( -13.795 -19.676 2.482) 24.158 9.027 ( 4.782 4.900 1.381) 6.985 9.294 ( 2.217 -1.733 -0.310) 2.831 10.091 ( 1.633 4.074 7.722) 8.882 10.579 ( -17.545 -4.789 -10.185) 20.845 11.239 ( 4.126 23.089 -8.009) 24.784 12.016 ( -9.806 2.698 3.873) 10.883 12.076 ( 5.741 -5.427 -3.577) 8.672 12.429 ( -2.556 -6.672 1.476) 7.295 12.740 ( -0.995 -1.766 3.602) 4.133 13.597 ( -4.199 -1.153 -12.436) 13.176 13.911 ( 10.199 -1.710 9.775) 14.230 18.064 ( 1.909 3.203 0.036) 3.729 18.314 ( 4.977 -8.380 -2.310) 10.017 19.045 ( 2.050 -1.369 3.037) 3.911 19.448 ( -16.525 7.364 4.568) 18.659 21.199 ( 6.367 3.508 -14.186) 15.940 22.586 ( 4.993 1.297 16.689) 17.468 23.447 ( -4.236 -4.477 -1.166) 6.273 23.776 ( 3.241 2.070 -7.529) 8.455 ======================= Grid point 178 (80/361) ======================= q-point: (-0.10 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( -10.936 -9.912 -12.808) 19.542 2.568 ( -21.890 -14.664 -11.170) 28.618 3.322 ( 7.316 4.653 3.458) 9.335 3.527 ( 2.279 6.148 4.130) 7.749 3.860 ( 11.326 7.553 2.640) 13.867 4.281 ( -8.004 -2.153 -21.726) 23.253 4.662 ( -4.026 -0.824 -1.029) 4.236 4.978 ( -8.238 5.443 9.097) 13.426 5.034 ( -5.457 -3.772 12.709) 14.336 5.285 ( -0.724 5.917 0.029) 5.961 5.381 ( -3.577 -5.657 7.604) 10.129 6.024 ( -6.698 0.401 -5.007) 8.372 6.211 ( -0.585 -10.042 5.465) 11.448 6.581 ( -2.460 9.855 14.358) 17.588 6.895 ( 4.446 6.900 6.040) 10.191 7.622 ( 8.522 -3.588 -2.957) 9.707 7.984 ( -8.026 -21.589 5.844) 23.763 9.042 ( 2.268 8.675 0.477) 8.979 9.315 ( 2.845 -1.178 -1.163) 3.291 10.052 ( -8.914 5.715 -2.426) 10.863 10.398 ( -2.924 -9.588 -2.307) 10.286 11.055 ( 7.606 16.527 -5.559) 19.023 11.884 ( -14.915 -2.781 5.528) 16.148 12.136 ( 2.765 -2.076 -2.889) 4.506 12.532 ( 4.365 -6.276 4.496) 8.869 12.820 ( 2.327 0.856 5.431) 5.970 13.344 ( -6.031 -2.235 -16.821) 18.009 14.242 ( 13.176 1.885 14.286) 19.526 18.034 ( 0.935 3.556 -5.603) 6.701 18.427 ( 9.526 -8.072 -5.828) 13.780 19.152 ( -5.598 7.491 0.969) 9.402 19.197 ( -5.670 4.023 9.918) 12.112 21.097 ( 4.327 -2.229 -13.444) 14.298 22.741 ( -2.638 8.645 12.277) 15.245 23.477 ( -1.213 -8.076 3.748) 8.986 23.728 ( 4.172 1.381 -6.186) 7.588 ======================= Grid point 186 (81/361) ======================= q-point: (-0.30 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( -11.406 -0.000 -19.780) 22.833 2.830 ( -22.473 -0.000 -11.549) 25.267 3.144 ( 14.813 0.000 9.494) 17.594 3.537 ( 7.189 0.000 7.182) 10.162 3.668 ( 20.301 0.000 0.737) 20.314 4.529 ( 13.749 0.000 -21.499) 25.520 4.631 ( -4.749 -0.000 26.551) 26.973 4.730 ( -7.021 -0.000 6.628) 9.656 5.111 ( 3.217 0.000 9.236) 9.780 5.139 ( -10.554 -0.000 14.221) 17.709 5.470 ( -8.526 -0.000 -3.730) 9.306 6.063 ( -4.408 -0.000 0.385) 4.424 6.143 ( 2.244 0.000 8.470) 8.762 6.568 ( 0.905 0.000 -3.924) 4.027 6.930 ( 15.323 0.000 -1.616) 15.408 7.604 ( -1.880 -0.000 -1.107) 2.182 7.627 ( -15.336 -0.000 4.149) 15.887 9.077 ( 5.073 0.000 0.037) 5.073 9.273 ( 3.547 0.000 1.107) 3.716 10.132 ( 2.288 0.000 8.678) 8.975 10.536 ( -19.780 -0.000 -10.474) 22.382 11.512 ( 4.395 0.000 -15.816) 16.416 11.973 ( 6.702 0.000 -0.195) 6.705 12.040 ( -13.984 -0.000 3.935) 14.527 12.361 ( -4.193 -0.000 4.379) 6.063 12.722 ( 0.534 0.000 3.541) 3.581 13.582 ( -4.631 -0.000 -15.223) 15.912 13.897 ( 11.625 0.000 12.878) 17.348 18.118 ( 5.289 0.000 0.358) 5.301 18.213 ( 1.262 0.000 -1.216) 1.752 19.033 ( 3.464 0.000 2.692) 4.387 19.513 ( -15.632 -0.000 4.992) 16.409 21.240 ( 5.933 0.000 -16.696) 17.719 22.596 ( 4.781 0.000 21.030) 21.566 23.401 ( -5.844 -0.000 -2.108) 6.213 23.796 ( 3.882 0.000 -8.501) 9.345 ======================= Grid point 187 (82/361) ======================= q-point: (-0.20 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -14.160 -3.749 -18.525) 23.616 2.364 ( -26.500 -6.550 -11.820) 29.747 3.400 ( 10.506 2.932 4.653) 11.859 3.647 ( 1.806 5.383 4.096) 7.001 3.927 ( 12.789 0.120 0.887) 12.820 4.285 ( -5.626 2.151 -26.316) 26.996 4.650 ( -11.066 0.887 3.409) 11.613 4.794 ( -9.717 -11.354 7.054) 16.526 5.180 ( -0.063 8.430 12.204) 14.833 5.305 ( -1.184 -4.003 9.488) 10.366 5.372 ( -2.447 2.714 10.629) 11.239 6.029 ( -4.716 -0.200 -1.317) 4.901 6.077 ( -4.436 -3.930 -4.512) 7.448 6.731 ( 4.578 5.120 17.370) 18.678 7.051 ( 7.774 9.410 0.152) 12.207 7.541 ( 1.181 -8.097 1.015) 8.246 7.627 ( -8.771 -11.037 3.215) 14.460 9.147 ( 6.173 2.562 0.344) 6.692 9.306 ( 1.348 0.196 -1.139) 1.775 10.132 ( -15.418 2.722 -7.165) 17.218 10.292 ( 2.786 -2.846 4.483) 5.997 11.323 ( 5.815 10.107 -16.012) 19.808 11.866 ( -18.152 1.106 7.612) 19.715 12.084 ( 4.525 -3.493 -1.421) 5.890 12.395 ( -3.332 -6.289 7.460) 10.310 12.835 ( 5.721 0.654 5.374) 7.877 13.313 ( -4.320 -0.972 -17.164) 17.726 14.262 ( 13.774 0.471 15.623) 20.833 18.110 ( 1.655 4.275 -9.812) 10.830 18.291 ( 8.955 -6.060 1.431) 10.907 19.179 ( 6.933 0.256 6.751) 9.681 19.322 ( -17.129 4.347 4.831) 18.320 21.088 ( 4.100 0.353 -18.349) 18.805 22.870 ( -1.442 4.838 21.318) 21.908 23.328 ( -5.050 -6.124 0.474) 7.952 23.759 ( 5.680 1.153 -7.945) 9.835 ======================= Grid point 188 (83/361) ======================= q-point: (-0.10 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -15.026 -12.862 -11.373) 22.816 1.958 ( -26.632 -16.685 -8.763) 32.626 3.454 ( -2.671 6.236 -8.684) 11.020 3.596 ( -2.211 2.049 -3.738) 4.802 3.789 ( -18.673 1.566 -10.681) 21.568 3.995 ( -1.603 2.743 -1.604) 3.559 4.509 ( -8.604 -3.081 -1.216) 9.220 4.838 ( -6.219 -3.999 6.087) 9.577 5.256 ( 5.221 6.148 5.374) 9.692 5.362 ( 5.030 2.499 -1.609) 5.842 5.532 ( -5.243 6.919 22.177) 23.816 5.850 ( -4.931 -1.351 -7.843) 9.362 6.191 ( -0.355 -10.912 8.945) 14.114 6.752 ( -11.301 17.961 9.831) 23.387 7.138 ( 4.056 5.250 12.025) 13.733 7.643 ( -2.557 -3.955 3.116) 5.647 7.782 ( 6.004 -26.280 0.720) 26.967 9.154 ( 1.176 10.814 -1.317) 10.958 9.342 ( 6.190 -4.086 -1.087) 7.496 9.840 ( -11.601 0.223 -5.260) 12.740 10.418 ( 4.791 0.820 3.208) 5.824 11.151 ( 7.211 6.660 -13.832) 16.961 11.724 ( -19.069 -0.070 13.013) 23.086 12.100 ( 0.060 -1.586 -3.191) 3.564 12.578 ( -0.133 -12.861 11.104) 16.992 12.969 ( 6.203 2.682 4.814) 8.297 13.069 ( -2.407 -0.328 -15.576) 15.765 14.634 ( 15.133 2.279 13.446) 20.371 17.916 ( 3.048 2.871 -22.545) 22.931 18.527 ( 12.252 -4.014 4.333) 13.601 19.076 ( -14.722 8.079 3.247) 17.104 19.362 ( 6.424 0.240 6.838) 9.385 20.928 ( 1.713 -3.363 -16.112) 16.548 22.915 ( -9.463 14.594 12.607) 21.482 23.446 ( -1.647 -13.578 11.682) 17.988 23.739 ( 5.319 1.980 -5.595) 7.970 ======================= Grid point 197 (84/361) ======================= q-point: (-0.20 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( -17.724 -0.000 -11.944) 21.372 1.792 ( -29.873 -0.000 -10.498) 31.664 3.533 ( -17.208 -0.000 -23.854) 29.413 3.587 ( 7.775 0.000 2.698) 8.230 3.843 ( -17.227 -0.000 -4.166) 17.724 4.002 ( -1.700 -0.000 -1.412) 2.210 4.472 ( -9.974 -0.000 0.171) 9.976 4.791 ( -0.220 -0.000 7.020) 7.023 5.323 ( 6.060 0.000 1.189) 6.176 5.374 ( 5.231 0.000 0.588) 5.264 5.614 ( -8.257 -0.000 28.994) 30.147 5.845 ( -5.530 -0.000 -8.911) 10.487 6.070 ( 0.672 0.000 6.838) 6.871 7.026 ( -6.236 -0.000 24.530) 25.310 7.201 ( 7.807 0.000 -4.432) 8.977 7.376 ( -11.014 -0.000 6.026) 12.554 7.639 ( 6.792 0.000 -0.854) 6.846 9.259 ( 8.284 0.000 -0.452) 8.296 9.295 ( -0.592 -0.000 -1.898) 1.988 9.841 ( -11.438 -0.000 -5.979) 12.907 10.434 ( 6.038 0.000 5.263) 8.010 11.212 ( 5.709 0.000 -19.717) 20.527 11.763 ( -18.358 -0.000 15.893) 24.282 12.082 ( 0.824 0.000 -3.022) 3.133 12.422 ( -4.319 -0.000 11.624) 12.400 12.994 ( 6.811 0.000 4.722) 8.288 13.065 ( -2.186 -0.000 -15.510) 15.663 14.654 ( 15.270 0.000 14.097) 20.782 17.945 ( 4.682 0.000 -24.694) 25.134 18.485 ( 10.917 0.000 7.611) 13.308 19.158 ( -15.828 -0.000 3.212) 16.151 19.363 ( 6.652 0.000 6.322) 9.177 20.900 ( 1.979 0.000 -18.305) 18.411 23.157 ( -5.467 -0.000 27.543) 28.080 23.210 ( -5.859 -0.000 -0.099) 5.860 23.759 ( 5.567 0.000 -5.916) 8.124 ======================= Grid point 198 (85/361) ======================= q-point: (-0.10 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.965 ( -21.347 -7.796 1.149) 22.755 1.334 ( -28.924 -15.639 -4.615) 33.204 2.735 ( -39.798 -3.987 -31.637) 50.997 3.679 ( -5.387 4.557 5.863) 9.174 3.708 ( -0.137 2.717 5.196) 5.865 3.882 ( -9.451 -0.180 -2.905) 9.889 4.420 ( -3.433 -0.473 4.463) 5.651 4.854 ( -0.431 0.023 2.684) 2.718 5.402 ( 0.651 2.704 0.104) 2.783 5.431 ( 7.057 1.871 1.171) 7.394 5.707 ( -3.098 -1.374 0.304) 3.403 5.788 ( -6.367 6.854 16.524) 18.989 6.236 ( 2.519 -6.948 9.519) 12.051 6.892 ( -13.011 30.159 8.384) 33.899 7.325 ( -5.710 3.415 10.473) 12.407 7.476 ( -3.049 -28.260 6.895) 29.249 7.783 ( 11.210 -8.361 0.314) 13.989 9.209 ( -2.303 7.791 -2.749) 8.577 9.406 ( 9.770 -4.362 0.201) 10.701 9.683 ( -3.791 0.044 -3.227) 4.979 10.550 ( 4.670 4.108 2.678) 6.771 11.057 ( 5.585 -0.933 -18.512) 19.359 11.713 ( -20.367 9.186 25.321) 33.769 12.046 ( -0.448 -0.895 -2.694) 2.874 12.569 ( -4.008 -12.412 11.289) 17.250 12.884 ( 1.271 -3.694 -11.518) 12.162 13.128 ( 5.765 1.377 3.480) 6.873 15.011 ( 14.900 1.459 9.905) 17.951 17.638 ( 6.457 2.208 -38.003) 38.611 18.733 ( 8.372 -2.650 7.258) 11.392 18.977 ( -9.264 3.135 0.967) 9.828 19.512 ( 4.786 -0.673 4.629) 6.692 20.725 ( 0.621 -2.087 -14.361) 14.525 23.035 ( -10.355 17.263 6.093) 21.033 23.500 ( -2.047 -12.850 21.737) 25.334 23.782 ( 1.537 0.373 4.028) 4.327 ======================= Grid point 208 (86/361) ======================= q-point: (-0.10 -0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.737 ( -29.146 -0.000 24.146) 37.848 0.799 ( -30.118 -0.000 1.954) 30.181 1.707 ( -52.329 -0.000 -23.747) 57.465 3.689 ( -5.199 -0.000 6.569) 8.378 3.698 ( -10.299 -0.000 -2.192) 10.530 3.832 ( 3.752 0.000 4.584) 5.924 4.536 ( -0.882 -0.000 21.373) 21.392 4.844 ( -0.807 -0.000 -2.297) 2.435 5.415 ( -0.436 -0.000 3.224) 3.253 5.560 ( 5.769 0.000 1.514) 5.964 5.662 ( -2.677 -0.000 -1.978) 3.329 5.897 ( -7.235 -0.000 12.175) 14.162 6.358 ( 4.302 0.000 6.018) 7.397 7.074 ( -13.112 -0.000 5.417) 14.187 7.217 ( 3.290 0.000 -3.799) 5.026 7.485 ( -9.404 -0.000 31.505) 32.879 7.892 ( 9.771 0.000 -0.244) 9.774 9.170 ( -3.933 -0.000 -1.393) 4.172 9.532 ( 9.471 0.000 0.435) 9.481 9.621 ( 2.063 0.000 -6.329) 6.656 10.661 ( 2.911 0.000 2.215) 3.658 10.861 ( 2.637 0.000 -23.943) 24.088 11.986 ( -12.789 -0.000 45.922) 47.670 12.013 ( 0.592 0.000 -1.878) 1.969 12.549 ( -3.804 -0.000 5.169) 6.418 12.724 ( -0.488 -0.000 -7.683) 7.699 13.235 ( 3.876 0.000 1.910) 4.321 15.292 ( 11.529 0.000 3.716) 12.113 17.197 ( 1.239 0.000 -41.817) 41.835 18.756 ( -7.433 -0.000 -0.183) 7.436 19.012 ( 6.800 0.000 4.084) 7.933 19.599 ( 2.050 0.000 2.928) 3.575 20.582 ( 1.488 0.000 -9.899) 10.010 23.060 ( -5.716 -0.000 1.669) 5.954 23.647 ( 3.876 0.000 4.226) 5.734 24.005 ( -5.236 -0.000 45.314) 45.616 ======================= Grid point 209 (87/361) ======================= q-point: ( 0.00 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( -6.209 -0.000 30.443) 31.070 1.275 ( 15.126 0.000 27.823) 31.669 2.365 ( -8.196 -0.000 50.602) 51.261 3.441 ( -0.128 -0.000 -4.267) 4.269 3.860 ( -0.503 -0.000 8.040) 8.056 4.072 ( -3.721 -0.000 3.649) 5.212 4.666 ( 4.023 0.000 -5.522) 6.832 5.074 ( 4.326 0.000 4.184) 6.018 5.255 ( -7.112 -0.000 -5.106) 8.755 5.429 ( -1.901 -0.000 -8.166) 8.384 5.675 ( -26.047 -0.000 6.862) 26.936 6.320 ( -19.565 -0.000 14.004) 24.061 6.430 ( -3.626 -0.000 2.808) 4.586 6.627 ( -0.315 -0.000 2.394) 2.415 7.151 ( -6.540 -0.000 12.134) 13.784 7.211 ( 0.257 0.000 -9.254) 9.257 8.063 ( 3.040 0.000 8.291) 8.831 9.338 ( -0.466 -0.000 6.235) 6.252 9.377 ( -0.900 -0.000 -8.178) 8.228 9.639 ( -6.055 -0.000 -2.152) 6.426 10.169 ( 16.547 0.000 4.783) 17.224 10.676 ( -2.529 -0.000 -2.225) 3.368 11.884 ( 1.239 0.000 -7.915) 8.012 12.043 ( -7.785 -0.000 13.277) 15.391 12.162 ( 0.288 0.000 -8.647) 8.652 12.968 ( 5.349 0.000 6.105) 8.117 13.233 ( -1.419 -0.000 -2.765) 3.108 15.034 ( -0.942 -0.000 -19.574) 19.597 18.428 ( 5.933 0.000 -8.685) 10.518 19.189 ( -11.779 -0.000 0.681) 11.799 19.298 ( 2.220 0.000 -7.411) 7.737 19.584 ( 22.118 0.000 -1.624) 22.178 20.553 ( 16.095 0.000 1.750) 16.190 22.893 ( -54.435 -0.000 -7.109) 54.897 23.119 ( -4.023 -0.000 5.435) 6.762 23.702 ( 5.600 0.000 -1.824) 5.890 ======================= Grid point 210 (88/361) ======================= q-point: ( 0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 1.760 -1.097 29.624) 29.697 1.804 ( 13.844 -5.648 22.570) 27.073 2.986 ( 9.690 -6.759 38.173) 39.959 3.395 ( 3.977 2.302 -6.199) 7.716 3.922 ( -4.700 0.694 10.229) 11.279 4.014 ( -3.350 4.156 -2.426) 5.864 4.615 ( 0.926 4.970 -6.769) 8.449 4.979 ( -16.394 -1.036 -9.664) 19.059 5.251 ( 0.119 0.680 0.047) 0.692 5.323 ( 1.110 1.030 -0.979) 1.803 5.425 ( -15.148 -1.613 20.511) 25.549 6.282 ( -12.256 1.931 15.901) 20.169 6.388 ( -6.907 1.776 6.297) 9.514 6.688 ( 3.458 11.778 6.557) 13.917 7.053 ( -0.903 3.311 -9.289) 9.903 7.302 ( -3.800 -8.894 9.072) 13.261 8.228 ( -1.943 -6.592 11.008) 12.977 9.338 ( -1.294 7.107 0.908) 7.281 9.354 ( 5.735 -4.890 -4.647) 8.854 9.544 ( -6.387 -4.694 -0.664) 7.954 10.366 ( 12.762 17.076 -0.299) 21.320 10.748 ( 4.458 -22.235 -1.119) 22.705 11.804 ( 3.565 1.056 -10.343) 10.991 11.984 ( -1.757 10.925 2.517) 11.348 12.238 ( -2.175 -14.484 5.571) 15.670 13.123 ( 3.776 2.104 2.360) 4.925 13.172 ( -0.412 -2.502 0.071) 2.536 14.721 ( -5.548 3.248 -20.577) 21.558 18.426 ( 10.470 3.970 -6.919) 13.163 18.849 ( -15.645 16.000 -6.170) 23.212 19.158 ( -14.268 -16.709 -6.696) 22.970 19.740 ( -1.713 -0.209 -1.180) 2.091 20.840 ( 17.064 4.051 8.845) 19.642 22.284 ( -13.358 11.702 -3.008) 18.012 23.203 ( -4.340 -13.737 0.996) 14.440 23.762 ( 5.508 -0.005 -1.414) 5.686 ======================= Grid point 211 (89/361) ======================= q-point: ( 0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 6.235 1.153 24.587) 25.392 2.329 ( 13.944 -10.216 19.574) 26.115 3.346 ( 5.284 5.591 -7.261) 10.578 3.528 ( 6.086 -4.613 16.270) 17.973 3.843 ( -2.342 7.465 -8.957) 11.893 4.018 ( 1.235 0.098 13.257) 13.315 4.437 ( -2.156 5.509 -9.658) 11.326 4.738 ( -8.222 -6.775 -5.942) 12.199 5.161 ( -11.778 -5.883 4.558) 13.933 5.324 ( -2.706 0.608 4.979) 5.699 5.730 ( 7.227 0.434 22.727) 23.852 6.245 ( -10.765 4.933 10.266) 15.672 6.392 ( -8.844 -4.445 8.291) 12.912 6.672 ( -0.363 13.376 7.159) 15.176 6.874 ( -1.322 4.774 -10.279) 11.411 7.422 ( -1.775 0.994 10.793) 10.983 8.363 ( -9.218 -12.240 9.469) 18.013 9.226 ( -1.534 10.791 -0.863) 10.934 9.393 ( -0.783 -2.064 -4.299) 4.833 9.632 ( 7.911 -8.812 5.730) 13.156 10.312 ( 1.650 6.031 -3.521) 7.176 11.035 ( 9.418 -12.895 0.076) 15.969 11.681 ( 1.105 4.808 -9.018) 10.280 11.952 ( 5.794 3.511 -1.541) 6.948 12.423 ( -2.123 -14.402 7.342) 16.304 13.021 ( -6.387 3.486 -2.651) 7.744 13.330 ( 8.113 -1.987 3.983) 9.254 14.351 ( -7.521 4.933 -17.483) 19.661 18.419 ( -5.610 9.929 -10.490) 15.495 18.491 ( 5.593 7.146 -1.654) 9.225 19.031 ( -13.703 -16.787 -6.347) 22.580 19.592 ( -16.278 1.382 2.121) 16.473 21.126 ( 13.643 9.415 9.885) 19.299 22.131 ( 5.889 -0.351 -7.894) 9.854 23.266 ( -1.274 -9.518 -0.791) 9.635 23.813 ( 4.611 1.242 -1.284) 4.945 ======================= Grid point 212 (90/361) ======================= q-point: ( 0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( 3.048 5.285 16.192) 17.303 2.838 ( 13.340 -10.107 15.986) 23.144 3.261 ( 2.241 6.365 -6.329) 9.252 3.543 ( -2.913 7.877 -4.751) 9.649 3.665 ( -5.144 3.954 -4.533) 7.915 4.225 ( 11.570 0.392 -11.048) 16.002 4.373 ( 2.554 -6.632 10.455) 12.642 4.682 ( -2.766 -9.020 -4.169) 10.315 5.142 ( -9.934 -7.851 5.542) 13.822 5.330 ( -8.140 0.621 8.470) 11.764 6.036 ( 2.400 -1.307 3.101) 4.133 6.187 ( -8.690 4.126 11.996) 15.377 6.366 ( -13.245 1.355 17.139) 21.703 6.662 ( -0.536 8.650 9.685) 12.996 6.734 ( 1.075 5.854 -2.912) 6.626 7.500 ( 3.855 5.423 4.634) 8.108 8.423 ( -15.317 -14.828 9.238) 23.234 9.105 ( -1.240 12.102 1.184) 12.223 9.330 ( -1.186 0.272 -3.272) 3.491 9.913 ( 8.415 -3.208 4.804) 10.207 10.299 ( 2.016 -9.754 -0.643) 9.981 11.088 ( 0.561 10.921 -6.578) 12.761 11.689 ( 8.688 -6.773 1.259) 11.088 12.012 ( 8.817 1.063 -3.315) 9.480 12.596 ( -2.424 -12.937 5.618) 14.311 12.844 ( -8.359 6.123 -1.574) 10.480 13.478 ( 5.871 -2.884 -3.041) 7.214 14.053 ( -3.801 4.343 -7.286) 9.295 18.143 ( -5.998 6.770 -5.047) 10.358 18.510 ( 7.521 3.528 -8.852) 12.140 18.941 ( -7.221 -12.607 -4.180) 15.118 19.382 ( -17.848 -0.962 5.233) 18.624 21.243 ( 8.497 15.020 1.539) 17.325 22.232 ( 9.824 -10.801 -3.301) 14.969 23.332 ( 2.484 -6.340 -1.143) 6.904 23.833 ( 3.017 3.435 -0.961) 4.672 ======================= Grid point 213 (91/361) ======================= q-point: (-0.60 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.262 ( -6.691 12.446 5.676) 15.228 3.072 ( -7.322 7.947 -2.926) 11.195 3.229 ( 3.432 -1.460 5.076) 6.298 3.469 ( 5.975 -0.317 -2.304) 6.412 3.526 ( -1.401 -2.293 0.435) 2.722 4.163 ( 9.306 2.104 -18.631) 20.932 4.625 ( -0.248 -5.289 5.777) 7.836 4.717 ( 3.896 -11.285 -1.152) 11.994 5.129 ( -11.260 -9.798 4.156) 15.494 5.294 ( -11.105 -1.154 7.728) 13.578 5.860 ( -13.320 6.970 -2.835) 15.298 6.091 ( -7.363 0.124 -3.243) 8.046 6.547 ( -4.187 5.145 18.491) 19.645 6.707 ( -4.535 6.273 16.151) 17.910 6.783 ( 3.240 -0.897 12.452) 12.897 7.552 ( 8.847 4.331 -3.209) 10.360 8.437 ( -15.344 -9.863 10.306) 20.951 9.001 ( -2.795 9.329 2.193) 9.983 9.299 ( 2.197 1.152 -1.620) 2.963 9.955 ( -4.955 -4.790 -3.645) 7.796 10.554 ( 10.294 -12.500 5.487) 17.097 10.834 ( -0.053 21.643 -6.625) 22.634 11.958 ( 8.383 -6.513 7.458) 12.974 12.079 ( 7.385 0.371 -3.323) 8.106 12.648 ( -6.256 4.167 0.988) 7.581 12.743 ( -0.308 -6.571 2.774) 7.140 13.380 ( -5.342 0.568 -12.892) 13.967 14.085 ( 9.009 -2.458 5.232) 10.704 17.977 ( -4.258 0.961 -8.148) 9.244 18.429 ( 3.570 2.365 -7.848) 8.940 18.965 ( -1.079 -8.567 0.149) 8.636 19.268 ( -10.887 -3.782 6.281) 13.125 21.163 ( 6.182 15.013 -7.940) 18.074 22.464 ( 4.523 -14.893 3.791) 16.020 23.423 ( 5.913 -3.720 -0.988) 7.055 23.816 ( 1.677 5.945 0.173) 6.180 ======================= Grid point 214 (92/361) ======================= q-point: (-0.50 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( -14.274 16.976 1.967) 22.267 2.725 ( -19.451 14.446 -2.420) 24.349 3.282 ( 2.637 -1.542 0.471) 3.090 3.496 ( -0.856 -3.591 -0.173) 3.695 3.722 ( 6.034 -10.670 -1.744) 12.381 3.971 ( -1.397 7.690 -12.516) 14.756 4.594 ( -6.950 -1.984 -1.991) 7.497 4.904 ( 6.633 -10.579 -2.619) 12.758 5.096 ( -11.716 -7.666 2.650) 14.250 5.275 ( -5.300 -4.530 6.540) 9.560 5.643 ( -11.437 1.772 6.317) 13.185 5.940 ( -6.011 1.848 -4.112) 7.514 6.560 ( -2.884 6.452 5.439) 8.918 6.756 ( -8.871 2.218 12.468) 15.462 7.081 ( -2.134 -5.270 23.697) 24.370 7.604 ( 9.840 1.913 -4.565) 11.014 8.411 ( -9.588 2.690 8.121) 12.850 8.925 ( -4.702 0.882 2.368) 5.338 9.325 ( 5.143 1.527 -1.125) 5.482 9.846 ( -9.515 -8.261 -5.262) 13.656 10.595 ( 3.698 21.432 -4.052) 22.123 10.844 ( 8.945 -6.124 4.181) 11.619 12.065 ( -0.075 1.234 -0.941) 1.554 12.144 ( -4.865 3.195 7.853) 9.775 12.665 ( 11.653 1.010 2.898) 12.051 12.846 ( 2.241 -6.370 1.530) 6.924 13.109 ( -9.759 2.368 -9.142) 13.580 14.367 ( 14.304 -7.046 4.720) 16.629 17.738 ( -6.116 -1.117 -18.887) 19.884 18.479 ( 8.303 0.893 4.562) 9.516 19.011 ( -6.109 -7.955 2.286) 10.288 19.305 ( 1.720 -3.243 4.593) 5.880 20.978 ( 4.770 12.938 -13.897) 19.577 22.677 ( -4.571 -16.585 6.728) 18.473 23.539 ( 8.412 -1.893 -1.263) 8.714 23.798 ( 1.639 7.477 4.617) 8.939 ======================= Grid point 215 (93/361) ======================= q-point: (-0.40 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( -19.453 16.727 6.152) 26.383 2.259 ( -22.735 18.662 0.056) 29.414 3.197 ( -15.612 10.489 -11.437) 22.013 3.504 ( 2.180 -7.247 2.903) 8.106 3.675 ( -5.114 -4.478 -2.569) 7.267 3.892 ( -4.701 -4.815 1.336) 6.861 4.491 ( -6.647 -2.800 -0.838) 7.262 4.931 ( -4.612 -2.635 0.090) 5.312 5.164 ( 8.446 -7.070 -0.327) 11.020 5.329 ( -2.982 -3.817 4.398) 6.543 5.670 ( -7.176 -11.577 8.923) 16.283 5.807 ( -4.279 2.545 -1.948) 5.346 6.513 ( -3.624 2.718 1.080) 4.657 6.730 ( -13.879 0.666 12.648) 18.790 7.328 ( -6.063 -7.354 15.938) 18.570 7.681 ( 7.243 0.182 -2.236) 7.583 8.316 ( -2.047 15.045 4.111) 15.730 8.931 ( -5.200 -8.438 4.939) 11.073 9.371 ( 6.959 2.149 -3.238) 7.971 9.752 ( -5.255 -3.739 -0.917) 6.514 10.445 ( 2.676 11.228 -4.343) 12.333 11.001 ( 5.211 1.517 1.748) 5.702 11.989 ( -9.694 1.624 3.329) 10.378 12.098 ( -5.245 4.312 5.051) 8.463 12.774 ( -0.740 -0.587 -13.295) 13.328 12.981 ( 10.799 1.975 9.798) 14.715 12.999 ( 2.042 -1.182 5.489) 5.974 14.695 ( 16.323 -9.104 0.978) 18.716 17.401 ( -6.316 -0.462 -21.653) 22.560 18.704 ( 10.484 0.688 9.664) 14.275 18.996 ( -7.026 -4.516 1.460) 8.479 19.452 ( 7.354 -2.305 3.440) 8.440 20.739 ( 3.070 10.235 -16.341) 19.525 22.785 ( -12.674 -17.854 5.923) 22.683 23.613 ( 7.051 1.945 -5.200) 8.974 23.910 ( 4.427 3.119 15.531) 16.448 ======================= Grid point 216 (94/361) ======================= q-point: (-0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.342 ( -23.048 13.562 13.001) 29.734 1.762 ( -26.414 17.219 0.395) 31.534 2.571 ( -32.126 22.331 -0.751) 39.132 3.618 ( -4.390 -6.101 -0.452) 7.530 3.727 ( 0.551 -9.028 7.899) 12.009 3.853 ( -6.584 -2.801 0.075) 7.156 4.494 ( -1.405 -7.490 5.443) 9.365 4.916 ( -0.288 1.281 1.584) 2.057 5.347 ( 7.988 -6.919 -0.744) 10.594 5.383 ( -2.792 -5.430 5.521) 8.232 5.707 ( -6.154 -3.958 -2.657) 7.784 5.814 ( -1.147 -7.859 6.526) 10.280 6.442 ( -5.095 -3.505 -2.498) 6.670 6.693 ( -15.385 -3.676 13.628) 20.879 7.410 ( -12.487 -5.747 8.146) 15.978 7.722 ( 5.323 1.007 -3.336) 6.362 8.229 ( 7.206 16.882 -0.469) 18.361 9.046 ( -3.821 -9.462 10.007) 14.293 9.395 ( 7.372 1.662 -6.175) 9.759 9.732 ( 2.068 7.261 1.851) 7.773 10.357 ( -3.422 -5.995 -5.467) 8.806 11.012 ( 0.889 8.876 1.213) 9.002 11.884 ( -11.621 -3.618 3.870) 12.771 12.065 ( -5.692 0.569 5.548) 7.969 12.595 ( -4.504 -1.000 -7.361) 8.688 13.121 ( 4.358 -3.893 1.405) 6.010 13.227 ( 15.384 13.688 7.083) 21.776 14.988 ( 15.647 -9.476 -4.389) 18.812 17.104 ( -4.764 0.907 -8.863) 10.103 18.924 ( -1.907 3.607 -1.256) 4.269 18.956 ( 7.751 0.473 7.555) 10.834 19.607 ( 6.870 0.484 3.274) 7.626 20.509 ( 2.456 5.417 -14.903) 16.046 22.811 ( -17.511 -21.130 5.708) 28.031 23.614 ( 6.459 3.352 -5.002) 8.830 24.194 ( 4.484 -2.406 18.702) 19.382 ======================= Grid point 217 (95/361) ======================= q-point: (-0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( -22.259 11.158 17.841) 30.631 1.180 ( -33.204 12.593 -2.171) 35.578 2.086 ( -31.900 23.209 33.594) 51.815 3.574 ( -6.716 -5.689 -1.614) 8.949 3.767 ( -4.894 1.010 0.459) 5.018 3.912 ( 0.003 -6.909 7.990) 10.563 4.644 ( 1.760 -9.571 -1.506) 9.847 4.992 ( 4.566 0.153 10.230) 11.204 5.455 ( -0.986 -6.182 -5.161) 8.113 5.480 ( -0.055 -4.870 4.375) 6.547 5.605 ( -1.909 -0.348 -1.033) 2.199 5.959 ( 0.345 -7.435 7.653) 10.675 6.399 ( -4.026 -8.128 -2.016) 9.292 6.705 ( -16.889 -16.604 10.617) 25.954 7.311 ( -17.049 -2.291 6.941) 18.549 7.755 ( 5.080 0.440 -4.420) 6.748 8.143 ( 11.565 19.288 -12.581) 25.769 9.176 ( -2.112 -4.796 4.891) 7.168 9.439 ( 7.827 1.919 1.036) 8.125 9.685 ( 4.622 13.814 -1.652) 14.660 10.289 ( -15.706 -18.920 -5.789) 25.262 10.911 ( -1.625 14.491 1.088) 14.623 11.853 ( -8.164 -12.081 3.003) 14.887 12.042 ( -8.079 -4.253 2.853) 9.566 12.503 ( -1.724 -0.458 -2.801) 3.321 13.161 ( 5.672 11.120 -10.609) 16.382 13.262 ( 7.029 12.190 -2.592) 14.308 15.175 ( 11.321 -8.054 -9.557) 16.863 17.273 ( 14.431 -8.125 31.382) 35.484 18.800 ( 4.733 13.374 -6.733) 15.704 19.135 ( 3.786 -1.002 6.354) 7.464 19.692 ( 2.806 5.296 2.743) 6.591 20.373 ( 4.995 -0.232 -11.625) 12.655 22.844 ( -19.210 -27.203 7.283) 34.090 23.623 ( 6.339 2.365 -3.884) 7.801 24.435 ( -1.938 -6.318 3.379) 7.422 ======================= Grid point 218 (96/361) ======================= q-point: (-0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.830 ( -5.954 9.015 24.281) 26.576 1.018 ( -15.582 7.324 25.517) 30.782 2.053 ( -27.089 11.018 50.743) 58.567 3.504 ( -4.431 -2.571 -2.594) 5.742 3.757 ( 0.614 0.373 5.291) 5.339 4.036 ( -2.200 -3.670 6.440) 7.732 4.669 ( 2.746 -4.085 -6.262) 7.965 5.106 ( -3.705 -1.879 -3.356) 5.340 5.331 ( -2.725 -0.508 -1.252) 3.042 5.522 ( -0.108 -3.196 -5.517) 6.377 5.716 ( 0.625 2.908 12.557) 12.904 6.191 ( 7.444 -8.476 9.426) 14.701 6.412 ( -4.373 -7.076 1.380) 8.432 6.747 ( -24.495 -35.486 0.741) 43.125 7.184 ( -16.003 -2.037 7.106) 17.628 7.541 ( -4.514 27.423 -16.572) 32.358 7.980 ( 7.684 10.572 -2.372) 13.283 9.239 ( -0.772 -3.836 5.686) 6.902 9.509 ( 0.908 3.977 -4.992) 6.447 9.662 ( 10.006 9.168 2.679) 13.833 10.080 ( -21.554 -13.581 -1.192) 25.504 10.773 ( -0.504 12.725 0.063) 12.736 11.921 ( -0.313 -8.318 -0.867) 8.369 11.990 ( -10.522 -9.373 2.659) 14.341 12.376 ( -1.982 11.488 -9.561) 15.077 12.908 ( 1.926 13.752 -0.840) 13.912 13.263 ( 1.150 0.188 -1.640) 2.012 15.200 ( 5.157 -4.395 -15.054) 16.508 18.257 ( 22.777 -30.967 15.650) 41.505 18.787 ( 36.544 24.908 6.388) 44.684 19.229 ( -3.745 -5.468 3.616) 7.549 19.637 ( -2.486 8.466 -2.120) 9.074 20.380 ( 10.518 -1.988 -6.278) 12.409 22.946 ( -17.724 -32.910 7.075) 38.043 23.654 ( 5.841 0.993 -2.727) 6.522 24.032 ( -38.608 12.534 -24.142) 47.228 ======================= Grid point 220 (97/361) ======================= q-point: ( 0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( 8.116 0.000 29.395) 30.495 2.203 ( 10.014 0.000 20.156) 22.507 3.400 ( 6.502 0.000 -7.545) 9.960 3.477 ( 10.683 0.000 18.203) 21.107 3.919 ( -3.349 -0.000 -8.710) 9.332 4.021 ( 0.319 0.000 11.752) 11.756 4.538 ( -1.454 -0.000 -9.068) 9.184 4.627 ( -10.468 -0.000 -11.583) 15.612 5.106 ( -15.462 -0.000 6.557) 16.795 5.325 ( -1.715 -0.000 4.455) 4.773 5.733 ( 7.606 0.000 20.808) 22.155 6.320 ( -10.541 -0.000 4.821) 11.591 6.320 ( -11.219 -0.000 15.508) 19.141 6.789 ( -1.383 -0.000 -0.952) 1.679 6.954 ( 3.270 0.000 -10.775) 11.260 7.421 ( -5.790 -0.000 23.909) 24.600 8.231 ( -11.048 -0.000 8.289) 13.812 9.355 ( 0.230 0.000 -5.813) 5.818 9.366 ( -0.228 -0.000 -0.355) 0.422 9.521 ( 8.823 0.000 6.475) 10.944 10.417 ( -8.064 -0.000 -6.940) 10.640 10.872 ( 22.948 0.000 3.407) 23.199 11.743 ( 7.199 0.000 -14.183) 15.905 12.033 ( 3.642 0.000 -4.121) 5.500 12.229 ( -7.287 -0.000 14.916) 16.600 13.053 ( -6.108 -0.000 -2.494) 6.598 13.311 ( 8.693 0.000 3.665) 9.434 14.396 ( -8.681 -0.000 -17.296) 19.353 18.498 ( 11.123 0.000 -10.568) 15.343 18.687 ( -13.589 -0.000 -11.077) 17.531 18.754 ( -13.703 -0.000 2.569) 13.942 19.605 ( -14.951 -0.000 0.415) 14.957 21.227 ( 15.527 0.000 12.681) 20.047 22.130 ( 0.125 0.000 -12.993) 12.993 23.166 ( 1.084 0.000 2.320) 2.560 23.825 ( 5.501 0.000 -1.356) 5.665 ======================= Grid point 221 (98/361) ======================= q-point: ( 0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 7.683 10.522 22.202) 25.742 2.621 ( 8.821 -12.853 19.037) 24.606 3.358 ( 2.207 3.457 -8.242) 9.206 3.634 ( -2.418 1.954 -0.210) 3.115 3.730 ( -1.468 2.694 -12.283) 12.661 4.228 ( 10.750 -1.141 5.343) 12.059 4.342 ( -2.120 5.221 -6.298) 8.451 4.504 ( -1.259 -10.649 -8.114) 13.447 5.045 ( -10.729 -2.712 10.013) 14.924 5.334 ( -7.858 -0.027 6.135) 9.969 6.013 ( 3.947 -0.787 5.468) 6.789 6.207 ( -9.495 -0.223 0.935) 9.543 6.391 ( -13.787 0.900 27.406) 30.692 6.734 ( -1.901 1.805 0.909) 2.775 6.895 ( 5.450 6.481 -3.529) 9.174 7.611 ( -4.416 6.009 19.876) 21.229 8.149 ( -17.098 -12.081 5.061) 21.539 9.263 ( -3.042 3.831 -0.900) 4.973 9.353 ( 1.027 2.558 -1.267) 3.033 9.848 ( 16.554 -3.240 9.730) 19.474 10.199 ( -8.023 -2.058 -8.024) 11.532 11.226 ( 18.646 3.111 3.371) 19.202 11.663 ( 8.247 2.671 -10.591) 13.686 12.047 ( 6.403 2.981 -2.096) 7.367 12.350 ( -6.208 -11.759 10.318) 16.831 12.921 ( -8.123 2.232 -1.152) 8.502 13.441 ( 7.051 -1.081 -3.496) 7.944 14.104 ( -7.097 1.406 -8.305) 11.014 18.298 ( -8.384 10.111 -8.917) 15.875 18.489 ( -1.672 -7.149 -11.116) 13.322 18.761 ( 2.193 -4.638 1.642) 5.386 19.379 ( -17.044 0.091 1.589) 17.118 21.518 ( 9.628 12.640 10.499) 19.044 22.031 ( 5.894 -9.826 -13.480) 17.692 23.241 ( 3.823 -2.996 1.565) 5.103 23.875 ( 4.362 1.239 -1.013) 4.646 ======================= Grid point 222 (99/361) ======================= q-point: ( 0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( -1.766 14.438 9.936) 17.616 3.094 ( 9.678 -11.580 15.736) 21.803 3.192 ( -7.643 4.187 -6.341) 10.777 3.507 ( -0.191 3.700 -6.247) 7.263 3.536 ( -5.257 2.196 -9.130) 10.762 4.210 ( 9.171 3.980 -13.081) 16.464 4.487 ( 1.631 -8.096 8.922) 12.158 4.532 ( 3.662 -10.396 -5.804) 12.456 5.026 ( -9.334 -1.608 4.377) 10.434 5.256 ( -13.056 -2.494 5.320) 14.317 5.938 ( -8.958 2.435 -5.554) 10.817 6.081 ( -6.911 -1.152 -3.202) 7.704 6.590 ( -11.478 1.330 28.349) 30.614 6.779 ( 0.817 0.801 11.095) 11.154 6.888 ( 2.122 9.563 4.576) 10.812 7.649 ( 0.508 7.301 2.881) 7.865 8.155 ( -15.696 -18.296 10.858) 26.439 9.178 ( -3.782 7.352 2.519) 8.643 9.327 ( 1.177 2.171 -1.179) 2.736 9.911 ( -7.042 -0.081 -8.273) 10.864 10.353 ( 15.394 -9.408 9.733) 20.499 11.265 ( 8.478 24.576 -3.698) 26.259 11.834 ( 14.318 -7.316 5.283) 16.925 12.093 ( 6.806 1.230 -3.161) 7.604 12.504 ( -3.268 -13.907 6.623) 15.747 12.767 ( -8.223 3.822 0.360) 9.075 13.377 ( -2.642 -0.517 -13.116) 13.389 14.047 ( 4.111 -1.588 2.362) 5.000 18.015 ( -6.299 2.986 -12.616) 14.414 18.406 ( -1.898 -4.561 -4.469) 6.662 18.868 ( 6.033 -1.585 0.102) 6.238 19.218 ( -9.984 -2.225 3.257) 10.735 21.476 ( 4.553 19.246 -5.965) 20.657 22.174 ( 3.741 -17.501 0.827) 17.916 23.359 ( 6.303 -2.919 1.601) 7.128 23.899 ( 2.948 3.192 -0.064) 4.345 ======================= Grid point 223 (100/361) ======================= q-point: (-0.60 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( -9.500 18.405 1.399) 20.759 2.915 ( -16.062 6.334 -4.032) 17.730 3.309 ( -0.707 3.680 -1.608) 4.077 3.453 ( -1.023 -1.580 -1.692) 2.531 3.501 ( 4.901 -12.580 2.661) 13.761 4.117 ( 4.814 7.990 -12.579) 15.660 4.551 ( -8.031 -3.539 1.777) 8.954 4.680 ( 2.142 -13.691 -0.419) 13.864 4.943 ( -5.879 -5.556 0.035) 8.089 5.194 ( -8.462 -5.339 4.465) 10.956 5.707 ( -11.759 4.103 -0.885) 12.485 5.956 ( -5.368 -0.189 -4.157) 6.792 6.634 ( -9.244 3.693 8.967) 13.397 6.880 ( -4.236 8.403 9.568) 13.420 6.999 ( -5.197 -3.626 22.777) 23.642 7.631 ( 5.012 1.502 -4.080) 6.635 8.253 ( -10.023 -14.391 9.219) 19.813 9.079 ( -4.374 10.614 3.888) 12.120 9.334 ( 2.204 -0.424 -0.166) 2.250 9.709 ( -8.589 -5.472 -8.847) 13.490 10.746 ( 14.004 -4.513 8.332) 16.908 11.076 ( 6.237 30.020 -2.049) 30.730 12.082 ( 3.898 0.168 -1.004) 4.029 12.171 ( 2.600 -0.367 8.023) 8.442 12.671 ( 2.339 -9.328 5.914) 11.289 12.693 ( 2.299 -1.480 -0.026) 2.734 13.131 ( -8.705 0.299 -11.459) 14.394 14.236 ( 11.775 -6.867 1.606) 13.725 17.722 ( -6.831 -0.644 -18.792) 20.005 18.462 ( 4.220 -2.584 6.213) 7.943 18.937 ( 2.239 -0.120 0.650) 2.334 19.238 ( 2.733 -4.234 2.692) 5.713 21.240 ( 2.344 15.733 -13.639) 20.954 22.374 ( -4.582 -16.890 5.762) 18.425 23.504 ( 7.619 -1.900 2.082) 8.124 23.909 ( 2.373 4.802 2.126) 5.763 ======================= Grid point 224 (101/361) ======================= q-point: (-0.50 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( -13.690 20.370 1.693) 24.601 2.529 ( -20.434 11.450 -3.877) 23.742 3.319 ( 1.773 -3.597 2.761) 4.869 3.409 ( -5.345 -0.582 -2.513) 5.934 3.600 ( -2.481 -2.769 -5.460) 6.606 3.885 ( -9.661 6.031 -2.279) 11.615 4.428 ( -10.224 -3.642 -1.496) 10.956 4.790 ( -2.444 -12.068 1.006) 12.354 5.027 ( 5.897 -8.471 0.473) 10.332 5.230 ( -3.304 -7.328 4.111) 9.029 5.543 ( -10.906 -1.993 2.192) 11.301 5.845 ( -3.052 1.599 -2.458) 4.233 6.530 ( -12.636 1.786 3.724) 13.294 6.829 ( -10.886 6.616 11.010) 16.837 7.206 ( -6.305 -5.696 16.680) 18.720 7.667 ( 6.423 -1.674 -4.477) 8.006 8.339 ( -4.818 -9.232 4.327) 11.276 8.973 ( -3.619 10.422 4.972) 12.101 9.380 ( 3.295 -1.115 -0.648) 3.538 9.592 ( -6.267 -10.401 -3.764) 12.713 10.841 ( 4.886 28.158 -3.430) 28.784 11.030 ( 9.374 2.888 6.736) 11.898 12.040 ( -3.915 3.192 -1.345) 5.227 12.182 ( -9.071 4.562 7.868) 12.845 12.745 ( 1.108 -4.173 -11.631) 12.407 12.888 ( 1.052 -5.648 1.912) 6.055 13.020 ( 10.201 -1.337 10.352) 14.595 14.505 ( 14.983 -11.297 -2.613) 18.945 17.394 ( -6.414 -0.288 -19.231) 20.275 18.693 ( 8.326 -1.838 11.981) 14.706 18.969 ( 3.160 1.627 0.047) 3.554 19.398 ( 9.518 -3.680 2.436) 10.491 20.943 ( -0.098 12.030 -16.736) 20.611 22.467 ( -13.572 -17.053 5.333) 22.438 23.634 ( 6.579 0.490 0.317) 6.605 23.966 ( 3.483 3.038 8.097) 9.323 ======================= Grid point 225 (102/361) ======================= q-point: (-0.40 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.662 ( -15.703 20.655 7.133) 26.909 2.041 ( -24.726 14.318 -5.606) 29.117 3.045 ( -18.445 27.790 0.771) 33.363 3.494 ( -8.120 -7.445 -0.835) 11.048 3.525 ( 1.166 -12.732 7.442) 14.793 3.795 ( -4.649 -3.088 0.857) 5.647 4.357 ( -5.219 -7.841 1.491) 9.536 4.870 ( -0.130 -6.603 0.913) 6.667 5.205 ( 6.459 -8.760 -0.115) 10.884 5.274 ( -6.270 -6.334 4.656) 10.055 5.498 ( -8.987 -12.782 0.948) 15.654 5.809 ( 1.468 2.445 2.193) 3.598 6.346 ( -19.237 -3.338 2.659) 19.705 6.748 ( -10.199 4.545 8.734) 14.176 7.307 ( -9.448 -4.745 9.171) 13.996 7.707 ( 6.392 -2.593 -6.827) 9.705 8.385 ( 0.738 -0.568 0.530) 1.071 8.960 ( -1.619 1.630 8.468) 8.774 9.415 ( 3.688 0.689 -1.447) 4.021 9.630 ( -3.983 -14.929 1.508) 15.525 10.581 ( 1.549 27.453 -5.266) 27.997 11.157 ( 4.818 7.284 4.938) 10.032 11.903 ( -10.949 4.352 2.863) 12.125 12.108 ( -6.301 3.064 3.825) 7.982 12.577 ( -3.800 -0.848 -8.903) 9.718 13.007 ( 2.723 -8.604 0.914) 9.071 13.371 ( 16.967 2.959 8.686) 19.290 14.773 ( 15.320 -13.860 -7.803) 22.083 17.121 ( -4.244 0.995 -9.670) 10.607 18.964 ( 7.597 0.692 10.475) 12.958 19.000 ( 7.345 4.379 -2.200) 8.829 19.610 ( 12.392 -0.163 3.725) 12.941 20.629 ( -2.133 7.610 -16.728) 18.501 22.440 ( -21.297 -19.181 4.592) 29.027 23.677 ( 4.941 3.544 -2.317) 6.507 24.151 ( 3.360 -2.242 12.701) 13.328 ======================= Grid point 226 (103/361) ======================= q-point: (-0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( -15.151 19.637 13.790) 28.378 1.465 ( -26.229 18.415 -2.312) 32.131 2.600 ( -21.955 31.607 20.553) 43.629 3.445 ( -8.079 -8.579 -0.269) 11.787 3.741 ( -0.098 -11.627 7.361) 13.761 3.769 ( -3.130 -0.927 0.924) 3.393 4.457 ( 2.119 -10.761 0.514) 10.980 4.943 ( 0.736 -5.646 3.294) 6.578 5.307 ( -1.421 -11.970 -0.177) 12.055 5.358 ( -4.390 -7.735 6.014) 10.736 5.498 ( -6.055 -9.925 1.070) 11.675 5.870 ( -1.402 -0.843 5.924) 6.146 6.167 ( -18.746 -9.865 5.229) 21.819 6.670 ( -7.247 2.976 3.721) 8.673 7.253 ( -13.781 -2.577 5.251) 14.971 7.737 ( 6.359 -2.760 -7.172) 9.975 8.386 ( 6.678 8.002 -4.136) 11.214 9.050 ( -1.731 -7.738 2.162) 8.218 9.479 ( 5.164 2.095 5.538) 7.857 9.724 ( -6.649 -16.361 0.599) 17.671 10.271 ( -2.259 24.429 -5.696) 25.186 11.163 ( 1.265 13.120 4.479) 13.921 11.763 ( -11.496 1.855 6.312) 13.245 12.041 ( -4.561 1.456 0.929) 4.877 12.485 ( -0.626 -1.089 -2.718) 2.995 13.106 ( 2.382 -7.233 -3.144) 8.238 13.549 ( 12.073 10.183 -7.183) 17.351 14.973 ( 12.122 -13.955 -12.157) 22.125 17.147 ( 5.168 -5.187 15.910) 17.514 19.029 ( 13.685 9.284 -5.657) 17.478 19.128 ( 3.851 1.813 3.598) 5.574 19.811 ( 10.144 7.380 6.369) 14.069 20.374 ( -0.381 0.623 -13.979) 13.998 22.355 ( -27.558 -24.351 6.943) 37.425 23.678 ( 4.553 3.659 -2.528) 6.364 24.332 ( -2.370 -5.147 6.119) 8.340 ======================= Grid point 227 (104/361) ======================= q-point: (-0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.106 ( -5.400 20.076 17.575) 27.223 1.238 ( -12.090 16.275 19.832) 28.361 2.404 ( -19.510 25.872 37.926) 49.883 3.417 ( -4.506 -6.922 -1.374) 8.373 3.767 ( 0.035 0.626 4.168) 4.215 3.911 ( -2.073 -9.786 6.379) 11.864 4.544 ( 3.399 -8.872 -6.072) 11.275 5.035 ( -2.765 -6.094 0.526) 6.713 5.297 ( -3.015 -4.115 -2.634) 5.741 5.449 ( -0.586 -4.405 -2.077) 4.905 5.655 ( -7.923 -23.966 21.269) 33.007 5.856 ( -17.786 -6.324 7.855) 20.446 6.178 ( -5.007 -8.078 8.408) 12.689 6.587 ( -3.313 1.772 -0.909) 3.866 7.147 ( -12.710 -1.745 6.085) 14.199 7.718 ( 0.761 -0.049 -9.256) 9.287 8.289 ( 7.007 16.859 -8.713) 20.230 9.109 ( -0.956 -10.242 0.637) 10.306 9.602 ( 2.468 4.880 1.526) 5.677 9.737 ( -10.184 -18.738 0.281) 21.328 9.987 ( 0.932 23.239 -0.601) 23.265 11.075 ( -0.039 18.209 3.231) 18.494 11.742 ( -7.556 -4.235 10.696) 13.764 11.973 ( -2.676 0.920 -2.273) 3.630 12.474 ( 1.346 1.816 -2.358) 3.266 13.096 ( 1.346 -0.615 -9.891) 10.001 13.378 ( 2.034 14.381 -9.799) 17.521 15.051 ( 6.185 -11.702 -15.661) 20.505 17.744 ( 15.470 -24.177 24.812) 37.940 19.089 ( 6.090 -2.434 -7.193) 9.734 19.179 ( 18.775 12.634 -1.261) 22.665 19.844 ( -1.538 12.674 3.107) 13.139 20.324 ( 8.979 -3.345 -5.769) 11.184 22.301 ( -31.123 -31.260 11.601) 45.612 23.685 ( 4.382 2.412 -2.084) 5.419 24.197 ( -17.292 4.513 -10.058) 20.507 ======================= Grid point 228 (105/361) ======================= q-point: (-0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.266 ( -6.099 9.337 25.794) 28.102 1.365 ( 15.117 9.593 25.387) 31.066 2.533 ( -6.525 17.307 45.642) 49.248 3.403 ( -0.252 -4.226 -3.838) 5.714 3.851 ( -0.971 -0.859 7.941) 8.046 4.006 ( -3.390 -6.985 3.054) 8.344 4.596 ( 4.144 -7.184 -6.101) 10.296 5.061 ( 1.857 -1.840 6.426) 6.937 5.238 ( -7.512 -3.295 -5.048) 9.632 5.395 ( -3.611 -1.592 -4.413) 5.920 5.657 ( -30.315 -7.108 6.635) 31.836 6.100 ( -3.270 -19.998 23.180) 30.788 6.289 ( -3.330 -6.732 7.453) 10.581 6.547 ( -0.358 -0.455 0.879) 1.052 7.095 ( -5.422 -1.825 3.450) 6.681 7.491 ( -4.912 11.366 -10.388) 16.162 8.189 ( 4.052 13.313 4.631) 14.667 9.237 ( 0.677 -9.740 3.502) 10.373 9.466 ( -2.054 8.105 -6.265) 10.448 9.692 ( -9.455 -0.388 -1.137) 9.531 10.039 ( 14.627 -2.268 3.470) 15.203 10.925 ( 0.326 20.559 0.654) 20.572 11.853 ( -6.341 -9.238 10.892) 15.627 11.891 ( 1.280 0.714 -7.539) 7.680 12.374 ( 0.469 11.590 -4.905) 12.594 13.020 ( 3.969 3.505 0.099) 5.296 13.245 ( -1.780 2.871 -2.518) 4.213 14.964 ( -0.182 -7.567 -19.557) 20.971 18.267 ( 8.185 -16.125 1.244) 18.126 19.003 ( -11.468 -12.126 -7.369) 18.244 19.422 ( 14.109 7.719 -3.967) 16.564 19.710 ( 4.955 10.099 -2.240) 11.470 20.502 ( 13.069 -3.892 3.937) 14.193 22.321 ( -26.972 -31.436 10.247) 42.670 23.608 ( -19.832 23.448 -9.159) 32.047 23.714 ( 4.316 1.961 -1.864) 5.094 ======================= Grid point 231 (106/361) ======================= q-point: ( 0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.712 ( -2.682 -0.000 10.187) 10.535 2.906 ( 11.193 0.000 17.884) 21.097 3.236 ( -7.011 -0.000 -6.376) 9.477 3.537 ( -5.674 -0.000 -6.567) 8.679 3.573 ( -0.389 -0.000 -12.315) 12.321 4.304 ( 6.326 0.000 -10.478) 12.240 4.371 ( 5.133 0.000 -5.051) 7.201 4.405 ( 2.559 0.000 5.979) 6.503 5.025 ( -6.949 -0.000 7.113) 9.944 5.228 ( -14.813 -0.000 2.895) 15.093 5.960 ( -6.787 -0.000 -5.413) 8.681 6.067 ( -7.135 -0.000 -3.319) 7.869 6.604 ( -12.890 -0.000 30.820) 33.407 6.790 ( -0.220 -0.000 10.313) 10.315 6.982 ( 6.178 0.000 -2.042) 6.507 7.836 ( -5.981 -0.000 20.514) 21.368 7.856 ( -15.344 -0.000 -0.722) 15.360 9.238 ( -2.992 -0.000 1.784) 3.484 9.357 ( -1.420 -0.000 -0.918) 1.691 9.924 ( -9.357 -0.000 -11.457) 14.792 10.254 ( 19.924 0.000 13.012) 23.796 11.607 ( 18.519 0.000 8.148) 20.232 11.685 ( 12.794 0.000 -10.016) 16.249 12.117 ( 5.444 0.000 -2.793) 6.118 12.328 ( -6.299 -0.000 11.248) 12.892 12.804 ( -9.111 -0.000 0.473) 9.123 13.371 ( -1.483 -0.000 -13.374) 13.456 14.032 ( 1.915 0.000 1.458) 2.407 18.053 ( -8.086 -0.000 -17.807) 19.556 18.343 ( -3.482 -0.000 2.392) 4.225 18.866 ( 11.400 0.000 -2.379) 11.646 19.194 ( -11.445 -0.000 2.577) 11.731 21.800 ( 3.702 0.000 -21.138) 21.460 21.869 ( 3.392 0.000 15.429) 15.797 23.331 ( 6.597 0.000 2.691) 7.125 23.928 ( 3.397 0.000 -0.209) 3.404 ======================= Grid point 232 (107/361) ======================= q-point: (-0.70 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.641 ( -8.025 13.730 2.641) 16.121 2.950 ( -12.199 -2.434 -6.266) 13.928 3.281 ( 2.504 -7.972 -0.541) 8.373 3.355 ( -6.884 0.805 -6.675) 9.622 3.481 ( 1.688 2.151 5.780) 6.394 4.256 ( 9.964 7.285 -13.092) 17.993 4.450 ( -7.429 -5.655 8.061) 12.335 4.468 ( 4.799 -8.746 -4.191) 10.820 4.950 ( -10.271 5.290 -0.404) 11.561 5.077 ( -9.356 -7.383 2.394) 12.156 5.765 ( -11.012 1.959 -3.150) 11.620 5.944 ( -4.312 -0.662 -3.864) 5.828 6.700 ( -13.624 2.650 16.975) 21.927 6.958 ( -5.073 -0.888 19.775) 20.434 6.987 ( -0.868 2.852 -0.368) 3.004 7.672 ( -4.007 2.708 -1.218) 4.988 8.020 ( -6.369 -9.113 13.697) 17.642 9.210 ( -4.230 3.668 3.907) 6.827 9.315 ( -2.617 -1.201 -0.307) 2.896 9.667 ( -6.257 -0.129 -11.882) 13.429 10.685 ( 16.985 -1.939 11.598) 20.658 11.610 ( 10.700 27.068 -2.170) 29.187 12.015 ( 10.634 -10.829 4.258) 15.763 12.147 ( 3.799 -0.990 -1.070) 4.069 12.451 ( -3.622 -8.944 10.304) 14.117 12.716 ( -0.916 0.990 2.260) 2.632 13.130 ( -7.557 -0.134 -13.587) 15.548 14.144 ( 9.451 -2.832 -0.080) 9.867 17.715 ( -7.380 -0.174 -19.284) 20.649 18.415 ( 2.097 -1.740 9.674) 10.050 18.974 ( 10.666 2.735 -4.201) 11.785 19.162 ( 0.245 -3.388 3.533) 4.901 21.504 ( 0.675 11.402 -19.617) 22.700 22.099 ( -4.619 -11.521 10.823) 16.468 23.478 ( 7.451 -0.821 3.992) 8.493 23.967 ( 2.711 1.668 1.050) 3.351 ======================= Grid point 233 (108/361) ======================= q-point: (-0.60 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.364 ( -10.459 18.801 -0.270) 21.516 2.678 ( -16.250 4.941 -4.497) 17.570 3.208 ( -4.823 -6.047 -2.204) 8.043 3.282 ( -6.270 -11.068 -4.434) 13.471 3.633 ( 3.949 3.380 7.491) 9.118 4.057 ( -3.750 8.828 -14.349) 17.259 4.400 ( -15.187 2.289 3.076) 15.663 4.576 ( 1.460 -9.540 2.474) 9.963 4.853 ( -0.495 -10.632 -0.561) 10.658 5.099 ( -2.069 -6.164 2.328) 6.906 5.551 ( -13.114 1.496 -1.566) 13.291 5.866 ( -1.154 0.829 -2.206) 2.624 6.592 ( -19.288 4.368 9.356) 21.878 6.905 ( -9.892 1.624 3.932) 10.768 7.134 ( -3.658 -2.554 15.297) 15.934 7.636 ( 2.413 -1.230 -3.488) 4.417 8.161 ( -4.347 -8.244 9.413) 13.246 9.146 ( -4.904 6.969 4.139) 9.473 9.309 ( -3.169 -5.953 0.064) 6.744 9.488 ( -1.474 -0.973 -8.000) 8.193 11.019 ( 12.103 0.641 7.932) 14.485 11.445 ( 6.972 32.394 -0.383) 33.138 12.084 ( 0.558 1.379 -3.772) 4.055 12.235 ( -8.229 -0.137 8.385) 11.749 12.561 ( -1.049 -14.620 -0.081) 14.658 12.846 ( -4.034 0.265 -7.858) 8.837 12.974 ( 13.172 -3.001 9.499) 16.515 14.324 ( 13.261 -7.889 -4.991) 16.217 17.391 ( -6.245 -0.107 -17.678) 18.749 18.658 ( 7.663 -1.660 15.009) 16.933 19.030 ( 10.345 4.212 -4.804) 12.158 19.324 ( 10.451 -4.209 3.609) 11.831 21.150 ( -2.615 10.123 -20.084) 22.642 22.195 ( -13.163 -12.437 7.457) 19.584 23.636 ( 6.030 -0.130 4.690) 7.641 24.012 ( 2.977 1.935 3.289) 4.840 ======================= Grid point 234 (109/361) ======================= q-point: (-0.50 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -10.927 21.125 2.944) 23.965 2.287 ( -19.317 12.965 -5.056) 23.808 3.230 ( -9.281 -10.902 -0.727) 14.336 3.294 ( -1.104 -12.804 5.537) 13.993 3.604 ( -6.198 21.230 -1.847) 22.193 3.761 ( -6.557 -0.088 -0.760) 6.601 4.226 ( -9.454 -5.117 0.352) 10.756 4.714 ( 0.658 -9.019 2.408) 9.359 5.004 ( 2.362 -14.488 0.296) 14.682 5.152 ( -3.792 -6.389 0.995) 7.496 5.359 ( -12.632 -2.758 2.572) 13.182 5.853 ( 2.566 2.293 0.999) 3.583 6.334 ( -25.987 1.219 5.851) 26.666 6.794 ( -9.418 0.530 2.504) 9.760 7.254 ( -4.818 -1.527 9.729) 10.963 7.645 ( 4.463 -3.504 -6.758) 8.824 8.291 ( -2.245 -6.802 8.734) 11.295 9.057 ( -3.530 6.733 1.761) 7.803 9.333 ( -4.936 -12.124 -0.032) 13.090 9.455 ( 2.520 -0.338 -0.463) 2.585 11.119 ( 5.691 23.869 -2.567) 24.672 11.307 ( 5.825 15.202 6.974) 17.711 11.990 ( -5.821 4.271 -0.892) 7.275 12.159 ( -10.647 2.444 6.181) 12.551 12.559 ( -1.946 -1.999 -9.741) 10.133 12.808 ( -0.281 -13.219 0.734) 13.243 13.374 ( 16.799 -1.522 10.346) 19.788 14.524 ( 14.529 -12.729 -9.936) 21.722 17.137 ( -3.628 0.729 -10.379) 11.019 18.976 ( 8.854 0.574 14.163) 16.713 19.076 ( 12.400 3.782 -7.309) 14.883 19.601 ( 16.827 -0.837 6.083) 17.912 20.769 ( -5.645 7.467 -19.487) 21.618 22.142 ( -20.903 -13.629 4.717) 25.395 23.735 ( 3.298 2.699 2.257) 4.822 24.116 ( 2.998 -1.576 6.835) 7.628 ======================= Grid point 235 (110/361) ======================= q-point: (-0.40 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( -10.718 21.467 7.122) 25.028 1.824 ( -16.958 21.261 0.461) 27.199 3.116 ( -12.440 16.139 7.072) 21.569 3.300 ( -11.997 0.199 1.926) 12.153 3.502 ( -1.106 -14.260 8.259) 16.516 3.753 ( -0.029 -0.473 1.246) 1.333 4.265 ( 1.460 -10.365 1.341) 10.553 4.807 ( -1.290 -8.556 1.733) 8.824 5.046 ( -9.589 -14.482 -4.743) 18.005 5.197 ( -4.855 -10.752 7.159) 13.800 5.364 ( -5.086 -4.384 8.075) 10.502 5.892 ( -2.531 2.222 4.122) 5.323 6.060 ( -18.067 -3.333 5.314) 19.125 6.696 ( -5.952 -0.486 -1.092) 6.071 7.244 ( -8.441 1.518 4.636) 9.749 7.664 ( 5.638 -4.718 -7.889) 10.783 8.431 ( 0.924 -2.777 7.969) 8.489 8.972 ( -3.496 0.238 -2.925) 4.565 9.375 ( -7.835 -15.736 0.480) 17.586 9.538 ( 4.505 0.659 5.573) 7.197 10.838 ( 2.632 34.353 -4.820) 34.789 11.369 ( 2.702 9.880 7.488) 12.688 11.848 ( -8.348 6.009 2.941) 10.698 12.070 ( -7.176 1.531 2.716) 7.824 12.472 ( 0.803 -0.391 -3.309) 3.428 12.932 ( 1.477 -12.324 -2.618) 12.685 13.641 ( 10.222 1.479 -0.377) 10.335 14.701 ( 12.793 -15.359 -13.888) 24.340 17.086 ( 2.359 -1.960 5.655) 6.433 19.070 ( 6.303 -0.668 -9.342) 11.289 19.250 ( 14.457 7.729 5.316) 17.233 19.935 ( 18.834 5.868 9.401) 21.853 20.402 ( -6.943 2.607 -17.168) 18.701 21.998 ( -26.069 -15.659 5.637) 30.929 23.750 ( 2.064 4.132 0.047) 4.620 24.246 ( -0.982 -4.439 5.029) 6.779 ======================= Grid point 236 (111/361) ======================= q-point: (-0.30 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( -5.520 22.558 12.371) 26.313 1.591 ( -5.527 22.691 11.987) 26.251 2.895 ( -12.611 26.447 23.196) 37.370 3.262 ( -5.370 -9.986 0.243) 11.341 3.701 ( -2.046 -13.040 7.375) 15.120 3.781 ( 0.720 0.995 3.359) 3.576 4.378 ( 4.423 -9.049 -6.019) 11.733 4.894 ( -4.039 -9.107 4.707) 11.018 5.069 ( -10.068 -22.173 3.589) 24.615 5.280 ( -10.490 -8.905 10.473) 17.292 5.397 ( -8.338 -3.509 6.878) 11.364 5.844 ( -7.552 -1.073 9.202) 11.952 6.083 ( 1.034 -2.698 5.178) 5.930 6.608 ( -2.325 -0.320 -4.055) 4.685 7.146 ( -8.943 2.075 3.714) 9.904 7.670 ( 2.167 -4.223 -8.438) 9.681 8.518 ( 3.829 8.059 1.730) 9.088 8.910 ( -3.938 -9.773 -1.917) 10.710 9.405 ( -7.959 -16.826 -0.778) 18.630 9.666 ( 2.712 2.329 6.704) 7.598 10.509 ( 2.386 32.940 -3.599) 33.222 11.370 ( -0.145 13.654 6.777) 15.244 11.753 ( -5.694 4.040 6.178) 9.323 11.994 ( -4.383 1.413 0.090) 4.606 12.495 ( 3.957 1.119 0.639) 4.161 12.992 ( 0.917 -9.229 -6.054) 11.075 13.595 ( 1.162 8.142 -11.244) 13.931 14.802 ( 7.945 -15.296 -16.719) 24.013 17.411 ( 10.054 -13.140 19.946) 25.916 18.997 ( -1.160 -4.898 -13.088) 14.022 19.413 ( 20.262 10.985 -3.029) 23.246 20.035 ( -8.038 6.580 -3.280) 10.894 20.307 ( 15.533 3.259 1.951) 15.991 21.874 ( -24.870 -17.454 10.211) 32.053 23.737 ( 1.837 3.257 -0.790) 3.821 24.222 ( -9.165 -0.873 -3.549) 9.867 ======================= Grid point 237 (112/361) ======================= q-point: (-0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( -1.533 17.708 16.043) 23.944 1.596 ( 11.338 15.598 20.033) 27.806 2.912 ( -3.686 22.519 34.595) 41.443 3.292 ( -0.603 -7.859 -2.525) 8.276 3.836 ( -6.328 -3.500 10.733) 12.942 3.843 ( 1.545 -7.459 -0.380) 7.627 4.436 ( 4.629 -9.966 -7.692) 13.414 4.980 ( -9.079 -8.182 14.915) 19.283 5.121 ( -4.356 -9.396 -4.208) 11.179 5.378 ( -18.091 -15.837 17.453) 29.711 5.389 ( -2.297 -0.147 0.453) 2.345 5.952 ( 1.423 -2.331 14.026) 14.289 6.181 ( -3.020 -4.623 6.495) 8.525 6.549 ( -0.618 -0.194 -2.504) 2.587 7.074 ( -5.258 -0.079 2.373) 5.769 7.562 ( -4.109 -0.707 -10.285) 11.098 8.453 ( 2.663 14.133 1.356) 14.446 9.017 ( -0.375 -14.278 2.991) 14.593 9.448 ( -3.044 -12.948 -1.703) 13.410 9.686 ( -0.900 6.417 0.938) 6.548 10.269 ( 4.329 23.414 -0.370) 23.814 11.284 ( -1.151 17.674 3.996) 18.156 11.765 ( -4.567 -0.931 8.204) 9.436 11.911 ( -0.929 1.619 -5.452) 5.763 12.529 ( 4.538 6.394 -1.053) 7.911 13.004 ( 1.907 -5.081 -3.417) 6.413 13.366 ( -3.427 8.641 -6.714) 11.467 14.776 ( 1.855 -12.839 -19.754) 23.632 17.940 ( 10.035 -18.101 13.773) 24.860 18.815 ( -9.135 -8.734 -13.782) 18.700 19.551 ( 15.769 6.425 -7.079) 18.441 19.827 ( -8.005 1.473 -2.969) 8.664 20.510 ( 10.900 6.733 7.831) 15.016 21.898 ( -12.342 -16.640 11.550) 23.720 23.729 ( 1.467 1.518 -1.313) 2.486 23.919 ( -13.901 10.293 -9.135) 19.560 ======================= Grid point 238 (113/361) ======================= q-point: (-0.10 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( 2.389 9.393 21.605) 23.680 1.952 ( 17.128 9.433 19.757) 27.797 3.195 ( 6.649 14.455 32.428) 36.121 3.318 ( 2.567 -5.687 -5.022) 8.009 3.880 ( -6.495 -8.378 1.513) 10.708 3.903 ( -1.980 -2.460 5.611) 6.438 4.483 ( 1.420 -8.707 -6.875) 11.184 4.971 ( -15.099 -1.730 0.363) 15.202 5.230 ( 4.557 -3.943 8.606) 10.506 5.324 ( -0.499 2.399 -4.426) 5.059 5.427 ( -12.091 -2.198 19.185) 22.784 6.227 ( -9.000 -4.817 8.596) 13.346 6.265 ( 2.367 -10.456 18.101) 21.038 6.526 ( -3.236 -2.640 1.885) 4.582 7.012 ( -3.276 -1.652 -6.874) 7.792 7.401 ( -3.243 1.429 -2.235) 4.190 8.417 ( -0.221 12.490 8.160) 14.921 9.153 ( -1.175 -12.948 -0.029) 13.001 9.460 ( -0.428 1.443 -2.192) 2.659 9.620 ( -0.211 5.203 0.777) 5.265 10.222 ( 7.566 4.267 -0.598) 8.707 11.134 ( 0.556 19.466 0.727) 19.488 11.758 ( -6.370 -2.740 -1.596) 7.115 11.872 ( 5.667 -1.919 -3.715) 7.043 12.486 ( 2.018 12.313 1.790) 12.605 13.065 ( 0.494 -4.194 -0.245) 4.230 13.237 ( 0.347 4.279 0.930) 4.393 14.609 ( -3.725 -8.965 -20.766) 22.923 18.292 ( 9.578 -10.400 1.685) 14.239 18.598 ( -12.541 -11.574 -10.580) 20.079 19.420 ( -8.424 11.055 -7.815) 15.946 19.735 ( -7.454 -1.028 0.689) 7.556 20.756 ( 13.336 -2.500 9.243) 16.417 22.055 ( 1.332 -10.747 3.075) 11.257 23.495 ( -9.699 14.934 -5.929) 18.768 23.765 ( 3.711 0.458 -1.384) 3.988 ======================= Grid point 242 (114/361) ======================= q-point: ( 0.30 -0.70 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.602 ( -10.719 -0.000 1.307) 10.798 2.688 ( -11.330 -0.000 -5.756) 12.708 3.131 ( -6.087 -0.000 -4.457) 7.545 3.165 ( -9.709 -0.000 -4.755) 10.811 3.667 ( 2.768 0.000 9.426) 9.824 4.120 ( -3.402 -0.000 -17.792) 18.114 4.488 ( -0.167 -0.000 9.841) 9.843 4.489 ( 3.110 0.000 1.169) 3.322 4.706 ( -17.465 -0.000 -4.334) 17.995 5.039 ( 0.809 0.000 2.014) 2.171 5.568 ( -13.792 -0.000 -2.512) 14.019 5.874 ( -0.163 -0.000 -2.003) 2.010 6.642 ( -25.181 -0.000 14.579) 29.096 6.913 ( -5.085 -0.000 -3.699) 6.288 7.108 ( -2.938 -0.000 14.643) 14.935 7.627 ( -1.087 -0.000 -1.312) 1.704 8.083 ( -2.828 -0.000 11.508) 11.851 9.211 ( -5.444 -0.000 3.966) 6.736 9.242 ( -5.254 -0.000 -0.626) 5.291 9.490 ( -0.001 -0.000 -8.848) 8.848 11.023 ( 13.055 0.000 9.607) 16.209 11.919 ( 13.653 0.000 -5.593) 14.754 12.036 ( -1.424 -0.000 4.963) 5.163 12.140 ( 0.871 0.000 -1.823) 2.021 12.406 ( -13.778 -0.000 8.467) 16.172 12.856 ( -8.723 -0.000 -11.398) 14.353 12.939 ( 17.947 0.000 10.788) 20.939 14.249 ( 12.460 0.000 -5.771) 13.731 17.390 ( -6.137 -0.000 -17.177) 18.240 18.642 ( 7.951 0.000 16.106) 17.962 19.080 ( 13.281 0.000 -9.475) 16.315 19.275 ( 9.883 0.000 6.849) 12.024 21.255 ( -3.585 -0.000 -23.687) 23.957 22.070 ( -12.842 -0.000 10.532) 16.609 23.634 ( 5.840 0.000 6.185) 8.507 24.030 ( 2.803 0.000 1.783) 3.322 ======================= Grid point 244 (115/361) ======================= q-point: (-0.60 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( -8.842 14.777 0.435) 17.225 2.474 ( -12.216 5.549 -2.593) 13.665 3.020 ( -11.215 -8.999 -0.445) 14.386 3.082 ( -5.309 -8.813 4.321) 11.159 3.741 ( -1.701 0.409 2.376) 2.951 3.864 ( -3.000 2.834 -13.321) 13.946 4.300 ( -13.828 13.665 1.395) 19.491 4.595 ( 1.347 -3.522 4.085) 5.560 4.707 ( -0.381 -16.763 2.870) 17.012 5.074 ( -1.793 -2.248 -0.639) 2.946 5.343 ( -14.736 -0.075 2.530) 14.951 5.884 ( 3.414 0.971 0.409) 3.573 6.361 ( -32.311 1.130 8.597) 33.454 6.789 ( -5.632 -0.422 -4.159) 7.014 7.232 ( -1.300 -0.921 9.071) 9.210 7.605 ( 0.285 -0.903 -2.403) 2.583 8.199 ( -1.977 -2.837 10.745) 11.287 9.150 ( -5.981 2.686 0.627) 6.587 9.168 ( -4.769 -4.718 -2.056) 7.017 9.462 ( 3.154 0.273 0.115) 3.168 11.270 ( 8.679 2.034 6.871) 11.255 11.803 ( 4.626 28.706 -1.435) 29.112 12.038 ( -2.265 0.820 -3.353) 4.129 12.182 ( -9.056 -1.120 6.362) 11.124 12.400 ( -1.332 -16.044 -0.387) 16.104 12.641 ( -6.322 -2.685 -5.952) 9.089 13.346 ( 16.901 -1.044 11.183) 20.293 14.355 ( 13.920 -5.150 -10.944) 18.441 17.146 ( -3.207 0.264 -10.774) 11.244 18.983 ( 9.249 0.225 15.755) 18.270 19.126 ( 15.029 1.569 -11.760) 19.147 19.586 ( 19.138 -0.539 9.076) 21.188 20.873 ( -7.426 3.430 -22.457) 23.900 21.967 ( -19.841 -5.301 6.350) 21.496 23.769 ( 2.191 1.002 6.379) 6.818 24.096 ( 2.979 -0.565 2.339) 3.830 ======================= Grid point 245 (116/361) ======================= q-point: (-0.50 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( -9.352 17.934 1.979) 20.323 2.203 ( -8.032 19.524 4.048) 21.496 2.992 ( -9.788 -12.789 3.400) 16.460 3.215 ( -4.331 -15.231 6.775) 17.223 3.591 ( -7.402 11.640 -3.435) 14.215 3.767 ( 1.668 1.166 0.778) 2.179 4.146 ( -1.958 0.604 3.958) 4.457 4.676 ( -1.989 -5.024 4.215) 6.853 4.825 ( -5.970 -10.417 -8.532) 14.730 4.995 ( -9.366 -10.390 7.496) 15.870 5.318 ( -6.371 -1.296 11.628) 13.322 5.935 ( -4.349 2.411 3.246) 5.938 6.017 ( -18.562 -1.888 4.551) 19.204 6.669 ( -3.903 -1.774 -5.956) 7.338 7.281 ( -3.671 1.599 4.223) 5.820 7.596 ( 2.393 -2.256 -4.123) 5.274 8.341 ( -1.888 -5.251 11.159) 12.477 9.024 ( -5.155 3.582 -3.409) 7.143 9.144 ( -5.136 -8.905 -1.093) 10.338 9.552 ( 3.764 0.425 6.465) 7.494 11.358 ( 5.381 15.687 -0.237) 16.585 11.595 ( 0.766 21.605 3.322) 21.872 11.936 ( -4.366 3.154 -1.727) 5.656 12.101 ( -10.644 2.314 6.784) 12.832 12.460 ( 2.828 -2.338 -3.821) 5.297 12.662 ( -0.554 -16.616 -1.007) 16.656 13.640 ( 8.844 -0.799 4.126) 9.792 14.460 ( 13.318 -10.280 -14.950) 22.507 17.066 ( 1.942 -0.489 0.519) 2.069 19.057 ( 5.792 -0.656 -13.067) 14.308 19.356 ( 16.035 3.989 7.367) 18.092 20.011 ( 24.141 2.658 10.887) 26.616 20.459 ( -10.290 3.107 -19.459) 22.230 21.785 ( -23.586 -8.042 5.595) 25.540 23.819 ( -0.776 3.204 3.552) 4.846 24.176 ( 0.946 -3.208 2.097) 3.947 ======================= Grid point 246 (117/361) ======================= q-point: (-0.40 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.892 ( -5.051 20.675 7.871) 22.691 2.026 ( -1.018 24.754 8.584) 26.220 3.047 ( -5.407 -11.783 4.276) 13.651 3.243 ( -9.282 2.097 4.661) 10.596 3.516 ( 0.423 -0.681 9.354) 9.388 3.807 ( 0.926 1.581 3.892) 4.302 4.242 ( 4.832 -5.049 -2.161) 7.315 4.683 ( -18.047 -15.621 5.281) 24.446 4.765 ( -0.364 -7.341 5.339) 9.085 5.129 ( -4.028 -9.331 7.051) 12.369 5.347 ( -11.868 -2.135 11.350) 16.560 5.805 ( -8.513 -2.525 7.377) 11.544 6.068 ( 3.650 0.305 3.600) 5.136 6.573 ( -1.153 -3.017 -7.164) 7.858 7.213 ( -5.979 4.438 1.608) 7.618 7.599 ( 2.193 -2.879 -5.883) 6.907 8.511 ( -1.089 -7.746 10.254) 12.897 8.865 ( -4.822 4.251 -4.650) 7.934 9.153 ( -4.112 -10.944 -1.023) 11.736 9.692 ( 2.395 0.766 8.845) 9.195 11.117 ( 2.635 32.925 -6.105) 33.590 11.556 ( -2.048 7.728 7.667) 11.077 11.838 ( -2.778 4.092 -0.200) 4.950 12.027 ( -7.459 2.446 5.239) 9.438 12.517 ( 6.175 0.926 1.603) 6.447 12.779 ( 0.501 -14.312 -3.353) 14.708 13.681 ( -0.755 2.127 -5.634) 6.070 14.534 ( 9.894 -13.459 -17.842) 24.441 17.249 ( 8.217 -5.647 13.073) 16.441 18.923 ( -0.109 -3.309 -18.205) 18.504 19.570 ( 15.198 6.540 -0.598) 16.556 20.072 ( -11.959 -0.491 -15.059) 19.236 20.441 ( 22.332 9.284 12.317) 27.141 21.635 ( -19.812 -9.840 8.730) 23.782 23.796 ( -1.651 3.149 1.048) 3.706 24.188 ( -4.203 -2.422 -2.109) 5.289 ======================= Grid point 247 (118/361) ======================= q-point: (-0.30 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 6.248 17.859 10.852) 21.811 1.932 ( 2.620 22.565 11.545) 25.482 3.125 ( -0.973 -9.807 -0.919) 9.898 3.244 ( -2.066 9.536 18.951) 21.315 3.666 ( 0.500 -6.315 5.489) 8.382 3.850 ( -3.829 1.846 8.850) 9.818 4.266 ( 4.018 -7.997 -9.068) 12.741 4.761 ( -16.002 -14.766 20.582) 29.962 4.935 ( 1.386 -9.333 7.298) 11.928 5.203 ( -4.133 -5.640 6.736) 9.709 5.367 ( -4.947 -2.557 7.140) 9.055 5.890 ( -1.515 -4.262 9.816) 10.808 6.145 ( 0.288 0.143 4.639) 4.650 6.523 ( 1.326 -2.828 -5.464) 6.294 7.104 ( -5.637 3.172 0.298) 6.475 7.535 ( -2.089 -1.010 -8.001) 8.331 8.662 ( 1.571 5.040 5.085) 7.330 8.755 ( -4.936 -10.319 0.693) 11.460 9.215 ( 0.345 -11.322 -0.372) 11.333 9.785 ( -0.722 3.976 6.974) 8.061 10.778 ( 1.899 31.382 -5.694) 31.951 11.519 ( -5.520 8.253 5.954) 11.578 11.793 ( 0.311 2.970 1.076) 3.174 11.956 ( -4.662 3.695 0.639) 5.983 12.615 ( 6.624 2.510 0.152) 7.085 12.874 ( 2.466 -8.256 0.586) 8.636 13.492 ( -6.765 4.845 -8.052) 11.579 14.528 ( 4.525 -13.927 -20.386) 25.100 17.665 ( 10.704 -11.957 16.763) 23.206 18.684 ( -6.721 -5.928 -18.493) 20.550 19.643 ( 9.461 3.530 -11.247) 15.115 19.800 ( -9.601 -2.520 -3.352) 10.477 20.719 ( 11.544 14.652 10.792) 21.551 21.668 ( -3.888 -10.255 10.054) 14.878 23.755 ( -1.773 1.326 -0.455) 2.260 24.033 ( -8.475 3.400 -7.240) 11.653 ======================= Grid point 248 (119/361) ======================= q-point: (-0.20 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( 4.591 18.244 11.365) 21.979 2.121 ( 15.983 9.186 15.959) 24.383 3.180 ( 2.274 -7.989 -4.613) 9.501 3.417 ( 0.872 4.258 17.473) 18.005 3.743 ( -0.284 -4.423 -0.990) 4.541 3.894 ( -6.358 2.851 15.481) 16.977 4.322 ( 5.296 -8.730 -6.434) 12.069 4.919 ( -10.176 -4.910 13.765) 17.808 5.124 ( 1.892 -6.921 9.364) 11.797 5.311 ( -1.955 -5.008 8.936) 10.429 5.403 ( -2.878 0.835 9.287) 9.758 6.047 ( -1.860 -9.261 8.043) 12.407 6.203 ( -2.799 -0.875 10.208) 10.621 6.515 ( 0.134 -0.468 -0.989) 1.102 6.993 ( -5.310 -0.381 -5.809) 7.880 7.402 ( -2.789 0.318 -5.174) 5.887 8.626 ( -0.643 10.044 5.103) 11.285 8.881 ( -2.386 -16.809 1.281) 17.026 9.343 ( 2.442 -9.900 0.455) 10.207 9.776 ( -0.524 9.230 4.617) 10.334 10.497 ( 2.410 23.387 -4.067) 23.860 11.394 ( -7.920 8.380 1.380) 11.613 11.785 ( -4.488 6.097 4.174) 8.645 11.864 ( 6.036 0.896 -8.323) 10.320 12.650 ( 4.050 4.542 -0.441) 6.101 12.993 ( 0.828 -2.466 2.649) 3.712 13.304 ( -3.201 2.711 -0.774) 4.265 14.414 ( -0.890 -12.210 -21.309) 24.576 18.087 ( 9.021 -11.302 10.471) 17.854 18.429 ( -8.394 -7.464 -14.321) 18.200 19.497 ( -6.439 -2.743 -10.545) 12.656 19.735 ( -5.767 2.106 1.847) 6.411 20.820 ( 6.373 9.597 7.483) 13.738 21.910 ( 10.567 -6.216 6.022) 13.659 23.673 ( -6.999 4.003 -4.775) 9.371 23.803 ( -1.416 4.603 -4.597) 6.658 ======================= Grid point 249 (120/361) ======================= q-point: (-0.10 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( 4.599 7.449 15.634) 17.918 2.497 ( 18.018 7.736 16.233) 25.456 3.224 ( 4.028 -7.198 -6.292) 10.374 3.539 ( -3.549 -5.971 3.671) 7.856 3.730 ( -2.318 -3.747 -3.484) 5.617 4.052 ( 4.912 5.266 17.035) 18.494 4.362 ( 3.396 -3.193 -6.779) 8.227 4.853 ( -6.619 6.304 -0.242) 9.144 5.271 ( -10.061 0.809 13.999) 17.258 5.297 ( -1.173 1.565 -1.474) 2.449 5.707 ( 6.353 -2.683 27.124) 27.987 6.126 ( -8.207 -8.578 5.571) 13.114 6.410 ( -0.565 -11.827 13.713) 18.118 6.479 ( -6.045 4.223 3.657) 8.232 6.815 ( -4.423 -2.251 -10.684) 11.780 7.382 ( 1.951 -2.616 0.843) 3.371 8.579 ( -6.462 9.946 8.107) 14.367 8.996 ( -1.501 -14.356 -0.277) 14.436 9.399 ( -2.382 -2.538 -2.045) 4.037 9.786 ( 5.858 8.246 5.509) 11.518 10.349 ( 4.469 11.509 -2.221) 12.544 11.199 ( -7.793 3.737 -4.375) 9.687 11.688 ( 0.983 7.394 -1.314) 7.574 11.918 ( 9.052 -0.964 -3.871) 9.892 12.648 ( 1.133 8.968 3.604) 9.731 12.943 ( -8.282 -4.176 -2.678) 9.654 13.374 ( 7.383 2.728 5.539) 9.625 14.223 ( -4.739 -9.160 -18.029) 20.770 18.244 ( -8.880 -8.241 -6.237) 13.626 18.374 ( 10.853 -6.818 -0.659) 12.834 19.259 ( -8.502 5.642 -10.420) 14.584 19.586 ( -18.050 2.721 6.350) 19.327 20.981 ( 9.794 -4.554 4.130) 11.564 22.147 ( 13.173 1.301 -0.108) 13.237 23.445 ( -3.613 9.130 -4.745) 10.905 23.785 ( 2.327 -1.725 -1.570) 3.295 ======================= Grid point 254 (121/361) ======================= q-point: ( 0.40 -0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( -7.681 -0.000 -0.348) 7.689 2.421 ( -3.606 -0.000 5.380) 6.477 2.837 ( -10.989 -0.000 5.194) 12.154 3.034 ( -6.577 -0.000 6.985) 9.594 3.686 ( -4.124 -0.000 -1.066) 4.259 3.748 ( 3.853 0.000 -8.332) 9.180 4.226 ( -7.927 -0.000 2.582) 8.337 4.653 ( -1.343 -0.000 8.489) 8.595 4.680 ( 2.070 0.000 -2.910) 3.572 4.892 ( -15.868 -0.000 1.338) 15.925 5.308 ( -7.068 -0.000 12.556) 14.409 5.970 ( 5.336 0.000 2.175) 5.762 5.988 ( -29.542 -0.000 5.060) 29.972 6.651 ( -2.801 -0.000 -8.156) 8.623 7.292 ( -0.848 -0.000 3.164) 3.276 7.581 ( -0.065 -0.000 -0.861) 0.863 8.288 ( -3.009 -0.000 11.002) 11.406 9.041 ( -2.089 -0.000 -5.401) 5.791 9.083 ( -7.591 -0.000 1.175) 7.681 9.555 ( 3.590 0.000 6.377) 7.318 11.456 ( 5.195 0.000 5.594) 7.634 11.941 ( 1.359 0.000 -7.732) 7.851 11.950 ( -8.237 -0.000 2.163) 8.517 12.226 ( -8.988 -0.000 3.558) 9.666 12.236 ( 5.146 0.000 1.424) 5.339 12.523 ( -0.888 -0.000 -1.289) 1.565 13.631 ( 8.413 0.000 5.595) 10.104 14.364 ( 13.525 0.000 -15.385) 20.485 17.062 ( 1.973 0.000 -0.995) 2.210 19.050 ( 5.849 0.000 -14.583) 15.712 19.392 ( 16.250 0.000 8.171) 18.189 20.034 ( 25.293 0.000 11.138) 27.636 20.491 ( -10.559 -0.000 -20.200) 22.793 21.712 ( -22.737 -0.000 5.935) 23.498 23.851 ( -2.438 -0.000 5.807) 6.298 24.144 ( 2.234 0.000 0.001) 2.234 ======================= Grid point 256 (122/361) ======================= q-point: (-0.50 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( -4.474 11.996 4.174) 13.467 2.431 ( 2.348 17.645 9.312) 20.089 2.842 ( -6.005 -8.671 6.580) 12.431 3.044 ( -8.013 -13.926 2.684) 16.290 3.638 ( 2.649 6.863 1.607) 7.530 3.790 ( 5.522 -3.792 -1.434) 6.850 4.223 ( -1.437 1.557 9.091) 9.335 4.483 ( -16.760 -5.710 -4.619) 18.299 4.725 ( -1.794 2.255 9.539) 9.965 4.950 ( 0.129 -9.089 9.049) 12.826 5.321 ( -15.790 -0.715 13.682) 20.906 5.772 ( -8.632 -0.936 5.618) 10.341 6.075 ( 4.589 0.290 3.207) 5.606 6.526 ( -0.104 -1.614 -9.447) 9.584 7.269 ( -3.286 1.417 -1.294) 3.805 7.581 ( 1.682 0.369 -1.382) 2.208 8.375 ( -5.868 -5.021 9.727) 12.420 8.948 ( -2.844 3.342 -2.862) 5.239 9.018 ( -3.451 -4.177 -0.326) 5.428 9.698 ( 2.263 0.075 9.666) 9.927 11.534 ( 3.073 7.775 1.512) 8.496 11.752 ( -3.992 16.489 -2.611) 17.165 11.877 ( -0.731 0.168 -4.789) 4.847 12.092 ( -9.238 5.579 7.730) 13.275 12.416 ( 2.842 -15.593 -1.914) 15.965 12.590 ( 4.734 -1.791 5.509) 7.481 13.697 ( -2.192 0.207 -1.818) 2.855 14.356 ( 11.359 -5.456 -18.784) 22.620 17.188 ( 7.816 -1.483 9.218) 12.177 18.882 ( 0.709 -1.208 -21.076) 21.122 19.649 ( 12.177 2.202 1.923) 12.523 20.060 ( -11.549 -0.460 -18.710) 21.992 20.574 ( 25.826 4.333 14.059) 29.722 21.512 ( -19.098 -3.641 8.379) 21.170 23.841 ( -5.021 1.480 2.884) 5.976 24.150 ( -0.543 -1.340 -2.761) 3.117 ======================= Grid point 257 (123/361) ======================= q-point: (-0.40 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( 2.706 13.383 7.354) 15.508 2.369 ( 2.418 24.762 6.707) 25.768 2.942 ( -0.148 -9.548 2.368) 9.839 3.165 ( -2.040 -14.765 6.059) 16.090 3.672 ( 2.834 3.447 3.349) 5.580 3.880 ( 2.970 -0.169 4.221) 5.164 4.193 ( -5.706 0.599 0.363) 5.749 4.517 ( -7.094 -11.073 19.980) 23.920 4.824 ( -1.253 -2.532 10.244) 10.627 5.119 ( 3.281 -4.281 4.326) 6.915 5.303 ( -10.777 -3.874 13.715) 17.868 5.830 ( -0.306 -2.122 7.518) 7.818 6.158 ( 1.775 0.822 3.536) 4.041 6.463 ( 3.168 -3.164 -7.532) 8.762 7.156 ( -5.741 1.800 -3.730) 7.079 7.558 ( 0.791 3.623 -3.296) 4.962 8.457 ( -7.612 -12.910 6.401) 16.297 8.850 ( -1.676 7.163 0.627) 7.383 9.055 ( 1.330 -6.713 0.645) 6.874 9.833 ( -0.018 1.513 10.214) 10.325 11.334 ( 2.175 28.532 -9.799) 30.246 11.607 ( -8.549 2.708 4.738) 10.142 11.827 ( 3.529 0.264 -5.782) 6.779 12.038 ( -7.392 4.499 8.376) 12.044 12.536 ( 2.039 -11.803 -3.948) 12.612 12.795 ( 8.414 0.265 10.525) 13.477 13.544 ( -9.960 1.311 -6.259) 11.836 14.310 ( 7.062 -9.306 -21.290) 24.285 17.512 ( 11.053 -5.361 15.280) 19.605 18.602 ( -4.921 -3.202 -21.506) 22.293 19.672 ( -6.119 0.019 -15.642) 16.796 19.778 ( 1.513 0.050 -1.779) 2.336 20.984 ( 15.749 13.778 12.721) 24.488 21.499 ( -3.112 -8.992 9.394) 13.372 23.774 ( -5.232 0.777 0.293) 5.297 24.066 ( -4.053 0.756 -6.386) 7.601 ======================= Grid point 258 (124/361) ======================= q-point: (-0.30 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 9.672 18.302 4.592) 21.204 2.283 ( 6.131 11.346 11.073) 16.998 3.040 ( 3.308 -7.032 -2.307) 8.107 3.332 ( -1.292 -10.220 4.348) 11.181 3.688 ( -3.743 -3.069 -0.065) 4.841 4.004 ( 4.969 3.827 9.388) 11.290 4.213 ( 2.149 -0.615 5.905) 6.314 4.793 ( -3.717 -7.797 21.910) 23.551 4.985 ( -2.013 -8.169 11.782) 14.477 5.247 ( 2.638 -1.288 5.563) 6.290 5.397 ( -2.403 -1.809 11.904) 12.278 5.932 ( -1.516 -3.710 6.231) 7.408 6.202 ( -1.576 0.413 5.292) 5.537 6.485 ( 5.029 -2.649 -3.235) 6.540 6.993 ( -7.059 0.030 -7.182) 10.070 7.458 ( -1.704 6.412 -3.207) 7.369 8.544 ( -8.036 -17.850 2.367) 19.718 8.803 ( 0.640 7.617 4.152) 8.699 9.180 ( 3.945 -7.862 2.032) 9.028 9.909 ( -1.405 5.393 9.048) 10.626 10.974 ( 1.532 27.580 -10.159) 29.432 11.472 ( -13.167 2.174 0.597) 13.359 11.837 ( 7.662 -0.605 -5.836) 9.651 11.979 ( -4.328 9.506 5.357) 11.738 12.606 ( 1.689 -8.445 -2.914) 9.092 13.020 ( 4.822 4.645 8.698) 10.977 13.323 ( -8.060 -0.650 -1.676) 8.258 14.198 ( 1.974 -10.941 -22.256) 24.879 17.913 ( 9.955 -7.706 14.264) 19.025 18.322 ( -5.901 -4.525 -15.917) 17.568 19.405 ( -9.376 -5.438 -11.396) 15.727 19.780 ( 0.153 2.078 -1.166) 2.388 21.051 ( 0.517 14.381 5.928) 15.564 21.806 ( 15.888 -5.791 9.100) 19.204 23.691 ( -5.395 -0.311 -1.801) 5.696 23.890 ( -3.757 3.900 -7.918) 9.593 ======================= Grid point 259 (125/361) ======================= q-point: (-0.20 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( 1.448 13.409 5.632) 14.616 2.600 ( 18.153 3.820 13.411) 22.891 3.112 ( 5.087 -4.793 -4.233) 8.172 3.401 ( -1.616 -7.089 -1.530) 7.430 3.637 ( -8.465 -7.076 -0.761) 11.059 4.156 ( 12.089 1.889 -1.564) 12.335 4.353 ( 3.372 4.769 12.451) 13.753 4.952 ( -4.059 3.973 6.239) 8.437 5.173 ( -2.630 -8.196 10.826) 13.831 5.354 ( -6.932 0.287 12.332) 14.150 5.622 ( 4.619 -5.189 22.117) 23.182 5.992 ( -3.063 -4.380 3.066) 6.162 6.270 ( -3.288 -4.469 9.069) 10.632 6.540 ( 1.300 1.817 1.681) 2.796 6.785 ( -5.745 -1.280 -10.694) 12.207 7.372 ( 0.834 2.801 -1.133) 3.134 8.590 ( -10.034 -13.574 2.410) 17.051 8.835 ( 2.120 2.048 4.777) 5.613 9.312 ( 1.575 -6.077 0.745) 6.322 9.935 ( 0.496 7.945 7.402) 10.870 10.672 ( 3.626 21.659 -7.536) 23.218 11.218 ( -16.207 0.813 -5.114) 17.015 11.880 ( 5.091 6.234 -3.864) 8.928 11.916 ( 5.260 5.869 1.959) 8.121 12.670 ( 0.684 -6.308 -0.575) 6.371 12.933 ( -10.758 2.783 -1.256) 11.183 13.423 ( 7.919 2.516 9.282) 12.458 14.036 ( -1.760 -10.957 -19.130) 22.116 18.130 ( -5.747 -4.454 -4.344) 8.470 18.251 ( 9.513 -6.607 2.790) 11.913 19.226 ( -7.322 -6.142 -8.170) 12.574 19.688 ( -10.366 6.013 2.863) 12.321 20.997 ( 3.138 5.857 -1.216) 6.755 22.168 ( 17.149 0.832 6.596) 18.393 23.563 ( -4.276 3.534 -4.955) 7.438 23.765 ( -0.202 -0.063 -4.228) 4.234 ======================= Grid point 260 (126/361) ======================= q-point: (-0.10 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( -2.928 0.074 7.186) 7.760 2.959 ( 13.403 3.183 10.649) 17.412 3.163 ( 2.754 -3.814 -2.647) 5.398 3.414 ( 2.621 -4.959 -4.642) 7.281 3.574 ( -8.164 -6.139 0.219) 10.217 4.221 ( 13.686 -0.696 -17.160) 21.961 4.517 ( 4.146 8.498 14.524) 17.330 4.841 ( -4.541 9.123 -0.655) 10.211 5.276 ( -3.938 0.953 2.822) 4.937 5.323 ( -12.178 4.530 14.282) 19.308 5.949 ( -11.873 -14.648 5.552) 19.656 6.116 ( 5.061 0.808 19.683) 20.339 6.335 ( -8.443 -3.456 5.186) 10.494 6.516 ( -3.706 -3.809 8.851) 10.324 6.710 ( 2.357 0.982 -0.256) 2.566 7.419 ( 7.222 -3.133 -1.371) 7.991 8.562 ( -13.715 -3.590 7.421) 16.001 8.922 ( 1.243 -4.098 3.004) 5.231 9.322 ( -1.840 -0.912 -2.452) 3.198 9.982 ( 3.231 5.035 4.547) 7.514 10.532 ( 7.482 14.542 -1.556) 16.428 10.922 ( -13.775 -5.363 -9.081) 17.349 11.862 ( 6.388 10.752 3.351) 12.948 12.001 ( 9.094 0.002 -3.136) 9.619 12.704 ( -5.351 -8.198 -1.386) 9.888 12.775 ( -5.034 5.515 2.554) 7.892 13.535 ( 2.965 3.001 -4.080) 5.869 13.954 ( 2.068 -6.259 -3.502) 7.464 18.058 ( -3.201 -2.782 -2.559) 4.953 18.416 ( 6.295 -6.187 -4.866) 10.079 19.088 ( -2.880 1.885 -6.429) 7.292 19.463 ( -18.841 8.667 7.342) 22.000 21.038 ( 7.157 -6.981 -5.065) 11.208 22.404 ( 12.403 8.348 4.136) 15.512 23.441 ( 1.274 5.070 -3.892) 6.517 23.759 ( 0.893 -4.476 -1.727) 4.880 ======================= Grid point 266 (127/361) ======================= q-point: (-0.50 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( -0.461 -0.000 4.387) 4.411 2.732 ( 2.828 0.000 9.072) 9.502 2.839 ( 2.488 0.000 5.866) 6.372 2.885 ( -2.376 -0.000 0.991) 2.574 3.710 ( -1.054 -0.000 0.534) 1.182 3.861 ( 11.734 0.000 -4.727) 12.651 4.222 ( -16.829 0.000 10.651) 19.916 4.406 ( 1.294 -0.000 18.580) 18.625 4.819 ( -2.689 -0.000 7.786) 8.238 5.067 ( 7.476 -0.000 6.471) 9.888 5.263 ( -14.269 -0.000 16.132) 21.537 5.812 ( 0.598 -0.000 6.778) 6.804 6.166 ( 2.151 -0.000 3.224) 3.876 6.431 ( 3.930 -0.000 -8.380) 9.256 7.169 ( -5.539 -0.000 -5.685) 7.938 7.610 ( 3.236 -0.000 -1.096) 3.416 8.324 ( -11.358 -0.000 6.743) 13.209 8.955 ( -2.802 -0.000 2.137) 3.524 8.957 ( 2.641 0.000 -0.318) 2.661 9.846 ( 0.300 -0.000 11.207) 11.212 11.607 ( -2.609 -0.000 3.441) 4.318 11.700 ( -3.711 0.000 -12.796) 13.323 11.799 ( 3.501 -0.000 -8.289) 8.998 12.086 ( -8.092 -0.000 9.094) 12.173 12.365 ( 1.050 -0.000 1.824) 2.105 12.807 ( 9.887 -0.000 11.592) 15.235 13.554 ( -11.401 -0.000 -5.222) 12.540 14.223 ( 8.238 -0.000 -21.795) 23.300 17.465 ( 11.180 -0.000 14.285) 18.140 18.573 ( -4.247 -0.000 -22.567) 22.963 19.669 ( -12.464 -0.000 -16.204) 20.443 19.782 ( 6.313 -0.000 -2.123) 6.660 21.147 ( 26.361 -0.000 14.663) 30.165 21.382 ( -12.075 0.000 8.028) 14.500 23.781 ( -6.770 -0.000 0.618) 6.798 24.071 ( -2.263 -0.000 -6.245) 6.643 ======================= Grid point 268 (128/361) ======================= q-point: (-0.40 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( 8.055 3.267 7.499) 11.480 2.624 ( -2.307 16.652 -0.804) 16.831 2.948 ( 6.294 -2.490 0.662) 6.801 3.115 ( 5.067 -12.212 6.128) 14.572 3.644 ( -8.105 -1.385 -1.048) 8.289 3.974 ( 16.282 -2.808 -10.251) 19.444 4.279 ( -8.548 3.277 27.936) 29.398 4.693 ( 3.394 -2.632 18.700) 19.187 4.871 ( -3.862 -3.607 7.689) 9.330 5.243 ( 4.567 0.134 6.298) 7.781 5.357 ( -2.998 -1.730 17.370) 17.712 5.898 ( -0.396 -0.654 5.665) 5.717 6.209 ( -1.096 0.280 3.124) 3.323 6.442 ( 7.691 -1.530 -4.596) 9.089 6.990 ( -7.552 -0.236 -8.416) 11.310 7.601 ( 1.839 7.035 -2.294) 7.624 8.264 ( -13.233 -10.790 5.129) 17.828 8.927 ( 0.001 5.812 2.859) 6.477 9.060 ( 3.829 -5.573 2.759) 7.303 9.972 ( -1.064 1.698 11.213) 11.391 11.375 ( -5.821 11.201 -16.186) 20.526 11.539 ( -5.567 8.450 0.107) 10.120 11.793 ( 6.728 -4.568 -8.423) 11.708 12.109 ( -4.809 4.140 10.894) 12.607 12.430 ( 0.374 -8.077 0.008) 8.085 13.105 ( 9.486 3.505 13.181) 16.614 13.293 ( -14.427 -1.961 -4.316) 15.186 14.054 ( 3.920 -4.391 -23.073) 23.812 17.819 ( 10.752 -2.632 15.044) 18.677 18.267 ( -4.584 -1.568 -16.565) 17.259 19.335 ( -10.421 -2.046 -12.806) 16.636 19.803 ( 1.712 0.617 -2.418) 3.026 21.276 ( -4.878 8.687 3.190) 10.461 21.702 ( 21.522 -4.770 13.317) 25.754 23.684 ( -6.387 -0.311 -1.224) 6.510 23.935 ( -3.034 1.195 -8.625) 9.221 ======================= Grid point 269 (129/361) ======================= q-point: (-0.30 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( -5.717 11.022 -2.960) 12.765 2.642 ( 15.938 1.189 11.389) 19.625 3.068 ( 9.480 0.237 -1.521) 9.604 3.306 ( 5.040 -3.851 1.448) 6.506 3.505 ( -12.641 -6.517 -1.299) 14.281 4.111 ( 17.956 -4.191 -13.389) 22.787 4.499 ( -0.851 8.538 23.936) 25.427 4.959 ( 3.480 -7.781 7.567) 11.398 5.001 ( -6.102 -4.681 16.642) 18.333 5.340 ( -6.050 -0.002 14.803) 15.992 5.578 ( 2.970 -0.581 12.877) 13.228 5.961 ( -0.060 -0.116 7.084) 7.085 6.219 ( -4.071 -1.603 4.295) 6.131 6.545 ( 8.739 -0.722 -0.795) 8.805 6.765 ( -7.271 -0.893 -10.918) 13.148 7.495 ( -1.040 9.983 -1.247) 10.114 8.275 ( -12.459 -17.797 4.326) 22.151 8.924 ( 1.258 5.365 3.684) 6.629 9.205 ( 3.610 -5.526 2.907) 7.213 10.051 ( -1.352 4.624 9.261) 10.439 10.996 ( -4.345 10.151 -17.005) 20.276 11.318 ( -10.119 12.776 -1.724) 16.388 11.854 ( 9.289 -4.199 -6.897) 12.308 12.114 ( -1.887 9.649 7.781) 12.538 12.509 ( -0.678 -9.673 -0.466) 9.708 12.974 ( -14.097 1.284 -2.618) 14.396 13.459 ( 9.790 1.328 13.870) 17.029 13.860 ( 0.262 -7.722 -21.084) 22.455 18.080 ( -2.217 -1.301 -3.426) 4.283 18.149 ( 7.524 -4.535 5.713) 10.479 19.118 ( -6.125 -4.800 -8.178) 11.289 19.761 ( -4.231 2.272 0.017) 4.803 21.138 ( -1.975 7.927 -4.895) 9.523 22.172 ( 19.114 -0.330 12.478) 22.829 23.582 ( -5.343 -0.470 -2.489) 5.913 23.781 ( -1.155 1.276 -8.612) 8.783 ======================= Grid point 270 (130/361) ======================= q-point: (-0.20 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( -10.873 1.501 -1.714) 11.109 2.974 ( 9.204 -0.330 5.712) 10.838 3.130 ( -0.006 -0.439 1.512) 1.575 3.361 ( 5.466 -2.001 -1.487) 6.008 3.485 ( 3.052 -2.240 1.575) 4.100 4.189 ( 15.681 -2.781 -19.009) 24.798 4.652 ( 1.553 6.312 11.012) 12.787 5.009 ( -2.790 8.724 2.842) 9.590 5.174 ( -3.959 -9.640 11.748) 15.704 5.444 ( -10.721 4.864 17.976) 21.488 5.678 ( -10.917 -11.255 6.162) 16.847 6.147 ( 5.063 1.714 14.262) 15.231 6.247 ( -6.630 -5.149 6.334) 10.516 6.510 ( -3.771 1.586 -0.162) 4.094 6.728 ( 7.870 0.049 0.091) 7.870 7.419 ( 2.825 3.954 -1.141) 4.992 8.320 ( -13.436 -18.446 5.935) 23.580 8.955 ( 2.115 4.123 4.130) 6.208 9.293 ( 0.321 -2.238 0.157) 2.266 10.087 ( 0.382 5.965 5.998) 8.468 10.682 ( -4.496 0.642 -15.597) 16.245 11.021 ( -8.224 16.813 -1.639) 18.788 11.950 ( 9.793 -1.772 -4.332) 10.854 12.091 ( 0.147 9.540 5.460) 10.993 12.542 ( -5.173 -8.873 -1.705) 10.411 12.821 ( -5.484 -0.148 2.112) 5.879 13.559 ( -2.189 -1.042 -11.408) 11.663 13.858 ( 9.655 -3.414 6.281) 12.013 18.037 ( -0.360 0.293 -0.546) 0.716 18.305 ( 3.128 -5.839 -2.218) 6.985 19.057 ( 0.338 -3.381 -1.839) 3.864 19.623 ( -13.051 7.249 3.622) 15.362 20.997 ( 3.480 1.736 -11.013) 11.680 22.530 ( 13.948 5.622 11.127) 18.707 23.494 ( -1.213 0.513 -3.378) 3.626 23.691 ( 0.214 -2.426 -5.635) 6.139 ======================= Grid point 271 (131/361) ======================= q-point: (-0.10 -0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( -13.750 -9.291 1.140) 16.634 2.902 ( -15.661 -10.476 -4.496) 19.371 3.238 ( 4.145 1.192 3.096) 5.309 3.478 ( 4.625 1.770 2.733) 5.657 3.620 ( 13.468 6.069 3.731) 15.236 4.118 ( 7.389 -2.932 -22.524) 23.885 4.686 ( -1.580 2.385 0.806) 2.973 4.929 ( 3.507 11.314 0.310) 11.849 5.278 ( -8.914 -3.537 8.426) 12.766 5.334 ( -12.543 11.356 7.623) 18.558 5.685 ( -14.244 -10.734 7.107) 19.200 6.088 ( -8.319 0.085 -5.365) 9.899 6.390 ( -1.426 -10.036 11.022) 14.975 6.701 ( -2.953 3.157 22.994) 23.396 6.824 ( 6.257 3.248 8.686) 11.187 7.485 ( 10.195 -2.783 -3.895) 11.263 8.374 ( -13.841 -15.295 9.410) 22.673 8.978 ( -0.786 5.403 2.947) 6.204 9.282 ( 1.031 -0.569 -2.088) 2.397 10.067 ( -3.460 6.983 -0.359) 7.801 10.507 ( -3.115 -12.954 -10.425) 16.918 10.819 ( 2.383 15.415 1.317) 15.654 12.035 ( 5.720 0.789 -0.964) 5.854 12.096 ( -0.454 2.875 5.108) 5.879 12.538 ( -0.696 -6.000 0.014) 6.040 12.829 ( 0.576 1.968 3.352) 3.930 13.346 ( -7.011 -3.274 -13.604) 15.651 14.131 ( 12.701 2.506 9.191) 15.877 17.982 ( -3.179 1.491 -6.680) 7.547 18.350 ( 5.020 -5.605 -4.232) 8.633 19.094 ( 3.642 4.099 0.324) 5.493 19.382 ( -16.315 8.936 6.728) 19.781 20.955 ( 6.734 -7.883 -12.814) 16.483 22.710 ( 5.280 12.557 9.071) 16.366 23.476 ( 5.469 1.635 -2.652) 6.294 23.695 ( 0.244 -7.005 -1.031) 7.085 ======================= Grid point 278 (132/361) ======================= q-point: (-0.40 0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -11.455 -0.000 -7.060) 13.456 2.651 ( 14.820 0.000 10.725) 18.294 3.093 ( 14.512 0.000 -2.445) 14.717 3.259 ( 8.796 0.000 7.296) 11.429 3.441 ( -15.378 -0.000 -2.556) 15.589 4.065 ( 19.495 0.000 -14.147) 24.087 4.599 ( -3.807 -0.000 31.706) 31.934 4.825 ( 1.550 0.000 -1.761) 2.346 4.984 ( -0.951 -0.000 20.502) 20.524 5.346 ( -5.674 -0.000 12.353) 13.594 5.574 ( 2.822 0.000 12.976) 13.280 5.963 ( 0.636 0.000 8.712) 8.735 6.205 ( -4.382 -0.000 2.365) 4.980 6.535 ( 11.751 0.000 -1.896) 11.903 6.757 ( -8.218 -0.000 -10.746) 13.528 7.633 ( 1.889 0.000 -3.879) 4.314 8.067 ( -17.370 -0.000 8.222) 19.218 8.987 ( 0.607 0.000 1.936) 2.029 9.141 ( 4.572 0.000 4.508) 6.421 10.094 ( -1.537 -0.000 9.943) 10.061 11.062 ( -12.323 -0.000 -17.066) 21.050 11.528 ( -1.533 -0.000 -6.285) 6.469 11.766 ( 8.050 0.000 -6.152) 10.131 12.215 ( -3.954 -0.000 11.239) 11.914 12.398 ( 0.494 0.000 -0.510) 0.710 12.984 ( -16.505 -0.000 -3.364) 16.844 13.469 ( 11.129 0.000 15.671) 19.220 13.787 ( 0.820 0.000 -22.147) 22.162 18.075 ( -0.669 -0.000 -7.301) 7.331 18.100 ( 6.639 0.000 10.929) 12.787 19.073 ( -5.490 -0.000 -8.758) 10.336 19.780 ( -2.571 -0.000 -0.785) 2.688 21.219 ( -3.474 -0.000 -6.636) 7.491 22.166 ( 19.793 0.000 15.348) 25.047 23.574 ( -6.102 -0.000 -1.832) 6.371 23.794 ( -1.136 -0.000 -10.027) 10.092 ======================= Grid point 280 (133/361) ======================= q-point: (-0.30 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -16.819 0.420 -6.250) 17.947 2.971 ( 6.295 -0.007 3.076) 7.006 3.117 ( -9.010 -0.951 2.394) 9.371 3.356 ( 16.002 1.312 -1.496) 16.125 3.478 ( 9.946 0.096 5.650) 11.440 4.140 ( 17.005 -1.911 -19.108) 25.650 4.761 ( -1.004 6.804 6.632) 9.554 4.938 ( -1.163 -11.916 7.490) 14.123 5.159 ( -2.772 4.546 13.315) 14.340 5.449 ( -10.389 -2.169 23.709) 25.976 5.610 ( -9.906 0.775 3.546) 10.550 6.160 ( -3.126 -0.739 6.160) 6.947 6.185 ( 0.410 -0.883 10.346) 10.392 6.542 ( -2.318 1.374 -3.075) 4.089 6.710 ( 13.333 -1.296 -1.148) 13.445 7.552 ( -0.538 8.712 -2.073) 8.971 8.005 ( -16.913 -13.857 9.726) 23.930 9.016 ( 2.334 2.081 1.703) 3.561 9.254 ( 2.386 -1.527 3.208) 4.279 10.169 ( -0.371 2.560 6.883) 7.353 10.669 ( -12.764 -0.705 -17.736) 21.863 11.338 ( -3.049 13.765 -6.419) 15.491 11.873 ( 9.985 -5.486 -3.464) 11.908 12.228 ( -7.332 4.583 7.542) 11.474 12.417 ( -0.524 -4.120 -1.066) 4.288 12.800 ( -7.329 -1.203 2.224) 7.753 13.516 ( -3.369 -2.271 -17.679) 18.140 13.834 ( 12.430 -0.089 13.401) 18.278 18.056 ( 2.810 1.198 0.922) 3.191 18.220 ( -0.428 -3.037 -1.131) 3.269 19.007 ( 2.858 -1.636 0.005) 3.293 19.704 ( -8.504 2.014 1.886) 8.941 21.049 ( 0.593 2.439 -14.692) 14.905 22.600 ( 14.903 2.055 16.502) 22.330 23.476 ( -5.252 -1.285 -1.466) 5.602 23.674 ( 1.876 -0.097 -10.151) 10.323 ======================= Grid point 281 (134/361) ======================= q-point: (-0.20 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( -20.050 -5.084 -1.230) 20.721 2.724 ( -23.432 -8.368 -6.236) 25.651 3.275 ( 7.953 2.459 5.147) 9.787 3.556 ( 9.608 6.564 3.928) 12.281 3.702 ( 16.629 2.142 3.405) 17.109 4.065 ( 6.782 -2.554 -24.464) 25.515 4.732 ( -2.812 3.419 0.435) 4.448 5.033 ( -0.039 -5.923 -2.747) 6.529 5.199 ( -6.962 1.109 9.142) 11.545 5.438 ( -13.287 -1.619 1.149) 13.435 5.627 ( -9.489 6.259 25.249) 27.690 6.095 ( -9.100 0.554 -7.030) 11.513 6.220 ( -4.137 -8.536 9.216) 13.225 6.768 ( 5.901 3.629 22.448) 23.493 6.875 ( 10.539 1.554 2.703) 10.991 7.484 ( 3.651 3.535 -1.403) 5.272 8.045 ( -16.251 -18.555 10.501) 26.808 9.061 ( 3.364 2.483 1.923) 4.602 9.287 ( -0.467 1.152 -0.107) 1.247 10.184 ( -3.707 5.629 -1.226) 6.851 10.344 ( -5.695 -5.826 -10.570) 13.346 11.100 ( -1.302 14.306 -4.884) 15.172 12.007 ( 8.057 -3.355 -3.766) 9.505 12.145 ( -12.858 2.155 8.786) 15.722 12.455 ( 4.126 -3.280 0.592) 5.304 12.830 ( 1.177 -0.940 4.993) 5.215 13.276 ( -5.944 -3.737 -15.031) 16.590 14.169 ( 13.603 1.590 12.156) 18.312 18.024 ( -3.326 2.875 -8.430) 9.508 18.249 ( 5.417 -5.125 1.070) 7.533 19.127 ( 6.601 0.590 4.875) 8.227 19.534 ( -15.190 6.477 3.796) 16.944 20.875 ( 5.337 -1.610 -18.526) 19.347 22.912 ( 6.750 9.563 15.673) 19.561 23.449 ( -0.383 -4.963 1.188) 5.118 23.606 ( 3.526 -1.933 -8.446) 9.355 ======================= Grid point 282 (135/361) ======================= q-point: (-0.10 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( -20.433 -11.779 4.457) 24.002 2.434 ( -24.664 -16.547 -2.779) 29.830 3.355 ( 3.499 5.792 -0.041) 6.766 3.578 ( -1.735 4.916 -1.646) 5.467 3.821 ( -0.574 -1.559 -15.119) 15.210 3.914 ( 6.088 3.836 1.042) 7.271 4.623 ( -6.713 1.248 -2.785) 7.375 5.018 ( -1.669 -1.197 -3.136) 3.749 5.154 ( -3.824 2.837 2.156) 5.227 5.345 ( -5.052 1.712 4.572) 7.026 5.705 ( -7.519 8.925 17.668) 21.175 5.902 ( -7.110 -1.874 -5.006) 8.895 6.394 ( -2.238 -10.598 9.908) 14.680 6.822 ( -5.663 7.786 5.160) 10.923 7.176 ( 2.171 4.901 23.640) 24.241 7.563 ( 10.342 -2.243 -2.684) 10.917 8.146 ( -12.302 -21.221 10.299) 26.603 9.057 ( -1.746 9.929 1.650) 10.215 9.283 ( 4.307 -2.463 -2.176) 5.418 9.936 ( -10.250 0.469 -8.448) 13.291 10.367 ( 4.601 -3.472 -1.344) 5.919 10.966 ( 2.810 7.092 -2.009) 7.888 12.050 ( 0.589 -0.621 -2.868) 2.993 12.079 ( -11.718 -2.714 10.223) 15.785 12.631 ( 11.944 -3.578 3.927) 13.072 12.919 ( 3.767 2.270 3.495) 5.618 13.049 ( -8.860 -3.719 -10.132) 13.964 14.472 ( 15.380 4.469 8.034) 17.918 17.759 ( -5.452 1.131 -19.983) 20.744 18.447 ( 9.364 -2.106 7.122) 11.952 19.182 ( -6.233 9.574 1.648) 11.543 19.356 ( -2.930 2.597 5.982) 7.149 20.787 ( 6.465 -8.104 -17.501) 20.341 22.963 ( -4.373 15.151 9.446) 18.382 23.567 ( 9.978 1.187 -5.056) 11.248 23.643 ( 0.463 -9.671 8.642) 12.978 ======================= Grid point 290 (136/361) ======================= q-point: (-0.30 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( -22.608 -0.000 -1.609) 22.666 2.641 ( -26.260 -0.000 -7.243) 27.241 3.302 ( 9.926 0.000 5.939) 11.567 3.671 ( 22.567 0.000 0.737) 22.579 3.676 ( 5.012 0.000 6.521) 8.224 4.042 ( 8.217 0.000 -25.273) 26.575 4.831 ( -0.658 -0.000 2.906) 2.979 4.856 ( -8.118 -0.000 -0.089) 8.118 5.250 ( -2.908 -0.000 4.043) 4.980 5.405 ( -11.563 -0.000 1.791) 11.701 5.717 ( -9.192 -0.000 30.356) 31.717 6.106 ( -8.967 -0.000 -7.943) 11.980 6.122 ( -5.624 -0.000 6.557) 8.639 6.809 ( 9.803 0.000 24.847) 26.711 6.879 ( 14.274 0.000 -3.443) 14.684 7.567 ( 1.126 0.000 -3.058) 3.259 7.822 ( -20.935 -0.000 15.176) 25.857 9.077 ( 4.189 0.000 -0.065) 4.189 9.303 ( 0.027 0.000 2.178) 2.178 10.262 ( -13.019 -0.000 -17.266) 21.624 10.269 ( 3.004 0.000 5.012) 5.844 11.250 ( -3.787 -0.000 -9.261) 10.006 11.960 ( 8.814 0.000 -1.974) 9.032 12.169 ( -14.536 -0.000 9.005) 17.100 12.421 ( 2.656 0.000 1.278) 2.947 12.819 ( 2.107 0.000 5.761) 6.134 13.238 ( -4.706 -0.000 -15.822) 16.507 14.184 ( 13.527 0.000 13.162) 18.873 18.061 ( -4.976 -0.000 -13.208) 14.114 18.192 ( 7.027 0.000 7.055) 9.958 19.131 ( 7.451 0.000 6.534) 9.910 19.593 ( -13.502 -0.000 3.025) 13.836 20.867 ( 4.251 0.000 -21.169) 21.591 23.015 ( 9.291 0.000 21.105) 23.060 23.378 ( -5.941 -0.000 -0.001) 5.941 23.596 ( 6.034 0.000 -11.217) 12.737 ======================= Grid point 291 (137/361) ======================= q-point: (-0.20 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( -24.940 -3.843 8.303) 26.566 2.195 ( -29.604 -8.006 -5.134) 31.094 3.461 ( 6.336 4.913 0.786) 8.056 3.606 ( -10.376 -2.007 -14.394) 17.857 3.854 ( 4.192 5.921 -5.107) 8.872 3.951 ( 9.261 -1.490 0.456) 9.391 4.652 ( -11.968 2.124 -1.743) 12.279 4.899 ( -3.708 -7.197 2.923) 8.608 5.230 ( 2.249 3.265 -0.841) 4.052 5.349 ( -2.031 -0.435 3.823) 4.351 5.857 ( -6.598 2.077 4.482) 8.242 5.917 ( -8.480 6.931 10.478) 15.157 6.209 ( -3.546 -8.860 11.006) 14.567 6.973 ( 7.554 6.733 -3.449) 10.690 7.239 ( 4.727 1.663 25.952) 26.432 7.551 ( 4.375 1.849 -0.567) 4.783 7.789 ( -19.854 -15.342 14.273) 28.866 9.143 ( 6.090 0.037 -0.779) 6.139 9.294 ( -1.777 2.891 0.447) 3.422 9.910 ( -9.248 -1.500 -14.376) 17.159 10.379 ( 5.634 1.684 3.255) 6.721 11.069 ( -2.737 3.385 -7.819) 8.949 12.017 ( 4.536 -1.403 -5.237) 7.069 12.098 ( -14.553 2.745 14.980) 21.065 12.537 ( 4.912 -5.144 5.821) 9.191 12.942 ( 5.068 0.605 5.125) 7.233 13.000 ( -5.465 -1.425 -12.813) 14.002 14.525 ( 15.403 1.439 10.096) 18.473 17.775 ( -5.012 0.482 -21.193) 21.783 18.417 ( 9.048 -0.914 9.704) 13.299 19.307 ( 4.111 3.527 5.744) 7.895 19.397 ( -14.061 1.663 2.518) 14.381 20.690 ( 6.918 -2.657 -21.413) 22.659 23.217 ( -4.256 12.850 9.282) 16.413 23.454 ( -0.364 -11.049 14.955) 18.598 23.581 ( 11.308 0.373 -8.280) 14.020 ======================= Grid point 292 (138/361) ======================= q-point: (-0.10 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( -25.554 -6.582 13.570) 29.673 1.895 ( -26.999 -19.786 2.440) 33.562 3.052 ( -27.341 -5.218 -20.025) 34.289 3.605 ( 5.930 3.643 3.065) 7.605 3.787 ( -3.990 7.579 2.687) 8.977 3.972 ( -4.656 2.601 -0.326) 5.344 4.521 ( -5.540 0.680 2.638) 6.174 4.913 ( -3.551 -3.036 0.930) 4.764 5.272 ( 9.441 4.473 -0.866) 10.483 5.386 ( -0.228 2.535 4.137) 4.858 5.759 ( -4.720 -2.243 -0.785) 5.284 5.899 ( -6.040 12.337 10.988) 17.590 6.385 ( -1.095 -9.476 7.477) 12.121 6.869 ( -7.132 13.776 2.925) 15.786 7.452 ( -3.633 5.693 13.377) 14.985 7.659 ( 6.161 -2.187 -0.332) 6.546 7.927 ( -7.874 -23.874 13.982) 28.765 9.144 ( -2.681 11.423 1.611) 11.844 9.303 ( 7.939 -4.541 -3.117) 9.662 9.710 ( -3.658 -4.866 -7.304) 9.508 10.443 ( 4.278 5.922 -0.273) 7.311 10.967 ( -0.434 -2.324 -3.492) 4.217 11.998 ( -0.563 0.296 -4.287) 4.334 12.067 ( -12.652 4.125 16.704) 21.357 12.779 ( 4.122 -1.174 -11.130) 11.927 12.811 ( -1.443 -11.930 10.194) 15.758 13.058 ( 5.366 2.354 3.617) 6.886 14.818 ( 16.578 4.489 4.419) 17.734 17.409 ( -5.902 0.381 -24.005) 24.722 18.684 ( 9.780 -1.128 10.382) 14.307 19.099 ( -13.285 5.752 -1.608) 14.566 19.480 ( 5.339 0.855 5.044) 7.395 20.588 ( 5.968 -6.168 -17.525) 19.514 23.084 ( -9.581 14.411 5.879) 18.277 23.563 ( 6.251 -3.455 -6.333) 9.545 23.858 ( 6.020 -2.475 21.395) 22.363 ======================= Grid point 301 (139/361) ======================= q-point: (-0.20 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -26.704 -0.000 22.034) 34.620 1.672 ( -31.637 -0.000 -1.593) 31.677 3.007 ( -30.544 -0.000 -22.425) 37.893 3.638 ( 7.640 0.000 2.602) 8.071 3.883 ( -6.596 -0.000 3.415) 7.428 3.978 ( -3.306 -0.000 -0.635) 3.366 4.526 ( -5.744 -0.000 5.530) 7.973 4.876 ( -1.616 -0.000 0.983) 1.891 5.313 ( 9.411 0.000 -0.958) 9.460 5.411 ( 1.186 0.000 4.055) 4.225 5.736 ( -4.977 -0.000 -0.385) 4.992 6.050 ( -6.639 -0.000 10.225) 12.192 6.258 ( -0.810 -0.000 9.999) 10.031 7.071 ( 9.077 0.000 -6.556) 11.197 7.484 ( -9.235 -0.000 6.912) 11.535 7.627 ( 7.792 0.000 -1.822) 8.002 7.660 ( -18.313 -0.000 32.174) 37.021 9.230 ( 9.828 0.000 -2.678) 10.186 9.284 ( -3.785 -0.000 1.328) 4.011 9.658 ( -2.399 -0.000 -11.571) 11.817 10.513 ( 6.329 0.000 2.619) 6.849 10.938 ( -3.881 -0.000 -6.599) 7.656 11.988 ( 3.171 0.000 -6.562) 7.288 12.176 ( -11.494 -0.000 23.926) 26.544 12.625 ( 0.339 0.000 7.774) 7.781 12.786 ( -3.599 -0.000 -11.307) 11.866 13.079 ( 5.801 0.000 3.585) 6.819 14.857 ( 16.422 0.000 5.848) 17.432 17.413 ( -5.651 -0.000 -24.983) 25.614 18.673 ( 9.082 0.000 11.038) 14.294 19.159 ( -15.528 -0.000 -3.773) 15.980 19.486 ( 4.682 0.000 6.040) 7.642 20.531 ( 7.260 0.000 -18.314) 19.701 23.238 ( -7.063 -0.000 3.122) 7.723 23.516 ( 4.845 0.000 -2.363) 5.390 23.832 ( 7.173 0.000 22.695) 23.801 ======================= Grid point 302 (140/361) ======================= q-point: (-0.10 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( -29.089 1.827 13.905) 32.294 1.441 ( -27.326 -16.239 15.018) 35.156 2.301 ( -42.403 -7.308 -6.665) 43.541 3.712 ( -0.351 3.857 -1.403) 4.119 3.815 ( -4.781 0.702 3.871) 6.192 3.896 ( -6.491 2.073 4.109) 7.958 4.622 ( 2.857 5.780 12.701) 14.244 4.855 ( -0.951 -4.044 -1.383) 4.379 5.439 ( 8.826 2.992 -0.045) 9.319 5.452 ( -0.375 1.904 4.940) 5.307 5.701 ( -3.655 -0.927 0.049) 3.771 5.993 ( -4.800 7.477 2.823) 9.323 6.386 ( 1.182 -5.106 3.769) 6.455 6.981 ( -4.854 22.477 3.627) 23.279 7.419 ( -12.267 -9.288 3.794) 15.848 7.707 ( 5.453 2.093 0.579) 5.870 7.894 ( -0.162 -15.513 11.614) 19.380 9.208 ( -4.858 6.451 3.606) 8.844 9.351 ( 11.173 -2.505 -6.284) 13.061 9.575 ( 1.686 -5.608 -4.511) 7.392 10.563 ( 2.102 10.794 -0.597) 11.013 10.848 ( -4.176 -8.417 -2.631) 9.757 11.956 ( 2.590 0.947 -5.300) 5.974 12.221 ( -11.740 19.314 18.255) 29.053 12.608 ( -4.678 0.357 -6.857) 8.309 12.851 ( 5.817 -23.873 6.552) 25.430 13.181 ( 4.799 1.397 1.586) 5.244 15.102 ( 15.166 3.134 -1.059) 15.523 17.091 ( -5.034 -0.378 -8.326) 9.737 18.876 ( -8.369 -1.477 -0.661) 8.524 18.951 ( 6.243 -0.118 3.640) 7.228 19.598 ( 2.793 -0.336 3.864) 4.779 20.442 ( 5.996 -1.951 -13.929) 15.290 23.128 ( -9.468 11.266 5.085) 15.570 23.563 ( 7.273 -2.013 -5.243) 9.189 24.230 ( 6.500 1.361 24.351) 25.241 ======================= Grid point 312 (141/361) ======================= q-point: (-0.10 -0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.007 ( -24.990 -0.000 16.910) 30.173 1.051 ( -36.555 -0.000 -1.053) 36.570 1.860 ( -38.398 -0.000 41.658) 56.655 3.634 ( -6.710 -0.000 -3.212) 7.439 3.749 ( -4.950 -0.000 1.507) 5.174 3.976 ( -0.043 -0.000 8.058) 8.058 4.751 ( -0.333 -0.000 -6.361) 6.370 4.973 ( 8.527 0.000 17.386) 19.365 5.514 ( -2.725 -0.000 -4.517) 5.276 5.553 ( 5.413 0.000 -2.352) 5.902 5.565 ( -4.773 -0.000 1.628) 5.043 6.041 ( 0.750 0.000 7.473) 7.510 6.414 ( 2.303 0.000 -0.197) 2.311 7.177 ( -16.146 -0.000 8.099) 18.063 7.210 ( 4.241 0.000 2.464) 4.905 7.756 ( -9.927 -0.000 -10.832) 14.693 7.840 ( 10.407 0.000 -3.894) 11.111 9.213 ( -4.340 -0.000 5.330) 6.874 9.420 ( 9.485 0.000 -2.637) 9.845 9.551 ( 3.791 0.000 -2.904) 4.775 10.564 ( -19.642 -0.000 -6.597) 20.720 10.690 ( 2.812 0.000 0.483) 2.853 11.953 ( 3.685 0.000 -4.167) 5.562 12.353 ( -11.734 -0.000 -4.303) 12.498 12.444 ( -3.348 -0.000 -9.684) 10.247 12.764 ( -0.606 -0.000 5.723) 5.755 13.248 ( 3.103 0.000 -0.679) 3.176 15.249 ( 10.869 0.000 -7.998) 13.495 17.369 ( 24.639 0.000 41.802) 48.524 18.653 ( -5.839 -0.000 -9.591) 11.228 19.146 ( 4.516 0.000 9.083) 10.144 19.641 ( -0.235 -0.000 0.659) 0.699 20.376 ( 6.995 0.000 -10.808) 12.874 23.137 ( -7.504 -0.000 5.931) 9.565 23.599 ( 7.106 0.000 -4.156) 8.232 24.514 ( 1.289 0.000 -1.374) 1.884 ======================= Grid point 313 (142/361) ======================= q-point: ( 0.00 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 10.877 0.000 21.408) 24.012 1.789 ( -3.881 -0.000 30.539) 30.784 3.224 ( -6.073 -0.000 35.061) 35.583 3.334 ( -1.061 -0.000 -6.423) 6.510 3.981 ( 4.255 0.000 3.355) 5.418 4.024 ( -0.446 -0.000 -8.865) 8.876 4.592 ( -0.521 -0.000 -2.510) 2.564 4.898 ( 4.080 0.000 -18.267) 18.717 5.333 ( -0.958 -0.000 0.231) 0.985 5.374 ( -10.705 -0.000 13.480) 17.213 5.865 ( -20.433 -0.000 13.039) 24.239 6.506 ( -1.870 -0.000 3.941) 4.362 6.579 ( -2.256 -0.000 10.364) 10.606 6.704 ( -2.764 -0.000 5.574) 6.222 6.980 ( -0.805 -0.000 -12.454) 12.480 7.557 ( -13.184 -0.000 28.356) 31.272 8.281 ( 2.820 0.000 12.159) 12.481 9.235 ( 1.198 0.000 -5.696) 5.820 9.407 ( -1.438 -0.000 0.461) 1.510 9.625 ( -9.193 -0.000 1.575) 9.327 10.285 ( 13.675 0.000 7.133) 15.423 10.596 ( -2.021 -0.000 -6.123) 6.448 11.677 ( 1.182 0.000 -12.425) 12.481 12.016 ( -0.506 -0.000 -6.502) 6.521 12.310 ( -3.755 -0.000 12.969) 13.502 13.048 ( 8.488 0.000 1.532) 8.625 13.178 ( -1.886 -0.000 -2.425) 3.072 14.618 ( -0.225 -0.000 -21.082) 21.084 18.238 ( 8.826 0.000 -10.215) 13.499 19.092 ( -8.679 -0.000 -13.205) 15.802 19.209 ( -16.507 -0.000 1.923) 16.619 19.562 ( 20.455 0.000 -0.628) 20.464 20.632 ( 22.597 0.000 6.229) 23.440 22.725 ( -38.921 -0.000 -9.786) 40.132 23.221 ( -6.129 -0.000 4.596) 7.661 23.645 ( 8.077 0.000 -3.923) 8.979 ======================= Grid point 314 (143/361) ======================= q-point: ( 0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( 3.211 4.113 25.107) 25.644 2.205 ( 11.121 -5.873 20.872) 24.368 3.254 ( 3.452 2.213 -7.809) 8.820 3.572 ( 0.929 -4.213 19.655) 20.123 3.852 ( -1.421 5.408 -11.804) 13.062 4.067 ( 1.531 -1.744 2.301) 3.268 4.465 ( -2.874 7.207 -8.667) 11.632 4.682 ( -4.353 -7.151 -14.932) 17.119 5.348 ( -6.600 2.685 9.090) 11.550 5.419 ( -6.490 -4.435 11.181) 13.667 5.894 ( -5.831 -0.421 20.172) 21.002 6.471 ( -7.347 2.180 3.143) 8.283 6.626 ( -12.182 0.756 18.743) 22.367 6.743 ( 3.929 4.299 0.081) 5.825 6.832 ( 0.403 1.691 -9.555) 9.711 7.719 ( -10.414 8.599 27.360) 30.512 8.445 ( -4.607 -8.269 10.200) 13.916 9.267 ( 5.144 -3.131 -3.295) 6.865 9.337 ( -1.345 4.396 -1.488) 4.832 9.586 ( -3.969 -5.028 5.713) 8.583 10.348 ( 3.691 15.359 -2.719) 16.029 10.751 ( 9.756 -20.991 2.308) 23.263 11.553 ( 3.797 0.152 -14.137) 14.638 11.919 ( 2.357 4.772 -6.166) 8.145 12.441 ( -3.472 -6.748 10.694) 13.112 13.100 ( -3.366 2.211 -1.218) 4.208 13.199 ( 9.090 -2.289 -0.737) 9.403 14.338 ( -3.564 3.189 -17.032) 17.691 18.254 ( 10.956 1.546 -9.353) 14.488 18.692 ( -12.328 11.484 -11.329) 20.303 19.061 ( -15.453 -11.375 -1.084) 19.219 19.706 ( 1.616 -0.360 -1.635) 2.327 21.043 ( 20.271 2.975 11.552) 23.521 22.165 ( -18.216 5.186 -8.890) 20.922 23.230 ( -4.212 -6.870 1.389) 8.177 23.713 ( 7.634 -0.136 -3.426) 8.369 ======================= Grid point 315 (144/361) ======================= q-point: ( 0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( 3.459 6.652 19.824) 21.195 2.678 ( 14.086 -6.971 17.284) 23.361 3.194 ( 5.303 4.237 -7.525) 10.134 3.601 ( -2.853 8.557 -10.728) 14.017 3.718 ( -3.928 -3.627 -0.612) 5.381 4.083 ( 1.916 1.941 -7.922) 8.378 4.334 ( 2.234 -1.689 -0.103) 2.802 4.591 ( -2.444 -10.052 -5.455) 11.695 5.334 ( -12.512 -1.359 12.422) 17.683 5.510 ( -7.355 -2.919 11.558) 14.007 6.044 ( -0.947 -1.516 5.403) 5.691 6.348 ( -9.840 -0.218 -1.702) 9.988 6.687 ( -2.602 1.665 5.056) 5.925 6.760 ( 2.051 6.330 5.277) 8.493 6.799 ( -4.557 3.715 20.017) 20.863 7.720 ( -7.967 18.823 14.463) 25.039 8.557 ( -12.800 -16.265 10.628) 23.267 9.229 ( -0.366 8.976 1.427) 9.096 9.311 ( -0.739 -2.142 -3.791) 4.417 9.791 ( 9.041 -5.100 10.005) 14.417 10.237 ( -1.232 -0.635 -3.926) 4.163 11.047 ( 6.882 -2.994 0.384) 7.515 11.471 ( 9.307 -3.986 -9.513) 13.892 11.880 ( 8.288 3.938 -5.902) 10.910 12.579 ( -3.380 -10.471 6.705) 12.885 12.996 ( -6.925 4.015 0.729) 8.038 13.321 ( 8.071 -3.410 -4.637) 9.913 14.080 ( -3.039 4.762 -9.870) 11.372 18.223 ( 0.185 6.728 -8.504) 10.846 18.383 ( 0.103 1.487 -9.911) 10.023 18.947 ( -11.507 -8.824 -0.605) 14.514 19.621 ( -12.096 -1.253 1.099) 12.210 21.311 ( 7.427 15.448 7.317) 18.637 21.975 ( 5.571 -9.477 -6.589) 12.817 23.257 ( -0.425 -5.362 -0.275) 5.386 23.772 ( 6.504 1.124 -2.549) 7.075 ======================= Grid point 316 (145/361) ======================= q-point: ( 0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( -3.883 10.507 11.147) 15.803 3.117 ( 13.886 -5.420 11.197) 18.643 3.149 ( 1.999 3.378 -3.270) 5.109 3.379 ( 0.220 7.296 -7.570) 10.515 3.614 ( -7.865 -3.100 -4.658) 9.653 3.956 ( 4.714 4.518 -11.498) 13.222 4.463 ( 7.986 -10.869 -4.810) 14.319 4.646 ( -0.560 -6.910 3.404) 7.723 5.305 ( -15.569 -5.509 9.306) 18.957 5.514 ( -12.834 -2.417 8.171) 15.406 5.995 ( -6.602 0.625 -3.589) 7.540 6.176 ( -9.092 -0.473 -3.749) 9.846 6.693 ( 1.153 2.696 1.371) 3.237 6.819 ( 2.842 4.631 6.791) 8.697 7.065 ( -5.803 3.736 35.862) 36.520 7.569 ( -2.134 16.124 1.165) 16.307 8.629 ( -16.752 -15.880 10.803) 25.485 9.160 ( -2.095 10.564 4.109) 11.527 9.275 ( 0.622 1.004 -1.611) 1.998 9.945 ( -1.382 -2.073 -2.410) 3.466 10.363 ( 7.958 -12.160 7.654) 16.425 10.945 ( 1.885 17.722 -7.402) 19.298 11.732 ( 16.781 -10.462 3.393) 20.064 11.920 ( 10.973 1.406 -6.094) 12.630 12.688 ( -2.894 -10.215 2.815) 10.984 12.856 ( -9.081 6.662 3.168) 11.700 13.329 ( -0.511 -3.207 -8.949) 9.520 13.985 ( 5.370 0.883 -2.599) 6.031 17.996 ( -7.170 1.624 -11.408) 13.572 18.342 ( 5.148 0.977 -4.460) 6.881 18.909 ( -2.959 -6.241 0.408) 6.919 19.471 ( -15.746 -4.324 3.842) 16.775 21.186 ( 2.658 18.483 -8.054) 20.336 22.247 ( 11.296 -15.398 5.498) 19.873 23.312 ( 4.049 -2.985 -1.131) 5.156 23.811 ( 4.796 3.178 -0.754) 5.803 ======================= Grid point 317 (146/361) ======================= q-point: (-0.60 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -13.058 12.996 6.587) 19.565 3.024 ( -10.964 5.695 -3.113) 12.741 3.258 ( 1.999 4.029 0.044) 4.498 3.429 ( 7.214 -3.895 -1.388) 8.315 3.566 ( 0.556 -7.132 0.395) 7.164 3.886 ( 8.008 4.591 -6.970) 11.566 4.621 ( 9.824 -12.446 -6.799) 17.253 4.688 ( -4.549 1.357 2.294) 5.272 5.234 ( -16.523 -11.932 3.353) 20.655 5.418 ( -12.270 -2.013 4.848) 13.346 5.835 ( -10.236 0.461 0.432) 10.255 6.024 ( -7.737 0.378 -2.081) 8.021 6.680 ( -1.668 4.224 1.603) 4.817 6.903 ( 1.322 4.357 7.842) 9.068 7.365 ( -7.233 2.540 27.625) 28.669 7.465 ( 6.374 6.003 -2.323) 9.058 8.631 ( -16.404 -10.044 8.615) 21.076 9.079 ( -4.975 8.849 5.459) 11.527 9.279 ( 2.850 2.225 0.196) 3.622 9.852 ( -8.577 -8.882 -6.151) 13.794 10.663 ( 9.117 8.297 1.424) 12.409 10.752 ( 5.352 8.973 2.281) 10.694 11.936 ( 10.192 0.739 -8.215) 13.111 12.162 ( 14.684 -6.591 8.881) 18.383 12.688 ( -7.447 6.044 3.469) 10.199 12.785 ( -1.099 -6.223 1.710) 6.547 13.180 ( -7.239 -0.921 -6.665) 9.883 14.123 ( 12.510 -6.703 -2.007) 14.334 17.702 ( -9.176 -0.775 -17.062) 19.388 18.427 ( 6.856 0.957 6.480) 9.482 18.969 ( 1.449 -7.182 -0.299) 7.332 19.372 ( -11.462 -5.726 4.296) 13.514 20.933 ( 4.282 16.400 -14.719) 22.449 22.594 ( 3.104 -16.735 8.683) 19.108 23.395 ( 8.679 0.259 -2.189) 8.955 23.846 ( 3.660 4.291 3.466) 6.620 ======================= Grid point 318 (147/361) ======================= q-point: (-0.50 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -19.002 12.386 9.752) 24.690 2.683 ( -19.395 11.020 -2.995) 22.507 3.315 ( 2.242 1.063 2.346) 3.415 3.464 ( -1.624 -2.417 -0.602) 2.974 3.599 ( 2.369 -4.324 -5.739) 7.566 3.931 ( 0.911 -0.868 2.311) 2.631 4.569 ( -8.799 0.132 0.027) 8.800 4.790 ( 10.434 -8.857 -7.015) 15.379 5.132 ( -10.122 -5.921 1.097) 11.778 5.395 ( -5.719 -5.459 4.878) 9.290 5.747 ( -9.543 -7.156 3.162) 12.339 5.901 ( -7.206 1.170 0.522) 7.319 6.610 ( -4.485 3.774 0.145) 5.863 6.953 ( -2.378 5.298 8.398) 10.210 7.423 ( 6.326 2.149 -2.179) 7.027 7.611 ( -5.260 -3.656 13.316) 14.776 8.552 ( -13.830 1.099 6.347) 15.257 9.029 ( -6.099 0.118 7.587) 9.735 9.305 ( 3.581 3.367 0.403) 4.931 9.764 ( -6.460 -8.860 -2.773) 11.310 10.509 ( 4.993 21.528 -4.272) 22.509 10.959 ( 6.425 -0.783 7.125) 9.626 11.933 ( 7.213 2.248 -9.853) 12.416 12.396 ( -8.349 1.660 13.055) 15.585 12.617 ( 5.341 1.473 -6.375) 8.446 12.902 ( 4.953 -4.993 5.131) 8.705 13.056 ( -3.536 -0.479 1.593) 3.908 14.363 ( 15.060 -11.362 -4.807) 19.468 17.368 ( -8.867 0.052 -15.606) 17.949 18.652 ( 9.295 0.502 11.283) 14.628 19.024 ( -3.293 -7.930 -1.632) 8.741 19.374 ( 0.026 -4.236 2.550) 4.945 20.666 ( 4.455 13.837 -16.292) 21.835 22.811 ( -7.193 -17.547 6.299) 19.983 23.477 ( 10.541 4.071 -4.516) 12.169 23.965 ( 5.174 1.519 11.495) 12.697 ======================= Grid point 319 (148/361) ======================= q-point: (-0.40 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.880 ( -22.625 10.902 14.115) 28.809 2.240 ( -24.356 11.729 -2.777) 27.175 3.119 ( -15.995 17.516 5.322) 24.310 3.599 ( 0.568 -4.485 3.002) 5.427 3.651 ( 4.297 -12.354 1.820) 13.206 3.915 ( -7.196 -3.234 0.648) 7.916 4.504 ( -5.439 -5.707 1.732) 8.072 4.869 ( 4.717 -3.730 -4.902) 7.758 5.176 ( 5.632 -5.520 1.463) 8.021 5.433 ( -3.364 -4.195 4.644) 7.105 5.727 ( -8.895 -10.401 -2.280) 13.874 5.849 ( -3.762 -1.667 6.102) 7.360 6.498 ( -5.797 1.886 -1.752) 6.343 6.951 ( -7.768 3.070 9.455) 12.616 7.493 ( 7.440 -1.282 -2.168) 7.854 7.635 ( -7.915 -5.192 0.193) 9.468 8.390 ( -9.484 11.031 3.897) 15.060 9.097 ( -4.066 -7.848 7.054) 11.308 9.333 ( 3.148 4.488 3.617) 6.568 9.760 ( 0.288 -0.267 0.753) 0.849 10.357 ( 0.195 8.487 -3.785) 9.295 11.077 ( 2.829 5.652 5.013) 8.067 11.868 ( 4.711 2.564 -10.133) 11.465 12.333 ( -15.853 2.170 11.691) 19.817 12.561 ( -0.542 -2.256 -7.537) 7.886 13.028 ( 2.985 -5.201 -0.724) 6.041 13.187 ( 10.660 6.095 7.340) 14.306 14.614 ( 15.577 -13.252 -8.035) 21.973 17.131 ( -4.917 0.176 -3.859) 6.254 18.910 ( 8.962 1.555 8.894) 12.722 18.963 ( -5.248 -2.573 -4.661) 7.476 19.499 ( 8.139 -3.305 1.562) 8.922 20.426 ( 2.913 9.723 -13.625) 16.990 22.886 ( -13.279 -18.965 4.204) 23.530 23.504 ( 9.221 5.956 -5.498) 12.277 24.221 ( 5.705 -2.596 14.340) 15.650 ======================= Grid point 320 (149/361) ======================= q-point: (-0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -22.593 11.292 15.982) 29.889 1.718 ( -29.463 11.542 -1.230) 31.667 2.881 ( -20.645 17.251 26.913) 38.054 3.601 ( -5.545 -5.457 -1.006) 7.845 3.825 ( -4.732 -4.516 -2.488) 6.998 3.885 ( 1.887 -6.288 6.694) 9.376 4.541 ( -2.504 -10.609 -1.324) 10.981 4.954 ( 7.016 -2.614 3.070) 8.092 5.334 ( 6.105 -5.709 -0.475) 8.372 5.470 ( -2.210 -3.357 -1.804) 4.405 5.642 ( -5.090 -3.284 0.901) 6.124 5.956 ( -0.849 -7.076 8.161) 10.835 6.401 ( -4.113 -1.352 -0.657) 4.379 6.908 ( -13.966 -4.442 7.305) 16.375 7.521 ( -12.136 -5.614 0.639) 13.387 7.606 ( 9.259 -2.781 -4.775) 10.782 8.192 ( -3.352 18.864 -0.033) 19.159 9.158 ( -2.754 -7.932 -0.380) 8.405 9.439 ( 3.622 3.674 10.663) 11.846 9.737 ( 4.567 13.531 -1.486) 14.358 10.285 ( -8.217 -11.334 -1.971) 14.137 11.060 ( -0.252 12.091 2.350) 12.319 11.801 ( 3.832 -0.479 -7.831) 8.732 12.220 ( -14.113 -1.236 5.226) 15.100 12.508 ( -2.902 -2.217 -0.851) 3.750 13.071 ( 3.175 -1.649 -7.186) 8.028 13.265 ( 6.534 11.955 -0.624) 13.639 14.823 ( 13.715 -12.268 -11.409) 21.651 17.241 ( 7.834 -5.949 18.244) 20.727 18.790 ( 0.868 7.673 -11.027) 13.462 19.114 ( 4.247 -2.026 6.426) 7.964 19.666 ( 9.377 1.239 2.681) 9.831 20.246 ( 1.675 4.564 -10.571) 11.635 22.917 ( -16.002 -22.789 4.953) 28.283 23.514 ( 8.835 5.191 -5.026) 11.413 24.436 ( 0.464 -3.288 5.331) 6.281 ======================= Grid point 321 (150/361) ======================= q-point: (-0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( -20.284 11.818 13.428) 27.045 1.507 ( -16.920 9.992 21.332) 29.003 2.873 ( -24.188 9.694 40.198) 47.905 3.534 ( -6.683 -4.105 -2.441) 8.214 3.770 ( -0.084 -0.547 -0.579) 0.802 4.033 ( 1.918 -5.489 2.460) 6.313 4.558 ( -1.362 -8.506 -4.201) 9.584 5.090 ( -0.658 -3.404 -3.563) 4.971 5.359 ( -1.272 -1.199 2.306) 2.894 5.443 ( 2.302 -2.167 -4.412) 5.428 5.753 ( 7.294 0.302 9.324) 11.842 6.131 ( -0.614 -10.604 8.909) 13.863 6.416 ( 0.325 -1.909 4.434) 4.839 6.820 ( -19.083 -17.332 0.716) 25.789 7.396 ( -10.882 -4.359 -2.438) 11.973 7.644 ( -2.423 3.869 -3.058) 5.495 8.004 ( 4.218 20.875 5.106) 21.901 9.212 ( -1.043 -9.462 2.305) 9.795 9.521 ( 0.778 6.612 -1.557) 6.837 9.678 ( 8.270 15.060 4.968) 17.885 10.209 ( -19.179 -18.780 -3.140) 27.025 10.923 ( -0.579 17.721 -0.518) 17.738 11.808 ( 4.962 -3.905 -5.308) 8.249 12.105 ( -11.087 -3.573 2.290) 11.872 12.441 ( -4.256 4.547 -2.711) 6.793 12.955 ( 1.480 7.304 -6.331) 9.779 13.240 ( 2.513 4.013 -0.918) 4.823 14.911 ( 9.563 -8.532 -16.900) 21.210 17.863 ( 20.685 -19.306 21.622) 35.610 18.644 ( 14.220 15.955 -7.047) 22.504 19.226 ( -2.512 -8.785 1.872) 9.327 19.752 ( 2.568 11.606 3.600) 12.420 20.158 ( 8.122 -0.881 -9.485) 12.519 22.978 ( -17.130 -27.384 5.988) 32.851 23.540 ( 8.753 3.345 -4.616) 10.446 24.310 ( -15.230 4.905 -11.640) 19.787 ======================= Grid point 322 (151/361) ======================= q-point: (-0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( 4.294 4.675 26.534) 27.282 1.546 ( -10.349 4.371 27.259) 29.483 2.972 ( -21.070 4.813 40.311) 45.739 3.436 ( -4.918 -1.833 -4.308) 6.790 3.850 ( 7.004 -0.975 2.728) 7.579 4.086 ( 0.792 -2.547 -3.022) 4.031 4.580 ( 0.479 -5.262 -1.444) 5.477 4.985 ( 2.193 1.311 -8.516) 8.891 5.387 ( -2.571 -1.566 -2.856) 4.149 5.401 ( -6.821 0.540 5.078) 8.521 5.955 ( -2.029 1.727 9.782) 10.139 6.347 ( 3.904 -12.528 6.155) 14.494 6.497 ( 1.832 4.033 5.688) 7.209 6.727 ( -18.617 -20.950 0.688) 28.035 7.184 ( -4.756 5.821 -11.272) 13.549 7.495 ( -14.047 7.387 16.430) 22.844 8.094 ( 6.282 6.645 11.800) 14.928 9.336 ( -0.482 -7.687 2.259) 8.027 9.372 ( -1.498 4.837 -6.222) 8.022 9.731 ( 1.984 11.617 3.782) 12.377 10.091 ( -10.481 -15.439 1.856) 18.752 10.747 ( 0.627 16.002 -2.908) 16.276 11.803 ( 1.561 -0.543 -9.124) 9.272 12.057 ( -4.488 -8.092 -1.188) 9.329 12.291 ( -4.365 10.077 4.515) 11.874 12.936 ( 4.741 1.767 1.455) 5.265 13.222 ( 0.453 1.001 -2.248) 2.502 14.832 ( 4.549 -4.050 -21.009) 21.874 18.241 ( 5.643 -7.619 -8.929) 13.024 18.981 ( 35.920 4.419 9.055) 37.307 19.246 ( -9.527 -16.779 -2.413) 19.446 19.585 ( -6.214 17.287 -2.490) 18.538 20.299 ( 18.868 -0.834 -1.278) 18.930 23.049 ( -20.523 -31.961 2.549) 38.069 23.585 ( 8.396 1.317 -4.338) 9.542 23.663 ( -30.148 23.443 -13.029) 40.352 ======================= Grid point 324 (152/361) ======================= q-point: ( 0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( 12.085 0.000 12.898) 17.675 2.549 ( 4.987 0.000 27.625) 28.071 3.236 ( 6.138 0.000 -8.546) 10.522 3.673 ( -2.823 -0.000 0.732) 2.917 3.693 ( -3.138 -0.000 -12.142) 12.541 4.090 ( 5.500 0.000 -6.531) 8.539 4.365 ( -2.426 -0.000 -7.966) 8.327 4.452 ( -3.194 -0.000 -1.610) 3.577 5.329 ( -16.129 -0.000 15.027) 22.044 5.478 ( -4.198 -0.000 9.362) 10.261 6.030 ( -0.732 -0.000 5.726) 5.773 6.343 ( -10.423 -0.000 -2.329) 10.680 6.698 ( -3.727 -0.000 6.914) 7.854 6.811 ( 4.796 0.000 -3.344) 5.847 6.846 ( -6.110 -0.000 24.006) 24.771 7.978 ( -11.219 -0.000 28.678) 30.794 8.322 ( -14.166 -0.000 0.303) 14.169 9.271 ( 1.815 0.000 -2.287) 2.920 9.340 ( 1.730 0.000 -1.836) 2.522 9.730 ( 9.434 0.000 14.747) 17.506 10.249 ( -8.484 -0.000 -10.050) 13.152 11.000 ( 20.337 0.000 9.276) 22.353 11.450 ( 7.082 0.000 -14.906) 16.503 11.932 ( 7.494 0.000 -6.485) 9.910 12.462 ( -5.340 -0.000 8.209) 9.793 13.034 ( -6.585 -0.000 1.120) 6.680 13.289 ( 8.715 0.000 -5.536) 10.325 14.123 ( -4.204 -0.000 -10.254) 11.083 18.302 ( 9.501 0.000 -8.069) 12.465 18.394 ( -10.586 -0.000 -17.322) 20.301 18.846 ( -12.050 -0.000 6.044) 13.481 19.611 ( -12.467 -0.000 0.435) 12.475 21.498 ( 17.672 0.000 14.711) 22.994 21.852 ( -6.242 -0.000 -15.564) 16.769 23.204 ( 0.800 0.000 1.432) 1.640 23.782 ( 7.396 0.000 -2.632) 7.850 ======================= Grid point 325 (153/361) ======================= q-point: ( 0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.717 ( 2.068 11.115 11.259) 15.955 2.972 ( 8.728 -9.396 12.647) 18.011 3.210 ( 2.743 2.266 -2.620) 4.418 3.498 ( -2.480 4.271 -7.900) 9.317 3.562 ( -5.260 -1.889 -7.873) 9.655 4.029 ( 6.893 3.296 -13.541) 15.548 4.302 ( 3.886 -5.812 -5.971) 9.194 4.519 ( -0.033 -5.399 7.414) 9.171 5.266 ( -16.536 0.105 10.894) 19.802 5.468 ( -12.501 -2.041 6.457) 14.218 5.998 ( -4.491 -0.029 -3.604) 5.759 6.165 ( -9.617 -0.508 -3.338) 10.193 6.727 ( 1.768 1.339 2.399) 3.266 6.869 ( 6.482 0.840 -0.292) 6.542 7.118 ( -9.768 1.798 36.656) 37.978 7.906 ( -11.509 20.388 5.401) 24.027 8.290 ( -15.630 -20.529 11.806) 28.374 9.270 ( -0.862 1.309 2.005) 2.545 9.327 ( 1.679 3.818 -1.553) 4.451 9.960 ( -6.513 3.178 -7.336) 10.312 10.163 ( 11.705 -8.678 12.944) 19.490 11.273 ( 12.897 17.077 -2.430) 21.538 11.533 ( 17.657 -12.154 1.606) 21.495 11.964 ( 9.652 2.534 -6.421) 11.866 12.505 ( -4.197 -7.641 4.766) 9.936 12.941 ( -9.338 2.488 3.455) 10.263 13.280 ( 2.148 -1.635 -10.215) 10.566 14.001 ( 1.038 0.592 -4.751) 4.899 18.029 ( -9.048 1.515 -17.014) 19.330 18.342 ( 5.319 -0.562 -2.546) 5.923 18.821 ( -3.269 -2.806 3.774) 5.727 19.421 ( -16.045 -1.355 2.467) 16.290 21.515 ( 2.043 15.955 -13.699) 21.128 21.970 ( 9.846 -14.048 10.047) 19.881 23.269 ( 5.014 -1.445 1.150) 5.344 23.850 ( 6.119 1.089 -1.231) 6.336 ======================= Grid point 326 (154/361) ======================= q-point: (-0.70 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( -7.766 14.801 3.150) 17.009 3.056 ( -5.751 -2.514 -6.934) 9.353 3.322 ( 3.113 -6.777 0.421) 7.470 3.360 ( -3.105 4.590 -3.550) 6.581 3.495 ( 1.096 0.325 7.417) 7.504 3.959 ( 10.031 3.762 -11.564) 15.764 4.406 ( 8.723 -10.500 -4.924) 14.512 4.653 ( -2.306 -6.092 6.090) 8.917 5.110 ( -17.166 0.194 3.616) 17.544 5.353 ( -15.515 -5.140 3.840) 16.789 5.854 ( -8.312 1.268 -2.975) 8.919 6.017 ( -7.694 -0.916 -2.077) 8.022 6.755 ( 1.024 4.469 1.419) 4.799 6.952 ( 4.334 0.300 1.932) 4.755 7.381 ( -13.576 0.227 33.253) 35.918 7.647 ( -4.341 12.269 -2.404) 13.235 8.383 ( -14.428 -14.670 11.287) 23.468 9.244 ( -3.094 6.967 3.536) 8.403 9.313 ( 1.665 1.496 0.320) 2.261 9.721 ( -9.984 -4.820 -10.200) 15.065 10.592 ( 13.887 -4.248 13.681) 19.952 11.187 ( 11.087 25.770 -4.242) 28.373 11.924 ( 12.974 -3.650 -1.420) 13.552 12.052 ( 14.553 -4.454 3.331) 15.579 12.605 ( 0.282 -9.673 3.741) 10.375 12.812 ( -11.104 4.310 4.155) 12.615 13.144 ( -5.572 -2.321 -9.398) 11.169 14.027 ( 8.712 -3.765 -5.309) 10.875 17.691 ( -9.038 -0.439 -17.308) 19.531 18.437 ( 5.595 0.210 6.590) 8.647 18.869 ( 2.189 -3.632 -0.336) 4.254 19.288 ( -10.288 -3.425 3.688) 11.454 21.218 ( 2.713 14.094 -17.887) 22.934 22.314 ( 2.043 -13.448 10.960) 17.468 23.392 ( 8.674 -0.340 1.777) 8.860 23.906 ( 4.548 2.328 1.117) 5.230 ======================= Grid point 327 (155/361) ======================= q-point: (-0.60 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( -13.211 14.998 3.806) 20.346 2.817 ( -14.963 4.029 -6.501) 16.804 3.279 ( 0.426 -3.300 0.216) 3.335 3.399 ( -1.172 -7.786 -1.620) 8.039 3.596 ( 1.700 5.408 4.408) 7.181 3.939 ( 3.503 1.047 -5.961) 6.993 4.555 ( -0.976 -5.274 -0.555) 5.392 4.649 ( -2.896 -3.440 -1.139) 4.638 4.977 ( -8.386 -8.580 2.291) 12.215 5.274 ( -8.654 -7.372 3.420) 11.871 5.691 ( -10.392 -0.138 -0.853) 10.428 5.910 ( -6.253 0.009 0.180) 6.256 6.692 ( -4.188 5.846 -0.122) 7.193 7.018 ( -0.295 0.553 3.864) 3.914 7.484 ( -10.032 3.045 11.752) 15.749 7.559 ( -3.302 -0.170 6.175) 7.004 8.434 ( -11.411 -10.130 9.164) 17.799 9.153 ( -4.454 9.774 3.040) 11.163 9.343 ( 2.091 0.456 1.572) 2.655 9.563 ( -7.911 -10.678 -5.189) 14.266 10.904 ( 9.357 6.811 5.410) 12.776 11.054 ( 9.877 23.879 1.724) 25.899 11.967 ( 7.458 1.576 -8.546) 11.452 12.377 ( 4.681 -5.060 6.915) 9.764 12.661 ( -8.813 2.723 -0.169) 9.226 12.802 ( 7.912 -5.083 6.650) 11.518 13.003 ( -4.278 -4.694 -1.383) 6.500 14.163 ( 13.244 -10.026 -8.540) 18.678 17.368 ( -8.476 -0.022 -14.721) 16.987 18.659 ( 8.785 0.186 12.509) 15.287 18.915 ( 1.940 -4.019 -3.110) 5.440 19.298 ( 0.855 -3.932 3.334) 5.225 20.907 ( 1.599 12.308 -18.453) 22.238 22.515 ( -7.347 -14.701 7.096) 17.901 23.541 ( 9.768 2.857 1.517) 10.290 23.986 ( 4.059 0.937 6.076) 7.367 ======================= Grid point 328 (156/361) ======================= q-point: (-0.50 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( -16.519 14.671 8.917) 23.825 2.429 ( -20.673 9.504 -5.433) 23.393 3.386 ( -4.553 3.272 2.853) 6.291 3.425 ( 3.431 -12.143 2.181) 12.805 3.552 ( -3.708 6.146 3.465) 7.971 3.864 ( -6.971 -2.317 -1.227) 7.448 4.413 ( -11.948 -3.610 -0.465) 12.490 4.755 ( 5.548 -8.012 -2.570) 10.078 5.057 ( 2.784 -8.505 2.173) 9.209 5.314 ( -3.951 -9.040 3.442) 10.449 5.559 ( -10.740 -5.219 0.484) 11.951 5.858 ( -3.003 1.139 3.489) 4.742 6.546 ( -8.853 4.022 -0.847) 9.760 7.002 ( -9.202 0.677 4.951) 10.471 7.477 ( -4.383 -0.869 5.755) 7.286 7.547 ( -3.665 -2.847 -2.695) 5.367 8.469 ( -7.232 -2.527 7.886) 10.995 9.060 ( -3.659 4.227 2.813) 6.259 9.397 ( 2.713 2.279 3.975) 5.325 9.565 ( -5.319 -15.351 0.646) 16.259 10.759 ( 4.825 29.702 -4.557) 30.435 11.184 ( 7.471 6.711 8.338) 13.053 11.921 ( 4.432 3.007 -9.133) 10.588 12.400 ( -14.962 3.669 11.562) 19.261 12.521 ( -1.043 -1.871 -9.516) 9.754 12.906 ( -0.041 -8.389 -1.182) 8.472 13.232 ( 14.389 -0.432 9.554) 17.277 14.354 ( 14.878 -14.777 -11.250) 23.796 17.133 ( -5.277 0.044 -5.919) 7.930 18.912 ( 3.492 -2.035 -4.068) 5.734 18.946 ( 8.026 1.429 9.933) 12.850 19.449 ( 10.685 -2.286 2.850) 11.292 20.600 ( -0.874 9.248 -16.209) 18.683 22.558 ( -14.669 -16.622 3.389) 22.427 23.620 ( 7.642 6.706 -1.301) 10.250 24.166 ( 3.825 -3.428 11.059) 12.194 ======================= Grid point 329 (157/361) ======================= q-point: (-0.40 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( -17.663 14.416 13.994) 26.751 1.956 ( -23.875 14.753 -1.186) 28.091 3.230 ( -13.191 18.500 14.662) 27.041 3.483 ( -6.640 -6.748 -0.172) 9.469 3.665 ( 1.411 -10.742 3.981) 11.542 3.815 ( -3.832 -3.020 3.582) 6.053 4.346 ( -3.536 -10.569 -3.627) 11.720 4.867 ( 4.268 -6.412 0.227) 7.706 5.201 ( 1.391 -10.116 1.057) 10.266 5.374 ( -2.865 -7.259 1.231) 7.900 5.527 ( -5.529 -6.889 5.798) 10.566 5.897 ( 0.938 -0.066 5.450) 5.530 6.374 ( -12.358 -0.561 1.380) 12.448 6.876 ( -15.279 -1.814 2.225) 15.547 7.423 ( -11.315 -4.013 0.727) 12.028 7.554 ( 7.100 -2.447 -4.154) 8.582 8.457 ( -2.381 9.159 6.100) 11.259 9.029 ( -4.003 -4.506 -0.477) 6.046 9.499 ( 4.114 2.890 8.990) 10.300 9.660 ( -5.676 -17.769 1.029) 18.681 10.479 ( 1.248 28.589 -4.580) 28.981 11.274 ( 4.353 11.341 5.932) 13.519 11.828 ( 2.209 3.176 -8.238) 9.101 12.256 ( -14.631 3.947 6.976) 16.683 12.461 ( -1.215 -2.665 -1.502) 3.292 12.968 ( 2.318 -8.408 -5.123) 10.115 13.445 ( 9.984 6.821 -0.367) 12.097 14.556 ( 13.622 -16.638 -12.484) 24.864 17.143 ( 2.625 -4.657 10.032) 11.367 18.880 ( 6.027 0.852 -10.358) 12.015 19.123 ( 5.210 4.189 4.782) 8.220 19.696 ( 17.024 1.977 4.702) 17.772 20.334 ( -3.784 4.849 -11.465) 13.011 22.517 ( -19.457 -20.375 3.166) 28.351 23.627 ( 6.567 7.290 -2.657) 10.165 24.359 ( -0.657 -5.157 7.558) 9.173 ======================= Grid point 330 (158/361) ======================= q-point: (-0.30 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( -15.988 18.855 11.349) 27.202 1.718 ( -15.925 13.021 18.472) 27.647 3.117 ( -17.294 16.164 27.806) 36.518 3.432 ( -7.753 -7.066 -1.180) 10.556 3.737 ( 2.850 -3.721 -2.812) 5.466 3.916 ( -1.873 -6.307 8.250) 10.552 4.370 ( 1.177 -11.433 -7.046) 13.481 4.993 ( 1.730 -7.215 0.183) 7.421 5.283 ( -3.963 -8.574 2.236) 9.706 5.399 ( 0.654 -2.738 -0.186) 2.821 5.683 ( 1.405 -8.264 12.601) 15.134 5.986 ( -1.292 -3.379 5.240) 6.367 6.299 ( -11.244 -8.008 8.586) 16.257 6.682 ( -13.227 -2.402 -2.846) 13.742 7.312 ( -9.451 -3.881 -0.500) 10.229 7.619 ( 2.765 -3.615 -3.215) 5.572 8.383 ( -0.022 18.353 5.585) 19.184 9.035 ( -2.550 -9.740 0.280) 10.072 9.630 ( 3.431 4.807 4.551) 7.456 9.711 ( -9.020 -17.419 -0.695) 19.628 10.199 ( -0.976 24.033 -1.413) 24.094 11.248 ( 2.650 17.742 3.131) 18.210 11.761 ( 2.792 -0.594 -5.392) 6.101 12.113 ( -10.984 3.042 3.999) 12.079 12.469 ( -0.959 -0.287 1.310) 1.648 12.974 ( 2.330 -4.623 -8.635) 10.068 13.401 ( 2.884 11.195 -4.934) 12.570 14.695 ( 9.497 -14.972 -15.887) 23.807 17.541 ( 11.939 -15.710 19.240) 27.559 18.843 ( 12.944 2.749 -12.508) 18.208 19.146 ( 1.343 3.533 -1.276) 3.989 19.960 ( 13.157 10.835 7.989) 18.823 20.138 ( -0.493 -1.185 -9.372) 9.459 22.479 ( -22.374 -25.532 5.422) 34.379 23.622 ( 6.441 5.734 -3.254) 9.217 24.350 ( -10.343 -0.525 -3.144) 10.823 ======================= Grid point 331 (159/361) ======================= q-point: (-0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.525 ( 2.147 13.165 22.184) 25.886 1.674 ( -12.069 9.216 23.747) 28.187 3.133 ( -14.067 12.167 32.421) 37.377 3.372 ( -5.124 -5.144 -2.848) 7.799 3.812 ( 6.622 -3.582 -1.684) 7.715 4.017 ( -1.974 -3.932 4.652) 6.404 4.422 ( 2.650 -11.281 -5.110) 12.665 5.000 ( 1.704 -0.638 -5.599) 5.888 5.331 ( -4.590 -5.044 2.414) 7.235 5.412 ( -4.268 0.440 5.040) 6.619 5.991 ( -14.127 -3.588 6.432) 15.932 6.021 ( 6.423 -16.446 13.642) 22.312 6.388 ( -9.312 -12.122 12.317) 19.631 6.549 ( -1.299 -0.365 -0.988) 1.672 7.196 ( -8.231 -1.991 -4.032) 9.379 7.579 ( -6.175 -0.087 -0.675) 6.213 8.327 ( 1.485 16.970 11.814) 20.731 9.145 ( 0.458 -11.717 2.671) 12.027 9.534 ( -2.244 8.847 -6.190) 11.029 9.757 ( -10.073 -16.532 1.013) 19.386 10.026 ( 4.262 19.625 3.375) 20.364 11.114 ( 1.697 22.208 0.119) 22.273 11.769 ( 4.051 -3.020 -6.808) 8.478 11.981 ( -8.880 0.210 0.344) 8.889 12.446 ( -1.089 6.244 2.438) 6.791 12.957 ( 4.304 -1.059 -3.315) 5.535 13.285 ( -0.535 6.710 -2.375) 7.138 14.692 ( 4.574 -11.258 -19.943) 23.354 18.022 ( 9.348 -15.058 4.432) 18.270 18.918 ( 2.556 -14.135 -8.333) 16.607 19.151 ( 17.106 8.390 -1.540) 19.115 19.856 ( -8.221 10.772 -2.372) 13.756 20.299 ( 19.275 2.745 3.089) 19.713 22.474 ( -24.118 -29.065 5.908) 38.228 23.629 ( 6.540 3.500 -3.696) 8.287 23.991 ( -19.797 12.167 -9.673) 25.170 ======================= Grid point 332 (160/361) ======================= q-point: (-0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.788 ( -0.346 2.895 23.562) 23.741 1.841 ( 5.912 5.746 25.054) 26.376 3.277 ( -1.433 0.007 7.257) 7.397 3.341 ( -3.784 5.810 18.418) 19.680 3.896 ( 3.406 -7.133 -6.202) 10.047 4.046 ( -1.601 0.829 2.949) 3.456 4.493 ( 1.247 -9.651 -5.542) 11.199 4.932 ( 3.305 2.560 -13.761) 14.382 5.315 ( -1.375 -1.414 0.082) 1.974 5.409 ( -10.263 2.906 15.265) 18.622 5.855 ( -20.595 -1.960 13.770) 24.852 6.391 ( 4.740 -10.774 5.834) 13.138 6.548 ( -5.103 -11.773 14.992) 19.733 6.587 ( -1.400 -1.085 5.550) 5.825 7.004 ( -4.620 1.240 -11.465) 12.423 7.542 ( -10.433 -2.704 15.177) 18.614 8.391 ( 1.031 11.039 14.114) 17.948 9.260 ( -0.504 -8.415 -1.013) 8.491 9.366 ( 0.432 8.584 -2.923) 9.078 9.695 ( -10.250 0.059 1.412) 10.347 10.100 ( 10.256 -4.401 2.678) 11.477 10.917 ( 1.686 23.945 -1.704) 24.065 11.687 ( 1.383 1.016 -12.557) 12.674 11.923 ( -2.628 -6.916 -2.747) 7.892 12.424 ( -1.379 9.240 8.731) 12.787 13.039 ( 6.964 -1.461 0.416) 7.128 13.203 ( -1.401 3.145 -1.814) 3.892 14.553 ( -0.039 -7.091 -20.682) 21.864 18.193 ( 9.130 -4.801 -7.347) 12.665 18.852 ( -13.297 -16.428 -7.531) 22.437 19.344 ( 3.442 5.682 -3.682) 7.596 19.650 ( 5.892 8.057 -3.291) 10.510 20.625 ( 19.757 0.259 8.095) 21.352 22.414 ( -25.227 -23.050 -0.042) 34.171 23.481 ( -14.521 17.888 -4.219) 23.423 23.660 ( 6.912 1.757 -3.706) 8.037 ======================= Grid point 335 (161/361) ======================= q-point: ( 0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.862 ( -6.274 -0.000 5.204) 8.151 2.935 ( -1.757 -0.000 -10.796) 10.938 3.263 ( -2.778 -0.000 1.368) 3.097 3.392 ( -4.755 -0.000 -6.832) 8.324 3.521 ( 3.058 0.000 11.160) 11.571 4.005 ( 12.456 0.000 -16.002) 20.278 4.295 ( 7.146 0.000 -2.021) 7.426 4.571 ( -3.098 -0.000 6.505) 7.205 5.157 ( -13.106 -0.000 6.194) 14.496 5.276 ( -19.370 -0.000 1.595) 19.435 5.868 ( -7.112 -0.000 -3.906) 8.114 6.006 ( -7.895 -0.000 -1.708) 8.077 6.811 ( 2.893 0.000 3.462) 4.511 6.938 ( 5.178 0.000 -3.174) 6.073 7.383 ( -16.149 -0.000 34.065) 37.699 7.801 ( -11.735 -0.000 -4.478) 12.561 8.208 ( -10.597 -0.000 16.654) 19.740 9.303 ( -2.168 -0.000 4.855) 5.317 9.329 ( -0.067 -0.000 -1.734) 1.736 9.683 ( -9.782 -0.000 -12.839) 16.141 10.552 ( 15.590 0.000 16.331) 22.578 11.503 ( 16.764 0.000 -8.505) 18.798 11.818 ( 15.611 0.000 12.251) 19.844 12.024 ( 8.755 0.000 -6.882) 11.136 12.496 ( 0.770 0.000 6.340) 6.387 12.853 ( -11.680 -0.000 4.538) 12.531 13.120 ( -4.592 -0.000 -11.009) 11.929 13.993 ( 6.769 0.000 -6.398) 9.315 17.687 ( -9.027 -0.000 -17.570) 19.753 18.438 ( 4.626 0.000 7.475) 8.790 18.838 ( 3.579 0.000 -0.867) 3.683 19.256 ( -10.214 -0.000 3.402) 10.766 21.366 ( 2.027 0.000 -22.526) 22.617 22.174 ( 1.639 0.000 14.959) 15.048 23.388 ( 8.709 0.000 3.314) 9.318 23.927 ( 4.900 0.000 0.339) 4.912 ======================= Grid point 336 (162/361) ======================= q-point: (-0.70 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( -8.322 13.262 -3.115) 15.964 2.821 ( -9.824 -4.412 -5.852) 12.256 3.222 ( -4.869 -3.275 0.447) 5.885 3.267 ( -5.551 -3.799 -2.109) 7.049 3.698 ( 1.898 3.943 10.560) 11.431 3.955 ( 6.502 0.558 -15.009) 16.367 4.433 ( 8.224 -4.743 1.534) 9.617 4.594 ( -5.658 -3.623 4.274) 7.963 4.946 ( -17.307 4.267 -0.211) 17.827 5.135 ( -8.703 -7.314 3.839) 11.999 5.703 ( -9.844 0.679 -3.008) 10.316 5.908 ( -5.252 -0.148 0.627) 5.291 6.818 ( -2.202 7.589 -0.074) 7.902 6.962 ( 0.115 -5.924 -2.051) 6.270 7.484 ( -21.630 -0.758 25.576) 33.505 7.628 ( -2.832 3.993 -2.768) 5.624 8.283 ( -8.634 -5.182 13.047) 16.481 9.296 ( -4.059 4.942 4.387) 7.755 9.314 ( -3.013 -2.375 -0.529) 3.872 9.442 ( -3.779 -2.865 -9.172) 10.325 10.930 ( 12.200 0.242 12.652) 17.578 11.541 ( 14.255 22.012 -4.643) 26.633 12.000 ( 6.517 3.263 -5.725) 9.268 12.186 ( 6.476 -15.135 2.755) 16.691 12.671 ( -9.273 -0.937 12.002) 15.196 12.780 ( 8.262 1.784 4.081) 9.386 12.918 ( -6.846 -3.715 -7.052) 10.508 14.033 ( 11.431 -3.879 -10.699) 16.130 17.368 ( -8.222 -0.023 -14.238) 16.441 18.659 ( 7.418 -0.113 14.432) 16.227 18.875 ( 6.368 -0.865 -5.879) 8.710 19.245 ( 1.103 -1.694 4.405) 4.846 21.076 ( -0.053 5.527 -22.141) 22.821 22.317 ( -7.302 -6.303 9.517) 13.551 23.575 ( 9.218 0.970 6.112) 11.102 23.998 ( 3.722 0.359 2.220) 4.349 ======================= Grid point 337 (163/361) ======================= q-point: (-0.60 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( -10.199 13.987 1.612) 17.385 2.577 ( -14.174 6.311 -4.289) 16.097 3.226 ( -3.707 -9.305 0.216) 10.019 3.272 ( -4.147 -9.003 5.252) 11.217 3.742 ( -0.059 7.872 2.478) 8.253 3.824 ( -4.037 -2.258 -6.988) 8.380 4.426 ( -16.195 6.276 -0.132) 17.369 4.622 ( 5.125 -5.799 2.827) 8.240 4.860 ( -1.509 -12.885 0.343) 12.977 5.170 ( -3.479 -5.822 5.051) 8.456 5.522 ( -11.239 -0.262 -0.462) 11.252 5.876 ( -1.825 0.793 2.973) 3.578 6.648 ( -9.925 7.126 -1.544) 12.315 6.943 ( -9.567 -6.811 -1.560) 11.847 7.450 ( -16.338 -1.426 13.465) 21.220 7.561 ( 1.158 2.837 -3.049) 4.323 8.381 ( -5.858 -4.899 12.410) 14.571 9.166 ( -4.272 4.019 -4.028) 7.115 9.318 ( -6.049 -7.494 3.234) 10.159 9.429 ( 2.183 -0.458 2.420) 3.291 11.162 ( 7.875 8.626 4.955) 12.688 11.440 ( 9.386 25.784 1.075) 27.461 11.967 ( 4.401 2.317 -7.829) 9.275 12.366 ( -0.126 -9.740 0.238) 9.744 12.531 ( -13.337 2.860 2.188) 13.815 12.750 ( -5.795 -7.432 -2.619) 9.781 13.201 ( 17.640 -2.251 11.738) 21.308 14.123 ( 14.162 -9.811 -14.054) 22.234 17.132 ( -5.410 -0.029 -7.363) 9.136 18.881 ( 7.014 -1.226 -9.976) 12.256 18.970 ( 9.474 1.053 15.718) 18.383 19.417 ( 12.697 -1.210 5.128) 13.747 20.742 ( -3.205 6.008 -19.837) 20.973 22.315 ( -14.499 -9.833 4.109) 17.994 23.732 ( 6.120 5.247 4.684) 9.323 24.104 ( 2.963 -3.236 5.917) 7.366 ======================= Grid point 338 (164/361) ======================= q-point: (-0.50 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( -11.860 14.769 6.588) 20.055 2.238 ( -16.045 16.037 2.085) 22.781 3.249 ( -7.427 -10.769 1.993) 13.233 3.428 ( 0.553 -11.042 4.798) 12.052 3.604 ( -8.305 7.239 1.179) 11.080 3.788 ( -2.846 0.711 5.166) 5.941 4.206 ( -6.500 -2.116 -2.313) 7.217 4.750 ( 2.069 -5.946 1.025) 6.378 4.968 ( -3.043 -14.296 -0.327) 14.620 5.242 ( -4.729 -6.870 6.818) 10.773 5.449 ( -4.001 -2.157 6.384) 7.837 5.913 ( 1.766 1.258 4.164) 4.694 6.394 ( -18.432 2.577 1.022) 18.639 6.793 ( -14.152 -7.055 -3.737) 16.248 7.390 ( -8.790 -0.515 2.860) 9.258 7.534 ( 2.934 0.552 -2.667) 4.003 8.502 ( -2.921 -2.515 11.474) 12.104 9.033 ( -4.870 3.273 -2.643) 6.436 9.349 ( -8.018 -13.845 2.249) 16.156 9.538 ( 4.589 1.150 7.539) 8.900 11.041 ( 4.587 30.003 -4.986) 30.758 11.466 ( 5.688 11.085 8.206) 14.919 11.890 ( 2.029 3.115 -8.097) 8.910 12.336 ( -15.500 4.521 7.963) 18.002 12.411 ( 1.442 -3.571 -3.503) 5.206 12.779 ( 0.031 -12.319 -3.578) 12.828 13.518 ( 11.572 1.940 3.838) 12.345 14.260 ( 14.083 -15.175 -14.826) 25.464 17.078 ( 0.406 -2.579 4.083) 4.846 18.850 ( 7.326 -2.620 -14.432) 16.396 19.228 ( 8.050 5.934 9.616) 13.874 19.730 ( 21.413 1.642 6.202) 22.354 20.412 ( -6.546 3.724 -14.957) 16.746 22.213 ( -19.291 -13.055 2.584) 23.436 23.767 ( 3.636 8.051 1.011) 8.891 24.255 ( -0.542 -6.337 6.477) 9.077 ======================= Grid point 339 (165/361) ======================= q-point: (-0.40 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.910 ( -12.349 19.118 9.953) 24.841 1.986 ( -10.949 17.775 12.751) 24.463 3.264 ( -7.362 -8.797 2.954) 11.845 3.391 ( -12.168 8.251 8.907) 17.190 3.617 ( 1.726 -8.723 0.924) 8.940 3.849 ( -2.219 -1.597 10.214) 10.574 4.197 ( 3.636 -5.246 -5.737) 8.582 4.840 ( 1.916 -9.815 -1.034) 10.053 5.053 ( -7.461 -14.360 7.662) 17.905 5.330 ( -3.356 -5.561 6.837) 9.430 5.558 ( -2.480 -4.226 10.799) 11.859 5.974 ( -0.212 0.757 3.401) 3.490 6.186 ( -15.818 -4.675 7.411) 18.083 6.621 ( -8.766 -5.159 -6.143) 11.883 7.284 ( -6.752 0.711 -1.142) 6.884 7.556 ( 2.026 -2.796 -2.717) 4.393 8.608 ( -0.355 4.572 9.778) 10.800 8.911 ( -6.473 -1.502 -0.644) 6.676 9.380 ( -9.971 -16.505 0.576) 19.292 9.693 ( 4.547 2.338 7.943) 9.446 10.737 ( 2.743 32.551 -5.153) 33.070 11.524 ( 3.156 12.131 7.361) 14.537 11.784 ( 1.645 2.775 -8.046) 8.669 12.187 ( -11.143 4.989 5.262) 13.294 12.454 ( 2.142 -1.327 2.062) 3.256 12.837 ( 1.760 -10.105 -5.926) 11.846 13.568 ( 3.636 7.082 -5.009) 9.405 14.399 ( 10.212 -17.093 -15.717) 25.367 17.312 ( 7.822 -9.728 14.838) 19.390 18.781 ( 5.862 -5.868 -18.194) 19.996 19.315 ( 8.135 11.483 0.250) 14.075 20.077 ( 14.436 -0.102 -3.916) 14.958 20.168 ( 0.581 6.605 2.393) 7.049 22.101 ( -21.149 -16.369 4.814) 27.174 23.740 ( 3.037 7.243 -1.141) 7.937 24.302 ( -7.399 -4.490 0.491) 8.669 ======================= Grid point 340 (166/361) ======================= q-point: (-0.30 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( -2.849 16.270 16.544) 23.378 1.885 ( -8.046 15.372 17.795) 24.854 3.242 ( -6.401 -7.151 -1.915) 9.787 3.361 ( -5.934 8.677 19.918) 22.522 3.713 ( 3.865 -6.864 -3.072) 8.455 3.980 ( -2.787 -1.168 12.997) 13.343 4.222 ( 3.930 -8.221 -7.479) 11.788 4.937 ( 4.192 -6.800 -4.016) 8.941 5.192 ( -7.276 -10.453 11.085) 16.885 5.403 ( -3.993 -2.305 7.709) 8.983 5.677 ( -14.007 -12.740 15.353) 24.376 6.008 ( -0.427 -1.445 6.639) 6.808 6.225 ( -3.732 -6.368 9.077) 11.699 6.519 ( -1.728 -3.258 -3.296) 4.946 7.169 ( -6.346 -0.229 -2.785) 6.934 7.538 ( -3.014 -2.996 -3.863) 5.743 8.616 ( -1.880 13.781 9.881) 17.061 8.933 ( -2.328 -11.323 3.583) 12.103 9.389 ( -8.232 -15.299 -0.277) 17.376 9.765 ( 1.494 7.493 2.779) 8.130 10.450 ( 2.389 27.414 -2.303) 27.614 11.488 ( 0.494 17.922 3.976) 18.365 11.724 ( 4.115 -1.560 -7.112) 8.364 12.033 ( -9.433 4.976 -0.705) 10.688 12.521 ( 2.811 2.391 3.374) 5.001 12.887 ( 3.774 -6.058 -2.556) 7.581 13.433 ( -1.846 8.411 -5.121) 10.019 14.445 ( 5.112 -15.613 -18.738) 24.920 17.750 ( 10.411 -14.123 13.147) 21.925 18.682 ( -0.537 -11.447 -16.676) 20.234 19.323 ( 14.130 9.817 -5.704) 18.127 19.926 ( -9.533 -1.647 -5.354) 11.057 20.444 ( 20.671 12.074 8.421) 25.377 22.045 ( -19.322 -18.660 6.953) 27.747 23.706 ( 3.274 4.919 -2.493) 6.414 24.118 ( -14.267 2.826 -6.365) 15.876 ======================= Grid point 341 (167/361) ======================= q-point: (-0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.880 ( -3.579 7.759 19.555) 21.340 1.988 ( 7.291 10.377 19.963) 23.651 3.201 ( -1.792 -6.227 -5.166) 8.287 3.502 ( -0.580 7.022 20.320) 21.507 3.765 ( 1.552 -6.066 -4.902) 7.952 4.066 ( -4.365 1.888 10.029) 11.100 4.290 ( 4.476 -11.501 -7.297) 14.337 4.959 ( 3.943 -0.157 -8.764) 9.612 5.275 ( -2.683 -3.479 5.234) 6.833 5.459 ( -8.909 2.134 16.730) 19.074 5.758 ( -16.795 -8.990 18.599) 26.624 6.189 ( 4.610 -9.628 7.190) 12.870 6.370 ( -2.367 -7.774 12.253) 14.702 6.545 ( -1.217 -3.556 3.783) 5.333 7.016 ( -5.921 0.356 -8.925) 10.717 7.470 ( -7.140 -4.049 2.298) 8.524 8.613 ( -2.181 12.234 13.552) 18.387 9.054 ( -2.128 -12.902 1.574) 13.171 9.437 ( -1.842 -9.164 0.296) 9.352 9.693 ( 0.124 10.471 0.615) 10.490 10.265 ( 2.276 17.908 -0.310) 18.055 11.334 ( -0.399 21.003 0.368) 21.010 11.704 ( 4.612 0.304 -11.383) 12.286 11.842 ( -6.599 -0.564 -3.896) 7.684 12.572 ( 1.768 6.276 6.335) 9.091 12.993 ( 5.258 -3.005 1.257) 6.185 13.287 ( -2.261 5.614 -2.413) 6.515 14.373 ( 0.635 -12.614 -19.839) 23.519 18.077 ( 9.803 -7.688 0.198) 12.460 18.570 ( -9.593 -14.491 -8.772) 19.466 19.403 ( 10.654 1.411 -7.372) 13.033 19.756 ( -3.904 2.328 -4.363) 6.300 20.698 ( 13.891 8.855 10.336) 19.447 22.052 ( -12.748 -16.446 4.127) 21.213 23.681 ( 0.596 3.350 -3.607) 4.959 23.758 ( -11.150 9.578 -7.028) 16.292 ======================= Grid point 342 (168/361) ======================= q-point: (-0.10 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( 0.141 0.679 22.209) 22.220 2.314 ( 14.611 6.178 17.858) 23.886 3.182 ( 2.419 -5.430 -7.056) 9.226 3.642 ( -0.980 -3.201 3.264) 4.676 3.753 ( -1.112 0.371 0.203) 1.190 4.098 ( -1.257 1.093 3.960) 4.296 4.329 ( 1.527 -6.340 -6.280) 9.053 4.815 ( -2.142 6.713 -10.413) 12.573 5.328 ( -2.237 -0.019 6.194) 6.585 5.498 ( -9.803 4.343 15.138) 18.550 5.903 ( -4.751 0.126 22.568) 23.063 6.371 ( -4.329 -9.770 7.308) 12.946 6.583 ( 0.053 -7.701 3.676) 8.533 6.620 ( -5.008 -3.758 16.330) 17.489 6.808 ( -4.126 -0.796 -10.610) 11.412 7.518 ( -7.007 -11.096 11.201) 17.254 8.638 ( -4.319 11.003 13.456) 17.911 9.141 ( -2.062 -11.761 0.151) 11.942 9.423 ( -2.086 4.737 -1.941) 5.528 9.675 ( 2.531 5.657 4.677) 7.764 10.211 ( 5.006 2.974 -0.502) 5.845 11.134 ( -0.107 19.458 -1.040) 19.486 11.559 ( 2.408 1.944 -13.262) 13.618 11.818 ( 3.828 -4.912 -4.852) 7.894 12.604 ( -0.507 9.198 8.136) 12.290 13.046 ( -3.246 -3.117 -0.887) 4.587 13.259 ( 6.972 4.021 -0.047) 8.049 14.226 ( -2.613 -8.995 -16.733) 19.176 18.203 ( 9.433 -3.929 -8.454) 13.263 18.472 ( -10.085 -11.415 -3.578) 15.646 19.254 ( -10.029 7.497 -7.713) 14.706 19.716 ( 0.692 0.624 -1.918) 2.132 20.971 ( 10.174 -3.212 11.924) 16.001 22.049 ( -3.487 -5.919 -3.637) 7.773 23.406 ( -7.925 10.514 -3.411) 13.601 23.717 ( 5.721 0.306 -3.316) 6.620 ======================= Grid point 346 (169/361) ======================= q-point: ( 0.30 -0.70 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.544 ( -5.380 -0.000 -7.306) 9.073 2.627 ( -10.705 -0.000 1.387) 10.794 3.130 ( -8.449 -0.000 0.552) 8.467 3.171 ( -6.098 -0.000 6.613) 8.996 3.792 ( -1.342 -0.000 -14.231) 14.294 3.812 ( -3.096 -0.000 6.111) 6.850 4.567 ( 5.689 0.000 5.925) 8.214 4.603 ( 1.700 0.000 1.150) 2.052 4.633 ( -20.751 -0.000 -2.420) 20.891 5.116 ( -2.497 -0.000 6.476) 6.941 5.522 ( -11.350 -0.000 -1.227) 11.416 5.884 ( -1.310 -0.000 2.829) 3.118 6.787 ( -15.593 -0.000 1.440) 15.659 6.802 ( -4.198 -0.000 -7.288) 8.410 7.437 ( -17.777 -0.000 14.950) 23.228 7.594 ( -0.386 -0.000 -2.041) 2.077 8.334 ( -5.488 -0.000 14.084) 15.115 9.155 ( -4.536 -0.000 -8.169) 9.344 9.304 ( -8.095 -0.000 5.973) 10.060 9.417 ( 4.386 0.000 1.786) 4.735 11.219 ( 8.902 0.000 9.507) 13.025 11.785 ( 13.388 0.000 -7.464) 15.328 12.071 ( 7.047 0.000 -5.843) 9.155 12.103 ( -2.433 -0.000 1.482) 2.849 12.567 ( -16.447 -0.000 8.007) 18.293 12.681 ( -8.105 -0.000 -6.561) 10.428 13.177 ( 19.259 0.000 12.564) 22.995 14.031 ( 13.781 0.000 -15.204) 20.521 17.132 ( -5.428 -0.000 -7.873) 9.563 18.870 ( 8.457 0.000 -11.793) 14.512 18.980 ( 9.623 0.000 17.230) 19.735 19.406 ( 13.536 0.000 6.181) 14.881 20.799 ( -4.007 -0.000 -21.727) 22.093 22.224 ( -14.235 -0.000 4.904) 15.056 23.785 ( 5.445 0.000 8.970) 10.493 24.069 ( 2.792 0.000 1.976) 3.421 ======================= Grid point 348 (170/361) ======================= q-point: (-0.60 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.377 ( -6.524 8.670 0.310) 10.855 2.487 ( -8.686 9.533 4.623) 13.701 3.065 ( -8.919 -7.413 3.323) 12.064 3.227 ( -4.418 -8.400 7.703) 12.224 3.641 ( 0.011 -0.564 -8.695) 8.713 3.782 ( -7.478 -1.452 2.256) 7.944 4.324 ( -9.567 10.870 2.409) 14.679 4.653 ( 0.455 -6.008 -3.066) 6.760 4.748 ( 1.070 -7.595 6.063) 9.777 5.145 ( -9.977 -3.261 9.385) 14.080 5.430 ( -3.156 -0.365 5.338) 6.212 5.932 ( 2.320 0.591 3.781) 4.475 6.455 ( -26.186 3.376 0.973) 26.421 6.665 ( -8.046 -5.631 -7.799) 12.541 7.380 ( -8.135 -0.511 4.579) 9.349 7.561 ( 0.469 1.412 -2.372) 2.800 8.449 ( -4.441 -1.937 14.099) 14.908 9.036 ( -2.004 -2.731 -6.625) 7.441 9.237 ( -10.662 0.103 5.727) 12.103 9.545 ( 5.263 -0.132 7.037) 8.789 11.385 ( 6.275 6.972 3.170) 9.901 11.750 ( 6.047 16.591 -3.488) 18.000 11.956 ( 0.102 7.781 -4.458) 8.968 12.257 ( 3.257 -14.955 -2.026) 15.439 12.422 ( -12.996 3.935 5.712) 14.731 12.577 ( -3.985 -7.619 -1.241) 8.687 13.536 ( 12.308 0.341 7.607) 14.474 14.057 ( 14.658 -6.341 -17.776) 23.896 17.048 ( -0.181 -0.801 1.104) 1.376 18.813 ( 7.899 -1.174 -17.277) 19.033 19.306 ( 9.369 2.326 13.791) 16.834 19.751 ( 23.286 0.613 6.893) 24.292 20.460 ( -7.339 1.433 -18.364) 19.828 22.055 ( -18.475 -4.474 2.926) 19.232 23.899 ( 0.473 5.631 6.181) 8.375 24.145 ( 0.991 -4.972 2.468) 5.639 ======================= Grid point 349 (171/361) ======================= q-point: (-0.50 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( -8.170 14.424 6.877) 17.947 2.343 ( -5.348 19.636 9.853) 22.611 3.076 ( -7.930 -10.563 3.486) 13.660 3.320 ( -7.978 -13.190 3.222) 15.748 3.571 ( 0.418 2.399 0.251) 2.448 3.775 ( 0.998 -6.652 -0.980) 6.798 4.258 ( 0.407 9.448 8.923) 13.002 4.644 ( -2.066 -10.443 -4.847) 11.697 4.872 ( -5.252 -5.073 11.070) 13.261 5.197 ( -8.965 -8.368 13.046) 17.905 5.520 ( -0.505 -0.702 8.788) 8.830 6.000 ( -1.320 2.040 2.831) 3.731 6.119 ( -19.155 -3.081 5.340) 20.123 6.517 ( -5.029 -5.298 -8.420) 11.147 7.305 ( -4.929 0.730 -2.028) 5.380 7.534 ( 1.378 0.389 -2.731) 3.084 8.577 ( -4.242 -4.087 12.102) 13.460 8.952 ( -3.833 1.464 -2.235) 4.673 9.171 ( -10.143 -5.453 4.342) 12.308 9.719 ( 4.821 0.713 9.305) 10.503 11.284 ( 4.195 25.285 -6.876) 26.537 11.688 ( 1.432 7.353 3.026) 8.079 11.842 ( -0.961 3.876 -4.641) 6.122 12.287 ( -12.062 5.472 8.534) 15.757 12.396 ( 6.850 -6.822 -2.776) 10.058 12.638 ( 0.933 -10.095 -0.015) 10.138 13.663 ( 3.320 3.812 -1.548) 5.287 14.120 ( 11.978 -12.767 -17.524) 24.770 17.187 ( 6.376 -4.388 10.725) 13.227 18.690 ( 5.131 -3.792 -21.497) 22.424 19.495 ( 7.560 7.740 4.395) 11.679 20.050 ( 1.288 -1.786 -11.526) 11.734 20.277 ( 16.798 4.482 5.977) 18.384 21.887 ( -19.186 -7.728 4.801) 21.233 23.874 ( -1.303 7.280 1.691) 7.587 24.203 ( -4.143 -6.072 0.457) 7.365 ======================= Grid point 350 (172/361) ======================= q-point: (-0.40 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( -5.547 15.053 10.723) 19.296 2.230 ( -2.961 21.774 12.344) 25.204 3.088 ( -6.398 -9.317 0.062) 11.302 3.370 ( -4.286 -9.643 5.289) 11.804 3.634 ( 3.663 -0.482 3.706) 5.233 3.868 ( 4.252 -9.394 -2.177) 10.539 4.264 ( -3.570 10.491 9.827) 14.811 4.754 ( 6.313 -12.696 -1.258) 14.235 5.008 ( -7.674 -7.912 17.099) 20.343 5.307 ( -9.245 -7.638 13.046) 17.720 5.571 ( -9.852 -1.158 11.013) 14.822 5.954 ( -4.670 -3.785 6.677) 8.984 6.156 ( 1.349 -1.815 5.454) 5.905 6.435 ( -0.938 -5.541 -5.402) 7.795 7.185 ( -4.794 1.190 -4.865) 6.933 7.507 ( -0.286 0.011 -3.714) 3.725 8.698 ( -3.982 -7.535 8.706) 12.183 8.859 ( -5.880 6.119 4.873) 9.786 9.164 ( -5.957 -9.057 2.746) 11.183 9.864 ( 2.654 3.584 7.751) 8.943 10.973 ( 2.059 29.196 -8.443) 30.462 11.688 ( 1.187 2.000 0.023) 2.326 11.739 ( -2.017 5.214 -2.708) 6.212 12.156 ( -8.303 8.217 2.135) 11.875 12.514 ( 5.114 -4.462 -0.492) 6.804 12.776 ( 5.612 -4.898 4.312) 8.607 13.562 ( -3.472 5.829 -5.476) 8.719 14.161 ( 6.630 -15.045 -18.527) 24.770 17.539 ( 10.545 -9.074 15.065) 20.506 18.513 ( 0.565 -7.318 -21.319) 22.547 19.492 ( 6.872 8.871 -7.591) 13.548 19.859 ( -8.807 -4.958 -6.230) 11.873 20.663 ( 24.838 11.025 9.405) 28.756 21.789 ( -15.665 -10.321 6.663) 19.908 23.800 ( -1.285 5.299 -0.954) 5.535 24.119 ( -9.496 -1.991 -4.610) 10.742 ======================= Grid point 351 (173/361) ======================= q-point: (-0.30 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( 0.927 12.476 11.976) 17.318 2.210 ( 1.514 14.503 15.479) 21.266 3.076 ( -2.328 -7.307 -3.652) 8.494 3.474 ( -1.735 -8.816 2.154) 9.240 3.729 ( 1.874 0.111 4.784) 5.139 3.993 ( 3.368 -11.152 -3.125) 12.062 4.256 ( -1.798 9.086 10.862) 14.275 4.914 ( 7.941 -4.979 -4.528) 10.409 5.186 ( -4.872 -6.213 13.899) 15.985 5.440 ( -8.780 -6.051 21.740) 24.214 5.612 ( -9.294 -3.652 15.872) 18.752 6.054 ( -0.916 -5.923 6.018) 8.493 6.269 ( 0.241 -3.585 7.968) 8.741 6.462 ( 1.628 -5.570 0.256) 5.809 7.024 ( -6.073 0.407 -8.520) 10.470 7.435 ( -3.360 0.780 -2.079) 4.028 8.802 ( -2.028 4.241 8.975) 10.132 8.817 ( -8.444 -8.678 6.384) 13.687 9.244 ( 0.246 -9.517 3.108) 10.014 9.902 ( 0.871 9.804 4.548) 10.843 10.656 ( 0.893 24.397 -6.494) 25.262 11.600 ( -7.743 7.552 -0.344) 10.822 11.690 ( 5.633 -1.138 -6.804) 8.906 11.949 ( -4.104 11.980 -5.447) 13.785 12.611 ( 2.588 -2.879 2.415) 4.562 12.968 ( 7.388 1.013 6.997) 10.226 13.382 ( -5.592 4.572 -3.370) 7.971 14.121 ( 1.998 -14.641 -19.368) 24.361 17.932 ( 10.570 -7.978 9.025) 16.026 18.346 ( -4.543 -10.249 -13.148) 17.278 19.404 ( 3.317 -0.945 -11.539) 12.043 19.754 ( -2.705 -1.210 -2.828) 4.096 20.925 ( 11.556 15.056 9.633) 21.284 21.815 ( -3.346 -10.659 4.641) 12.097 23.729 ( -1.246 2.424 -2.233) 3.523 23.880 ( -10.447 4.054 -7.879) 13.699 ======================= Grid point 352 (174/361) ======================= q-point: (-0.20 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( 0.289 7.961 15.438) 17.373 2.423 ( 13.674 5.910 14.918) 21.082 3.077 ( 1.816 -5.727 -4.954) 7.787 3.492 ( -3.406 -9.517 -6.291) 11.906 3.788 ( -2.703 -0.576 4.756) 5.501 4.044 ( 0.507 -7.631 -6.517) 10.048 4.331 ( 4.886 7.202 8.803) 12.379 4.917 ( 2.065 4.476 -6.869) 8.455 5.314 ( -1.256 -2.244 8.614) 8.990 5.580 ( -10.594 4.633 18.314) 21.659 5.865 ( -1.236 -6.170 29.334) 30.002 6.149 ( -3.768 -11.351 3.274) 12.400 6.433 ( -0.439 -7.207 9.628) 12.034 6.567 ( -0.279 -4.014 8.125) 9.067 6.800 ( -7.082 -0.208 -11.275) 13.316 7.383 ( -3.699 -2.846 1.317) 4.849 8.802 ( -6.513 5.888 11.918) 14.803 8.909 ( -3.316 -12.329 3.199) 13.162 9.371 ( -0.055 -7.195 1.705) 7.394 9.864 ( 2.859 12.935 4.180) 13.891 10.416 ( 1.382 17.032 -3.941) 17.536 11.362 ( -12.559 5.423 -5.461) 14.729 11.675 ( 7.367 7.544 -9.007) 13.867 11.786 ( 5.077 5.124 -4.420) 8.460 12.697 ( 0.988 -0.562 4.700) 4.836 13.029 ( -5.436 2.393 1.264) 6.072 13.334 ( 6.244 4.079 2.242) 7.788 14.026 ( -0.966 -12.858 -16.502) 20.942 18.125 ( 6.676 -4.433 -7.558) 11.015 18.295 ( -4.290 -8.362 2.609) 9.754 19.289 ( -5.461 -3.380 -9.977) 11.865 19.727 ( 1.432 0.542 -2.373) 2.825 20.989 ( -2.035 5.752 8.990) 10.865 21.974 ( 10.902 -2.602 0.568) 11.222 23.564 ( -8.819 6.606 -5.586) 12.354 23.724 ( 2.333 0.498 -3.851) 4.530 ======================= Grid point 353 (175/361) ======================= q-point: (-0.10 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( -0.811 -1.567 16.116) 16.212 2.782 ( 17.599 4.577 13.180) 22.458 3.109 ( 4.356 -4.434 -4.548) 7.702 3.430 ( -2.521 -9.208 -9.450) 13.433 3.762 ( -6.792 -0.075 0.733) 6.832 4.008 ( 1.836 -5.725 -10.984) 12.522 4.436 ( 6.924 8.187 4.810) 11.752 4.766 ( -1.253 9.350 -6.061) 11.213 5.381 ( -6.583 2.796 10.092) 12.369 5.572 ( -11.867 4.291 14.415) 19.159 6.074 ( -2.424 1.141 3.177) 4.156 6.321 ( -6.258 -5.013 6.490) 10.315 6.554 ( -2.687 -10.505 10.608) 15.169 6.678 ( 0.870 -3.043 1.042) 3.332 6.734 ( -4.141 -3.681 19.273) 20.054 7.433 ( -1.715 -11.380 2.707) 11.823 8.785 ( -10.099 7.669 12.289) 17.659 9.027 ( -1.604 -11.673 4.198) 12.508 9.350 ( -4.748 0.751 -2.909) 5.619 9.894 ( 6.251 7.154 4.858) 10.671 10.328 ( 5.579 9.261 0.487) 10.822 11.058 ( -11.644 -0.688 -9.630) 15.126 11.627 ( 11.815 12.023 -3.045) 17.130 11.833 ( 10.236 -0.775 -5.761) 11.771 12.745 ( -0.887 5.178 5.252) 7.429 12.912 ( -9.632 -3.536 -0.087) 10.261 13.404 ( 6.561 5.474 -2.781) 8.985 13.959 ( 0.386 -8.412 -8.172) 11.734 18.111 ( -1.807 -5.082 -5.093) 7.419 18.344 ( 3.264 -2.672 -4.584) 6.229 19.077 ( -7.772 3.947 -6.672) 10.977 19.660 ( -9.400 3.014 1.706) 10.018 21.058 ( -0.760 -10.824 2.579) 11.153 22.138 ( 15.105 8.523 0.031) 17.344 23.367 ( -2.344 6.063 -3.356) 7.315 23.742 ( 4.071 -2.257 -2.431) 5.251 ======================= Grid point 358 (176/361) ======================= q-point: ( 0.40 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -5.760 -0.000 4.637) 7.394 2.568 ( -0.574 -0.000 10.059) 10.075 2.956 ( -8.342 -0.000 4.786) 9.617 3.148 ( -11.699 -0.000 3.401) 12.183 3.609 ( 7.429 0.000 -6.569) 9.916 3.688 ( -2.830 -0.000 1.624) 3.263 4.374 ( -3.800 -0.000 11.811) 12.407 4.537 ( -1.694 -0.000 -6.129) 6.359 4.840 ( -0.619 -0.000 9.624) 9.644 5.098 ( -13.753 -0.000 16.164) 21.223 5.516 ( 0.163 0.000 8.639) 8.641 6.031 ( 4.642 0.000 3.564) 5.852 6.079 ( -27.448 -0.000 3.753) 27.703 6.464 ( -3.124 -0.000 -9.459) 9.961 7.309 ( -4.546 -0.000 -1.938) 4.942 7.545 ( 1.736 0.000 -3.397) 3.815 8.535 ( -6.822 -0.000 13.358) 14.999 8.943 ( -0.458 -0.000 -3.531) 3.561 9.148 ( -11.833 -0.000 6.158) 13.340 9.724 ( 4.969 0.000 9.838) 11.022 11.515 ( 5.283 0.000 -2.052) 5.668 11.769 ( 2.525 0.000 -9.497) 9.827 11.952 ( -8.483 -0.000 -0.350) 8.490 12.233 ( 9.762 0.000 -2.377) 10.047 12.351 ( -13.070 -0.000 8.996) 15.867 12.547 ( 4.043 0.000 3.325) 5.235 13.703 ( 2.086 0.000 2.194) 3.028 13.992 ( 13.879 0.000 -20.657) 24.887 17.149 ( 6.098 0.000 9.130) 10.979 18.655 ( 5.129 0.000 -22.625) 23.199 19.569 ( 6.912 0.000 7.506) 10.204 20.031 ( -1.285 -0.000 -14.441) 14.498 20.318 ( 20.862 0.000 5.635) 21.610 21.818 ( -18.540 -0.000 5.032) 19.211 23.963 ( -5.833 -0.000 5.123) 7.763 24.124 ( -0.110 -0.000 -2.144) 2.147 ======================= Grid point 360 (177/361) ======================= q-point: (-0.50 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -5.199 8.721 6.523) 12.068 2.625 ( 0.522 20.350 10.184) 22.762 2.935 ( -5.965 -6.173 2.755) 9.016 3.096 ( -6.959 -17.548 2.583) 19.053 3.643 ( 8.120 0.374 -4.770) 9.425 3.745 ( 2.345 -3.354 1.078) 4.232 4.448 ( -6.081 7.239 12.074) 15.335 4.558 ( 4.374 -7.184 6.275) 10.494 4.933 ( -4.285 -0.771 12.280) 13.029 5.170 ( -9.831 -6.009 16.036) 19.746 5.570 ( -9.722 0.249 11.403) 14.986 5.902 ( -6.896 -1.578 6.891) 9.876 6.140 ( 4.095 -0.281 3.329) 5.284 6.352 ( 0.228 -2.815 -6.803) 7.366 7.194 ( -4.724 0.017 -6.189) 7.786 7.529 ( 3.311 1.471 -4.340) 5.654 8.577 ( -10.573 -4.090 10.947) 15.759 8.928 ( 0.127 0.841 1.363) 1.607 9.079 ( -8.800 -0.974 6.717) 11.113 9.903 ( 3.015 1.009 10.284) 10.764 11.417 ( 3.660 16.695 -12.928) 21.430 11.690 ( 3.142 -0.641 -8.641) 9.217 11.808 ( -9.521 2.216 2.526) 10.096 12.281 ( -9.140 4.380 7.536) 12.630 12.366 ( 4.477 -8.733 -0.961) 9.861 12.735 ( 10.495 -0.513 8.444) 13.480 13.645 ( -6.432 3.213 -2.966) 7.777 13.945 ( 9.867 -7.592 -20.684) 24.142 17.430 ( 10.658 -3.022 14.396) 18.165 18.423 ( 1.296 -2.555 -23.290) 23.465 19.638 ( 0.491 7.353 -6.915) 10.106 19.760 ( -6.651 -6.022 -8.032) 12.043 20.808 ( 30.445 4.454 9.200) 32.115 21.665 ( -15.891 -3.534 6.814) 17.648 23.884 ( -6.945 3.364 1.105) 7.796 24.071 ( -4.108 -2.478 -5.101) 7.003 ======================= Grid point 361 (178/361) ======================= q-point: (-0.40 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( 2.461 9.772 7.327) 12.460 2.518 ( -3.188 19.378 8.846) 21.539 2.953 ( -1.199 -5.855 -0.847) 6.036 3.255 ( -1.155 -15.134 2.636) 15.405 3.709 ( 5.247 -2.300 -2.379) 6.203 3.815 ( 1.343 -6.809 -0.672) 6.973 4.453 ( -2.948 10.845 13.093) 17.255 4.790 ( 9.039 -8.031 1.678) 12.207 5.077 ( -5.311 -5.043 17.691) 19.147 5.308 ( -6.326 -6.099 19.060) 20.988 5.603 ( -8.094 0.613 16.124) 18.053 5.974 ( -1.140 -2.823 6.975) 7.611 6.230 ( 1.607 -1.165 4.275) 4.713 6.363 ( 3.748 -4.606 -1.903) 6.236 7.024 ( -6.486 -0.284 -9.082) 11.164 7.491 ( 2.113 4.324 -4.274) 6.437 8.596 ( -12.313 -9.819 9.058) 18.168 8.935 ( -3.226 5.586 7.544) 9.926 9.112 ( -0.500 -5.433 4.875) 7.317 10.027 ( 1.047 4.327 8.765) 9.831 11.086 ( 0.923 21.461 -14.961) 26.177 11.645 ( 1.594 -1.118 -10.032) 10.219 11.687 ( -7.075 0.921 1.435) 7.278 12.177 ( -3.580 11.221 1.336) 11.854 12.488 ( 1.150 -9.163 1.605) 9.373 13.013 ( 11.979 2.877 10.753) 16.353 13.445 ( -10.531 2.475 -3.362) 11.328 13.881 ( 4.483 -10.896 -20.035) 23.243 17.810 ( 11.346 -5.092 14.175) 18.857 18.207 ( -1.058 -5.180 -16.683) 17.501 19.382 ( -6.864 -1.119 -13.469) 15.159 19.736 ( 1.832 -0.654 -2.876) 3.472 21.196 ( 14.674 14.241 8.496) 22.143 21.643 ( -0.424 -9.158 4.877) 10.385 23.767 ( -5.990 1.644 -1.187) 6.323 23.919 ( -6.493 0.780 -8.052) 10.373 ======================= Grid point 362 (179/361) ======================= q-point: (-0.30 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( 2.467 12.861 7.258) 14.972 2.521 ( 7.301 4.983 12.169) 15.041 2.992 ( 3.001 -3.563 -1.740) 4.973 3.332 ( -1.718 -8.090 -3.366) 8.929 3.734 ( -7.108 -4.339 3.342) 8.973 3.886 ( 6.361 -8.764 -9.074) 14.129 4.499 ( 4.528 9.889 8.109) 13.566 4.951 ( 7.619 -1.795 -3.642) 8.634 5.251 ( -4.914 -3.990 14.946) 16.231 5.617 ( -6.005 -5.585 29.864) 30.969 5.709 ( -2.659 -2.860 16.405) 16.863 6.049 ( -2.944 -1.494 6.644) 7.419 6.328 ( -1.136 -4.533 7.649) 8.964 6.478 ( 5.244 -5.228 2.516) 7.820 6.797 ( -8.257 -0.214 -11.082) 13.821 7.415 ( -0.185 5.255 -2.643) 5.885 8.637 ( -11.982 -13.477 8.500) 19.936 8.935 ( -3.407 5.424 8.842) 10.918 9.244 ( 2.198 -6.349 4.018) 7.828 10.066 ( 0.186 8.795 6.284) 10.811 10.745 ( 0.573 17.678 -12.520) 21.670 11.425 ( -14.029 3.693 -5.428) 15.489 11.692 ( 8.538 -1.570 -7.115) 11.224 12.031 ( 2.417 15.532 -2.732) 15.955 12.602 ( -0.498 -8.407 2.973) 8.931 13.109 ( -8.545 5.070 1.413) 10.036 13.397 ( 7.565 2.534 7.152) 10.715 13.789 ( 0.914 -12.598 -17.284) 21.408 18.055 ( 4.185 -3.076 -6.956) 8.681 18.169 ( 2.252 -5.720 8.077) 10.150 19.184 ( -5.508 -6.580 -10.559) 13.606 19.734 ( 3.230 0.214 -3.649) 4.877 21.147 ( -9.497 10.193 3.486) 14.361 21.941 ( 21.232 -1.449 4.484) 21.749 23.639 ( -7.656 2.017 -3.790) 8.778 23.737 ( -1.760 1.017 -6.684) 6.986 ======================= Grid point 363 (180/361) ======================= q-point: (-0.20 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( -5.653 3.772 9.582) 11.747 2.842 ( 17.720 2.053 10.955) 20.934 3.052 ( 4.509 -1.944 -1.323) 5.085 3.307 ( 0.518 -3.637 -6.495) 7.462 3.691 ( -12.486 -7.549 4.525) 15.276 3.909 ( 8.777 -4.819 -14.830) 17.893 4.580 ( 7.164 7.131 3.004) 10.545 4.923 ( 1.668 7.447 -6.141) 9.795 5.389 ( -4.622 -2.260 13.293) 14.254 5.679 ( -12.823 7.361 15.235) 21.231 5.994 ( -8.098 -12.941 4.237) 15.843 6.207 ( 3.591 -1.785 20.295) 20.687 6.433 ( -6.163 -4.711 4.496) 8.967 6.611 ( -3.340 -3.900 7.646) 9.210 6.657 ( 4.961 -4.618 4.228) 7.989 7.348 ( 0.512 1.596 -2.462) 2.978 8.706 ( -12.031 -13.761 9.926) 20.800 8.966 ( -1.643 3.313 8.318) 9.102 9.329 ( -1.832 -2.572 0.796) 3.257 10.049 ( 1.236 9.211 3.784) 10.034 10.515 ( 3.515 9.574 -8.060) 12.999 11.090 ( -15.745 5.856 -6.891) 18.158 11.759 ( 11.899 0.504 -6.350) 13.497 11.938 ( 8.179 13.224 -2.456) 15.742 12.688 ( -3.270 -8.296 2.723) 9.324 12.933 ( -10.335 2.842 1.134) 10.779 13.494 ( 2.184 3.252 -4.461) 5.937 13.802 ( 7.191 -7.728 -1.922) 10.730 18.047 ( -0.037 -2.167 -1.607) 2.698 18.293 ( 1.912 -2.824 -1.322) 3.658 19.073 ( -3.059 -3.648 -6.018) 7.673 19.712 ( -2.829 2.210 -0.472) 3.621 20.960 ( -8.173 -0.286 -3.014) 8.715 22.279 ( 21.207 7.028 4.856) 22.863 23.459 ( -3.652 4.140 -5.255) 7.622 23.692 ( 0.815 -3.156 -2.790) 4.290 ======================= Grid point 364 (181/361) ======================= q-point: (-0.10 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( -10.323 -6.742 9.267) 15.424 3.075 ( -1.797 -4.333 2.451) 5.293 3.181 ( 10.141 1.593 2.249) 10.509 3.302 ( 9.983 -0.541 -4.111) 10.810 3.638 ( -8.232 -1.209 3.452) 9.008 3.872 ( 7.897 -4.303 -15.332) 17.775 4.631 ( 7.311 5.850 -1.790) 9.533 4.776 ( -0.963 9.152 -3.965) 10.020 5.440 ( -8.855 6.199 10.748) 15.243 5.554 ( -16.108 3.654 7.408) 18.102 5.955 ( -9.629 -4.386 0.089) 10.581 6.175 ( -9.133 -0.444 -4.470) 10.178 6.581 ( -0.896 -9.264 9.048) 12.980 6.769 ( 3.146 -0.465 5.199) 6.094 6.984 ( -0.052 -5.427 33.178) 33.619 7.366 ( 5.258 -5.535 -4.118) 8.675 8.757 ( -14.507 -6.049 11.543) 19.501 9.020 ( -2.949 -0.331 7.213) 7.800 9.271 ( -2.252 0.702 -2.389) 3.357 10.027 ( 0.116 6.496 -0.266) 6.503 10.496 ( 7.161 -3.325 -3.316) 8.564 10.772 ( -9.297 5.149 -3.780) 11.280 11.859 ( 12.907 1.321 -5.267) 14.003 11.971 ( 12.353 9.128 1.169) 15.405 12.710 ( -9.524 -9.153 2.745) 13.491 12.829 ( -2.449 5.054 2.201) 6.032 13.364 ( -4.586 -0.191 -8.843) 9.964 13.985 ( 11.497 1.316 2.349) 11.808 17.984 ( -5.760 0.419 -7.558) 9.512 18.305 ( 3.912 -3.042 -2.763) 5.674 19.010 ( 0.837 4.308 -1.443) 4.620 19.572 ( -13.724 6.473 3.888) 15.664 20.896 ( 1.150 -12.892 -9.629) 16.132 22.510 ( 14.453 13.804 6.932) 21.154 23.363 ( 2.712 2.464 -4.191) 5.566 23.737 ( 2.422 -5.032 0.111) 5.585 ======================= Grid point 370 (182/361) ======================= q-point: (-0.50 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.377 ( 0.074 -0.000 5.756) 5.756 2.802 ( -7.809 -0.000 0.726) 7.843 2.904 ( -1.780 -0.000 0.599) 1.878 3.002 ( 6.989 -0.000 9.158) 11.520 3.677 ( 11.465 -0.000 -9.410) 14.832 3.760 ( -6.248 0.000 5.081) 8.053 4.596 ( -0.785 0.000 15.201) 15.221 4.671 ( 5.404 -0.000 2.189) 5.830 5.028 ( -5.453 -0.000 17.013) 17.865 5.251 ( -2.904 -0.000 17.026) 17.272 5.610 ( -8.823 -0.000 17.896) 19.953 5.951 ( -0.439 -0.000 7.335) 7.348 6.219 ( 2.004 -0.000 2.721) 3.379 6.319 ( 4.690 -0.000 -2.354) 5.248 7.020 ( -6.595 -0.000 -9.104) 11.242 7.540 ( 5.471 -0.000 -6.073) 8.174 8.500 ( -16.114 -0.000 11.812) 19.979 9.001 ( 3.482 -0.000 4.634) 5.797 9.049 ( -7.028 -0.000 7.089) 9.983 10.064 ( 1.156 -0.000 10.178) 10.244 11.315 ( 0.631 -0.000 -21.880) 21.889 11.619 ( 4.890 -0.000 -9.690) 10.854 11.699 ( -10.291 -0.000 2.640) 10.624 12.320 ( -8.221 0.000 13.213) 15.562 12.349 ( 4.274 -0.000 -4.786) 6.417 13.043 ( 14.522 0.000 11.405) 18.465 13.469 ( -14.711 -0.000 -2.900) 14.994 13.774 ( 7.147 -0.000 -21.100) 22.278 17.762 ( 11.715 -0.000 15.385) 19.337 18.160 ( 0.065 -0.000 -17.685) 17.685 19.372 ( -10.907 -0.000 -13.845) 17.625 19.731 ( 3.779 -0.000 -3.281) 5.005 21.381 ( 31.303 -0.000 8.728) 32.497 21.508 ( -14.769 0.000 4.381) 15.405 23.783 ( -8.636 -0.000 -0.615) 8.658 23.924 ( -4.169 -0.000 -8.290) 9.279 ======================= Grid point 372 (183/361) ======================= q-point: (-0.40 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.522 ( 10.937 3.990 7.233) 13.706 2.629 ( -9.073 7.047 2.762) 11.816 2.944 ( 4.873 -1.958 -0.569) 5.283 3.212 ( 5.295 -4.503 3.308) 7.698 3.670 ( -13.402 -2.077 3.158) 13.925 3.760 ( 11.960 -4.305 -9.318) 15.761 4.667 ( 5.180 8.643 1.429) 10.177 4.846 ( 5.829 -8.332 3.510) 10.758 5.199 ( -5.085 -1.578 19.223) 19.947 5.496 ( 0.619 -3.634 21.933) 22.240 5.731 ( -6.972 1.343 19.074) 20.353 6.042 ( -0.820 0.147 10.226) 10.260 6.273 ( -1.123 -1.541 3.964) 4.399 6.406 ( 7.145 -2.296 0.860) 7.554 6.793 ( -8.381 -0.127 -10.609) 13.520 7.516 ( 4.482 4.170 -6.552) 8.967 8.444 ( -17.778 -6.546 13.901) 23.498 9.022 ( -4.071 3.890 6.422) 8.541 9.147 ( 2.975 -4.166 5.818) 7.749 10.170 ( -0.611 2.872 8.122) 8.636 10.979 ( -2.938 6.956 -21.817) 23.087 11.525 ( -6.657 7.163 -3.102) 10.259 11.641 ( 5.218 -4.538 -6.035) 9.178 12.266 ( 1.437 10.052 -1.986) 10.347 12.440 ( -2.518 -8.586 5.810) 10.669 13.188 ( -15.140 3.277 -1.217) 15.538 13.406 ( 12.743 -1.511 11.615) 17.308 13.623 ( 2.114 -4.605 -18.095) 18.791 18.019 ( 2.135 -0.990 -7.300) 7.670 18.095 ( 7.376 -2.245 11.883) 14.166 19.095 ( -7.017 -2.728 -11.300) 13.578 19.735 ( 4.034 0.007 -4.559) 6.088 21.296 ( -13.715 5.049 -1.290) 14.672 21.918 ( 28.147 -0.875 8.256) 29.346 23.655 ( -7.267 0.200 -1.778) 7.484 23.753 ( -3.828 0.489 -9.060) 9.848 ======================= Grid point 373 (184/361) ======================= q-point: (-0.30 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -12.931 4.751 3.951) 14.331 2.861 ( 16.537 0.387 10.171) 19.418 3.031 ( 8.026 -0.510 -1.787) 8.238 3.308 ( 4.801 2.999 -1.372) 5.824 3.534 ( -14.288 -8.607 3.390) 17.021 3.837 ( 11.719 -3.131 -12.680) 17.548 4.686 ( 6.216 4.816 -1.723) 8.050 4.979 ( 5.022 -2.352 -3.862) 6.758 5.340 ( -6.545 -1.310 15.824) 17.175 5.749 ( -5.538 -8.142 5.547) 11.301 5.819 ( -11.241 4.468 24.234) 27.085 6.220 ( 2.668 1.636 14.746) 15.074 6.336 ( -4.727 -5.561 7.589) 10.529 6.558 ( 2.955 -2.313 2.230) 4.366 6.590 ( 1.547 -2.213 -1.449) 3.064 7.439 ( 2.327 6.602 -5.092) 8.656 8.460 ( -17.160 -11.839 15.103) 25.743 9.021 ( -2.365 2.458 5.903) 6.817 9.279 ( 1.139 -2.545 4.485) 5.281 10.190 ( -1.277 5.810 4.253) 7.312 10.627 ( -4.240 3.057 -19.121) 19.822 11.278 ( -9.627 13.395 -2.067) 16.624 11.728 ( 11.420 -3.712 -6.035) 13.440 12.174 ( 5.824 11.329 -4.253) 13.430 12.531 ( -5.078 -8.179 4.325) 10.554 12.962 ( -12.602 0.548 1.333) 12.684 13.469 ( -2.624 -5.151 -13.447) 14.637 13.740 ( 13.986 0.472 10.193) 17.313 18.026 ( 2.569 -0.368 1.116) 2.825 18.249 ( -0.623 -1.914 0.466) 2.066 18.990 ( 0.962 -4.412 -3.634) 5.796 19.733 ( 1.939 0.383 -2.920) 3.526 21.006 ( -12.179 3.796 -8.506) 15.333 22.383 ( 25.144 4.268 8.543) 26.897 23.517 ( -4.798 2.442 -4.567) 7.060 23.634 ( -1.934 -3.110 -4.732) 5.984 ======================= Grid point 374 (185/361) ======================= q-point: (-0.20 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( -17.129 -2.973 7.454) 18.916 2.995 ( -7.939 -4.140 0.015) 8.953 3.224 ( 5.079 3.195 3.227) 6.813 3.312 ( 15.926 0.622 -1.486) 16.007 3.588 ( 2.729 -2.717 7.157) 8.127 3.816 ( 7.769 -2.047 -16.796) 18.619 4.694 ( 3.407 2.676 -2.922) 5.225 4.936 ( 2.509 6.187 -6.821) 9.545 5.431 ( -8.240 -4.500 10.169) 13.841 5.654 ( -14.355 1.621 2.509) 14.663 5.885 ( -10.429 1.210 13.889) 17.411 6.173 ( -9.462 0.307 -5.686) 11.043 6.425 ( -2.780 -7.802 10.443) 13.328 6.745 ( 7.503 -3.038 0.816) 8.136 6.894 ( 7.859 -3.458 29.267) 30.501 7.367 ( 3.941 4.510 -4.035) 7.221 8.531 ( -16.775 -14.476 15.362) 26.962 9.056 ( -1.065 1.273 6.087) 6.309 9.301 ( -3.199 2.272 1.029) 4.056 10.151 ( -0.583 6.574 -0.483) 6.617 10.368 ( -3.772 -6.535 -14.368) 16.228 11.009 ( -6.547 16.086 0.662) 17.380 11.849 ( 12.104 -1.781 -6.725) 13.961 12.156 ( 9.690 9.833 0.188) 13.807 12.544 ( -9.161 -8.644 3.269) 13.013 12.878 ( -3.524 0.873 3.319) 4.919 13.312 ( -6.012 -5.052 -9.819) 12.573 14.030 ( 14.092 3.119 7.386) 16.213 18.009 ( -5.633 2.169 -6.834) 9.118 18.241 ( 3.060 -3.833 0.777) 4.966 19.058 ( 5.292 1.243 1.937) 5.770 19.675 ( -7.750 4.220 1.500) 8.951 20.741 ( -3.099 -4.401 -14.798) 15.746 22.736 ( 18.521 10.998 9.255) 23.444 23.399 ( 0.716 1.746 -5.943) 6.236 23.634 ( -0.479 -6.291 0.622) 6.340 ======================= Grid point 375 (186/361) ======================= q-point: (-0.10 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( -18.746 -8.952 9.832) 22.983 2.859 ( -18.117 -11.716 -0.900) 21.594 3.259 ( 4.794 3.396 0.596) 5.905 3.497 ( 7.837 4.576 -0.408) 9.084 3.674 ( 2.906 2.757 -8.757) 9.630 3.806 ( 9.624 -2.761 0.990) 10.061 4.661 ( -2.489 -0.267 -1.979) 3.191 4.831 ( 6.612 9.571 -7.420) 13.798 5.364 ( -16.698 -0.942 0.666) 16.738 5.474 ( -9.289 4.890 5.454) 11.830 5.863 ( -9.159 4.635 8.608) 13.397 6.002 ( -8.447 -1.628 -1.847) 8.798 6.574 ( -2.559 -7.755 6.279) 10.301 6.846 ( 1.707 -1.600 3.553) 4.255 7.304 ( 4.813 -1.983 10.968) 12.140 7.431 ( 6.356 0.194 10.278) 12.086 8.597 ( -16.608 -12.407 12.392) 24.152 9.072 ( -5.983 6.157 7.232) 11.225 9.243 ( 1.048 -0.732 -1.405) 1.899 9.986 ( -7.673 3.617 -7.246) 11.156 10.349 ( 3.916 -11.957 -5.042) 13.554 10.877 ( 1.164 10.366 4.559) 11.384 11.916 ( 9.664 -1.484 -9.335) 13.518 12.274 ( 7.296 5.683 8.993) 12.899 12.554 ( -3.615 -7.523 2.430) 8.693 12.878 ( 0.600 3.619 2.029) 4.192 13.158 ( -7.855 -3.461 -5.082) 9.975 14.249 ( 14.667 6.742 2.266) 16.301 17.716 ( -9.472 0.769 -17.473) 19.890 18.407 ( 7.177 -1.083 8.547) 11.213 19.109 ( 4.030 7.847 0.775) 8.855 19.485 ( -13.589 6.529 3.638) 15.509 20.659 ( 5.523 -13.436 -16.510) 21.992 22.895 ( 4.714 16.449 9.226) 19.440 23.381 ( 8.503 -1.184 -6.784) 10.942 23.753 ( 2.675 -6.072 7.050) 9.681 ======================= Grid point 382 (187/361) ======================= q-point: (-0.40 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( -17.642 -0.000 2.073) 17.763 2.864 ( 16.061 0.000 10.086) 18.966 3.028 ( 12.092 0.000 -3.056) 12.472 3.365 ( 11.595 0.000 2.146) 11.792 3.429 ( -19.851 -0.000 0.862) 19.870 3.806 ( 11.978 0.000 -10.342) 15.825 4.742 ( 6.793 0.000 -5.987) 9.055 4.918 ( 2.696 0.000 2.002) 3.358 5.340 ( -4.949 -0.000 14.292) 15.125 5.665 ( -4.426 -0.000 8.432) 9.523 5.876 ( -10.080 -0.000 24.426) 26.424 6.247 ( 2.755 0.000 14.855) 15.108 6.269 ( -5.161 -0.000 4.987) 7.176 6.532 ( 9.847 0.000 1.167) 9.916 6.575 ( -4.656 -0.000 -2.659) 5.362 7.513 ( 4.962 0.000 -8.044) 9.451 8.341 ( -21.263 -0.000 19.354) 28.752 9.046 ( -2.878 -0.000 3.988) 4.918 9.253 ( 2.383 0.000 6.525) 6.946 10.244 ( -1.830 -0.000 4.739) 5.080 10.650 ( -7.465 -0.000 -22.317) 23.532 11.451 ( -7.694 -0.000 -2.497) 8.089 11.658 ( 11.988 0.000 -5.014) 12.994 12.295 ( 7.215 0.000 -10.276) 12.556 12.439 ( -7.476 -0.000 10.778) 13.117 12.965 ( -14.321 -0.000 1.492) 14.398 13.406 ( -1.170 -0.000 -14.689) 14.736 13.753 ( 13.624 0.000 12.281) 18.342 18.025 ( 3.992 0.000 2.254) 4.584 18.230 ( -2.051 -0.000 0.945) 2.258 18.946 ( 2.589 0.000 -2.798) 3.812 19.735 ( 3.172 0.000 -3.781) 4.935 21.047 ( -12.926 -0.000 -10.769) 16.824 22.423 ( 26.641 0.000 10.065) 28.479 23.545 ( -6.066 -0.000 -0.980) 6.144 23.597 ( -2.348 -0.000 -8.728) 9.038 ======================= Grid point 383 (188/361) ======================= q-point: (-0.30 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( -21.739 -0.566 6.958) 22.833 2.934 ( -15.364 -2.269 -2.460) 15.724 3.261 ( -0.977 0.604 5.031) 5.160 3.331 ( 24.694 1.299 1.911) 24.802 3.568 ( 14.561 -0.042 0.255) 14.564 3.794 ( 4.268 -0.497 -11.919) 12.670 4.753 ( 4.854 3.707 -3.902) 7.248 4.940 ( 0.323 -4.337 -4.260) 6.088 5.379 ( -8.523 -0.310 7.789) 11.550 5.607 ( -11.849 -2.968 1.775) 12.343 5.998 ( -8.837 6.614 18.744) 21.753 6.182 ( -9.319 0.546 -5.545) 10.858 6.296 ( -5.370 -5.845 9.227) 12.171 6.690 ( 10.617 -1.972 -0.950) 10.840 6.860 ( 11.458 -0.828 26.534) 28.915 7.465 ( 4.312 4.256 -6.652) 8.998 8.320 ( -22.431 -7.249 21.664) 32.016 9.061 ( -0.835 -0.171 3.174) 3.287 9.335 ( -1.122 1.091 5.027) 5.265 10.242 ( -3.164 3.357 -6.120) 7.664 10.289 ( -5.181 -2.674 -12.548) 13.836 11.262 ( -8.066 9.582 -1.488) 12.613 11.799 ( 12.336 -3.009 -5.294) 13.757 12.286 ( 9.684 3.711 -5.518) 11.747 12.433 ( -10.668 -2.878 7.378) 13.286 12.879 ( -4.370 -0.289 5.209) 6.805 13.223 ( -5.226 -3.425 -10.469) 12.192 14.075 ( 13.889 1.485 9.765) 17.043 18.051 ( -7.726 2.040 -10.519) 13.210 18.178 ( 4.639 -2.594 6.553) 8.437 19.067 ( 8.163 0.109 5.716) 9.966 19.718 ( -2.493 0.916 -0.543) 2.711 20.711 ( -6.812 -0.117 -19.262) 20.432 22.885 ( 23.202 4.732 10.429) 25.874 23.438 ( -2.700 2.946 -3.729) 5.466 23.522 ( -2.427 -5.654 -1.520) 6.337 ======================= Grid point 384 (189/361) ======================= q-point: (-0.20 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( -22.766 -3.471 13.004) 26.447 2.647 ( -25.036 -10.481 -1.817) 27.202 3.339 ( 6.339 4.496 1.729) 7.962 3.603 ( 6.631 5.885 -1.005) 8.922 3.640 ( 6.333 -2.722 -13.952) 15.562 3.811 ( 12.074 0.644 5.931) 13.468 4.693 ( -2.172 4.076 -3.043) 5.531 4.919 ( 4.043 -1.193 -7.806) 8.871 5.313 ( -12.251 -2.056 3.865) 13.009 5.493 ( -10.312 -1.779 3.602) 11.067 5.955 ( -7.770 0.808 1.231) 7.909 6.034 ( -7.930 8.688 8.543) 14.537 6.423 ( -3.549 -8.611 8.868) 12.860 6.819 ( 7.809 -1.710 -2.511) 8.379 7.311 ( 7.924 1.727 16.222) 18.136 7.447 ( 6.821 1.613 2.330) 7.386 8.353 ( -22.092 -12.033 20.026) 32.154 9.108 ( 0.564 -1.635 3.421) 3.833 9.309 ( -4.537 6.128 2.896) 8.156 9.941 ( -8.485 -5.281 -15.851) 18.739 10.298 ( 4.873 2.457 0.148) 5.459 11.064 ( -6.118 9.271 1.219) 11.174 11.882 ( 9.250 -2.206 -9.623) 13.529 12.361 ( -3.903 3.825 11.383) 12.627 12.444 ( 6.096 -4.231 -0.227) 7.423 12.921 ( 1.263 1.377 3.921) 4.343 13.071 ( -7.722 -5.318 -5.256) 10.749 14.348 ( 14.927 3.950 5.477) 16.383 17.727 ( -9.729 0.431 -18.248) 20.684 18.392 ( 7.128 -0.604 10.890) 13.029 19.230 ( 6.928 5.105 5.165) 10.036 19.589 ( -13.773 4.461 1.582) 14.564 20.468 ( 5.214 -7.461 -21.880) 23.698 23.169 ( 8.805 13.334 8.343) 18.026 23.362 ( 5.751 -0.404 -8.562) 10.322 23.626 ( 1.905 -8.089 10.867) 13.680 ======================= Grid point 385 (190/361) ======================= q-point: (-0.10 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( -23.724 -6.054 14.767) 28.593 2.431 ( -22.977 -16.104 1.678) 28.109 3.264 ( -11.265 -2.985 -7.474) 13.844 3.528 ( 3.442 2.631 2.344) 4.926 3.697 ( 6.583 7.648 -2.008) 10.289 3.972 ( 2.275 2.681 3.135) 4.710 4.584 ( -4.794 1.735 -0.469) 5.120 4.899 ( 6.953 2.221 -7.670) 10.588 5.195 ( -7.019 2.410 1.833) 7.644 5.449 ( -4.777 1.068 5.057) 7.038 5.869 ( -7.413 -2.113 1.591) 7.871 5.936 ( -6.795 12.150 5.663) 15.028 6.525 ( -3.195 -6.305 2.805) 7.605 6.887 ( 0.523 -1.272 3.611) 3.864 7.417 ( 9.340 1.487 -3.665) 10.143 7.659 ( -0.037 1.006 11.335) 11.379 8.386 ( -18.030 -13.090 12.412) 25.504 9.150 ( -5.659 7.966 8.932) 13.239 9.239 ( 2.304 -1.895 -1.435) 3.310 9.767 ( -4.090 -7.816 -7.285) 11.441 10.340 ( 4.219 1.934 -1.303) 4.821 10.989 ( -1.058 2.218 3.834) 4.554 11.889 ( 7.273 -2.465 -10.879) 13.317 12.370 ( -13.839 0.314 15.035) 20.437 12.604 ( 11.671 -0.520 -5.916) 13.095 12.959 ( 1.007 -0.363 4.933) 5.047 13.022 ( -1.414 -2.315 1.955) 3.344 14.543 ( 15.958 8.113 -0.935) 17.927 17.367 ( -9.220 -0.112 -16.619) 19.006 18.644 ( 8.786 -0.349 11.343) 14.352 19.187 ( -8.463 9.669 -2.142) 13.027 19.440 ( -0.422 2.854 2.750) 3.985 20.430 ( 8.029 -11.885 -17.093) 22.314 23.117 ( -6.884 15.595 6.520) 18.251 23.404 ( 11.185 -3.668 -8.978) 14.804 23.930 ( 7.398 -2.389 16.652) 18.377 ======================= Grid point 393 (191/361) ======================= q-point: (-0.30 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( -23.887 -0.000 14.994) 28.203 2.540 ( -28.314 -0.000 -3.109) 28.484 3.388 ( 8.385 0.000 3.452) 9.068 3.585 ( -2.660 -0.000 -18.467) 18.657 3.710 ( 20.272 0.000 2.628) 20.441 3.795 ( 7.952 0.000 4.484) 9.129 4.797 ( -7.977 -0.000 -4.229) 9.029 4.823 ( 7.007 0.000 -3.859) 8.000 5.307 ( -9.267 -0.000 2.947) 9.724 5.467 ( -9.293 -0.000 4.330) 10.252 5.955 ( -9.129 -0.000 -2.747) 9.533 6.169 ( -5.554 -0.000 10.903) 12.236 6.302 ( -4.897 -0.000 10.129) 11.250 6.800 ( 10.798 0.000 -4.331) 11.634 7.329 ( 10.609 0.000 21.930) 24.361 7.471 ( 5.731 0.000 -6.554) 8.706 8.233 ( -26.034 -0.000 25.289) 36.295 9.086 ( 0.523 0.000 1.932) 2.002 9.373 ( -3.539 -0.000 5.159) 6.256 9.887 ( -8.637 -0.000 -18.582) 20.491 10.329 ( 5.164 0.000 0.841) 5.232 11.158 ( -10.035 -0.000 -0.364) 10.042 11.856 ( 9.518 0.000 -9.266) 13.284 12.399 ( -10.508 -0.000 13.900) 17.426 12.407 ( 12.434 0.000 -2.190) 12.625 12.933 ( 1.678 0.000 5.286) 5.546 13.013 ( -7.483 -0.000 -6.531) 9.932 14.384 ( 14.796 0.000 6.621) 16.210 17.731 ( -9.814 -0.000 -18.625) 21.052 18.386 ( 7.086 0.000 11.846) 13.804 19.278 ( 7.833 0.000 8.075) 11.250 19.630 ( -12.739 -0.000 0.700) 12.758 20.400 ( 4.388 0.000 -25.362) 25.739 23.297 ( 19.989 0.000 -6.829) 21.123 23.406 ( -5.756 -0.000 2.932) 6.460 23.496 ( 2.500 0.000 15.270) 15.473 ======================= Grid point 394 (192/361) ======================= q-point: (-0.20 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -24.588 2.013 19.513) 31.454 2.162 ( -28.035 -11.543 2.327) 30.407 3.227 ( -18.550 -1.071 -13.112) 22.742 3.549 ( 7.541 0.345 3.442) 8.296 3.860 ( 6.777 9.138 1.351) 11.457 3.978 ( 4.851 -3.067 1.837) 6.026 4.626 ( -6.206 2.362 -0.425) 6.654 4.878 ( 4.385 -2.703 -4.599) 6.906 5.235 ( -2.726 1.558 1.719) 3.579 5.457 ( -2.445 0.135 5.584) 6.098 5.837 ( -7.460 -1.074 2.254) 7.867 6.133 ( -5.423 8.411 3.804) 10.706 6.397 ( -3.302 -6.551 6.923) 10.087 6.887 ( 8.734 0.384 -3.440) 9.395 7.471 ( 7.564 3.626 -4.315) 9.433 7.635 ( 1.844 -2.989 9.146) 9.798 8.201 ( -23.428 -5.719 21.264) 32.152 9.136 ( 2.328 -2.559 1.694) 3.852 9.345 ( -5.540 6.036 4.936) 9.565 9.629 ( -3.800 -5.218 -11.374) 13.078 10.412 ( 7.007 3.090 0.042) 7.658 11.022 ( -8.568 1.069 2.276) 8.929 11.852 ( 7.636 -1.337 -11.054) 13.502 12.434 ( -9.063 5.944 15.724) 19.098 12.573 ( 10.339 -3.454 -1.681) 11.030 12.874 ( -7.862 -4.832 0.684) 9.253 13.028 ( 4.284 0.795 3.174) 5.391 14.643 ( 16.203 2.847 1.528) 16.522 17.365 ( -9.412 -0.061 -17.308) 19.702 18.640 ( 8.284 -0.105 11.614) 14.266 19.338 ( -16.006 5.823 -4.195) 17.542 19.468 ( 2.790 0.147 5.557) 6.220 20.267 ( 11.449 -5.317 -19.818) 23.497 23.331 ( -5.006 6.398 3.068) 8.683 23.358 ( 9.115 -0.776 -8.482) 12.475 23.886 ( 10.355 -1.879 21.053) 23.537 ======================= Grid point 395 (193/361) ======================= q-point: (-0.10 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -26.962 -4.144 13.468) 30.422 2.017 ( -25.151 -12.120 6.229) 28.605 2.866 ( -25.896 -9.728 4.597) 28.043 3.661 ( 3.321 2.423 1.864) 4.514 3.850 ( 1.782 8.985 3.540) 9.820 3.966 ( -6.415 1.946 -0.374) 6.714 4.605 ( 0.415 5.347 5.126) 7.419 4.878 ( 1.722 -2.253 -3.489) 4.496 5.265 ( 8.150 4.091 0.192) 9.121 5.488 ( -1.149 2.138 4.387) 5.014 5.784 ( -6.759 -0.425 0.384) 6.783 5.996 ( -5.088 9.976 2.743) 11.530 6.449 ( -2.423 -4.031 -0.535) 4.733 6.951 ( -0.542 3.311 6.119) 6.978 7.522 ( 9.887 1.851 -3.624) 10.692 7.678 ( -6.806 -1.635 1.847) 7.239 8.167 ( -14.644 -10.475 5.552) 18.842 9.240 ( 3.638 -2.873 -0.893) 4.721 9.267 ( -5.031 6.598 10.287) 13.217 9.599 ( 1.368 -10.709 -3.535) 11.359 10.435 ( 2.880 9.220 -0.426) 9.669 10.981 ( -4.491 -4.833 3.412) 7.428 11.835 ( 6.597 -1.183 -10.167) 12.178 12.376 ( -12.568 7.866 9.648) 17.689 12.595 ( -1.005 1.198 -4.947) 5.188 12.996 ( 3.793 -13.424 5.223) 14.896 13.105 ( 4.934 2.120 1.239) 5.512 14.805 ( 16.161 7.525 -5.350) 18.612 17.127 ( -4.445 -0.190 -1.897) 4.837 18.886 ( 8.073 -1.003 4.464) 9.279 19.004 ( -11.981 1.806 -3.661) 12.657 19.562 ( 4.840 3.379 3.077) 6.656 20.269 ( 7.797 -7.126 -13.473) 17.120 23.195 ( -9.635 14.002 5.523) 17.872 23.415 ( 9.933 -3.707 -7.457) 12.962 24.257 ( 8.364 1.354 15.891) 18.009 ======================= Grid point 404 (194/361) ======================= q-point: (-0.20 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( -28.584 -0.000 5.910) 29.188 1.881 ( -25.328 -0.000 17.582) 30.832 2.779 ( -29.672 -0.000 3.665) 29.898 3.683 ( 4.879 0.000 1.592) 5.133 3.943 ( -7.035 -0.000 2.885) 7.604 3.977 ( 0.092 0.000 0.101) 0.137 4.669 ( 5.831 0.000 7.931) 9.844 4.837 ( -1.998 -0.000 -3.865) 4.351 5.305 ( 8.887 0.000 -0.149) 8.888 5.508 ( -0.155 -0.000 4.019) 4.022 5.778 ( -6.556 -0.000 1.602) 6.749 6.102 ( -4.967 -0.000 0.145) 4.969 6.393 ( -1.897 -0.000 2.298) 2.979 7.006 ( 9.722 0.000 0.825) 9.757 7.551 ( 10.270 0.000 -5.243) 11.531 7.619 ( -12.253 -0.000 6.940) 14.082 8.078 ( -16.860 -0.000 5.911) 17.866 9.191 ( 4.628 0.000 1.920) 5.011 9.356 ( -6.703 -0.000 5.506) 8.674 9.492 ( 0.850 0.000 -3.816) 3.910 10.534 ( 7.809 0.000 -0.602) 7.832 10.928 ( -10.176 -0.000 3.808) 10.865 11.824 ( 7.651 0.000 -9.676) 12.335 12.559 ( 0.975 0.000 -7.962) 8.021 12.574 ( -7.303 -0.000 12.504) 14.481 12.793 ( -4.155 -0.000 5.495) 6.889 13.126 ( 5.062 0.000 0.850) 5.133 14.874 ( 16.402 0.000 -4.255) 16.944 17.125 ( -4.219 -0.000 -1.060) 4.350 18.877 ( 7.694 0.000 2.751) 8.171 19.021 ( -14.766 -0.000 -3.930) 15.280 19.598 ( 2.493 0.000 4.995) 5.582 20.199 ( 10.812 0.000 -14.443) 18.041 23.339 ( -8.087 -0.000 6.935) 10.653 23.373 ( 10.704 0.000 -8.727) 13.811 24.269 ( 9.934 0.000 16.261) 19.056 ======================= Grid point 405 (195/361) ======================= q-point: (-0.10 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( -23.783 -5.183 14.667) 28.419 1.564 ( -33.700 -4.682 -0.841) 34.034 2.664 ( -26.326 -6.258 35.921) 44.973 3.674 ( -3.909 2.375 -2.103) 5.034 3.846 ( -8.102 -0.223 0.190) 8.107 3.996 ( 2.716 3.817 3.552) 5.879 4.705 ( -3.175 6.442 -2.899) 7.745 4.955 ( 10.888 -1.663 10.280) 15.066 5.416 ( 8.344 2.926 -2.513) 9.193 5.504 ( -2.401 0.572 -6.921) 7.348 5.653 ( -5.185 -0.510 0.653) 5.251 6.091 ( -1.959 5.622 9.939) 11.586 6.390 ( 0.650 -1.915 -1.943) 2.805 7.084 ( -1.075 12.659 5.114) 13.695 7.554 ( -12.775 -4.173 7.706) 15.492 7.647 ( 10.091 1.929 -2.530) 10.581 7.869 ( -10.917 -12.179 -10.039) 19.191 9.275 ( -0.329 4.979 2.021) 5.384 9.364 ( 0.841 -4.695 9.234) 10.393 9.513 ( 2.509 -6.564 -3.092) 7.677 10.551 ( -0.388 13.002 -1.056) 13.051 10.853 ( -8.984 -10.287 1.033) 13.696 11.825 ( 7.292 1.125 -7.482) 10.508 12.347 ( -10.822 12.201 -2.633) 16.520 12.524 ( -6.131 -1.541 -2.307) 6.730 12.897 ( -0.368 -14.856 -0.806) 14.883 13.185 ( 4.253 0.532 -0.694) 4.342 14.977 ( 14.046 4.478 -11.195) 18.511 17.332 ( 14.412 3.227 25.493) 29.462 18.670 ( -5.853 -4.215 -14.884) 16.539 19.149 ( 5.252 1.274 11.319) 12.543 19.653 ( 1.073 -0.225 1.378) 1.761 20.183 ( 7.526 -2.053 -11.750) 14.103 23.254 ( -9.795 11.871 7.200) 16.992 23.444 ( 10.161 -2.509 -6.168) 12.148 24.475 ( 2.241 1.081 0.689) 2.582 ======================= Grid point 415 (196/361) ======================= q-point: (-0.10 -0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( -22.411 -0.000 14.671) 26.786 1.405 ( -16.917 -0.000 22.164) 27.882 2.786 ( -27.326 -0.000 45.313) 52.915 3.573 ( -6.444 -0.000 -3.127) 7.163 3.772 ( -0.747 -0.000 0.542) 0.923 4.086 ( 3.000 0.000 0.843) 3.116 4.641 ( -2.381 -0.000 -2.958) 3.797 5.118 ( -2.490 -0.000 -7.140) 7.562 5.364 ( 0.472 0.000 3.771) 3.801 5.466 ( 3.131 0.000 -5.975) 6.745 5.740 ( 6.834 0.000 8.762) 11.112 6.259 ( -0.382 -0.000 13.967) 13.972 6.395 ( 4.013 0.000 -0.879) 4.108 7.213 ( 2.576 0.000 -4.404) 5.103 7.347 ( -23.438 -0.000 -15.991) 28.374 7.462 ( -15.396 -0.000 13.675) 20.592 7.836 ( 10.421 0.000 5.639) 11.849 9.339 ( -2.917 -0.000 6.096) 6.758 9.448 ( -0.443 -0.000 -4.796) 4.817 9.496 ( 9.562 0.000 5.472) 11.016 10.485 ( -25.258 -0.000 -2.882) 25.422 10.671 ( 3.824 0.000 -2.522) 4.581 11.849 ( 5.752 0.000 -6.291) 8.525 12.262 ( -5.086 -0.000 -8.345) 9.773 12.281 ( -12.178 -0.000 0.817) 12.205 12.855 ( 0.771 0.000 3.224) 3.315 13.220 ( 2.834 0.000 -1.908) 3.416 14.989 ( 9.721 0.000 -17.465) 19.988 18.128 ( 38.856 0.000 30.102) 49.151 18.410 ( -1.105 -0.000 -14.078) 14.121 19.346 ( 0.199 0.000 10.511) 10.513 19.609 ( -3.516 -0.000 -4.125) 5.421 20.166 ( 11.070 0.000 -9.690) 14.712 23.282 ( -9.111 -0.000 8.134) 12.213 23.506 ( 9.983 0.000 -5.280) 11.293 24.236 ( -21.180 -0.000 -19.694) 28.921 ======================= Grid point 416 (197/361) ======================= q-point: ( 0.00 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( 7.654 0.000 16.021) 17.755 2.382 ( -1.370 -0.000 28.679) 28.712 3.191 ( -1.762 -0.000 -7.698) 7.897 3.729 ( -6.271 -0.000 14.660) 15.945 3.782 ( 1.282 0.000 -13.678) 13.738 3.976 ( 8.008 0.000 -4.015) 8.959 4.519 ( -5.257 -0.000 -4.911) 7.194 4.531 ( 0.434 0.000 -15.706) 15.712 5.447 ( 1.204 0.000 9.901) 9.974 5.658 ( -11.040 -0.000 14.803) 18.466 6.102 ( -6.389 -0.000 7.184) 9.614 6.551 ( -0.384 -0.000 -0.214) 0.440 6.685 ( 6.702 0.000 2.015) 6.999 6.765 ( -0.525 -0.000 -8.154) 8.171 6.962 ( -11.293 -0.000 20.890) 23.747 8.186 ( -13.675 -0.000 32.352) 35.123 8.499 ( 0.084 0.000 8.631) 8.632 9.158 ( 3.007 0.000 -2.023) 3.624 9.358 ( -1.271 -0.000 -4.951) 5.112 9.736 ( -11.693 -0.000 10.252) 15.551 10.422 ( -0.197 -0.000 -11.513) 11.514 10.462 ( 12.702 0.000 10.872) 16.720 11.406 ( 1.338 0.000 -14.658) 14.719 11.881 ( -2.324 -0.000 -7.644) 7.990 12.539 ( -3.179 -0.000 9.670) 10.179 13.021 ( 10.599 0.000 -4.081) 11.357 13.154 ( -2.300 -0.000 0.526) 2.359 14.235 ( 1.663 0.000 -16.915) 16.996 18.042 ( 10.168 0.000 -8.781) 13.435 18.785 ( -10.956 -0.000 -17.193) 20.387 19.277 ( -17.838 -0.000 4.841) 18.483 19.557 ( 16.237 0.000 0.025) 16.237 20.798 ( 26.736 0.000 10.525) 28.733 22.500 ( -33.066 -0.000 -13.075) 35.558 23.297 ( -7.906 -0.000 3.069) 8.481 23.553 ( 9.978 0.000 -4.994) 11.157 ======================= Grid point 417 (198/361) ======================= q-point: ( 0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( 10.752 0.384 12.559) 16.537 2.712 ( 1.494 0.741 24.182) 24.240 3.103 ( 2.868 1.642 -5.798) 6.673 3.604 ( -0.751 4.899 -11.408) 12.438 3.727 ( -4.534 -1.798 -5.218) 7.143 3.995 ( 2.194 -2.441 -7.312) 8.015 4.332 ( -2.073 4.592 -3.571) 6.175 4.483 ( 0.244 -8.394 -4.820) 9.682 5.572 ( -2.626 3.122 11.884) 12.565 5.699 ( -12.331 -4.689 15.493) 20.349 6.098 ( -3.483 -0.774 1.326) 3.806 6.449 ( -7.900 -0.136 -4.102) 8.903 6.708 ( 0.967 2.773 -2.392) 3.787 6.739 ( 2.921 -0.143 -0.581) 2.981 7.153 ( -5.883 3.434 31.475) 32.204 8.190 ( -11.274 25.853 15.131) 32.007 8.647 ( -10.962 -20.774 12.129) 26.435 9.228 ( 3.818 -3.887 -0.446) 5.466 9.287 ( 0.296 1.986 -2.840) 3.478 9.800 ( -1.042 -0.210 15.410) 15.447 10.228 ( -0.914 3.968 -9.064) 9.936 10.865 ( 13.947 -9.505 9.097) 19.173 11.261 ( 4.076 -0.670 -14.782) 15.348 11.761 ( 4.366 3.806 -9.871) 11.445 12.605 ( -4.151 -5.621 5.472) 8.875 13.102 ( 3.788 1.642 -1.448) 4.375 13.143 ( 1.699 -2.394 -0.855) 3.058 14.054 ( 0.023 2.836 -12.184) 12.510 18.097 ( 10.441 1.121 -5.498) 11.853 18.401 ( -10.782 1.953 -16.644) 19.928 19.112 ( -15.992 -2.293 4.970) 16.903 19.684 ( 2.743 0.139 -0.656) 2.824 21.301 ( 21.404 3.140 14.443) 26.011 21.934 ( -19.184 0.730 -14.206) 23.882 23.253 ( -4.623 -3.470 0.862) 5.844 23.638 ( 9.406 -0.196 -3.712) 10.114 ======================= Grid point 418 (199/361) ======================= q-point: ( 0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.682 ( 4.196 5.403 10.196) 12.279 2.942 ( 8.387 -2.135 1.245) 8.743 3.150 ( 4.781 3.689 8.622) 10.526 3.417 ( -1.394 7.881 -5.460) 9.688 3.582 ( -2.736 -3.239 -9.809) 10.686 3.905 ( -1.982 -1.524 -9.695) 10.012 4.276 ( 0.693 -5.289 -4.443) 6.942 4.585 ( 4.149 -6.671 3.049) 8.427 5.580 ( -13.388 0.930 10.755) 17.198 5.727 ( -13.172 -4.439 9.178) 16.656 6.039 ( -4.096 -1.096 -2.938) 5.158 6.280 ( -9.421 -0.219 -2.931) 9.869 6.686 ( 2.276 2.332 -0.754) 3.345 6.796 ( 4.553 -1.205 0.534) 4.740 7.450 ( -3.426 6.532 33.366) 34.172 7.881 ( -10.582 25.333 1.406) 27.490 8.789 ( -16.339 -19.065 11.642) 27.676 9.257 ( 0.893 3.387 0.214) 3.510 9.282 ( 0.056 0.459 2.578) 2.620 9.938 ( 0.415 3.021 -0.700) 3.129 10.237 ( 4.624 -10.217 8.757) 14.229 10.985 ( 2.854 11.177 -7.446) 13.730 11.405 ( 18.433 -10.841 3.906) 21.739 11.714 ( 11.860 3.825 -10.688) 16.417 12.659 ( -3.884 -9.597 1.477) 10.458 13.064 ( -7.244 4.505 5.919) 10.383 13.198 ( 4.493 -5.421 -6.251) 9.416 13.907 ( 2.499 3.164 -9.068) 9.924 18.026 ( -8.903 1.228 -13.445) 16.172 18.221 ( 8.342 -0.935 -1.922) 8.611 18.988 ( -11.188 -1.562 3.510) 11.830 19.645 ( -8.563 -1.708 1.398) 8.843 21.307 ( -7.698 15.761 -9.594) 19.993 21.976 ( 16.786 -12.217 8.645) 22.489 23.249 ( -0.014 -2.584 -0.679) 2.672 23.727 ( 8.252 0.759 -1.681) 8.456 ======================= Grid point 419 (200/361) ======================= q-point: (-0.70 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.678 ( -7.801 7.348 6.369) 12.467 3.037 ( 3.313 -1.855 -6.867) 7.847 3.277 ( 8.285 0.388 1.165) 8.375 3.321 ( -0.891 6.593 0.334) 6.661 3.538 ( 0.420 -1.356 1.996) 2.450 3.786 ( 1.331 -0.508 -6.806) 6.953 4.342 ( 7.141 -9.337 -4.913) 12.740 4.732 ( 1.989 -3.487 4.158) 5.780 5.442 ( -20.361 -4.681 3.874) 21.248 5.627 ( -14.484 -1.822 3.261) 14.958 5.948 ( -7.305 -1.543 -0.696) 7.499 6.134 ( -9.029 -0.339 -0.044) 9.035 6.697 ( 2.884 2.360 -1.026) 3.865 6.896 ( 5.850 -1.810 1.129) 6.227 7.547 ( -5.077 19.614 -2.732) 20.443 7.715 ( -3.865 7.155 26.909) 28.111 8.815 ( -16.923 -14.467 7.261) 23.419 9.245 ( -2.652 3.681 4.070) 6.095 9.303 ( -0.768 3.325 5.273) 6.281 9.835 ( -6.818 -7.110 -7.712) 12.510 10.576 ( 9.750 -4.551 12.292) 16.336 10.811 ( 5.772 18.847 -5.510) 20.467 11.691 ( 14.690 1.213 -11.164) 18.490 11.891 ( 20.205 -6.728 6.089) 22.149 12.710 ( -1.815 -9.296 -0.034) 9.472 12.972 ( -11.130 6.307 8.374) 15.290 13.180 ( -2.993 -4.815 -6.064) 8.302 13.882 ( 9.202 -3.457 -7.977) 12.660 17.713 ( -10.671 -0.925 -14.555) 18.071 18.381 ( 8.491 0.017 7.176) 11.117 18.925 ( -4.020 -3.093 0.549) 5.102 19.541 ( -13.710 -4.884 3.300) 14.923 20.932 ( -1.370 14.954 -16.436) 22.263 22.439 ( 11.133 -12.842 12.884) 21.328 23.279 ( 5.606 0.806 -2.281) 6.106 23.821 ( 6.748 1.420 2.063) 7.198 ======================= Grid point 420 (201/361) ======================= q-point: (-0.60 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( -15.763 6.718 10.241) 19.962 2.912 ( -8.978 1.080 -7.822) 11.957 3.250 ( 3.629 0.404 -1.831) 4.084 3.425 ( 4.212 -2.462 1.472) 5.095 3.563 ( 0.665 3.748 1.734) 4.183 3.842 ( 8.112 -3.530 -0.701) 8.874 4.500 ( 11.092 -8.485 -4.645) 14.717 4.744 ( -7.574 3.916 3.356) 9.163 5.254 ( -15.995 -8.544 -0.131) 18.134 5.488 ( -11.415 -3.920 1.969) 12.228 5.849 ( -9.542 -3.768 0.322) 10.264 6.027 ( -8.532 -0.193 2.229) 8.820 6.677 ( -0.386 3.210 -1.641) 3.625 7.003 ( 4.645 -1.018 1.444) 4.970 7.349 ( 3.589 12.863 -3.588) 13.828 7.842 ( -6.660 5.417 14.286) 16.667 8.774 ( -15.539 -9.423 5.898) 19.107 9.201 ( -7.363 3.854 6.500) 10.551 9.341 ( -0.791 1.954 6.624) 6.951 9.735 ( -6.537 -10.860 -5.220) 13.708 10.605 ( 7.046 24.342 -3.856) 25.633 10.916 ( 7.680 -1.656 10.414) 13.045 11.714 ( 13.534 2.310 -14.046) 19.641 12.279 ( 16.589 -4.856 1.917) 17.391 12.770 ( -3.049 -0.400 3.043) 4.326 12.880 ( -7.572 0.567 9.753) 12.361 13.090 ( -4.526 -3.410 -3.164) 6.490 14.012 ( 12.550 -11.547 -8.365) 18.995 17.403 ( -10.491 0.153 -11.243) 15.378 18.621 ( 8.744 0.540 11.776) 14.677 18.934 ( 0.417 -7.036 -3.683) 7.952 19.444 ( -11.502 -5.161 2.956) 12.949 20.615 ( 3.327 14.227 -16.032) 21.691 22.779 ( -1.481 -15.779 9.169) 18.310 23.332 ( 11.743 6.539 -3.823) 13.974 23.967 ( 6.614 -0.188 8.541) 10.804 ======================= Grid point 421 (202/361) ======================= q-point: (-0.50 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( -20.530 6.994 13.361) 25.474 2.600 ( -18.663 6.157 -4.249) 20.107 3.347 ( 5.151 1.832 0.183) 5.470 3.468 ( 2.211 -4.815 -0.930) 5.379 3.597 ( 1.343 0.284 6.425) 6.570 3.951 ( 0.122 -5.663 -0.548) 5.691 4.607 ( -10.991 0.617 3.472) 11.543 4.661 ( 10.890 -5.311 -5.172) 13.174 5.160 ( -7.039 -5.161 2.163) 8.992 5.449 ( -3.506 -5.807 0.314) 6.790 5.764 ( -9.567 -7.427 -0.772) 12.136 5.960 ( -6.889 -0.709 4.656) 8.345 6.588 ( -4.180 3.859 -1.851) 5.982 7.067 ( 1.174 0.277 1.570) 1.980 7.322 ( 9.846 5.705 -3.657) 11.953 7.782 ( -10.229 2.349 2.453) 10.778 8.675 ( -15.204 0.426 6.142) 16.403 9.163 ( -7.237 -2.422 5.821) 9.598 9.410 ( -1.127 1.262 9.623) 9.771 9.727 ( -1.193 -7.275 -1.422) 7.508 10.435 ( 3.759 19.837 -2.904) 20.398 11.111 ( 4.567 2.884 7.658) 9.371 11.685 ( 11.430 3.442 -15.011) 19.178 12.447 ( 5.746 -3.789 -5.353) 8.719 12.663 ( -13.800 4.778 8.477) 16.886 12.948 ( -0.002 -4.511 -1.823) 4.866 13.148 ( 6.778 0.155 7.133) 9.841 14.211 ( 13.430 -15.257 -9.260) 22.335 17.189 ( -6.600 0.022 -1.661) 6.806 18.862 ( 8.601 3.514 3.928) 10.087 18.930 ( -2.007 -8.705 -3.699) 9.669 19.413 ( -0.579 -2.964 1.587) 3.411 20.388 ( 3.377 10.931 -10.359) 15.434 22.913 ( -10.335 -17.811 3.761) 20.933 23.383 ( 12.455 9.582 -4.397) 16.318 24.214 ( 6.789 -2.665 12.518) 14.488 ======================= Grid point 422 (203/361) ======================= q-point: (-0.40 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( -20.435 9.112 8.817) 24.050 2.197 ( -25.878 9.876 4.653) 28.087 3.322 ( -3.272 9.788 10.678) 14.851 3.584 ( 1.251 -8.948 -2.030) 9.260 3.743 ( 4.788 -4.202 5.155) 8.195 3.936 ( -8.188 -5.097 1.781) 9.808 4.525 ( -9.402 -8.913 -0.636) 12.971 4.805 ( 10.304 -3.742 -0.254) 10.965 5.221 ( 4.362 -3.084 3.451) 6.360 5.449 ( -2.066 -3.679 -3.579) 5.533 5.693 ( -6.011 -4.039 0.439) 7.255 5.982 ( -3.310 -5.658 5.921) 8.834 6.474 ( -4.730 2.893 0.199) 5.549 7.059 ( -5.044 -1.796 -0.185) 5.358 7.401 ( 10.006 -0.676 -4.609) 11.038 7.631 ( -9.395 -0.209 0.165) 9.398 8.506 ( -13.036 11.184 8.400) 19.120 9.166 ( -7.223 -6.528 4.196) 10.602 9.520 ( 0.205 1.153 10.163) 10.230 9.749 ( 3.628 4.148 -2.226) 5.943 10.312 ( -2.258 4.104 -0.433) 4.704 11.168 ( 1.049 8.505 3.271) 9.172 11.629 ( 10.072 2.114 -13.311) 16.825 12.399 ( -5.660 0.591 -3.640) 6.755 12.579 ( -9.015 -0.635 7.422) 11.694 12.948 ( 1.684 -4.701 -6.933) 8.544 13.277 ( 5.619 7.515 2.763) 9.781 14.417 ( 13.519 -14.681 -11.323) 22.946 17.238 ( 2.620 -4.454 12.880) 13.879 18.730 ( 0.221 3.370 -16.322) 16.668 19.083 ( 3.951 -2.388 5.876) 7.472 19.522 ( 9.733 -1.714 0.835) 9.918 20.245 ( -0.106 7.623 -4.424) 8.815 22.952 ( -12.658 -20.432 2.359) 24.151 23.404 ( 10.125 8.561 -4.302) 13.940 24.442 ( 2.493 -2.225 7.535) 8.243 ======================= Grid point 423 (204/361) ======================= q-point: (-0.30 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.774 ( -23.202 11.887 8.239) 27.340 1.990 ( -16.913 11.252 17.414) 26.756 3.397 ( -2.928 3.911 17.678) 18.340 3.584 ( -6.847 -3.933 -0.287) 7.902 3.802 ( -11.022 -4.978 3.728) 12.656 3.940 ( 5.263 -1.490 -1.925) 5.799 4.488 ( -6.356 -13.174 -3.062) 14.944 4.992 ( 5.977 -5.867 -1.170) 8.456 5.361 ( 0.078 0.803 -5.337) 5.398 5.374 ( 5.352 -0.850 6.809) 8.702 5.722 ( 3.371 0.371 3.776) 5.076 6.094 ( 0.270 -9.922 3.982) 10.695 6.462 ( -1.509 -0.627 8.129) 8.291 6.945 ( -13.552 -7.179 -3.471) 15.724 7.384 ( -1.270 -2.711 -11.580) 11.960 7.637 ( 0.949 -3.093 6.849) 7.574 8.345 ( -9.472 19.339 15.124) 26.314 9.193 ( -6.144 -9.217 4.864) 12.098 9.569 ( -0.103 6.969 -1.335) 7.096 9.730 ( 6.135 9.500 3.405) 11.810 10.263 ( -10.543 -10.359 -0.174) 14.781 11.072 ( -0.474 14.630 -1.828) 14.751 11.629 ( 9.201 -1.866 -8.822) 12.882 12.247 ( -8.996 1.385 -1.753) 9.270 12.547 ( -6.526 1.512 3.834) 7.719 12.903 ( 1.438 -1.376 -7.115) 7.389 13.264 ( 1.996 8.440 0.415) 8.683 14.542 ( 11.365 -10.938 -16.540) 22.856 17.642 ( 12.716 -12.828 18.599) 25.926 18.522 ( 8.247 9.274 -14.151) 18.822 19.186 ( -1.688 -8.123 0.744) 8.330 19.709 ( 15.490 3.469 1.542) 15.949 20.107 ( -3.894 7.005 -3.659) 8.810 23.003 ( -13.914 -24.609 3.487) 28.485 23.416 ( 9.208 6.394 -4.805) 12.196 24.440 ( -7.359 3.194 -3.619) 8.801 ======================= Grid point 424 (205/361) ======================= q-point: (-0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( -7.441 8.723 20.341) 23.350 1.949 ( -11.165 8.170 22.936) 26.785 3.470 ( -7.784 -3.156 -4.145) 9.367 3.552 ( -13.151 0.465 24.499) 27.809 3.741 ( -1.071 -2.232 -0.297) 2.493 3.981 ( 6.985 1.078 -6.693) 9.734 4.511 ( -2.843 -12.796 -2.245) 13.298 4.943 ( -2.181 2.895 -7.868) 8.663 5.344 ( 1.343 -1.295 -3.016) 3.546 5.560 ( -1.626 -0.320 13.728) 13.828 5.882 ( 15.739 1.735 3.631) 16.245 6.261 ( 3.255 -10.809 3.527) 11.827 6.600 ( -3.998 0.189 13.145) 13.741 6.767 ( -13.660 -14.518 -3.541) 20.246 7.192 ( -2.836 3.862 -13.296) 14.133 7.773 ( -6.860 -8.377 13.084) 16.983 8.302 ( -3.120 19.260 21.126) 28.758 9.285 ( -2.403 -10.430 4.548) 11.630 9.408 ( -1.498 9.351 -7.239) 11.920 9.816 ( 6.758 9.735 7.210) 13.872 10.159 ( -18.334 -15.873 -1.618) 24.304 10.876 ( 0.980 19.676 -4.430) 20.192 11.667 ( 5.746 -3.032 -8.778) 10.920 12.088 ( -7.781 -0.903 -3.660) 8.646 12.474 ( -5.001 6.845 6.282) 10.551 12.884 ( 2.947 -0.619 -2.248) 3.758 13.221 ( 0.899 4.698 -0.833) 4.856 14.529 ( 8.153 -6.829 -20.638) 23.217 18.018 ( 6.533 -9.547 -5.197) 12.682 18.639 ( 27.459 4.071 7.259) 28.693 19.196 ( -8.078 -14.523 -4.648) 17.256 19.832 ( -3.984 16.309 3.498) 17.149 20.012 ( 16.597 -0.074 -4.323) 17.151 23.070 ( -17.430 -28.374 3.058) 33.440 23.436 ( 9.976 4.174 -6.029) 12.381 24.076 ( -19.531 14.005 -10.806) 26.351 ======================= Grid point 425 (206/361) ======================= q-point: (-0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( 3.777 2.553 20.897) 21.388 2.091 ( -5.622 2.722 27.298) 28.003 3.326 ( -6.026 -1.866 -6.379) 8.971 3.625 ( -14.362 1.616 24.412) 28.369 3.826 ( 8.320 -6.386 -6.233) 12.200 3.950 ( 6.547 5.769 -7.597) 11.570 4.551 ( -1.705 -10.984 -4.989) 12.183 4.768 ( -0.320 7.128 -10.981) 13.096 5.351 ( -0.239 -0.884 3.102) 3.235 5.633 ( -8.494 1.742 13.564) 16.099 6.096 ( 2.511 0.839 4.360) 5.101 6.446 ( 4.482 -8.765 3.436) 10.427 6.573 ( -1.449 -1.112 2.745) 3.297 6.855 ( -4.581 -6.434 9.140) 12.080 6.955 ( -4.973 4.292 -7.343) 9.853 7.944 ( -13.222 -11.298 25.023) 30.473 8.390 ( 1.591 13.569 17.304) 22.047 9.224 ( -1.693 5.186 -5.799) 7.961 9.384 ( -0.309 -5.561 -0.116) 5.570 9.831 ( -8.365 8.128 7.296) 13.758 10.146 ( -1.588 -18.603 3.374) 18.973 10.653 ( 2.350 20.350 -6.287) 21.428 11.576 ( -0.227 -0.152 -13.315) 13.318 11.983 ( -4.009 -3.285 -4.451) 6.832 12.472 ( -2.894 4.939 10.772) 12.198 12.932 ( 7.039 -0.081 -2.227) 7.384 13.184 ( -0.363 1.650 -1.198) 2.071 14.408 ( 4.790 -3.238 -20.627) 21.422 18.031 ( 7.746 -1.706 -11.044) 13.597 19.043 ( 1.788 -1.945 -7.172) 7.643 19.196 ( 11.718 -15.000 2.246) 19.167 19.558 ( -11.666 14.630 0.047) 18.712 20.337 ( 25.620 1.448 5.025) 26.149 23.012 ( -28.858 -25.232 -6.716) 38.918 23.470 ( 5.134 4.608 -6.169) 9.255 23.523 ( -11.840 17.260 -2.499) 21.080 ======================= Grid point 427 (207/361) ======================= q-point: ( 0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.742 ( 11.177 0.000 9.815) 14.875 2.915 ( 2.568 0.000 -0.116) 2.571 3.194 ( 4.060 0.000 12.265) 12.919 3.500 ( -1.156 -0.000 -5.151) 5.279 3.543 ( -4.230 -0.000 -10.884) 11.677 3.878 ( 0.961 0.000 -12.438) 12.475 4.234 ( -2.356 -0.000 -4.967) 5.497 4.510 ( 4.392 0.000 4.327) 6.165 5.624 ( -19.314 -0.000 12.990) 23.276 5.654 ( -7.750 -0.000 7.760) 10.967 6.028 ( -3.686 -0.000 -3.167) 4.860 6.277 ( -9.540 -0.000 -2.797) 9.941 6.720 ( 1.509 0.000 0.258) 1.530 6.772 ( 5.293 0.000 -2.044) 5.673 7.512 ( -5.240 -0.000 34.732) 35.125 8.240 ( -15.007 -0.000 -8.073) 17.041 8.484 ( -14.205 -0.000 21.283) 25.588 9.280 ( 2.441 0.000 3.697) 4.430 9.296 ( 2.700 0.000 -2.827) 3.909 10.018 ( -7.328 -0.000 -13.179) 15.080 10.091 ( 8.668 0.000 20.564) 22.316 11.163 ( 9.130 0.000 -13.709) 16.471 11.236 ( 18.795 0.000 14.328) 23.633 11.761 ( 10.818 0.000 -10.993) 15.423 12.556 ( -4.532 -0.000 1.743) 4.856 13.111 ( -7.604 -0.000 6.572) 10.051 13.141 ( 6.141 0.000 -8.020) 10.101 13.937 ( 0.951 0.000 -9.975) 10.021 18.041 ( -10.611 -0.000 -17.172) 20.186 18.210 ( 10.149 0.000 -0.587) 10.166 18.972 ( -12.715 -0.000 6.061) 14.085 19.628 ( -10.226 -0.000 1.322) 10.311 21.501 ( -9.492 -0.000 -19.800) 21.958 21.819 ( 18.271 0.000 17.721) 25.453 23.223 ( 0.901 0.000 0.591) 1.078 23.734 ( 9.037 0.000 -2.011) 9.258 ======================= Grid point 428 (208/361) ======================= q-point: ( 0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.813 ( -1.690 7.081 -3.972) 8.293 2.975 ( 2.898 -4.978 -0.490) 5.781 3.301 ( 0.089 1.812 1.691) 2.480 3.384 ( -2.509 0.362 -6.715) 7.177 3.564 ( 2.981 3.066 13.507) 14.167 3.755 ( 5.059 -1.990 -13.893) 14.919 4.220 ( 4.326 -3.619 -1.468) 5.829 4.637 ( 2.483 -4.742 3.995) 6.679 5.438 ( -20.802 2.618 6.040) 21.819 5.570 ( -16.169 -3.634 3.549) 16.948 5.931 ( -5.808 -0.413 -2.211) 6.228 6.127 ( -9.446 -0.298 0.061) 9.451 6.753 ( 4.253 3.536 -0.054) 5.531 6.845 ( 6.537 -3.400 -2.221) 7.696 7.803 ( -9.009 3.332 29.099) 30.644 7.869 ( -11.688 12.223 -5.135) 17.674 8.562 ( -14.642 -10.887 13.175) 22.505 9.286 ( 1.942 1.037 -2.518) 3.345 9.357 ( -0.588 1.849 7.134) 7.393 9.740 ( -9.801 -2.931 -12.834) 16.413 10.502 ( 12.010 -2.237 18.349) 22.043 11.136 ( 14.358 12.665 -8.622) 20.998 11.692 ( 17.159 -1.561 6.747) 18.503 11.803 ( 15.274 -2.152 -5.923) 16.523 12.552 ( -1.231 -6.240 0.845) 6.416 13.054 ( -10.463 2.704 6.775) 12.755 13.099 ( -1.502 -3.164 -6.682) 7.544 13.850 ( 4.960 -0.657 -10.863) 11.960 17.701 ( -10.335 -0.365 -14.536) 17.839 18.382 ( 9.595 0.023 6.281) 11.468 18.890 ( -7.408 -0.932 2.722) 7.947 19.475 ( -14.824 -2.053 2.950) 15.254 21.144 ( -0.656 7.065 -21.364) 22.512 22.257 ( 8.555 -6.110 16.555) 19.611 23.289 ( 7.169 0.278 1.122) 7.262 23.837 ( 7.677 0.448 0.090) 7.690 ======================= Grid point 429 (209/361) ======================= q-point: (-0.70 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( -7.814 4.470 -1.677) 9.157 2.917 ( -6.856 0.222 -5.303) 8.670 3.264 ( -1.918 0.931 -3.812) 4.367 3.360 ( -0.555 -4.109 3.035) 5.138 3.670 ( 4.507 6.064 2.243) 7.881 3.780 ( 6.964 -2.273 -1.673) 7.514 4.367 ( 9.313 -5.522 1.364) 10.912 4.734 ( -2.806 -6.075 2.362) 7.096 5.171 ( -19.644 2.184 2.711) 19.950 5.403 ( -15.439 -5.811 1.262) 16.544 5.814 ( -8.839 -0.701 -0.953) 8.918 6.021 ( -8.293 -0.372 2.438) 8.652 6.749 ( 1.820 4.914 -2.054) 5.629 6.947 ( 5.724 -4.639 -2.094) 7.659 7.582 ( -3.800 11.176 -3.773) 12.393 7.924 ( -14.647 3.361 19.663) 24.748 8.593 ( -12.818 -8.716 9.952) 18.421 9.280 ( 0.169 2.999 0.430) 3.035 9.372 ( -4.379 1.966 3.423) 5.895 9.541 ( -7.368 -8.986 -5.063) 12.676 10.867 ( 10.153 1.440 12.839) 16.431 11.099 ( 14.040 22.141 -4.015) 26.522 11.760 ( 13.158 3.301 -12.649) 18.548 12.169 ( 14.458 -8.168 3.900) 17.058 12.682 ( 7.507 -5.799 4.483) 10.492 12.945 ( -14.290 3.309 9.657) 17.561 13.002 ( -5.756 -5.009 -5.318) 9.301 13.842 ( 9.754 -6.681 -12.310) 17.068 17.404 ( -10.215 0.047 -10.280) 14.492 18.631 ( 9.852 0.417 11.779) 15.362 18.845 ( -2.188 -2.999 -2.089) 4.259 19.360 ( -9.904 -3.690 3.516) 11.139 20.830 ( 2.153 9.075 -20.021) 22.087 22.538 ( -2.940 -10.149 10.437) 14.852 23.436 ( 12.157 4.550 2.875) 13.295 23.955 ( 6.219 -0.933 3.867) 7.382 ======================= Grid point 430 (210/361) ======================= q-point: (-0.60 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( -13.006 4.459 4.527) 14.476 2.695 ( -13.760 5.013 -2.815) 14.913 3.255 ( 5.830 -5.729 -4.404) 9.285 3.421 ( -2.680 -5.262 3.128) 6.683 3.692 ( 1.292 7.252 5.172) 9.001 3.848 ( 1.100 -4.036 -2.294) 4.771 4.564 ( 7.531 -4.270 1.761) 8.835 4.643 ( -13.896 1.748 0.007) 14.005 5.031 ( -7.665 -8.490 3.345) 11.917 5.320 ( -6.297 -6.728 1.338) 9.312 5.684 ( -10.291 -1.908 0.685) 10.489 5.958 ( -6.187 0.228 3.947) 7.342 6.664 ( -3.627 4.680 -2.355) 6.372 7.015 ( 2.087 -5.084 -3.753) 6.655 7.460 ( 2.785 7.929 -1.986) 8.635 7.820 ( -18.893 1.936 7.667) 20.481 8.616 ( -9.095 -4.745 8.961) 13.621 9.185 ( -6.762 2.345 0.010) 7.158 9.408 ( 1.601 -2.922 4.311) 5.449 9.540 ( -5.689 -8.133 4.029) 10.712 10.896 ( 7.405 26.301 -3.680) 27.570 11.194 ( 9.984 7.027 9.314) 15.356 11.745 ( 11.751 3.181 -14.074) 18.608 12.358 ( 5.955 -6.547 -5.257) 10.294 12.738 ( -10.618 2.256 3.599) 11.436 12.871 ( -6.919 -3.147 0.085) 7.601 13.107 ( 10.892 -4.014 11.311) 16.208 13.940 ( 12.221 -13.766 -12.381) 22.185 17.188 ( -7.794 -0.041 -2.798) 8.281 18.795 ( 0.387 -5.677 -8.253) 10.025 18.928 ( 9.614 3.260 12.607) 16.187 19.364 ( 0.865 -2.494 3.146) 4.107 20.557 ( 1.037 7.726 -15.551) 17.395 22.625 ( -10.959 -13.421 3.905) 17.761 23.565 ( 10.923 10.165 0.989) 14.954 24.145 ( 5.420 -4.843 9.289) 11.795 ======================= Grid point 431 (211/361) ======================= q-point: (-0.50 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -15.023 6.650 4.732) 17.097 2.396 ( -20.043 11.734 7.350) 24.360 3.388 ( 5.077 -11.569 -2.961) 12.976 3.443 ( 0.247 0.644 1.000) 1.215 3.724 ( -4.654 -0.140 7.946) 9.210 3.853 ( -0.771 -1.045 2.633) 2.936 4.392 ( -17.277 -4.786 -1.725) 18.010 4.731 ( 7.489 -3.831 0.358) 8.419 5.123 ( 0.068 -9.575 4.808) 10.715 5.347 ( -1.217 -5.300 0.770) 5.492 5.612 ( -7.061 -3.721 4.993) 9.414 5.943 ( -2.501 0.162 3.881) 4.620 6.527 ( -7.248 3.084 -0.542) 7.895 6.984 ( -6.088 -6.357 -5.793) 10.537 7.427 ( 3.159 3.240 -4.573) 6.433 7.625 ( -14.806 -0.422 4.569) 15.501 8.631 ( -5.231 2.691 8.419) 10.270 9.100 ( -7.406 -1.206 2.650) 7.958 9.533 ( 2.967 -0.393 7.741) 8.300 9.604 ( -5.367 -12.423 3.431) 13.961 10.669 ( 3.909 28.927 -4.219) 29.493 11.336 ( 6.804 9.631 6.112) 13.282 11.686 ( 9.703 3.866 -14.578) 17.934 12.373 ( -0.172 -3.414 -5.441) 6.426 12.606 ( -13.282 2.709 8.502) 16.001 12.835 ( -0.803 -7.387 -5.256) 9.101 13.374 ( 9.295 3.286 4.815) 10.972 14.120 ( 12.921 -17.559 -11.173) 24.497 17.163 ( -1.435 -3.613 8.270) 9.139 18.712 ( 1.665 -4.355 -14.498) 15.229 19.130 ( 6.860 6.577 6.411) 11.464 19.510 ( 12.796 -0.023 3.044) 13.153 20.350 ( -2.289 4.104 -8.247) 9.492 22.605 ( -15.091 -16.986 1.733) 22.788 23.591 ( 8.303 11.705 -1.603) 14.440 24.368 ( 1.539 -5.920 8.547) 10.511 ======================= Grid point 432 (212/361) ======================= q-point: (-0.40 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( -16.857 15.559 8.242) 24.376 2.187 ( -16.832 10.658 16.117) 25.625 3.429 ( -3.723 -4.294 1.719) 5.938 3.511 ( 0.974 -2.255 1.697) 2.986 3.714 ( -10.592 -4.839 5.659) 12.947 3.945 ( 4.757 3.253 6.317) 8.551 4.239 ( -8.786 -13.132 -5.485) 16.725 4.868 ( 4.560 -7.430 -0.701) 8.745 5.272 ( -2.064 -9.961 4.316) 11.050 5.391 ( 2.922 1.621 4.612) 5.696 5.688 ( 0.543 -3.962 8.410) 9.312 5.979 ( 1.039 -2.305 2.173) 3.334 6.438 ( -6.887 -1.493 5.595) 8.998 6.819 ( -14.923 -7.658 -6.375) 17.944 7.337 ( -2.840 -1.511 -7.524) 8.183 7.586 ( -3.197 -2.710 4.901) 6.448 8.632 ( -3.012 11.392 11.542) 16.495 9.058 ( -8.332 -5.026 4.973) 10.928 9.648 ( -0.952 -2.014 1.617) 2.753 9.678 ( -2.141 -8.982 3.745) 9.964 10.412 ( 0.208 24.797 -1.832) 24.865 11.354 ( 6.206 16.012 0.507) 17.180 11.619 ( 7.805 0.795 -11.698) 14.085 12.282 ( -6.571 1.525 -2.691) 7.262 12.556 ( -7.345 0.150 8.243) 11.042 12.830 ( 1.802 -6.209 -6.799) 9.382 13.423 ( 3.148 8.056 -0.791) 8.686 14.295 ( 10.571 -16.024 -13.715) 23.593 17.425 ( 6.665 -10.861 16.245) 20.647 18.593 ( 6.707 -2.201 -17.363) 18.743 19.161 ( 1.905 6.293 -0.477) 6.592 19.768 ( 20.194 2.966 1.909) 20.500 20.203 ( -5.934 3.213 -2.118) 7.072 22.575 ( -17.384 -21.437 2.974) 27.759 23.569 ( 7.384 10.226 -3.326) 13.044 24.444 ( -6.239 -2.690 1.157) 6.892 ======================= Grid point 433 (213/361) ======================= q-point: (-0.30 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.855 ( -7.996 15.640 16.996) 24.442 2.110 ( -13.262 9.064 20.821) 26.297 3.390 ( -8.135 -5.685 -3.108) 10.400 3.559 ( -4.397 -0.524 10.189) 11.109 3.696 ( -3.895 -2.420 4.042) 6.113 4.031 ( 5.795 5.293 1.531) 7.996 4.245 ( -1.535 -16.267 -4.983) 17.082 4.931 ( -0.236 -4.457 -3.832) 5.883 5.316 ( -0.250 -2.623 -0.809) 2.756 5.550 ( -0.426 -0.433 15.329) 15.341 5.884 ( 9.511 -3.265 6.893) 12.191 6.073 ( 0.427 -7.638 3.997) 8.631 6.509 ( -8.054 -9.752 10.810) 16.638 6.600 ( -11.248 -4.432 -2.445) 12.335 7.207 ( -3.534 -1.019 -9.527) 10.212 7.639 ( -4.864 -6.615 5.376) 9.814 8.632 ( -3.948 15.954 17.691) 24.147 9.103 ( -4.713 -9.067 6.939) 12.353 9.576 ( -2.852 3.583 -6.330) 7.813 9.754 ( -4.361 -8.525 2.552) 9.910 10.211 ( -1.125 18.891 2.262) 19.059 11.242 ( 6.351 20.850 -5.083) 22.381 11.611 ( 6.025 -2.642 -8.557) 10.794 12.108 ( -9.112 2.480 -4.175) 10.325 12.563 ( -4.075 2.887 7.875) 9.325 12.848 ( 3.901 -3.478 -3.260) 6.159 13.346 ( -0.469 8.356 -1.330) 8.474 14.352 ( 6.975 -12.553 -17.954) 22.991 17.818 ( 8.076 -11.946 6.872) 15.974 18.602 ( 13.387 -9.356 -8.733) 18.521 19.095 ( 0.659 4.539 -3.709) 5.899 19.991 ( 1.073 -0.934 -5.849) 6.020 20.108 ( 13.179 12.549 6.426) 19.299 22.573 ( -19.638 -25.295 4.139) 32.290 23.543 ( 7.609 7.554 -4.850) 11.767 24.248 ( -15.158 5.088 -6.497) 17.259 ======================= Grid point 434 (214/361) ======================= q-point: (-0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( 1.870 8.167 18.218) 20.053 2.167 ( -9.196 5.256 25.474) 27.588 3.268 ( -6.702 -4.367 -5.667) 9.803 3.641 ( -3.298 -2.228 9.318) 10.132 3.742 ( 1.010 -1.016 2.818) 3.161 4.054 ( 5.581 6.300 -1.976) 8.645 4.314 ( 0.957 -14.654 -7.504) 16.491 4.863 ( -1.235 2.566 -6.333) 6.944 5.333 ( -0.437 -0.876 3.225) 3.371 5.679 ( -6.533 2.797 15.046) 16.640 6.113 ( 1.386 0.435 4.033) 4.287 6.226 ( 1.546 -14.242 9.789) 17.351 6.488 ( -0.342 -7.080 0.202) 7.091 6.731 ( -3.998 -7.683 15.908) 18.113 7.008 ( -5.505 1.759 -11.397) 12.779 7.719 ( -9.278 -12.132 11.721) 19.252 8.672 ( -4.268 15.216 20.405) 25.809 9.212 ( -3.659 -8.600 4.022) 10.175 9.415 ( 1.169 9.642 -4.449) 10.683 9.787 ( -9.334 -14.009 2.282) 16.987 10.090 ( 2.111 15.627 3.086) 16.068 11.057 ( 5.727 23.052 -6.162) 24.539 11.566 ( 2.308 -1.083 -12.789) 13.041 11.923 ( -7.669 -2.095 -4.622) 9.196 12.588 ( -2.071 6.226 9.894) 11.872 12.921 ( 7.010 -1.214 -1.227) 7.219 13.249 ( -1.755 5.545 -1.370) 5.976 14.295 ( 3.900 -9.225 -19.108) 21.574 17.975 ( 8.011 -4.234 -7.275) 11.620 18.797 ( -6.678 -20.014 -4.409) 21.555 19.124 ( 19.013 2.801 -0.743) 19.233 19.774 ( -10.231 7.600 -5.010) 13.694 20.410 ( 24.231 7.504 7.346) 26.408 22.542 ( -23.339 -24.992 0.961) 34.208 23.535 ( 8.285 4.615 -5.769) 11.101 23.825 ( -18.209 13.036 -7.056) 23.480 ======================= Grid point 435 (215/361) ======================= q-point: (-0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 6.462 2.342 15.283) 16.757 2.388 ( -2.280 0.838 27.458) 27.565 3.160 ( -1.985 -3.192 -7.239) 8.157 3.682 ( 0.407 -6.923 -8.027) 10.608 3.787 ( -3.656 3.417 8.240) 9.641 4.039 ( 5.901 5.003 -4.958) 9.189 4.336 ( 0.363 -10.068 -7.867) 12.782 4.692 ( -2.615 7.832 -9.272) 12.415 5.423 ( -0.024 -1.680 10.008) 10.148 5.708 ( -9.439 4.608 14.602) 17.987 6.112 ( -6.368 0.923 7.704) 10.037 6.488 ( 3.305 -6.808 3.763) 8.452 6.624 ( 5.905 -6.451 2.555) 9.111 6.779 ( -3.718 1.483 -9.295) 10.120 6.916 ( -9.315 -5.075 19.885) 22.538 7.911 ( -10.121 -20.311 18.047) 28.994 8.713 ( -5.038 14.222 17.747) 23.294 9.223 ( 1.145 0.301 -1.695) 2.067 9.349 ( -1.141 5.095 0.008) 5.221 9.759 ( -10.115 -1.244 5.911) 11.781 10.143 ( 6.649 -6.410 1.390) 9.339 10.864 ( 6.375 23.769 -2.805) 24.768 11.412 ( 1.434 0.707 -14.747) 14.833 11.816 ( -3.100 -5.838 -7.345) 9.881 12.619 ( -2.306 7.397 9.412) 12.191 13.022 ( 8.848 -0.078 -2.097) 9.093 13.173 ( -1.717 2.523 -0.729) 3.138 14.180 ( 1.393 -6.107 -16.418) 17.573 18.025 ( 9.958 -1.773 -8.196) 13.018 18.678 ( -11.829 -9.923 -10.865) 18.879 19.303 ( -5.839 0.836 0.258) 5.905 19.594 ( 7.572 3.809 -2.264) 8.773 20.817 ( 23.992 2.597 11.297) 26.645 22.337 ( -26.277 -14.777 -7.572) 31.084 23.424 ( -10.735 10.843 -1.860) 15.371 23.572 ( 8.218 2.115 -4.832) 9.765 ======================= Grid point 438 (216/361) ======================= q-point: ( 0.20 -0.80 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.693 ( -2.224 -0.000 -12.248) 12.448 2.919 ( -8.700 -0.000 1.359) 8.806 3.295 ( -3.722 -0.000 3.558) 5.149 3.297 ( -3.503 -0.000 -3.732) 5.118 3.703 ( 11.896 0.000 -13.129) 17.716 3.792 ( 1.107 0.000 12.675) 12.724 4.317 ( 8.433 0.000 4.593) 9.603 4.646 ( -2.348 -0.000 1.490) 2.781 5.273 ( -13.767 -0.000 5.209) 14.720 5.285 ( -22.555 -0.000 -0.620) 22.563 5.809 ( -8.216 -0.000 -1.483) 8.348 6.017 ( -8.214 -0.000 2.743) 8.660 6.845 ( 4.308 0.000 -5.997) 7.384 6.852 ( 3.959 0.000 0.703) 4.021 7.693 ( -7.075 -0.000 -6.061) 9.316 7.954 ( -17.440 -0.000 21.563) 27.733 8.507 ( -11.434 -0.000 14.084) 18.141 9.296 ( 3.235 0.000 -1.328) 3.497 9.415 ( -9.171 -0.000 -13.996) 16.732 9.442 ( -3.922 -0.000 9.587) 10.358 10.876 ( 11.302 0.000 15.652) 19.306 11.339 ( 19.052 0.000 -8.107) 20.705 11.831 ( 13.442 0.000 -13.042) 18.729 12.032 ( 8.826 0.000 7.507) 11.586 12.625 ( 11.304 0.000 7.556) 13.596 12.938 ( -5.891 -0.000 -7.723) 9.714 12.987 ( -14.972 -0.000 9.214) 17.580 13.782 ( 8.146 0.000 -13.878) 16.092 17.405 ( -10.097 -0.000 -9.893) 14.136 18.634 ( 10.466 0.000 11.021) 15.199 18.820 ( -3.529 -0.000 -0.439) 3.556 19.325 ( -9.149 -0.000 3.470) 9.785 20.916 ( 1.774 0.000 -22.323) 22.394 22.442 ( -3.378 -0.000 11.516) 12.001 23.480 ( 12.186 0.000 6.426) 13.777 23.944 ( 6.117 0.000 1.206) 6.235 ======================= Grid point 440 (217/361) ======================= q-point: (-0.70 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( -3.291 0.805 -6.928) 7.712 2.780 ( -11.557 3.425 2.272) 12.266 3.195 ( -1.082 -0.952 -5.256) 5.450 3.316 ( -4.453 -4.771 4.724) 8.056 3.700 ( 3.509 -2.445 -8.310) 9.346 3.897 ( -2.073 4.719 10.035) 11.281 4.518 ( 8.171 -0.662 6.050) 10.188 4.627 ( -5.379 -3.132 -0.231) 6.229 4.934 ( -20.533 -1.379 -0.912) 20.600 5.232 ( -5.187 -2.887 5.458) 8.064 5.669 ( -10.492 -0.210 0.473) 10.505 5.963 ( -5.676 0.158 4.260) 7.099 6.756 ( -2.034 5.164 -5.207) 7.611 6.909 ( -0.037 -5.777 -3.177) 6.593 7.566 ( -0.656 3.205 -3.649) 4.901 7.849 ( -22.853 1.010 9.940) 24.942 8.556 ( -8.386 -1.651 14.638) 16.950 9.166 ( -5.564 -3.259 -10.967) 12.722 9.361 ( 4.433 -0.040 3.019) 5.364 9.486 ( -7.360 -0.633 9.957) 12.398 11.160 ( 7.959 3.974 9.272) 12.849 11.439 ( 16.379 14.430 -4.781) 22.346 11.815 ( 11.894 5.580 -13.147) 18.586 12.188 ( 3.199 -11.243 -1.979) 11.855 12.745 ( -7.107 0.048 -4.941) 8.656 12.843 ( -11.121 -0.878 3.550) 11.707 13.041 ( 12.527 -2.201 16.869) 21.127 13.759 ( 11.066 -5.416 -15.345) 19.679 17.188 ( -8.562 -0.029 -3.395) 9.211 18.727 ( 1.518 -1.912 -9.045) 9.368 18.972 ( 9.278 1.408 16.209) 18.730 19.329 ( 2.752 -1.128 4.009) 4.991 20.655 ( -0.178 2.879 -19.698) 19.908 22.456 ( -10.985 -4.995 4.627) 12.924 23.722 ( 10.133 6.036 8.208) 14.369 24.056 ( 4.551 -4.047 3.474) 7.011 ======================= Grid point 441 (218/361) ======================= q-point: (-0.60 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( -6.117 4.908 1.165) 7.929 2.599 ( -13.854 10.001 7.439) 18.636 3.196 ( 2.497 -8.994 -3.859) 10.101 3.368 ( -1.333 -6.551 2.259) 7.057 3.646 ( -3.850 -5.471 -4.682) 8.166 3.930 ( -4.555 4.495 10.956) 12.688 4.397 ( -15.983 6.032 -2.538) 17.271 4.677 ( 3.370 -2.565 1.760) 4.586 4.891 ( -2.742 -13.874 4.065) 14.715 5.299 ( 0.270 -0.902 7.594) 7.652 5.563 ( -9.095 -1.862 5.109) 10.596 5.956 ( -2.071 0.818 4.063) 4.633 6.588 ( -7.643 3.864 -3.482) 9.245 6.852 ( -8.902 -7.571 -6.299) 13.275 7.495 ( 0.032 3.626 -4.996) 6.173 7.617 ( -17.328 -0.509 3.655) 17.717 8.642 ( -5.416 -0.187 13.701) 14.734 9.050 ( -2.711 -5.287 -5.772) 8.284 9.451 ( -7.102 -1.314 9.377) 11.836 9.535 ( 1.716 -1.413 7.432) 7.757 11.168 ( 5.838 22.295 -3.708) 23.344 11.509 ( 10.175 10.106 4.068) 14.907 11.761 ( 10.085 4.945 -13.498) 17.560 12.276 ( 2.787 -8.307 -5.401) 10.293 12.619 ( -8.684 -2.574 0.899) 9.102 12.729 ( -10.218 -2.394 2.852) 10.876 13.409 ( 12.272 1.230 8.557) 15.011 13.830 ( 12.575 -13.278 -13.384) 22.662 17.113 ( -3.791 -1.959 5.174) 6.707 18.633 ( 2.732 -3.524 -15.106) 15.750 19.252 ( 8.122 5.698 11.904) 15.497 19.512 ( 15.064 0.148 4.116) 15.617 20.397 ( -3.493 1.340 -14.236) 14.719 22.367 ( -15.213 -9.136 1.799) 17.837 23.809 ( 5.532 12.135 2.835) 13.635 24.234 ( 1.583 -8.765 6.654) 11.118 ======================= Grid point 442 (219/361) ======================= q-point: (-0.50 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -9.109 11.685 8.573) 17.117 2.408 ( -14.072 14.747 12.766) 24.051 3.272 ( -3.398 -10.879 0.029) 11.397 3.448 ( 3.281 -6.054 -1.623) 7.075 3.611 ( -3.820 -6.516 -0.320) 7.560 3.942 ( -11.498 -7.196 6.018) 14.839 4.185 ( 0.346 10.164 1.692) 10.310 4.733 ( -1.024 -7.673 -0.882) 7.791 5.060 ( -1.082 -11.390 7.443) 13.649 5.418 ( 0.246 1.195 10.935) 11.003 5.605 ( -2.243 -4.826 9.356) 10.764 5.980 ( 1.472 1.449 1.820) 2.753 6.419 ( -11.977 -0.412 2.574) 12.257 6.664 ( -14.215 -9.133 -7.746) 18.587 7.342 ( -4.822 1.790 -6.745) 8.482 7.536 ( -3.625 -2.880 0.920) 4.720 8.738 ( -3.023 1.539 12.498) 12.950 9.006 ( -4.943 -2.761 0.385) 5.675 9.447 ( -12.652 -7.136 8.189) 16.675 9.696 ( 5.836 1.194 7.263) 9.393 10.926 ( 3.624 28.939 -6.581) 29.898 11.588 ( 6.273 6.669 1.392) 9.261 11.678 ( 9.249 8.326 -12.129) 17.378 12.281 ( -0.085 -2.094 -5.281) 5.681 12.556 ( -9.920 -0.670 8.628) 13.164 12.703 ( -0.705 -6.977 -1.994) 7.290 13.537 ( 5.334 4.797 -1.469) 7.322 13.996 ( 10.157 -16.258 -10.587) 21.899 17.264 ( 3.234 -6.956 13.531) 15.554 18.505 ( 4.194 -5.542 -19.771) 20.957 19.347 ( 4.673 11.991 2.232) 13.062 19.811 ( 20.997 1.721 1.370) 21.112 20.218 ( -4.160 -1.332 -4.401) 6.201 22.263 ( -17.186 -12.986 2.896) 21.734 23.771 ( 3.712 11.947 -0.814) 12.537 24.352 ( -5.071 -7.282 2.997) 9.366 ======================= Grid point 443 (220/361) ======================= q-point: (-0.40 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( -8.875 16.650 13.896) 23.432 2.285 ( -11.581 11.886 16.895) 23.682 3.268 ( -8.228 -7.893 -1.336) 11.480 3.505 ( -0.515 -5.532 0.223) 5.561 3.649 ( -0.803 -3.657 4.175) 5.608 3.947 ( -3.195 -14.937 -2.153) 15.425 4.199 ( 6.179 12.320 4.659) 14.549 4.795 ( -0.168 -10.036 -1.064) 10.094 5.220 ( -0.793 -7.541 5.890) 9.602 5.560 ( -1.767 1.395 16.749) 16.899 5.769 ( -1.137 -7.464 10.612) 13.024 6.014 ( 2.424 -0.395 0.956) 2.636 6.352 ( -12.808 -7.606 7.920) 16.871 6.504 ( -5.920 -6.527 -3.120) 9.348 7.192 ( -3.587 -0.028 -7.712) 8.506 7.533 ( -3.275 -5.177 -0.197) 6.129 8.828 ( -2.346 4.223 12.084) 13.014 8.988 ( -6.916 -2.678 8.195) 11.053 9.424 ( -12.847 -10.063 4.623) 16.961 9.810 ( 4.384 6.041 3.591) 8.283 10.636 ( 2.137 26.537 -4.927) 27.075 11.559 ( 7.525 3.537 -14.620) 16.820 11.620 ( 6.370 13.436 0.848) 14.894 12.157 ( -6.660 2.628 -6.740) 9.833 12.579 ( -4.087 -1.161 9.085) 10.029 12.770 ( 4.037 -4.646 0.450) 6.171 13.486 ( -0.032 6.621 -3.151) 7.332 14.098 ( 5.418 -14.905 -13.870) 21.069 17.611 ( 7.817 -10.522 13.855) 19.073 18.400 ( 5.229 -10.789 -18.088) 21.700 19.267 ( 3.962 12.298 -4.616) 13.720 19.949 ( -1.361 -3.590 -5.054) 6.347 20.298 ( 19.003 8.222 5.645) 21.461 22.195 ( -18.108 -16.373 4.836) 24.887 23.698 ( 3.601 9.472 -3.239) 10.638 24.271 ( -12.286 -2.075 -3.441) 12.927 ======================= Grid point 444 (221/361) ======================= q-point: (-0.30 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( -3.415 11.224 14.287) 18.487 2.284 ( -8.750 8.540 21.631) 24.847 3.175 ( -7.411 -5.851 -4.354) 10.398 3.554 ( 0.287 -6.200 -1.868) 6.482 3.744 ( 1.214 -1.484 6.193) 6.483 4.043 ( 1.751 -13.609 -3.514) 14.164 4.208 ( 4.791 10.362 1.239) 11.483 4.845 ( 0.841 -4.710 -3.710) 6.054 5.315 ( -0.398 -1.491 5.739) 5.943 5.725 ( -4.738 2.348 17.833) 18.601 5.963 ( -6.820 -13.975 15.463) 21.930 6.099 ( 4.456 -2.260 2.776) 5.716 6.366 ( -0.778 -6.030 2.546) 6.592 6.577 ( -3.109 -9.153 10.874) 14.550 7.026 ( -5.062 0.538 -9.981) 11.204 7.533 ( -6.436 -8.166 2.415) 10.674 8.887 ( -4.423 7.520 14.660) 17.060 9.064 ( -7.237 -6.452 11.270) 14.867 9.400 ( -6.425 -9.334 1.188) 11.394 9.790 ( 1.611 11.509 0.742) 11.645 10.414 ( 1.069 19.797 -1.575) 19.888 11.437 ( 8.787 14.487 -10.954) 20.176 11.565 ( 3.881 5.363 -8.406) 10.699 11.919 ( -10.306 1.477 -7.406) 12.777 12.658 ( -1.251 0.863 9.064) 9.191 12.900 ( 7.456 -0.527 2.959) 8.039 13.366 ( -3.240 6.734 -2.192) 7.788 14.089 ( 2.271 -13.157 -16.265) 21.043 17.889 ( 8.423 -5.056 -0.684) 9.848 18.443 ( -0.360 -18.468 -4.386) 18.985 19.200 ( 9.971 5.330 -6.421) 13.002 19.825 ( -8.457 -1.039 -5.272) 10.020 20.599 ( 23.950 12.256 7.063) 27.815 22.151 ( -18.484 -18.012 3.762) 26.082 23.634 ( 4.577 6.262 -4.712) 9.075 23.982 ( -16.196 4.826 -7.111) 18.334 ======================= Grid point 445 (222/361) ======================= q-point: (-0.20 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( 2.424 4.178 13.853) 14.671 2.426 ( -1.954 3.997 23.334) 23.755 3.087 ( -2.545 -4.622 -5.680) 7.753 3.549 ( -1.427 -7.378 -7.836) 10.857 3.816 ( -0.360 -1.931 -0.080) 1.966 4.091 ( 0.291 -2.525 -3.929) 4.679 4.232 ( 6.413 2.558 0.863) 6.958 4.793 ( 0.147 3.178 -7.346) 8.005 5.409 ( -0.609 0.213 10.550) 10.570 5.797 ( -7.906 4.995 14.909) 17.599 6.124 ( -5.708 -0.001 11.181) 12.553 6.303 ( 4.842 -13.566 9.527) 17.270 6.500 ( 4.835 -6.202 2.666) 8.304 6.779 ( -5.942 -8.827 13.139) 16.907 6.809 ( -5.279 0.387 -6.283) 8.215 7.582 ( -8.733 -14.895 6.806) 18.559 8.925 ( -6.542 8.975 15.936) 19.424 9.125 ( -7.181 -7.242 6.467) 12.077 9.450 ( -0.252 -3.462 1.084) 3.637 9.738 ( 1.258 8.027 4.462) 9.269 10.253 ( 0.314 13.772 -0.834) 13.801 11.273 ( 5.913 20.388 -6.763) 22.279 11.436 ( 3.343 2.903 -14.463) 15.126 11.719 ( -5.022 -4.068 -7.801) 10.131 12.736 ( -0.981 3.670 8.846) 9.627 13.029 ( 5.760 1.991 2.255) 6.498 13.246 ( -1.208 5.190 -1.887) 5.653 14.022 ( 0.628 -11.130 -15.022) 18.706 17.984 ( 9.343 -2.656 -6.851) 11.886 18.483 ( -8.872 -11.096 -2.275) 14.388 19.275 ( 4.781 -3.634 -4.819) 7.700 19.658 ( -0.954 2.327 -5.260) 5.830 20.912 ( 17.949 8.273 11.345) 22.789 22.067 ( -15.545 -13.917 -2.582) 21.024 23.591 ( -2.327 6.038 -4.916) 8.126 23.636 ( -5.054 5.588 -5.457) 9.304 ======================= Grid point 446 (223/361) ======================= q-point: (-0.10 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( 5.817 -0.613 13.473) 14.688 2.701 ( 4.733 0.077 19.578) 20.142 3.057 ( 2.534 -3.001 -4.438) 5.926 3.475 ( -2.515 -8.309 -9.949) 13.204 3.750 ( -1.586 -0.232 -9.088) 9.228 4.036 ( -1.729 0.602 -5.015) 5.339 4.309 ( 3.990 2.620 1.124) 4.903 4.641 ( 0.108 8.310 -6.262) 10.406 5.535 ( -3.272 -0.422 12.599) 13.023 5.796 ( -10.923 5.577 14.370) 18.892 6.122 ( -3.297 1.631 0.822) 3.769 6.447 ( -6.856 -0.876 -2.232) 7.264 6.639 ( 2.544 -5.055 -0.369) 5.671 6.711 ( 2.893 -3.212 2.793) 5.146 7.045 ( -4.632 -8.031 27.267) 28.800 7.726 ( -9.189 -24.144 7.555) 26.916 8.932 ( -8.389 10.695 15.614) 20.702 9.188 ( -2.451 -6.698 4.437) 8.400 9.373 ( -5.215 7.162 -3.156) 9.404 9.807 ( 3.710 2.211 8.010) 9.100 10.209 ( 3.967 3.982 0.938) 5.698 11.078 ( -2.649 10.057 -5.544) 11.786 11.315 ( 10.289 7.480 -9.148) 15.669 11.668 ( 6.383 -5.123 -10.080) 12.984 12.752 ( -2.791 8.406 5.886) 10.635 13.056 ( -4.176 -2.708 2.415) 5.532 13.221 ( 7.257 6.141 -3.221) 10.037 13.955 ( 0.690 -7.971 -11.235) 13.793 18.062 ( 8.118 -2.601 -4.419) 9.602 18.352 ( -7.863 -2.874 -9.566) 12.712 19.159 ( -12.162 1.507 -1.349) 12.329 19.676 ( 4.661 -0.724 -1.867) 5.074 21.213 ( 4.485 -5.390 11.722) 13.659 21.926 ( -1.070 0.347 -7.843) 7.923 23.352 ( -6.734 6.584 -2.105) 9.650 23.644 ( 7.583 0.412 -3.611) 8.409 ======================= Grid point 450 (224/361) ======================= q-point: ( 0.30 -0.70 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( -0.567 -0.000 -0.568) 0.803 2.703 ( -10.304 -0.000 7.350) 12.657 3.106 ( -0.414 -0.000 -4.876) 4.893 3.290 ( -3.092 -0.000 3.437) 4.623 3.591 ( -3.618 -0.000 -5.248) 6.374 3.964 ( -10.638 -0.000 9.780) 14.450 4.563 ( -0.671 -0.000 -3.926) 3.983 4.579 ( -14.017 -0.000 -0.828) 14.041 4.739 ( 3.037 0.000 9.136) 9.628 5.293 ( -0.129 -0.000 10.065) 10.066 5.546 ( -10.074 -0.000 4.453) 11.014 5.964 ( -1.941 -0.000 4.369) 4.780 6.644 ( -5.390 -0.000 -7.743) 9.435 6.759 ( -12.521 -0.000 -3.124) 12.905 7.533 ( 0.889 0.000 -4.695) 4.778 7.610 ( -19.724 -0.000 2.082) 19.834 8.641 ( -6.715 -0.000 16.470) 17.787 8.984 ( -1.051 -0.000 -7.880) 7.949 9.472 ( -12.432 -0.000 11.221) 16.747 9.505 ( 7.367 0.000 6.128) 9.583 11.359 ( 5.589 0.000 3.087) 6.385 11.634 ( 11.945 0.000 -7.662) 14.191 11.881 ( 15.923 0.000 -13.840) 21.097 12.113 ( -2.472 -0.000 0.615) 2.548 12.581 ( -5.429 -0.000 -3.666) 6.551 12.720 ( -14.804 -0.000 7.047) 16.395 13.424 ( 13.845 0.000 12.199) 18.453 13.698 ( 12.105 0.000 -16.760) 20.675 17.095 ( -4.539 -0.000 4.100) 6.117 18.600 ( 2.995 0.000 -15.545) 15.831 19.307 ( 8.512 0.000 15.029) 17.272 19.513 ( 15.974 0.000 4.419) 16.574 20.407 ( -3.911 -0.000 -17.398) 17.832 22.284 ( -15.023 -0.000 2.033) 15.160 23.977 ( 3.623 0.000 9.808) 10.456 24.098 ( 2.436 0.000 0.555) 2.499 ======================= Grid point 452 (225/361) ======================= q-point: (-0.60 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.450 ( -4.081 6.224 7.299) 10.425 2.655 ( -7.704 9.727 11.700) 17.054 3.093 ( -1.754 -6.975 -0.777) 7.234 3.316 ( -1.892 -6.643 0.866) 6.961 3.513 ( -0.387 -3.317 -4.470) 5.580 3.843 ( -15.807 -2.758 3.420) 16.406 4.402 ( 0.747 11.633 2.825) 11.995 4.585 ( -4.339 -8.912 0.827) 9.947 4.919 ( 2.018 -3.777 9.565) 10.480 5.425 ( -6.573 -0.320 17.530) 18.724 5.539 ( -0.059 -1.882 5.929) 6.220 6.007 ( 1.877 1.048 3.032) 3.717 6.434 ( -15.119 2.383 -1.820) 15.413 6.516 ( -14.277 -6.726 -6.152) 16.938 7.381 ( -8.816 1.778 -4.568) 10.087 7.490 ( 0.202 -1.810 -5.020) 5.340 8.745 ( -6.682 0.136 15.535) 16.912 8.933 ( 0.247 -3.519 -3.193) 4.758 9.410 ( -15.362 0.588 11.859) 19.416 9.706 ( 7.516 0.107 8.461) 11.318 11.342 ( 4.476 13.931 -7.635) 16.505 11.634 ( 5.440 0.827 -9.847) 11.280 11.883 ( 10.708 13.224 -4.086) 17.500 12.162 ( 2.193 -11.855 -4.513) 12.873 12.533 ( -2.483 -0.630 2.950) 3.907 12.623 ( -10.676 -1.975 7.019) 12.928 13.616 ( 7.989 4.856 -4.712) 10.469 13.749 ( 9.207 -10.466 -5.915) 15.142 17.179 ( 1.799 -2.373 11.564) 11.941 18.432 ( 3.506 -2.219 -20.841) 21.250 19.526 ( 4.988 6.282 7.874) 11.240 19.829 ( 19.645 0.327 -0.029) 19.648 20.178 ( -1.080 -2.056 -9.059) 9.352 22.110 ( -16.350 -4.171 3.207) 17.176 23.987 ( -0.328 11.795 2.020) 11.971 24.192 ( -2.805 -10.199 2.299) 10.824 ======================= Grid point 453 (226/361) ======================= q-point: (-0.50 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -8.983 10.271 11.078) 17.576 2.578 ( -6.382 18.461 12.684) 23.290 3.114 ( -6.701 -8.586 0.670) 10.912 3.351 ( -5.338 -12.226 0.494) 13.350 3.537 ( 4.835 -7.107 -4.849) 9.869 3.779 ( -2.726 -3.294 4.121) 5.938 4.421 ( 8.411 9.578 1.900) 12.888 4.616 ( -4.764 -7.435 3.741) 9.590 5.095 ( 0.020 -5.329 10.617) 11.879 5.558 ( -11.227 -3.173 22.921) 25.719 5.671 ( 2.793 -1.836 6.449) 7.264 6.038 ( -0.321 2.930 1.212) 3.188 6.229 ( -13.361 -6.289 5.065) 15.612 6.385 ( -4.697 -5.819 -2.919) 8.028 7.205 ( -4.492 1.038 -7.528) 8.828 7.458 ( 0.872 -2.986 -5.314) 6.158 8.825 ( -7.502 -1.310 13.305) 15.331 8.958 ( -0.713 -2.852 2.726) 4.009 9.334 ( -15.935 -0.618 11.992) 19.953 9.890 ( 6.071 2.889 7.305) 9.928 11.094 ( 2.775 22.143 -12.112) 25.392 11.559 ( 4.950 -0.311 -12.861) 13.784 11.866 ( 2.864 10.396 1.858) 10.942 12.183 ( 3.347 -1.261 -11.355) 11.905 12.537 ( -7.667 -1.586 10.478) 13.081 12.696 ( 4.865 -3.771 5.472) 8.236 13.576 ( 3.358 3.440 -7.488) 8.898 13.854 ( 2.217 -11.048 -7.082) 13.309 17.458 ( 7.325 -6.107 15.856) 18.503 18.249 ( 3.558 -5.790 -21.754) 22.790 19.494 ( 0.795 12.405 -4.639) 13.268 19.858 ( -4.942 -6.580 -6.009) 10.189 20.401 ( 27.405 3.462 4.548) 27.995 21.985 ( -16.355 -7.316 5.236) 18.666 23.875 ( -1.137 9.933 -1.813) 10.161 24.190 ( -9.198 -6.552 -1.836) 11.441 ======================= Grid point 454 (227/361) ======================= q-point: (-0.40 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( -8.397 9.871 11.180) 17.115 2.502 ( -4.709 15.502 14.590) 21.803 3.063 ( -7.591 -6.385 -2.171) 10.154 3.414 ( -2.424 -10.481 -0.326) 10.762 3.632 ( 6.129 -9.716 -5.739) 12.842 3.887 ( 1.441 -3.134 8.306) 8.994 4.417 ( 3.497 11.716 -0.688) 12.246 4.712 ( 4.372 -8.989 -1.232) 10.072 5.271 ( -0.210 -3.225 11.362) 11.813 5.725 ( -12.466 -9.327 23.357) 28.071 5.781 ( -2.299 1.096 12.300) 12.561 6.056 ( 0.906 -1.976 4.079) 4.622 6.272 ( 0.701 -4.424 4.443) 6.309 6.416 ( -2.484 -8.385 5.335) 10.244 7.035 ( -4.993 0.379 -9.246) 10.515 7.431 ( -0.460 -3.366 -4.354) 5.523 8.892 ( -8.314 -4.040 11.994) 15.143 9.029 ( -3.006 -0.400 10.321) 10.757 9.278 ( -11.589 -2.809 9.051) 14.971 9.983 ( 4.140 8.380 4.032) 10.179 10.783 ( 1.122 20.318 -10.426) 22.865 11.484 ( 6.804 -0.839 -13.466) 15.110 11.797 ( -2.427 9.308 0.223) 9.621 11.995 ( -0.810 8.598 -14.632) 16.991 12.617 ( -3.281 -4.434 9.074) 10.619 12.907 ( 10.371 0.635 7.721) 12.945 13.471 ( -2.930 4.724 -3.890) 6.785 13.850 ( -0.743 -12.513 -11.721) 17.161 17.802 ( 9.052 -4.437 8.303) 13.060 18.160 ( 2.887 -12.432 -10.049) 16.244 19.307 ( 0.382 6.274 -10.058) 11.860 19.770 ( -6.215 -4.330 -4.115) 8.620 20.807 ( 28.603 10.021 5.178) 30.747 21.899 ( -15.650 -10.169 4.442) 19.185 23.752 ( -0.251 6.663 -3.845) 7.697 24.013 ( -13.173 -0.933 -5.917) 14.471 ======================= Grid point 455 (228/361) ======================= q-point: (-0.30 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( -0.136 6.391 11.393) 13.064 2.538 ( -2.139 8.226 17.097) 19.093 3.004 ( -2.258 -4.436 -3.096) 5.862 3.416 ( -3.850 -7.691 -5.680) 10.308 3.715 ( 5.018 -7.834 -7.480) 11.937 4.011 ( -4.368 -4.409 6.624) 9.078 4.359 ( 6.723 8.401 -2.614) 11.074 4.804 ( 6.282 -1.713 -5.556) 8.559 5.417 ( -1.307 0.139 12.607) 12.676 5.877 ( -5.425 2.848 14.053) 15.331 6.011 ( -2.935 -13.456 24.365) 27.988 6.138 ( -0.821 -1.485 4.241) 4.567 6.408 ( 4.350 -4.234 5.082) 7.917 6.578 ( -2.163 -11.927 11.113) 16.445 6.825 ( -7.193 0.587 -9.705) 12.094 7.404 ( -2.969 -5.019 -2.005) 6.167 8.960 ( -8.348 -5.870 11.526) 15.395 9.079 ( -11.112 3.456 15.023) 19.003 9.321 ( -0.369 -6.964 4.241) 8.162 9.970 ( 3.491 13.405 2.754) 14.123 10.524 ( -0.702 15.119 -6.620) 16.520 11.418 ( 4.158 0.814 -12.981) 13.654 11.638 ( -5.745 6.846 -3.393) 9.560 11.728 ( 5.568 12.361 -15.000) 20.219 12.722 ( -2.156 -4.246 7.708) 9.060 13.110 ( 6.203 5.861 6.865) 10.953 13.341 ( -2.103 5.012 -1.129) 5.552 13.797 ( -0.915 -13.306 -12.907) 18.561 17.938 ( 8.410 -2.239 -5.687) 10.396 18.291 ( -1.917 -10.053 5.393) 11.568 19.196 ( 1.370 -4.465 -9.088) 10.218 19.671 ( -1.229 -0.577 -5.660) 5.821 21.104 ( 14.055 12.313 8.584) 20.563 21.852 ( -5.535 -10.120 -0.864) 11.567 23.666 ( 1.263 3.391 -4.025) 5.412 23.731 ( -12.182 3.738 -6.898) 14.490 ======================= Grid point 456 (229/361) ======================= q-point: (-0.20 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.434 ( 1.449 1.996 12.558) 12.798 2.720 ( 6.824 1.714 13.983) 15.653 3.013 ( 2.938 -1.596 -0.783) 3.434 3.330 ( -4.155 -7.372 -8.628) 12.085 3.715 ( 3.428 -3.105 -10.273) 11.266 3.992 ( -9.153 -5.266 0.600) 10.577 4.400 ( 9.132 6.097 -1.029) 11.028 4.769 ( 3.214 5.808 -6.880) 9.560 5.546 ( -2.607 0.870 13.105) 13.390 5.896 ( -10.404 5.447 13.147) 17.628 6.137 ( -3.523 -1.134 -0.297) 3.713 6.378 ( -1.601 -7.290 10.376) 12.781 6.544 ( 1.187 -3.825 3.294) 5.185 6.649 ( -0.331 -3.163 0.583) 3.234 6.863 ( -0.876 -12.666 19.733) 23.465 7.396 ( -5.365 -10.714 -0.470) 11.991 9.050 ( -10.036 -7.832 12.185) 17.622 9.066 ( -6.365 4.835 12.699) 15.005 9.400 ( -3.367 -3.037 1.179) 4.685 9.944 ( 3.512 11.508 3.837) 12.629 10.348 ( 1.901 9.675 -2.534) 10.180 11.183 ( -11.690 4.223 -11.139) 16.691 11.524 ( 9.600 9.104 -6.668) 14.816 11.626 ( 12.624 4.636 -11.011) 17.381 12.815 ( -2.266 -2.604 7.027) 7.829 13.059 ( -9.526 3.757 1.809) 10.399 13.352 ( 7.689 8.011 -0.664) 11.124 13.779 ( 2.613 -11.133 -8.846) 14.458 18.015 ( 6.255 -2.268 -1.870) 6.911 18.309 ( -4.520 -1.808 -3.248) 5.852 19.132 ( -6.301 -4.604 -4.709) 9.115 19.657 ( 6.286 -1.387 -4.282) 7.731 21.152 ( -11.722 -0.721 6.578) 13.461 21.950 ( 16.815 2.201 -2.058) 17.083 23.463 ( -8.284 5.377 -4.413) 10.817 23.650 ( 4.261 0.153 -3.256) 5.365 ======================= Grid point 457 (230/361) ======================= q-point: (-0.10 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.588 ( -2.958 -4.312 11.415) 12.556 2.978 ( 13.228 1.875 2.691) 13.629 3.101 ( 5.226 -1.201 5.447) 7.644 3.263 ( -1.500 -8.271 -5.461) 10.024 3.628 ( 1.292 1.629 -9.813) 10.031 3.891 ( -7.484 -3.647 -3.903) 9.195 4.412 ( 5.998 8.539 -5.086) 11.608 4.698 ( 2.915 5.616 -0.191) 6.330 5.608 ( -8.848 3.148 10.657) 14.204 5.797 ( -15.229 3.560 6.851) 17.075 6.061 ( -5.315 1.125 -1.244) 5.574 6.280 ( -9.321 -0.333 -3.042) 9.810 6.647 ( 2.670 -2.483 0.506) 3.681 6.793 ( 4.022 -1.798 5.034) 6.690 7.292 ( 1.521 -11.395 28.668) 30.887 7.454 ( -5.249 -19.310 -0.286) 20.013 9.039 ( -13.110 6.457 12.102) 18.974 9.169 ( -3.938 -4.781 9.667) 11.482 9.297 ( -5.365 2.401 -1.584) 6.087 9.952 ( 2.697 4.615 0.227) 5.350 10.384 ( 7.967 3.866 5.132) 10.235 10.851 ( -10.430 -0.892 -9.872) 14.389 11.582 ( 16.210 6.273 -3.712) 17.774 11.681 ( 15.816 3.075 -7.010) 17.571 12.828 ( -3.528 7.536 2.365) 8.650 12.958 ( -9.654 -6.511 5.516) 12.885 13.313 ( 1.364 6.091 -5.162) 8.100 13.841 ( 7.770 -3.246 -5.468) 10.040 18.013 ( -6.842 -0.028 -8.105) 10.607 18.233 ( 5.690 0.162 -2.090) 6.064 19.014 ( -6.875 1.042 -0.217) 6.957 19.677 ( -3.131 1.383 0.461) 3.454 21.032 ( -12.148 -13.421 -6.050) 19.087 22.191 ( 21.034 11.333 6.155) 24.673 23.304 ( -2.126 3.320 -3.056) 4.988 23.706 ( 6.023 -1.607 -0.716) 6.275 ======================= Grid point 462 (231/361) ======================= q-point: ( 0.40 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( -7.748 -0.000 8.918) 11.813 2.811 ( -0.103 -0.000 12.860) 12.860 3.021 ( -6.162 -0.000 2.716) 6.733 3.162 ( -12.549 -0.000 -1.676) 12.660 3.471 ( 5.887 0.000 -6.589) 8.836 3.761 ( -0.719 -0.000 5.814) 5.858 4.461 ( 3.858 0.000 -2.283) 4.483 4.598 ( -0.969 -0.000 7.351) 7.414 5.046 ( -0.096 -0.000 12.069) 12.070 5.507 ( -14.505 -0.000 22.564) 26.824 5.668 ( 4.198 0.000 8.283) 9.286 6.097 ( 4.964 0.000 2.497) 5.556 6.140 ( -19.770 -0.000 2.683) 19.951 6.327 ( -4.848 -0.000 -2.582) 5.492 7.216 ( -5.986 -0.000 -6.933) 9.159 7.431 ( 3.994 0.000 -8.060) 8.996 8.816 ( -10.381 -0.000 15.254) 18.451 8.919 ( 1.647 0.000 1.170) 2.020 9.339 ( -16.183 -0.000 12.751) 20.603 9.916 ( 6.458 0.000 8.692) 10.829 11.322 ( 3.761 0.000 -16.230) 16.660 11.555 ( 4.216 0.000 -12.692) 13.374 11.990 ( -10.046 -0.000 3.307) 10.577 12.114 ( 16.722 0.000 -9.928) 19.447 12.552 ( -11.592 -0.000 10.393) 15.569 12.642 ( 8.426 0.000 5.956) 10.318 13.611 ( 9.673 0.000 -15.925) 18.632 13.744 ( -3.795 -0.000 2.493) 4.541 17.402 ( 7.158 0.000 15.933) 17.466 18.197 ( 3.220 0.000 -22.605) 22.833 19.671 ( 1.382 0.000 2.674) 3.010 19.737 ( -8.687 -0.000 -13.648) 16.178 20.431 ( 31.094 0.000 3.941) 31.343 21.921 ( -15.722 -0.000 5.474) 16.647 24.040 ( -8.721 -0.000 2.365) 9.036 24.054 ( -2.337 -0.000 -4.980) 5.501 ======================= Grid point 464 (232/361) ======================= q-point: (-0.50 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( -8.276 5.650 7.602) 12.578 2.811 ( -4.445 18.058 7.847) 20.185 2.963 ( -6.699 -3.605 0.244) 7.612 3.153 ( -2.622 -17.604 2.956) 18.042 3.506 ( 7.254 -3.416 -5.705) 9.841 3.870 ( -0.072 -0.016 9.539) 9.540 4.572 ( 11.640 -2.251 -2.627) 12.143 4.587 ( -1.700 3.061 -1.062) 3.658 5.221 ( -0.997 -1.716 15.840) 15.963 5.579 ( -13.334 -4.911 18.757) 23.532 5.823 ( -3.070 1.777 17.508) 17.864 6.036 ( -3.738 -0.399 6.675) 7.661 6.214 ( 4.520 -1.776 3.463) 5.964 6.298 ( -2.010 -3.955 2.786) 5.239 7.038 ( -5.830 0.023 -8.900) 10.639 7.400 ( 5.224 -0.532 -8.518) 10.007 8.837 ( -13.900 -1.651 15.823) 21.126 9.001 ( 2.620 -1.501 5.586) 6.350 9.273 ( -14.482 0.599 12.216) 18.956 10.080 ( 4.685 2.597 6.851) 8.697 11.079 ( 1.694 10.236 -19.764) 22.322 11.470 ( 5.832 -0.662 -12.784) 14.067 11.865 ( -11.001 0.912 1.464) 11.135 12.153 ( 10.316 5.208 -13.835) 18.026 12.550 ( -7.990 -1.810 11.718) 14.298 12.904 ( 14.340 -0.778 8.088) 16.482 13.534 ( 2.736 2.283 -9.662) 10.298 13.676 ( -8.181 -5.839 -3.067) 10.509 17.740 ( 9.759 -2.014 16.071) 18.910 18.011 ( 3.905 -4.104 -16.661) 17.597 19.406 ( -9.223 3.852 -12.504) 16.008 19.694 ( -1.302 -3.211 -2.906) 4.522 20.935 ( 34.508 3.793 3.681) 34.910 21.780 ( -16.086 -3.241 4.775) 17.090 23.867 ( -5.580 5.958 -3.334) 8.818 23.963 ( -9.075 -4.232 -5.060) 11.219 ======================= Grid point 465 (233/361) ======================= q-point: (-0.40 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.432 ( 0.879 6.611 7.898) 10.337 2.706 ( -6.473 9.713 9.264) 14.902 2.935 ( -0.218 -2.951 -0.456) 2.994 3.266 ( -2.318 -8.823 -1.347) 9.222 3.587 ( 8.085 -5.438 -5.675) 11.276 3.940 ( -9.865 -3.363 8.894) 13.701 4.492 ( 6.207 5.896 -7.468) 11.361 4.750 ( 11.217 -3.556 -3.150) 12.182 5.405 ( -2.282 -1.297 14.988) 15.216 5.741 ( -2.859 -10.239 15.358) 18.679 5.979 ( -7.085 3.518 22.864) 24.193 6.124 ( 0.403 -0.364 9.092) 9.108 6.343 ( 2.433 -3.056 6.575) 7.648 6.396 ( 0.628 -7.447 5.538) 9.302 6.830 ( -7.705 0.048 -9.445) 12.189 7.370 ( 4.227 0.039 -7.911) 8.969 8.859 ( -15.672 -4.415 17.777) 24.106 9.123 ( -2.518 0.921 10.392) 10.732 9.238 ( -6.458 -2.269 7.684) 10.290 10.159 ( 3.109 7.164 4.111) 8.825 10.763 ( -0.404 10.446 -16.617) 19.631 11.419 ( 7.019 -0.316 -11.939) 13.853 11.685 ( -11.314 2.299 -2.430) 11.798 12.008 ( 9.260 12.954 -15.977) 22.557 12.628 ( -5.167 -5.042 9.873) 12.231 13.197 ( 10.848 3.170 7.036) 13.313 13.416 ( -4.061 3.105 0.379) 5.126 13.578 ( -4.083 -9.893 -9.743) 14.473 17.910 ( 7.068 -0.837 -5.976) 9.294 18.135 ( 5.245 -6.842 11.608) 14.459 19.133 ( -6.542 -2.344 -11.591) 13.515 19.652 ( 1.063 -1.080 -5.769) 5.965 21.327 ( 14.549 11.914 4.998) 19.457 21.690 ( 0.009 -8.445 -0.042) 8.445 23.720 ( -3.162 2.586 -3.905) 5.651 23.767 ( -10.250 0.518 -6.426) 12.109 ======================= Grid point 466 (234/361) ======================= q-point: (-0.30 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.511 ( 0.438 6.444 8.901) 10.998 2.746 ( 5.068 0.727 9.728) 10.993 2.993 ( 3.365 -1.385 2.059) 4.181 3.230 ( -1.362 -3.048 -6.515) 7.320 3.660 ( 6.673 -2.598 -6.854) 9.913 3.869 ( -15.677 -7.619 3.325) 17.744 4.497 ( 10.395 4.371 -4.972) 12.324 4.839 ( 7.802 1.640 -6.371) 10.206 5.543 ( -3.806 -1.344 13.011) 13.622 5.926 ( -4.759 -6.553 5.255) 9.654 6.088 ( -7.370 1.516 13.798) 15.716 6.298 ( 1.330 -0.517 14.897) 14.965 6.492 ( -1.347 -3.314 5.513) 6.572 6.560 ( 1.291 -8.616 2.940) 9.195 6.666 ( -2.016 -4.987 6.614) 8.525 7.322 ( 1.843 0.229 -6.603) 6.859 8.914 ( -16.007 -6.623 19.367) 25.984 9.133 ( -7.882 2.717 10.347) 13.288 9.331 ( 0.508 -3.678 4.727) 6.011 10.145 ( 1.295 9.713 1.547) 9.920 10.498 ( -1.588 6.006 -11.684) 13.233 11.287 ( -7.371 7.453 -7.407) 12.835 11.550 ( 6.276 -0.288 -8.044) 10.207 11.855 ( 12.848 13.527 -13.020) 22.750 12.719 ( -4.979 -6.226 8.101) 11.366 13.137 ( -12.382 3.910 1.891) 13.121 13.459 ( -0.160 -0.069 -5.469) 5.472 13.602 ( 12.048 -4.646 1.659) 13.019 17.985 ( 6.255 -1.140 1.023) 6.440 18.285 ( -2.412 -0.938 1.228) 2.865 19.016 ( -2.038 -7.214 -4.902) 8.957 19.632 ( 6.207 -1.276 -6.592) 9.144 21.180 ( -19.529 2.970 -0.365) 19.757 21.995 ( 28.448 2.497 1.398) 28.592 23.541 ( -8.350 3.397 -5.094) 10.355 23.647 ( -0.021 -0.576 -2.737) 2.797 ======================= Grid point 467 (235/361) ======================= q-point: (-0.20 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( -8.324 -0.588 10.926) 13.748 3.009 ( 16.690 1.472 4.458) 17.338 3.083 ( 0.584 -2.870 5.256) 6.017 3.171 ( 3.833 0.216 -7.114) 8.083 3.642 ( 4.001 -0.390 -9.583) 10.392 3.778 ( -11.121 -7.819 2.204) 13.772 4.536 ( 8.602 4.672 -5.255) 11.110 4.799 ( 2.937 5.582 -5.106) 8.116 5.634 ( -5.925 -1.323 10.041) 11.733 5.853 ( -13.635 1.068 1.207) 13.730 6.083 ( -7.975 2.488 6.713) 10.717 6.270 ( -9.352 -0.532 -3.107) 9.869 6.579 ( 0.582 -4.960 6.419) 8.133 6.720 ( 4.383 -6.565 4.726) 9.200 7.045 ( 7.666 -12.002 18.837) 23.615 7.283 ( 1.228 -2.154 -0.963) 2.660 8.985 ( -15.272 -7.356 16.980) 23.993 9.157 ( -4.742 0.603 10.801) 11.812 9.352 ( -5.475 2.764 2.153) 6.500 10.077 ( 0.732 8.055 -1.060) 8.157 10.357 ( 0.089 -4.454 -7.620) 8.827 10.985 ( -9.729 13.384 -2.941) 16.806 11.602 ( 14.400 -0.651 -10.899) 18.071 11.842 ( 17.003 10.542 -4.890) 20.595 12.793 ( -7.633 -7.884 7.890) 13.516 12.964 ( -9.160 4.244 1.727) 10.242 13.356 ( -3.842 -2.217 -7.023) 8.307 13.833 ( 14.588 2.829 1.723) 14.959 18.029 ( -5.853 1.776 -4.975) 7.884 18.224 ( 3.366 -1.207 -0.478) 3.608 19.020 ( -0.546 -0.447 0.400) 0.811 19.679 ( 4.335 -1.294 -2.451) 5.145 20.856 ( -18.566 -5.921 -7.606) 20.919 22.374 ( 26.545 8.748 4.798) 28.358 23.365 ( -4.343 3.477 -3.897) 6.792 23.667 ( 2.755 -2.775 0.540) 3.947 ======================= Grid point 468 (236/361) ======================= q-point: (-0.10 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( -13.244 -5.796 11.419) 18.423 3.068 ( -1.621 1.144 -4.902) 5.289 3.186 ( 1.870 -5.257 0.912) 5.653 3.299 ( 13.912 1.433 1.801) 14.101 3.573 ( 1.537 1.154 -6.396) 6.679 3.766 ( 0.368 -2.215 1.523) 2.713 4.515 ( 8.997 8.357 -7.509) 14.393 4.754 ( -1.422 0.716 1.178) 1.981 5.579 ( -16.431 7.722 -0.334) 18.158 5.626 ( -11.976 -1.609 4.083) 12.755 5.994 ( -8.645 4.031 2.923) 9.977 6.132 ( -8.943 -0.700 0.467) 8.983 6.661 ( 1.141 -2.292 -0.020) 2.561 6.887 ( 3.200 -4.240 5.402) 7.576 7.243 ( 3.533 -11.093 -5.502) 12.877 7.571 ( 4.007 -8.404 20.900) 22.880 8.981 ( -16.551 0.209 9.769) 19.220 9.213 ( -9.507 3.765 10.944) 14.977 9.256 ( -1.124 -1.660 2.987) 3.598 9.970 ( -3.722 6.929 -5.138) 9.395 10.394 ( 3.018 -17.246 -5.451) 18.337 10.805 ( 0.480 11.952 5.861) 13.321 11.667 ( 14.719 -1.283 -13.401) 19.948 12.020 ( 19.921 7.230 3.133) 21.423 12.811 ( -10.598 -4.545 5.078) 12.599 12.876 ( -3.713 2.341 4.902) 6.580 13.228 ( -5.070 -0.241 -5.404) 7.414 13.982 ( 13.692 7.332 -2.804) 15.783 17.731 ( -11.337 1.011 -15.045) 18.865 18.382 ( 7.240 0.084 8.813) 11.406 19.002 ( 0.998 5.383 -0.315) 5.483 19.632 ( -9.925 4.698 2.499) 11.262 20.653 ( -3.996 -15.138 -14.328) 21.223 22.678 ( 16.719 12.728 9.458) 23.043 23.269 ( 1.681 0.150 -5.156) 5.426 23.784 ( 5.275 -2.787 4.881) 7.708 ======================= Grid point 474 (237/361) ======================= q-point: (-0.50 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.500 ( 1.033 -0.000 6.525) 6.606 2.820 ( -8.893 -0.000 1.269) 8.983 2.911 ( -1.660 -0.000 0.451) 1.721 3.155 ( 3.210 -0.000 5.554) 6.415 3.537 ( 8.252 -0.000 -4.281) 9.297 3.906 ( -12.264 -0.000 8.936) 15.174 4.552 ( 7.074 0.000 -11.034) 13.107 4.709 ( 11.073 -0.000 -0.467) 11.082 5.389 ( -2.703 -0.000 15.993) 16.220 5.644 ( -3.492 -0.000 15.298) 15.691 6.017 ( -7.233 -0.000 23.531) 24.617 6.122 ( 1.007 -0.000 10.586) 10.633 6.308 ( -0.464 -0.000 6.585) 6.601 6.330 ( 4.625 -0.000 3.094) 5.565 6.829 ( -7.808 -0.000 -9.233) 12.092 7.374 ( 7.229 -0.000 -10.246) 12.540 8.817 ( -18.378 -0.000 20.345) 27.417 9.126 ( 3.932 -0.000 7.525) 8.490 9.223 ( -12.396 -0.000 10.022) 15.941 10.223 ( 2.999 -0.000 5.116) 5.930 10.863 ( -0.773 -0.000 -22.392) 22.406 11.415 ( 7.983 -0.000 -11.030) 13.616 11.712 ( -10.616 -0.000 -1.377) 10.705 12.130 ( 9.017 0.000 -16.900) 19.155 12.578 ( -7.158 -0.000 12.118) 14.074 13.221 ( 17.092 0.000 4.683) 17.722 13.447 ( -17.277 -0.000 0.723) 17.292 13.482 ( 2.994 0.000 -6.144) 6.835 17.904 ( 5.836 -0.000 -7.518) 9.517 18.068 ( 8.707 -0.000 15.111) 17.440 19.112 ( -10.165 -0.000 -12.282) 15.943 19.641 ( 2.327 -0.000 -5.940) 6.379 21.497 ( 36.033 -0.000 3.165) 36.171 21.555 ( -19.013 0.000 0.572) 19.021 23.754 ( -8.708 -0.000 -2.300) 9.007 23.760 ( -5.647 0.000 -7.673) 9.527 ======================= Grid point 476 (238/361) ======================= q-point: (-0.40 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.644 ( 2.794 7.224 5.798) 9.675 2.736 ( 0.166 -2.184 6.561) 6.917 2.948 ( 2.434 -2.674 1.627) 3.965 3.218 ( 5.010 0.533 -3.713) 6.259 3.632 ( 8.074 -0.542 -1.555) 8.241 3.755 ( -20.274 -3.908 3.520) 20.945 4.552 ( 10.496 1.700 -8.073) 13.351 4.834 ( 8.863 -1.197 -3.900) 9.757 5.516 ( -4.485 -1.002 12.013) 12.862 5.785 ( -2.091 -5.093 6.775) 8.730 6.157 ( -6.958 3.030 17.478) 19.055 6.317 ( 1.040 1.907 14.027) 14.194 6.393 ( -2.111 -4.942 7.813) 9.483 6.460 ( 4.917 -2.606 4.290) 7.026 6.633 ( -5.215 -0.509 -1.177) 5.370 7.343 ( 6.891 1.095 -10.474) 12.585 8.828 ( -20.795 -2.605 24.431) 32.188 9.169 ( -8.931 1.252 8.087) 12.114 9.280 ( 2.528 -1.751 7.338) 7.957 10.270 ( 0.093 3.786 1.413) 4.042 10.560 ( -4.160 1.331 -19.124) 19.617 11.412 ( 7.154 4.718 -7.600) 11.455 11.549 ( -4.045 0.115 -4.155) 5.800 12.029 ( 11.288 5.031 -16.866) 20.910 12.635 ( -6.692 -2.477 10.342) 12.565 13.195 ( -15.785 2.575 1.906) 16.107 13.345 ( -0.302 -6.496 -8.964) 11.074 13.629 ( 14.295 2.282 8.850) 16.967 17.972 ( 6.876 -0.303 2.866) 7.456 18.274 ( -1.118 -0.315 3.996) 4.161 18.914 ( -0.989 -3.260 -5.037) 6.081 19.615 ( 5.978 -0.519 -7.774) 9.820 21.228 ( -21.694 1.705 -5.279) 22.393 22.029 ( 34.171 1.089 2.957) 34.316 23.589 ( -6.476 1.911 -5.095) 8.458 23.630 ( -4.584 -1.145 -2.189) 5.207 ======================= Grid point 477 (239/361) ======================= q-point: (-0.30 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.560 ( -13.930 1.865 9.109) 16.748 3.014 ( 11.894 -1.544 0.725) 12.015 3.039 ( 8.671 -0.292 7.267) 11.317 3.231 ( 7.601 4.539 -6.649) 11.072 3.556 ( -10.567 -8.481 -3.221) 13.927 3.710 ( 0.894 0.703 1.960) 2.266 4.591 ( 8.672 2.057 -5.893) 10.685 4.868 ( 4.884 1.401 -6.399) 8.171 5.578 ( -7.185 -3.471 8.465) 11.633 5.799 ( -8.925 -5.040 0.597) 10.267 6.180 ( -9.256 6.908 12.028) 16.676 6.268 ( -9.105 0.225 -3.803) 9.870 6.480 ( -3.098 -6.031 8.790) 11.101 6.602 ( 6.435 -4.635 0.797) 7.970 6.906 ( 11.621 -4.521 20.491) 23.986 7.297 ( 5.830 2.204 -8.364) 10.431 8.866 ( -21.339 -5.108 24.044) 32.551 9.158 ( -5.918 -0.287 8.279) 10.181 9.386 ( -1.137 1.144 6.488) 6.685 10.200 ( -1.903 4.852 -4.709) 7.024 10.288 ( -5.515 -2.552 -12.586) 13.977 11.248 ( -6.001 14.178 -0.809) 15.417 11.580 ( 13.612 -2.176 -10.233) 17.168 11.997 ( 15.411 5.782 -9.620) 19.065 12.672 ( -9.226 -4.668 8.671) 13.494 13.018 ( -10.803 1.835 3.942) 11.646 13.265 ( -3.815 -6.064 -7.536) 10.398 13.908 ( 15.305 4.066 6.050) 16.952 18.072 ( -6.359 2.791 -5.085) 8.607 18.191 ( 2.361 -2.383 2.420) 4.136 19.005 ( 5.852 -0.912 4.739) 7.585 19.643 ( 8.479 -2.120 -6.163) 10.694 20.805 ( -22.141 -0.690 -11.292) 24.864 22.496 ( 30.932 4.675 2.355) 31.371 23.433 ( -5.201 4.229 -2.102) 7.025 23.605 ( -0.981 -4.049 1.243) 4.347 ======================= Grid point 478 (240/361) ======================= q-point: (-0.20 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.479 ( -17.026 -2.821 12.779) 21.474 3.002 ( -13.849 -6.378 -0.072) 15.247 3.208 ( 7.603 4.727 -2.201) 9.220 3.334 ( 18.184 2.575 1.156) 18.402 3.542 ( 3.613 -4.326 -7.395) 9.297 3.749 ( 2.350 0.795 5.735) 6.249 4.606 ( 6.572 2.592 -5.470) 8.935 4.804 ( 0.611 3.813 -5.424) 6.658 5.559 ( -13.093 -4.441 3.079) 14.165 5.662 ( -10.592 0.243 -0.766) 10.622 6.091 ( -9.652 2.818 5.085) 11.268 6.128 ( -8.256 4.240 2.896) 9.723 6.592 ( -2.485 -5.757 5.311) 8.217 6.746 ( 6.380 -8.164 -0.240) 10.364 7.196 ( 7.756 3.116 -4.355) 9.425 7.428 ( 10.464 -7.187 13.212) 18.322 8.890 ( -20.231 -6.660 17.987) 27.878 9.208 ( -4.295 -2.047 9.546) 10.666 9.361 ( -7.347 7.870 6.129) 12.389 10.011 ( -8.567 -4.883 -10.303) 14.261 10.207 ( 4.076 -0.794 -4.038) 5.792 11.053 ( -4.222 14.453 3.734) 15.513 11.643 ( 14.117 -1.594 -14.209) 20.093 12.133 ( 18.726 4.714 -0.868) 19.330 12.682 ( -11.531 -6.223 9.398) 16.125 12.948 ( -3.596 3.270 3.833) 6.190 13.174 ( -5.111 -5.039 -4.878) 8.678 14.118 ( 14.775 6.896 1.405) 16.365 17.747 ( -12.075 0.636 -15.954) 20.019 18.384 ( 6.529 0.174 10.722) 12.554 19.112 ( 5.630 6.488 2.532) 8.956 19.688 ( -1.720 1.086 0.192) 2.043 20.422 ( -10.603 -9.856 -16.500) 21.950 22.857 ( 24.009 6.356 1.403) 24.876 23.312 ( -3.612 5.354 -1.041) 6.542 23.716 ( 3.607 -4.830 7.476) 9.604 ======================= Grid point 479 (241/361) ======================= q-point: (-0.10 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -19.615 -5.279 14.700) 25.073 2.828 ( -16.982 -8.691 -2.668) 19.262 3.270 ( 6.350 2.353 -0.176) 6.774 3.476 ( 4.830 4.968 -1.263) 7.043 3.528 ( 4.130 -1.495 -1.658) 4.695 3.896 ( 8.739 2.379 3.564) 9.733 4.618 ( 7.602 2.248 -4.503) 9.117 4.704 ( -3.840 2.369 -2.224) 5.030 5.357 ( -15.015 2.455 -0.515) 15.223 5.543 ( -7.308 1.540 1.407) 7.600 5.966 ( -8.194 8.421 1.412) 11.835 6.025 ( -8.880 0.148 3.822) 9.669 6.621 ( -2.283 -3.421 -1.044) 4.243 6.932 ( 4.011 -9.080 4.814) 11.032 7.219 ( 9.565 -0.068 -6.771) 11.719 7.737 ( 3.013 -6.146 7.769) 10.354 8.828 ( -20.248 -3.971 9.954) 22.909 9.233 ( -6.277 6.770 4.436) 10.242 9.306 ( -4.938 -0.800 12.445) 13.413 9.837 ( -5.822 -2.671 -6.597) 9.195 10.280 ( 5.443 -8.015 -2.486) 10.002 10.995 ( 0.631 6.802 7.098) 9.852 11.671 ( 12.935 -2.536 -15.105) 20.047 12.356 ( 16.310 3.468 -0.202) 16.675 12.688 ( -11.875 -5.650 9.223) 16.063 12.940 ( 0.324 4.142 4.460) 6.096 13.103 ( -3.695 -2.122 -1.452) 4.502 14.223 ( 14.079 11.016 -4.400) 18.410 17.399 ( -10.784 -0.247 -12.316) 16.372 18.614 ( 7.917 -0.221 10.476) 13.133 19.096 ( 2.616 10.761 -2.888) 11.445 19.533 ( -13.145 4.483 1.347) 13.954 20.340 ( 5.110 -15.906 -13.999) 21.796 23.065 ( 5.523 13.601 7.376) 16.429 23.228 ( 6.011 -3.108 -7.881) 10.387 23.955 ( 7.558 -1.612 12.393) 14.605 ======================= Grid point 486 (242/361) ======================= q-point: (-0.40 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.582 ( -17.206 -0.000 8.149) 19.038 2.997 ( 10.318 0.000 0.090) 10.318 3.039 ( 12.747 0.000 7.379) 14.729 3.289 ( 14.658 0.000 -8.701) 17.046 3.454 ( -19.663 -0.000 1.121) 19.695 3.727 ( 3.373 0.000 1.757) 3.803 4.612 ( 9.490 0.000 -6.422) 11.458 4.868 ( 4.344 0.000 -5.004) 6.627 5.546 ( -7.298 -0.000 7.197) 10.250 5.744 ( -7.740 -0.000 1.866) 7.962 6.260 ( -11.122 -0.000 5.588) 12.447 6.276 ( -5.309 -0.000 2.402) 5.827 6.403 ( -4.187 -0.000 7.274) 8.393 6.564 ( 5.695 0.000 1.954) 6.021 6.865 ( 12.408 0.000 20.138) 23.653 7.322 ( 7.872 0.000 -10.863) 13.415 8.818 ( -24.029 -0.000 26.996) 36.141 9.154 ( -6.605 -0.000 7.606) 10.073 9.396 ( 0.580 0.000 7.908) 7.930 10.238 ( -8.925 -0.000 -17.773) 19.888 10.271 ( -0.624 -0.000 -2.130) 2.219 11.418 ( -7.541 -0.000 -0.640) 7.568 11.530 ( 15.605 0.000 -9.560) 18.301 12.043 ( 14.392 0.000 -11.936) 18.698 12.634 ( -8.946 -0.000 9.047) 12.723 13.035 ( -12.002 -0.000 4.993) 12.999 13.199 ( -2.968 -0.000 -7.203) 7.790 13.948 ( 14.821 0.000 7.086) 16.428 18.111 ( -11.381 -0.000 -12.047) 16.573 18.155 ( 6.730 0.000 10.228) 12.243 18.995 ( 8.665 0.000 7.263) 11.306 19.621 ( 9.202 0.000 -7.991) 12.187 20.803 ( -22.803 -0.000 -13.085) 26.290 22.538 ( 32.529 0.000 0.889) 32.541 23.500 ( -3.233 -0.000 0.141) 3.236 23.540 ( -4.675 -0.000 0.593) 4.713 ======================= Grid point 487 (243/361) ======================= q-point: (-0.30 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.455 ( -18.570 -0.238 13.151) 22.757 2.903 ( -20.826 -3.630 -0.973) 21.163 3.273 ( 9.895 2.096 -0.268) 10.118 3.379 ( 16.207 1.290 -6.344) 17.452 3.475 ( 11.073 -1.727 2.535) 11.490 3.770 ( 1.401 0.852 3.559) 3.918 4.650 ( 7.656 2.334 -5.866) 9.923 4.833 ( -0.200 -0.565 -5.736) 5.768 5.496 ( -11.205 -1.838 4.667) 12.276 5.632 ( -9.630 -1.904 -0.220) 9.819 6.088 ( -10.836 -0.413 0.941) 10.884 6.264 ( -5.677 6.801 5.836) 10.609 6.471 ( -3.588 -6.174 7.302) 10.214 6.658 ( 6.937 -2.071 -2.404) 7.628 7.263 ( 11.634 3.051 3.164) 12.437 7.328 ( 11.288 -3.605 1.238) 11.914 8.798 ( -24.179 -2.838 22.516) 33.161 9.180 ( -6.189 -0.917 10.540) 12.258 9.463 ( -3.873 3.074 8.075) 9.469 9.910 ( -11.005 -3.572 -14.009) 18.169 10.245 ( 4.096 1.925 -3.640) 5.808 11.274 ( -8.314 8.217 2.534) 11.961 11.607 ( 13.982 -2.006 -14.378) 20.156 12.172 ( 16.968 0.134 -3.535) 17.333 12.625 ( -8.937 -0.527 10.691) 13.944 12.986 ( -4.314 1.066 5.265) 6.890 13.084 ( -5.242 -3.673 -4.516) 7.834 14.207 ( 14.512 2.645 3.367) 15.130 17.754 ( -12.518 0.185 -16.635) 20.820 18.387 ( 6.293 0.097 12.012) 13.561 19.211 ( 8.279 3.655 8.115) 12.155 19.677 ( 6.843 -1.402 -3.907) 8.004 20.310 ( -17.933 -2.770 -19.583) 26.698 22.914 ( 25.647 0.950 -7.052) 26.616 23.447 ( -3.413 8.377 4.968) 10.320 23.609 ( 2.076 -6.912 9.667) 12.064 ======================= Grid point 488 (244/361) ======================= q-point: (-0.20 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( -20.630 -0.642 15.836) 26.015 2.638 ( -22.397 -10.888 0.846) 24.918 3.305 ( -1.254 1.324 -4.877) 5.207 3.483 ( 6.051 -2.412 1.101) 6.606 3.626 ( 12.233 9.739 -0.053) 15.636 3.914 ( 9.454 -0.802 4.425) 10.469 4.642 ( 1.438 2.562 -2.036) 3.574 4.754 ( 2.493 0.552 -7.740) 8.150 5.375 ( -12.837 0.308 2.575) 13.097 5.540 ( -5.154 -1.197 0.284) 5.299 5.993 ( -9.201 -1.275 3.887) 10.070 6.155 ( -6.305 9.124 2.405) 11.348 6.542 ( -3.990 -5.303 2.600) 7.128 6.774 ( 8.978 -6.545 -0.992) 11.155 7.275 ( 8.601 4.219 -6.553) 11.607 7.630 ( 9.797 -5.242 3.597) 11.679 8.724 ( -23.863 -5.421 14.101) 28.244 9.243 ( -5.635 -1.988 10.654) 12.215 9.422 ( -7.899 8.312 8.811) 14.461 9.696 ( -7.727 -8.412 -7.257) 13.532 10.271 ( 7.729 2.563 -2.945) 8.659 11.134 ( -7.113 7.396 5.258) 11.531 11.625 ( 12.486 -2.401 -15.562) 20.095 12.380 ( 14.619 -0.961 -2.128) 14.804 12.645 ( -8.495 1.550 11.905) 14.707 12.996 ( -0.763 1.609 4.295) 4.650 13.026 ( -3.496 -5.191 -0.947) 6.330 14.382 ( 14.629 6.286 -1.862) 16.031 17.395 ( -10.999 -0.202 -13.070) 17.083 18.612 ( 7.361 0.004 9.189) 11.774 19.306 ( 4.269 11.813 1.263) 12.624 19.596 ( -15.199 2.405 -0.685) 15.404 20.063 ( 7.404 -14.071 -16.167) 22.676 23.096 ( 16.808 -3.217 -10.825) 20.249 23.374 ( -4.774 11.848 6.587) 14.372 23.910 ( 9.376 -3.199 15.536) 18.425 ======================= Grid point 489 (245/361) ======================= q-point: (-0.10 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( -24.144 -6.278 12.848) 28.060 2.465 ( -21.531 -8.316 1.362) 23.121 3.219 ( -8.141 -7.369 3.438) 11.506 3.612 ( 4.576 0.706 3.750) 5.958 3.657 ( 9.851 12.603 -1.728) 16.089 4.030 ( -0.954 2.883 3.289) 4.476 4.616 ( -2.873 1.373 3.652) 4.845 4.740 ( 9.976 2.871 -7.720) 12.937 5.231 ( -7.034 3.247 1.959) 7.991 5.504 ( -1.027 1.061 -0.250) 1.498 5.879 ( -8.751 2.603 -3.402) 9.744 6.029 ( -6.438 7.975 6.805) 12.303 6.520 ( -3.894 -3.843 -2.350) 5.954 6.987 ( 5.226 -7.065 5.528) 10.382 7.303 ( 11.326 2.595 -6.044) 13.097 7.734 ( -0.663 -3.000 -3.104) 4.368 8.585 ( -22.717 -7.880 8.595) 25.535 9.262 ( -5.510 5.068 4.784) 8.884 9.400 ( -5.325 1.774 13.684) 14.791 9.664 ( -0.344 -10.914 -3.425) 11.444 10.315 ( 4.712 3.325 -1.106) 5.873 11.092 ( -3.219 0.677 5.815) 6.681 11.630 ( 11.504 -2.502 -14.898) 18.988 12.478 ( 3.241 -0.603 -4.845) 5.860 12.627 ( -9.707 1.995 9.014) 13.396 13.013 ( 1.784 2.020 -2.511) 3.683 13.093 ( 2.785 -5.264 6.018) 8.467 14.452 ( 14.490 10.940 -7.477) 19.635 17.188 ( -5.459 -0.080 -0.273) 5.466 18.803 ( 8.208 -2.794 -0.978) 8.726 19.098 ( -9.422 9.114 -2.790) 13.402 19.476 ( 1.071 4.307 0.890) 4.527 20.175 ( 6.851 -12.401 -7.315) 15.944 23.192 ( 2.346 2.979 -5.360) 6.565 23.272 ( 2.610 6.684 2.455) 7.584 24.239 ( 8.822 0.248 13.392) 16.039 ======================= Grid point 497 (246/361) ======================= q-point: (-0.30 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( -17.950 -0.000 18.073) 25.472 2.509 ( -27.596 -0.000 -0.257) 27.597 3.318 ( -5.427 -0.000 -8.384) 9.987 3.458 ( 9.617 0.000 3.529) 10.244 3.749 ( 15.785 0.000 0.796) 15.805 3.881 ( 7.511 0.000 4.621) 8.819 4.706 ( 9.396 0.000 -6.957) 11.691 4.719 ( -6.165 -0.000 -3.184) 6.939 5.378 ( -11.438 -0.000 3.846) 12.067 5.525 ( -3.744 -0.000 0.236) 3.752 5.979 ( -9.450 -0.000 4.629) 10.523 6.256 ( -5.446 -0.000 0.138) 5.448 6.473 ( -4.134 -0.000 5.912) 7.214 6.717 ( 9.606 0.000 -3.530) 10.234 7.321 ( 8.807 0.000 -7.855) 11.801 7.577 ( 11.737 0.000 2.961) 12.105 8.672 ( -25.201 -0.000 15.072) 29.364 9.223 ( -7.721 -0.000 12.805) 14.953 9.512 ( -6.368 -0.000 8.619) 10.717 9.607 ( -8.740 -0.000 -7.494) 11.513 10.299 ( 8.674 0.000 -3.773) 9.459 11.211 ( -11.352 -0.000 4.940) 12.380 11.598 ( 12.909 0.000 -15.758) 20.371 12.362 ( 13.623 0.000 -1.938) 13.760 12.684 ( -4.876 -0.000 12.988) 13.873 12.950 ( -6.037 -0.000 -0.942) 6.110 13.020 ( 0.121 0.000 3.479) 3.481 14.440 ( 14.771 0.000 -1.006) 14.806 17.393 ( -11.078 -0.000 -13.327) 17.330 18.613 ( 7.150 0.000 8.682) 11.247 19.446 ( 6.247 0.000 8.537) 10.579 19.616 ( -19.079 -0.000 -2.626) 19.259 19.906 ( 10.052 0.000 -21.752) 23.962 23.064 ( 16.187 0.000 -12.672) 20.557 23.497 ( -5.099 -0.000 6.179) 8.012 23.869 ( 11.361 0.000 17.752) 21.077 ======================= Grid point 498 (247/361) ======================= q-point: (-0.20 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( -26.286 -3.179 5.877) 27.122 2.345 ( -22.057 -3.849 10.662) 24.799 3.129 ( -13.102 -2.476 3.722) 13.844 3.618 ( 6.691 0.097 2.915) 7.300 3.860 ( 8.768 8.218 -2.317) 12.238 4.044 ( 0.464 -1.189 5.901) 6.038 4.641 ( 0.453 0.983 2.106) 2.368 4.761 ( 8.692 0.000 -6.225) 10.692 5.278 ( -6.028 1.593 2.131) 6.590 5.511 ( 0.925 0.105 -1.034) 1.392 5.891 ( -8.624 -0.032 -1.359) 8.731 6.167 ( -5.691 5.337 5.292) 9.428 6.455 ( -3.992 -2.814 -1.619) 5.146 6.881 ( 11.239 -3.529 2.951) 12.145 7.357 ( 9.887 2.207 -5.610) 11.580 7.684 ( 4.437 -1.922 -5.114) 7.038 8.463 ( -26.307 -4.137 8.247) 27.878 9.273 ( -6.716 -1.430 11.347) 13.263 9.477 ( -6.320 3.255 6.902) 9.908 9.518 ( -4.219 -3.500 0.410) 5.497 10.382 ( 9.496 2.331 -2.726) 10.150 11.115 ( -10.185 1.122 5.970) 11.859 11.598 ( 12.274 -0.994 -13.939) 18.600 12.466 ( 4.821 -0.129 -4.043) 6.293 12.710 ( -6.754 5.967 7.048) 11.441 12.931 ( -2.756 -7.951 2.240) 8.709 13.067 ( 2.893 0.777 1.356) 3.288 14.588 ( 15.205 3.892 -6.771) 17.094 17.186 ( -4.773 -0.046 0.737) 4.830 18.768 ( 7.581 -1.041 -4.767) 9.016 19.219 ( -18.078 3.625 -2.103) 18.557 19.573 ( 3.622 5.489 4.128) 7.764 19.970 ( 11.837 -8.648 -8.958) 17.180 23.134 ( 13.649 -2.397 -10.840) 17.594 23.471 ( -6.765 7.164 7.974) 12.675 24.232 ( 10.833 -0.645 12.789) 16.773 ======================= Grid point 499 (248/361) ======================= q-point: (-0.10 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -21.993 -9.267 11.536) 26.508 2.058 ( -30.331 -5.462 0.661) 30.826 3.177 ( -7.370 -5.503 19.437) 21.503 3.677 ( -0.566 2.241 0.011) 2.312 3.865 ( 8.238 7.432 -2.964) 11.484 4.006 ( -12.432 2.571 5.665) 13.902 4.680 ( -2.653 7.578 0.738) 8.063 4.844 ( 12.647 0.210 1.998) 12.806 5.269 ( 5.321 2.388 0.240) 5.838 5.472 ( -1.287 -0.225 -7.312) 7.428 5.725 ( -6.153 0.237 -2.592) 6.681 6.135 ( -3.452 9.651 8.553) 13.350 6.417 ( -2.206 -3.699 -0.146) 4.309 7.064 ( 2.118 -0.401 2.818) 3.548 7.443 ( 12.709 3.254 -2.822) 13.419 7.628 ( -2.132 -0.679 -6.984) 7.333 8.274 ( -23.567 -12.457 10.048) 28.487 9.293 ( -6.066 5.821 6.269) 10.487 9.497 ( -2.954 -1.516 10.698) 11.202 9.543 ( 1.440 -10.573 -2.499) 10.959 10.419 ( 3.658 8.069 -1.150) 8.934 11.053 ( -8.036 -4.011 2.782) 9.402 11.615 ( 11.454 0.260 -11.439) 16.189 12.394 ( -6.138 1.366 -3.631) 7.261 12.614 ( -7.756 2.433 2.790) 8.595 12.968 ( 0.318 -4.314 -5.631) 7.101 13.144 ( 3.234 -4.491 2.340) 6.009 14.625 ( 14.288 8.028 -12.415) 20.560 17.312 ( 7.425 3.416 17.638) 19.440 18.637 ( -1.780 -5.097 -19.682) 20.409 19.160 ( 1.141 4.100 9.908) 10.784 19.588 ( 5.122 5.719 -0.798) 7.719 20.086 ( 3.755 -9.430 -4.885) 11.265 23.213 ( 8.211 1.526 -6.342) 10.487 23.369 ( -5.597 10.032 5.180) 12.601 24.450 ( 3.754 -0.952 3.846) 5.459 ======================= Grid point 508 (249/361) ======================= q-point: (-0.20 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( -22.493 -0.000 10.917) 25.003 2.008 ( -31.878 -0.000 0.448) 31.881 3.129 ( -8.725 -0.000 22.592) 24.218 3.694 ( 0.795 0.000 -0.349) 0.868 3.941 ( 6.479 0.000 -4.936) 8.145 4.028 ( -13.714 -0.000 7.288) 15.530 4.767 ( -1.120 -0.000 -2.406) 2.654 4.826 ( 15.011 0.000 7.648) 16.847 5.294 ( 5.534 0.000 -0.968) 5.618 5.466 ( -1.447 -0.000 -10.144) 10.246 5.725 ( -6.412 -0.000 -2.903) 7.038 6.258 ( -3.531 -0.000 14.765) 15.182 6.355 ( -1.346 -0.000 -4.951) 5.131 7.060 ( 9.462 0.000 1.686) 9.611 7.481 ( 12.092 0.000 0.796) 12.118 7.616 ( 1.307 0.000 -11.563) 11.637 8.146 ( -29.803 -0.000 10.258) 31.519 9.331 ( -2.093 -0.000 9.794) 10.015 9.469 ( -7.494 -0.000 4.701) 8.847 9.477 ( -1.994 -0.000 2.267) 3.019 10.495 ( 9.167 0.000 -2.949) 9.630 11.019 ( -13.510 -0.000 4.013) 14.093 11.621 ( 12.401 0.000 -10.254) 16.091 12.427 ( -2.108 -0.000 -5.615) 5.998 12.645 ( -10.949 -0.000 -3.160) 11.396 12.876 ( -2.527 -0.000 2.853) 3.811 13.121 ( 3.779 0.000 -0.568) 3.821 14.698 ( 14.639 0.000 -13.003) 19.581 17.345 ( 9.836 0.000 19.853) 22.156 18.587 ( -3.183 -0.000 -21.512) 21.746 19.197 ( 0.594 0.000 11.761) 11.776 19.671 ( -0.388 -0.000 1.898) 1.937 19.971 ( 8.590 0.000 -8.464) 12.059 23.196 ( 13.893 0.000 -8.954) 16.529 23.504 ( -8.650 -0.000 9.354) 12.741 24.434 ( 4.341 0.000 0.941) 4.442 ======================= Grid point 509 (250/361) ======================= q-point: (-0.10 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( -26.887 -4.432 8.364) 28.505 1.820 ( -16.423 -5.952 17.872) 24.991 3.350 ( -5.634 -1.166 25.911) 26.542 3.631 ( -5.776 1.294 -2.258) 6.335 3.870 ( -15.921 2.038 4.974) 16.804 3.968 ( 7.603 1.128 -6.575) 10.115 4.673 ( -5.604 6.281 0.152) 8.419 5.059 ( 3.648 1.510 -5.454) 6.733 5.344 ( 5.082 -0.493 -1.076) 5.218 5.364 ( 6.832 -1.019 0.505) 6.926 5.704 ( 2.564 -0.836 1.684) 3.180 6.273 ( 2.293 8.123 0.718) 8.471 6.441 ( -1.488 -2.874 14.060) 14.428 7.088 ( -1.175 7.378 -5.080) 9.035 7.397 ( -4.534 -1.424 -18.312) 18.919 7.707 ( 7.842 4.604 9.816) 13.381 8.010 ( -19.985 -14.515 20.101) 31.845 9.360 ( -3.583 8.175 4.758) 10.115 9.437 ( -0.809 -4.761 -4.353) 6.501 9.559 ( 0.405 -8.032 10.467) 13.200 10.506 ( -0.385 11.602 -3.525) 12.132 10.846 ( -13.629 -9.698 -1.923) 16.837 11.671 ( 10.511 1.924 -7.712) 13.178 12.266 ( -7.649 3.456 -4.706) 9.622 12.478 ( -9.126 -5.583 -0.733) 10.723 12.885 ( -0.837 -1.852 -0.322) 2.058 13.169 ( 3.125 -1.975 -0.699) 3.762 14.676 ( 12.063 3.794 -18.364) 22.297 17.853 ( 22.228 8.718 23.105) 33.225 18.342 ( 2.053 -8.127 -16.479) 18.488 19.358 ( 2.126 7.998 8.722) 12.023 19.647 ( 1.859 -3.052 -1.579) 3.907 19.986 ( 3.883 -4.845 -7.879) 10.031 23.290 ( 11.498 1.181 -6.236) 13.133 23.430 ( -9.536 10.654 6.941) 15.894 24.351 ( -9.713 -4.928 -10.762) 15.312 ======================= Grid point 519 (251/361) ======================= q-point: (-0.10 -0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( -7.006 -0.000 21.994) 23.083 1.865 ( -10.013 -0.000 23.812) 25.832 3.500 ( -7.434 -0.000 -4.494) 8.686 3.549 ( -17.160 -0.000 29.301) 33.956 3.763 ( 0.537 0.000 -0.504) 0.737 3.973 ( 7.416 0.000 -10.862) 13.152 4.653 ( -4.610 -0.000 2.492) 5.241 4.886 ( -1.455 -0.000 -13.172) 13.252 5.359 ( 1.158 0.000 -3.251) 3.451 5.562 ( -2.487 -0.000 12.926) 13.163 5.862 ( 17.243 0.000 3.558) 17.607 6.380 ( 8.137 0.000 -0.963) 8.193 6.580 ( -8.756 -0.000 17.372) 19.454 7.016 ( -11.582 -0.000 -12.148) 16.785 7.056 ( 0.128 0.000 -9.658) 9.659 7.914 ( -20.213 -0.000 26.526) 33.349 8.046 ( 9.534 0.000 13.736) 16.721 9.317 ( -2.393 -0.000 -6.811) 7.219 9.416 ( -0.722 -0.000 1.021) 1.250 9.677 ( 2.200 0.000 12.293) 12.489 10.441 ( -22.990 -0.000 -1.169) 23.020 10.583 ( 4.681 0.000 -6.645) 8.128 11.697 ( 4.628 0.000 -9.155) 10.258 12.119 ( -5.628 -0.000 -5.804) 8.085 12.381 ( -5.598 -0.000 8.085) 9.834 12.886 ( 1.966 0.000 -0.306) 1.990 13.182 ( 1.977 0.000 -1.615) 2.553 14.591 ( 8.632 0.000 -21.615) 23.275 18.117 ( 3.784 0.000 -14.876) 15.349 18.580 ( 31.650 0.000 16.706) 35.789 19.472 ( -6.849 -0.000 -9.669) 11.849 19.552 ( -6.416 -0.000 10.008) 11.888 20.013 ( 17.333 0.000 -5.229) 18.104 23.388 ( 12.276 0.000 -6.489) 13.885 23.442 ( -10.680 -0.000 7.595) 13.106 23.851 ( -28.158 -0.000 -18.304) 33.584 ======================= Grid point 520 (252/361) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( 5.657 0.000 12.578) 13.792 2.869 ( -0.934 -0.000 13.477) 13.509 3.083 ( -0.567 -0.000 3.421) 3.468 3.533 ( 1.601 0.000 -10.300) 10.424 3.701 ( -1.365 -0.000 -13.297) 13.367 3.921 ( -0.252 -0.000 -2.971) 2.982 4.353 ( 4.144 0.000 -2.951) 5.087 4.421 ( -7.797 -0.000 -4.381) 8.944 5.668 ( 1.857 0.000 11.241) 11.393 5.949 ( -7.059 -0.000 13.465) 15.203 6.135 ( -2.989 -0.000 -1.748) 3.463 6.495 ( -1.814 -0.000 -4.293) 4.661 6.663 ( 2.721 0.000 -3.157) 4.168 6.687 ( 3.586 0.000 -1.643) 3.944 7.470 ( -3.526 -0.000 27.671) 27.895 8.572 ( -4.840 -0.000 -2.488) 5.442 8.767 ( -12.378 -0.000 24.565) 27.507 9.165 ( 2.711 0.000 3.609) 4.514 9.246 ( 1.573 0.000 -5.267) 5.497 10.030 ( -11.514 -0.000 18.322) 21.639 10.142 ( 2.420 0.000 -16.439) 16.617 10.725 ( 11.098 0.000 15.708) 19.233 11.099 ( 2.083 0.000 -16.113) 16.247 11.696 ( -4.555 -0.000 -11.311) 12.194 12.683 ( -4.882 -0.000 4.844) 6.877 12.911 ( 10.868 0.000 -5.990) 12.409 13.221 ( -2.711 -0.000 6.557) 7.095 13.938 ( 4.015 0.000 -13.720) 14.296 17.918 ( 10.751 0.000 -3.053) 11.176 18.435 ( -11.649 -0.000 -17.339) 20.889 19.387 ( -16.915 -0.000 5.693) 17.848 19.557 ( 13.819 0.000 -0.227) 13.821 21.055 ( 28.834 0.000 15.421) 32.699 22.198 ( -30.689 -0.000 -17.476) 35.317 23.344 ( -9.132 -0.000 1.782) 9.304 23.462 ( 10.740 0.000 -3.880) 11.420 ======================= Grid point 521 (253/361) ======================= q-point: ( 0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( 9.452 0.373 10.014) 13.775 2.858 ( 0.732 -0.261 -6.389) 6.436 3.250 ( 0.825 5.161 13.765) 14.724 3.452 ( 0.972 4.260 -1.200) 4.531 3.520 ( -2.171 -2.278 -9.396) 9.909 3.816 ( -1.858 -2.265 -11.417) 11.787 4.272 ( -6.262 -1.631 -2.567) 6.962 4.467 ( 7.359 -4.498 1.355) 8.731 5.785 ( -3.277 1.333 9.194) 9.851 5.982 ( -15.475 -1.928 9.891) 18.466 6.047 ( -1.627 -1.083 -2.447) 3.132 6.379 ( -7.239 -0.316 -2.351) 7.617 6.662 ( 2.981 2.929 -2.760) 5.009 6.714 ( 3.514 -2.433 -2.112) 4.767 7.776 ( -0.353 6.061 29.154) 29.779 8.244 ( -11.257 21.026 -7.053) 24.870 8.930 ( -14.485 -17.622 12.398) 25.963 9.240 ( 2.174 -1.683 -2.080) 3.447 9.285 ( 2.428 -0.376 8.243) 8.601 9.940 ( 0.480 3.674 -12.191) 12.742 10.218 ( 0.048 -5.092 17.931) 18.640 10.936 ( 3.742 3.597 -12.646) 13.669 11.138 ( 15.943 -5.314 12.623) 21.018 11.521 ( 5.653 3.795 -14.405) 15.933 12.666 ( -5.968 -5.753 1.292) 8.390 12.998 ( 8.690 -3.811 -5.511) 10.973 13.255 ( -5.545 1.858 9.111) 10.827 13.813 ( 2.853 2.202 -12.758) 13.258 18.052 ( 1.159 1.650 -4.228) 4.684 18.090 ( -1.507 -2.365 -8.209) 8.675 19.219 ( -15.813 1.059 5.127) 16.657 19.676 ( 4.414 0.749 -0.273) 4.485 21.521 ( -13.538 9.639 -7.694) 18.313 21.706 ( 15.425 -8.064 6.989) 18.757 23.265 ( -5.358 -1.696 0.367) 5.632 23.577 ( 10.703 -0.353 -2.331) 10.959 ======================= Grid point 522 (254/361) ======================= q-point: ( 0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.770 ( 0.229 -0.713 -4.691) 4.750 2.917 ( 8.498 -0.148 3.613) 9.235 3.249 ( 0.713 6.460 1.873) 6.764 3.361 ( -1.478 2.560 -4.628) 5.492 3.586 ( 1.115 3.317 8.564) 9.251 3.688 ( 0.071 -5.004 -9.089) 10.376 4.220 ( -1.099 -4.122 -0.770) 4.335 4.646 ( 6.826 -6.146 2.619) 9.551 5.733 ( -16.542 0.987 3.540) 16.946 5.818 ( -11.729 -1.381 0.148) 11.811 6.034 ( -7.934 -2.672 3.877) 9.226 6.260 ( -8.314 -0.314 0.621) 8.343 6.649 ( 4.134 2.710 -3.174) 5.874 6.781 ( 5.481 -3.610 -1.594) 6.754 7.809 ( -9.402 20.149 -7.336) 23.413 8.017 ( -0.168 11.746 22.057) 24.990 8.960 ( -14.598 -12.957 5.167) 20.192 9.275 ( -0.747 -5.205 0.803) 5.319 9.412 ( -0.942 2.629 11.451) 11.787 9.784 ( -3.406 -5.635 -11.634) 13.368 10.532 ( 6.970 -2.844 17.108) 18.691 10.807 ( 6.229 9.856 -8.945) 14.695 11.406 ( 14.323 4.794 -14.735) 21.101 11.614 ( 19.408 -4.338 9.399) 21.996 12.662 ( -4.548 -9.282 -0.398) 10.344 13.074 ( 3.001 -7.438 -4.984) 9.443 13.243 ( -9.150 4.457 10.363) 14.525 13.692 ( 5.013 0.427 -12.276) 13.267 17.759 ( -11.252 -0.950 -11.502) 16.118 18.297 ( 10.787 -1.077 8.390) 13.708 19.051 ( -12.400 1.699 2.297) 12.725 19.677 ( -5.398 -1.403 1.786) 5.856 20.998 ( -13.296 7.935 -19.151) 24.628 22.259 ( 19.344 -5.842 17.665) 26.840 23.229 ( -0.261 -0.016 -1.325) 1.350 23.714 ( 10.050 -0.773 0.411) 10.088 ======================= Grid point 523 (255/361) ======================= q-point: (-0.70 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.732 ( -1.655 -7.526 -5.467) 9.448 2.947 ( -5.298 5.639 3.889) 8.660 3.241 ( -2.362 1.630 -6.282) 6.907 3.350 ( 8.021 0.425 4.599) 9.256 3.590 ( 1.799 -1.288 -1.288) 2.560 3.733 ( 3.130 2.616 4.039) 5.741 4.296 ( 6.879 -3.478 -0.072) 7.708 4.801 ( 2.601 -4.123 2.867) 5.655 5.466 ( -19.554 -0.836 -0.939) 19.594 5.665 ( -15.004 -2.806 0.984) 15.296 5.957 ( -9.909 -2.110 1.143) 10.196 6.166 ( -8.421 -0.366 2.502) 8.793 6.647 ( 4.693 2.610 -3.916) 6.647 6.883 ( 6.236 -4.125 -1.560) 7.638 7.473 ( -3.330 16.987 -4.808) 17.965 8.085 ( -2.222 13.648 10.248) 17.212 8.919 ( -13.194 -10.341 3.919) 17.216 9.327 ( -3.334 -5.342 4.193) 7.565 9.468 ( -5.556 2.711 8.619) 10.607 9.678 ( -5.367 -10.417 -5.855) 13.100 10.672 ( 8.034 19.454 -3.359) 21.314 10.879 ( 8.096 -1.366 12.742) 15.158 11.389 ( 17.772 3.068 -18.508) 25.841 12.022 ( 17.760 -3.340 5.437) 18.872 12.711 ( 0.434 -8.440 0.685) 8.478 13.066 ( -2.694 -5.536 -5.969) 8.575 13.180 ( -11.990 5.423 11.937) 17.767 13.693 ( 9.226 -8.801 -9.733) 16.041 17.489 ( -11.252 0.264 -6.908) 13.206 18.582 ( 10.146 -0.530 12.057) 15.766 18.910 ( -6.711 -0.664 -2.541) 7.207 19.604 ( -12.843 -4.635 3.089) 13.999 20.582 ( -1.934 9.927 -17.597) 20.296 22.719 ( 6.673 -9.640 14.292) 18.486 23.222 ( 7.669 6.410 -3.241) 10.507 23.897 ( 9.476 -2.577 5.522) 11.266 ======================= Grid point 524 (256/361) ======================= q-point: (-0.60 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.679 ( -8.835 -7.125 -5.223) 12.494 2.843 ( -12.609 5.951 8.748) 16.460 3.168 ( 4.561 -4.304 -5.409) 8.282 3.472 ( 1.763 0.759 2.264) 2.968 3.655 ( 3.047 3.613 6.282) 7.861 3.813 ( 6.481 -3.535 -1.270) 7.491 4.443 ( 11.330 -1.323 -1.370) 11.489 4.817 ( -8.163 1.954 3.790) 9.209 5.260 ( -12.138 -5.780 0.970) 13.478 5.498 ( -11.836 -4.146 -0.576) 12.555 5.843 ( -9.328 -2.955 -0.602) 9.803 6.089 ( -7.648 -0.464 2.819) 8.164 6.625 ( 1.526 3.322 -2.938) 4.690 6.976 ( 4.698 -4.387 -2.647) 6.951 7.298 ( 4.241 12.869 -3.218) 13.927 7.976 ( -5.852 11.491 1.359) 12.967 8.873 ( -13.059 -8.255 4.256) 16.025 9.342 ( -10.211 -1.984 7.805) 13.005 9.481 ( -2.083 -5.668 3.662) 7.062 9.677 ( -2.147 -4.462 1.599) 5.203 10.545 ( 5.446 21.896 -1.569) 22.618 11.123 ( 5.854 1.313 9.903) 11.579 11.380 ( 17.067 2.986 -19.437) 26.039 12.266 ( 9.799 -4.424 -2.070) 10.948 12.797 ( 0.754 -2.674 -0.631) 2.849 12.983 ( -5.231 -0.821 -2.660) 5.925 13.165 ( -3.569 1.306 11.972) 12.560 13.840 ( 9.883 -15.424 -7.536) 19.808 17.298 ( -8.848 0.714 1.074) 8.942 18.791 ( -0.394 0.542 -8.824) 8.849 18.861 ( 6.734 -2.471 9.120) 11.603 19.490 ( -11.549 -3.670 1.766) 12.246 20.350 ( 3.879 8.222 -9.566) 13.197 22.932 ( -8.959 -15.461 5.663) 18.745 23.262 ( 15.676 13.768 -2.625) 21.028 24.163 ( 9.080 -4.301 10.449) 14.496 ======================= Grid point 525 (257/361) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( -14.514 1.370 -2.658) 14.818 2.680 ( -19.835 8.205 11.462) 24.333 3.309 ( 10.276 -9.145 -2.891) 14.056 3.464 ( 0.088 1.363 -0.031) 1.366 3.752 ( 3.826 5.520 7.376) 9.976 3.923 ( 1.310 -11.284 -1.862) 11.511 4.569 ( 5.306 0.429 -2.893) 6.059 4.716 ( -7.698 -2.570 5.553) 9.833 5.229 ( -4.157 -3.549 4.763) 7.250 5.418 ( -3.003 -3.722 -2.730) 5.507 5.749 ( -6.406 -2.554 0.101) 6.897 6.036 ( -5.248 -2.630 1.453) 6.048 6.562 ( -2.646 3.587 0.432) 4.478 7.019 ( 1.034 -5.051 -4.120) 6.599 7.259 ( 9.046 6.817 -5.736) 12.697 7.803 ( -7.532 7.529 2.148) 10.865 8.790 ( -12.837 -1.813 5.033) 13.907 9.321 ( -12.198 -4.688 10.296) 16.637 9.580 ( 0.916 -3.988 5.325) 6.716 9.699 ( 1.266 1.067 -0.886) 1.878 10.417 ( 0.571 14.844 1.899) 14.975 11.233 ( 1.937 5.182 1.543) 5.743 11.354 ( 15.409 2.446 -15.307) 21.857 12.358 ( 2.861 -4.044 -3.406) 6.012 12.756 ( -4.641 0.280 -0.871) 4.730 12.887 ( -5.334 -1.246 -1.308) 5.632 13.290 ( 4.065 3.929 6.780) 8.828 14.032 ( 10.312 -15.504 -8.341) 20.403 17.296 ( -2.361 -2.506 11.554) 12.056 18.605 ( -0.047 1.260 -18.894) 18.936 19.053 ( 4.713 -0.601 5.793) 7.492 19.443 ( -0.209 -1.446 1.408) 2.030 20.274 ( 1.850 5.208 -1.691) 5.779 22.957 ( -10.363 -15.667 0.759) 18.799 23.318 ( 11.438 11.031 -1.936) 16.009 24.429 ( 5.276 -3.094 8.617) 10.567 ======================= Grid point 526 (258/361) ======================= q-point: (-0.40 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -17.613 8.370 4.510) 20.015 2.454 ( -18.331 11.274 13.264) 25.280 3.424 ( 4.295 0.514 0.186) 4.329 3.543 ( 4.004 -9.046 -1.723) 10.042 3.805 ( 6.575 6.860 -1.663) 9.646 4.009 ( -8.411 -13.562 5.539) 16.893 4.478 ( -11.144 -7.907 -3.332) 14.064 4.846 ( 7.107 -4.810 3.148) 9.140 5.322 ( 5.615 3.555 3.713) 7.612 5.364 ( -1.044 -1.679 -0.775) 2.124 5.734 ( -0.533 0.440 3.899) 3.960 6.028 ( -0.701 -6.105 -2.020) 6.468 6.552 ( -2.478 -0.493 8.051) 8.438 6.983 ( -5.701 -6.097 -5.202) 9.836 7.238 ( 6.470 1.175 -11.439) 13.194 7.733 ( -4.752 2.049 8.842) 10.245 8.702 ( -8.369 6.863 9.959) 14.708 9.325 ( -12.713 -5.694 11.241) 17.900 9.625 ( -0.653 7.584 -2.586) 8.039 9.707 ( 4.632 -1.336 1.628) 5.088 10.352 ( -5.179 2.760 4.878) 7.631 11.140 ( 2.252 7.748 -9.075) 12.144 11.405 ( 10.626 0.513 -6.060) 12.243 12.325 ( -3.898 0.072 -3.772) 5.425 12.683 ( -4.171 2.019 1.247) 4.798 12.835 ( -2.674 -3.183 -1.285) 4.351 13.330 ( 1.225 7.922 2.851) 8.508 14.170 ( 9.994 -11.436 -13.331) 20.209 17.554 ( 5.586 -8.305 16.346) 19.167 18.363 ( 5.096 4.767 -18.235) 19.525 19.147 ( -0.402 -4.966 0.812) 5.048 19.534 ( 10.685 1.117 0.394) 10.751 20.218 ( -2.801 6.176 0.471) 6.798 22.981 ( -8.195 -17.398 0.724) 19.245 23.336 ( 6.474 6.534 -2.738) 9.597 24.522 ( -2.679 1.442 0.819) 3.151 ======================= Grid point 527 (259/361) ======================= q-point: (-0.30 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( -13.052 11.116 13.628) 21.901 2.344 ( -10.780 9.903 18.143) 23.312 3.476 ( 1.338 -2.931 -2.906) 4.339 3.573 ( -2.219 -2.635 -1.554) 3.779 3.815 ( 11.728 4.871 -8.643) 15.361 4.031 ( -17.183 -8.141 11.299) 22.118 4.394 ( -5.082 -13.920 -6.984) 16.382 4.948 ( -0.763 -0.597 -1.619) 1.887 5.292 ( 2.899 1.261 -1.031) 3.325 5.580 ( 14.069 1.528 10.052) 17.358 5.793 ( 1.651 2.820 5.664) 6.539 6.102 ( 6.565 -7.867 -2.107) 10.461 6.703 ( 0.045 -6.718 11.560) 13.371 6.845 ( -13.595 -6.687 -2.555) 15.364 7.129 ( 1.433 2.373 -12.109) 12.423 7.841 ( -2.295 -7.053 11.880) 14.005 8.687 ( -3.911 13.745 16.537) 21.856 9.344 ( -8.800 -4.290 9.188) 13.427 9.460 ( -1.294 9.861 -7.168) 12.259 9.817 ( 2.752 -3.296 4.352) 6.114 10.298 ( -11.848 -2.440 4.668) 12.966 10.963 ( 1.038 11.412 -9.136) 14.656 11.476 ( 7.965 -2.470 -6.367) 10.492 12.175 ( -7.654 1.833 -4.636) 9.134 12.636 ( -2.645 5.318 4.922) 7.714 12.829 ( -0.841 -2.791 -0.704) 2.999 13.279 ( -0.655 8.150 1.211) 8.265 14.190 ( 8.853 -7.290 -18.162) 21.479 17.825 ( 5.315 -6.741 -3.896) 9.427 18.381 ( 18.302 0.140 4.360) 18.815 19.150 ( -6.231 -10.357 -4.083) 12.758 19.724 ( 18.923 3.195 -0.029) 19.191 20.078 ( -7.406 9.746 0.259) 12.244 23.055 ( -9.087 -21.366 1.910) 23.297 23.318 ( 4.894 4.048 -5.263) 8.248 24.331 ( -12.457 8.798 -6.790) 16.694 ======================= Grid point 528 (260/361) ======================= q-point: (-0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( -2.675 5.893 17.646) 18.795 2.408 ( -5.766 6.544 22.975) 24.575 3.364 ( -8.417 -2.239 -6.562) 10.905 3.612 ( 6.348 -4.162 -5.253) 9.231 3.810 ( 10.014 5.893 -8.774) 14.560 3.987 ( -14.523 -2.762 10.831) 18.326 4.386 ( -1.394 -14.615 -9.549) 17.514 4.827 ( -4.344 7.404 -4.226) 9.568 5.362 ( 2.328 -1.157 5.024) 5.657 5.842 ( -4.683 1.990 12.568) 13.559 5.923 ( 20.021 0.880 2.089) 20.149 6.281 ( 10.995 -6.354 -1.114) 12.748 6.650 ( -10.583 -6.754 -3.768) 13.107 6.908 ( -2.810 0.719 -0.393) 2.927 7.019 ( -2.281 -3.862 9.197) 10.232 8.061 ( -3.927 -15.885 14.262) 21.706 8.733 ( -2.423 17.402 20.202) 26.774 9.263 ( -2.401 6.578 -6.003) 9.223 9.375 ( -1.875 0.644 2.675) 3.330 9.969 ( 1.961 -8.966 6.791) 11.417 10.176 ( -17.491 -3.152 6.004) 18.759 10.750 ( 1.649 16.828 -7.532) 18.510 11.460 ( 1.325 -2.118 -12.047) 12.303 12.013 ( -7.065 -1.022 -3.208) 7.826 12.639 ( -2.002 6.538 9.283) 11.530 12.832 ( 2.904 -0.459 -3.479) 4.555 13.217 ( -0.938 5.040 0.845) 5.196 14.127 ( 7.757 -4.564 -19.042) 21.062 17.824 ( 7.238 -1.901 -11.126) 13.409 18.822 ( 23.264 -2.223 8.853) 24.991 19.053 ( -10.627 -13.724 -9.345) 19.713 19.822 ( -8.854 6.873 -3.371) 11.704 20.055 ( 22.395 6.762 7.797) 24.659 23.093 ( -21.140 -26.005 -1.251) 33.537 23.295 ( 11.425 5.312 -7.867) 14.854 23.899 ( -17.964 15.769 -6.828) 24.859 ======================= Grid point 529 (261/361) ======================= q-point: (-0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.195 ( 2.092 1.293 15.562) 15.755 2.615 ( -1.757 1.747 24.917) 25.040 3.185 ( -6.274 -1.277 -7.268) 9.686 3.622 ( 3.533 -3.759 -11.391) 12.505 3.806 ( 10.010 4.340 -9.012) 14.151 3.936 ( -8.747 -0.656 6.097) 10.682 4.368 ( -0.699 -9.897 -8.975) 13.379 4.623 ( -5.760 8.722 -4.936) 11.559 5.496 ( 2.338 -0.759 10.086) 10.381 5.891 ( -5.471 2.041 11.729) 13.102 6.135 ( 5.994 0.156 0.503) 6.017 6.457 ( 9.690 -2.936 -2.122) 10.345 6.618 ( 1.704 -3.621 0.940) 4.111 6.752 ( -4.156 2.239 -6.619) 8.130 7.225 ( -5.293 -4.221 20.631) 21.714 8.360 ( -4.478 -23.257 14.411) 27.724 8.772 ( -4.543 20.280 20.694) 29.328 9.148 ( -0.163 3.371 -1.556) 3.716 9.328 ( 0.236 3.511 -5.243) 6.314 10.047 ( -18.395 -1.790 12.420) 22.267 10.178 ( 3.601 -14.760 -1.489) 15.266 10.564 ( 4.383 18.734 1.294) 19.283 11.287 ( -0.910 -0.115 -15.601) 15.628 11.883 ( -7.669 -2.883 -6.121) 10.227 12.672 ( -2.703 4.506 8.838) 10.282 12.850 ( 8.510 1.353 -5.554) 10.252 13.194 ( -1.380 1.166 2.764) 3.302 14.039 ( 6.106 -2.452 -16.473) 17.739 17.837 ( 9.575 -0.650 -7.640) 12.267 18.789 ( -10.387 -2.954 -15.651) 19.015 19.273 ( 18.216 -6.378 3.550) 19.624 19.584 ( -14.018 5.354 2.284) 15.179 20.497 ( 28.325 2.424 11.135) 30.531 22.798 ( -30.604 -11.263 -14.278) 35.600 23.360 ( 10.355 -0.017 -4.632) 11.343 23.513 ( -12.288 9.836 0.682) 15.755 ======================= Grid point 531 (262/361) ======================= q-point: ( 0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.766 ( 0.675 0.000 -10.035) 10.057 2.913 ( 9.072 0.000 7.350) 11.676 3.346 ( -1.263 -0.000 2.372) 2.687 3.358 ( -2.032 -0.000 -5.812) 6.157 3.603 ( -1.728 -0.000 -15.444) 15.540 3.654 ( 3.566 0.000 16.115) 16.505 4.182 ( -1.145 -0.000 0.137) 1.153 4.574 ( 6.384 0.000 1.973) 6.682 5.775 ( -18.071 -0.000 0.087) 18.071 5.777 ( -11.413 -0.000 4.672) 12.333 6.008 ( -6.829 -0.000 3.742) 7.787 6.257 ( -8.212 -0.000 0.520) 8.228 6.702 ( 5.370 0.000 -4.896) 7.267 6.720 ( 4.047 0.000 -0.174) 4.051 8.027 ( -12.022 -0.000 -12.802) 17.562 8.126 ( -3.460 -0.000 25.705) 25.937 8.812 ( -13.489 -0.000 12.076) 18.104 9.224 ( 2.649 0.000 -4.266) 5.022 9.438 ( 0.181 0.000 12.402) 12.404 9.726 ( -5.164 -0.000 -16.226) 17.028 10.503 ( 7.312 0.000 20.115) 21.402 10.909 ( 12.433 0.000 -11.875) 17.193 11.486 ( 13.648 0.000 -17.005) 21.804 11.548 ( 17.487 0.000 16.059) 23.742 12.566 ( -4.663 -0.000 0.197) 4.667 13.000 ( 4.074 0.000 -6.142) 7.371 13.284 ( -9.122 -0.000 10.487) 13.899 13.699 ( 2.999 0.000 -13.742) 14.066 17.750 ( -10.994 -0.000 -11.336) 15.792 18.287 ( 11.135 0.000 8.167) 13.809 19.070 ( -13.859 -0.000 3.481) 14.290 19.661 ( -7.856 -0.000 1.867) 8.075 21.075 ( -11.218 -0.000 -22.551) 25.187 22.200 ( 17.110 0.000 20.429) 26.648 23.230 ( 1.379 0.000 0.263) 1.403 23.706 ( 10.498 0.000 -0.897) 10.536 ======================= Grid point 532 (263/361) ======================= q-point: (-0.80 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.637 ( -1.307 -2.694 -10.987) 11.388 3.018 ( -3.592 1.763 3.696) 5.447 3.279 ( -2.985 2.801 -7.424) 8.478 3.360 ( 2.219 0.633 4.653) 5.194 3.492 ( 6.049 -5.905 -7.992) 11.634 3.845 ( 1.865 5.526 12.128) 13.458 4.258 ( 5.983 -0.819 4.957) 7.813 4.684 ( 2.606 -5.939 1.305) 6.616 5.500 ( -18.392 3.330 0.082) 18.692 5.606 ( -18.105 -3.316 0.321) 18.409 5.935 ( -9.470 -0.531 2.786) 9.885 6.161 ( -8.342 -0.149 2.630) 8.748 6.702 ( 5.816 3.097 -4.823) 8.165 6.810 ( 5.537 -3.600 -0.780) 6.650 7.706 ( -7.336 7.593 -9.065) 13.915 8.265 ( -9.223 5.322 14.615) 18.083 8.791 ( -11.926 -3.379 10.331) 16.136 9.237 ( 2.957 -3.461 -2.106) 5.016 9.450 ( -8.200 -3.783 -12.755) 15.628 9.580 ( -3.016 -0.287 11.941) 12.319 10.852 ( 9.215 0.862 16.105) 18.575 10.969 ( 17.057 8.060 -7.557) 20.323 11.463 ( 17.171 4.275 -19.026) 25.983 11.959 ( 14.317 -3.245 8.681) 17.055 12.583 ( 2.887 -4.461 3.333) 6.272 12.958 ( -1.888 -4.362 -6.440) 8.004 13.253 ( -12.707 2.212 11.648) 17.379 13.593 ( 5.504 -2.569 -13.694) 14.981 17.492 ( -10.765 0.071 -5.910) 12.281 18.571 ( 10.644 -0.438 11.807) 15.902 18.919 ( -9.709 0.792 0.281) 9.746 19.536 ( -14.114 -2.321 3.173) 14.652 20.708 ( -0.307 3.779 -21.732) 22.060 22.584 ( 1.655 -4.270 15.424) 16.089 23.327 ( 11.881 3.823 3.239) 12.894 23.851 ( 9.340 -1.899 1.096) 9.594 ======================= Grid point 533 (264/361) ======================= q-point: (-0.70 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( -1.943 -6.852 -8.534) 11.116 2.943 ( -11.545 4.201 7.757) 14.529 3.120 ( 1.534 -0.813 -11.362) 11.494 3.436 ( -1.991 -4.333 3.163) 5.722 3.605 ( 8.528 -4.254 -2.003) 9.739 3.922 ( 0.272 10.200 10.731) 14.808 4.436 ( 9.711 0.510 4.519) 10.723 4.764 ( -4.248 -7.726 1.214) 8.900 5.214 ( -18.426 1.521 1.343) 18.537 5.408 ( -12.967 -5.213 -0.559) 13.987 5.827 ( -10.082 0.313 2.410) 10.371 6.087 ( -7.297 0.061 2.957) 7.873 6.684 ( 2.443 3.200 -3.571) 5.382 6.897 ( 3.819 -4.140 -2.128) 6.022 7.491 ( -0.514 7.836 -5.978) 9.870 8.140 ( -14.652 6.190 2.879) 16.164 8.786 ( -8.760 -0.899 9.256) 12.775 9.233 ( -7.871 -9.304 -6.957) 14.033 9.350 ( 2.845 -5.987 0.944) 6.695 9.668 ( -5.633 1.726 13.073) 14.339 10.951 ( 11.658 20.206 -4.033) 23.674 11.165 ( 10.084 2.471 9.923) 14.362 11.435 ( 17.871 3.375 -20.069) 27.084 12.176 ( 6.803 -5.704 -1.961) 9.091 12.750 ( 3.875 -1.282 0.703) 4.141 12.909 ( 0.081 -6.898 -3.018) 7.530 13.208 ( -10.311 2.833 15.057) 18.467 13.595 ( 7.879 -10.559 -10.628) 16.927 17.309 ( -9.882 0.483 0.874) 9.932 18.715 ( -4.063 -3.777 -6.400) 8.470 18.932 ( 8.689 4.655 12.866) 16.208 19.425 ( -9.514 -3.234 2.887) 10.455 20.461 ( 3.047 4.145 -16.330) 17.122 22.705 ( -9.767 -9.084 6.415) 14.801 23.508 ( 14.729 12.795 4.064) 19.929 24.056 ( 8.400 -7.126 6.190) 12.636 ======================= Grid point 534 (265/361) ======================= q-point: (-0.60 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.467 ( -4.763 -2.268 -3.351) 6.250 2.815 ( -16.133 6.857 11.014) 20.702 3.128 ( 9.282 -9.420 -6.637) 14.797 3.453 ( -3.030 -3.796 -0.411) 4.874 3.708 ( 1.936 -7.377 -1.816) 7.840 3.953 ( 0.571 11.683 10.151) 15.487 4.602 ( 4.282 2.773 0.293) 5.110 4.654 ( -14.313 -3.833 2.695) 15.061 5.106 ( -6.316 -10.336 3.828) 12.703 5.347 ( -2.473 -2.555 1.723) 3.952 5.732 ( -7.508 0.459 4.281) 8.655 6.025 ( -4.965 0.473 1.349) 5.167 6.620 ( -3.302 2.728 -1.016) 4.402 6.924 ( -0.912 -5.132 -4.107) 6.636 7.379 ( 3.643 6.092 -7.396) 10.251 7.886 ( -16.380 1.783 0.345) 16.480 8.784 ( -4.946 2.362 7.689) 9.443 9.169 ( -8.027 -12.094 -0.618) 14.528 9.496 ( 4.742 -4.171 4.894) 7.990 9.712 ( -7.276 1.408 11.430) 13.622 10.814 ( 6.551 25.861 -4.031) 26.981 11.345 ( 7.742 6.029 3.717) 10.493 11.402 ( 16.076 2.731 -19.313) 25.276 12.264 ( 3.551 -5.988 -3.095) 7.619 12.711 ( -3.299 -4.368 -4.474) 7.070 12.895 ( -7.301 1.029 1.947) 7.626 13.339 ( 4.959 1.896 9.539) 10.917 13.738 ( 8.982 -16.173 -6.008) 19.451 17.258 ( -5.932 -1.734 9.284) 11.153 18.560 ( -2.968 -4.227 -15.130) 15.987 19.147 ( 8.441 8.500 8.579) 14.734 19.419 ( 1.858 -1.243 2.318) 3.220 20.321 ( 0.926 0.427 -7.970) 8.035 22.684 ( -13.629 -12.795 2.640) 18.879 23.578 ( 10.788 16.122 0.118) 19.399 24.327 ( 5.062 -8.268 8.326) 12.779 ======================= Grid point 535 (266/361) ======================= q-point: (-0.50 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.364 ( -7.414 7.427 4.858) 11.564 2.638 ( -17.990 9.635 12.617) 23.993 3.330 ( 10.149 -12.056 -2.288) 15.924 3.433 ( -1.357 -2.687 -1.603) 3.411 3.761 ( -4.125 -12.278 -0.666) 12.969 3.982 ( 4.875 11.865 5.080) 13.797 4.355 ( -20.688 -5.615 -1.662) 21.501 4.767 ( 4.048 -3.336 3.451) 6.279 5.229 ( -0.946 -11.454 4.764) 12.441 5.395 ( 4.878 3.259 4.280) 7.261 5.738 ( -1.704 0.020 7.652) 7.839 5.977 ( -1.313 -0.014 -1.035) 1.672 6.552 ( -5.214 0.257 3.874) 6.501 6.854 ( -8.390 -7.381 -5.889) 12.632 7.274 ( 2.164 2.670 -10.218) 10.780 7.716 ( -11.950 -3.967 3.607) 13.098 8.810 ( -0.705 6.043 9.612) 11.376 9.184 ( -9.375 -10.806 5.208) 15.224 9.652 ( 4.266 -1.910 4.938) 6.799 9.714 ( -6.882 1.436 6.693) 9.707 10.605 ( 1.237 23.280 -1.718) 23.376 11.297 ( 13.282 8.035 -18.557) 24.194 11.442 ( 7.346 3.987 -1.781) 8.546 12.297 ( -1.183 -3.213 -2.320) 4.136 12.676 ( -1.218 -3.366 -1.790) 4.002 12.805 ( -7.873 0.537 4.074) 8.881 13.439 ( 3.092 3.746 1.737) 5.158 13.934 ( 8.693 -13.814 -6.870) 17.709 17.416 ( 0.655 -6.783 15.762) 17.172 18.363 ( 1.340 -3.783 -19.204) 19.619 19.199 ( 3.262 9.791 0.902) 10.359 19.557 ( 13.371 1.166 1.534) 13.509 20.262 ( -2.739 -1.250 -1.773) 3.494 22.647 ( -14.844 -16.802 2.915) 22.609 23.551 ( 8.153 14.890 -2.672) 17.185 24.489 ( -2.226 -5.075 3.407) 6.505 ======================= Grid point 536 (267/361) ======================= q-point: (-0.40 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -9.632 15.054 12.595) 21.865 2.508 ( -12.177 8.141 15.904) 21.622 3.415 ( -4.343 -4.933 -1.977) 6.864 3.497 ( 4.192 -5.142 -1.138) 6.732 3.805 ( -4.622 -11.685 0.373) 12.571 3.986 ( 7.543 9.450 -2.253) 12.299 4.170 ( -12.434 -10.785 -1.828) 16.561 4.880 ( 0.195 -5.592 2.555) 6.151 5.302 ( -1.072 -2.419 0.782) 2.759 5.589 ( 10.708 0.430 10.664) 15.118 5.840 ( 2.634 1.752 7.582) 8.215 5.993 ( 3.851 -3.170 -0.057) 4.988 6.594 ( -3.826 -5.224 8.066) 10.343 6.699 ( -13.460 -9.097 -2.923) 16.507 7.151 ( -0.120 0.554 -10.020) 10.036 7.700 ( -7.373 -8.972 5.604) 12.894 8.883 ( 0.534 8.520 12.798) 15.384 9.228 ( -9.827 -8.964 10.392) 16.879 9.631 ( -5.427 6.473 -1.136) 8.523 9.758 ( 1.299 -1.127 3.548) 3.943 10.417 ( -3.449 15.800 2.778) 16.409 11.170 ( 12.790 10.342 -18.381) 24.666 11.468 ( 5.647 2.477 -4.256) 7.492 12.209 ( -7.137 1.261 -3.722) 8.148 12.689 ( -0.710 0.256 3.737) 3.812 12.786 ( -2.533 -1.534 3.583) 4.648 13.419 ( -0.393 6.179 -0.081) 6.192 14.030 ( 6.386 -9.871 -12.199) 16.942 17.696 ( 4.409 -7.381 6.954) 11.058 18.289 ( 8.785 -9.564 -8.360) 15.444 19.120 ( -0.697 6.810 -3.377) 7.634 19.778 ( 18.247 2.542 -0.463) 18.429 20.196 ( -3.981 2.948 0.027) 4.954 22.645 ( -16.160 -20.945 4.290) 26.800 23.488 ( 7.344 12.270 -4.968) 15.138 24.415 ( -10.677 0.745 -3.816) 11.363 ======================= Grid point 537 (268/361) ======================= q-point: (-0.30 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.178 ( -5.403 11.920 14.939) 19.861 2.531 ( -8.489 6.233 20.993) 23.487 3.308 ( -9.541 -3.849 -4.950) 11.417 3.548 ( 2.779 -3.194 -3.396) 5.427 3.851 ( -2.913 -6.653 2.593) 7.711 3.977 ( 8.091 6.504 -7.740) 12.949 4.139 ( -2.649 -11.596 -2.745) 12.207 4.890 ( -4.356 -0.695 -1.372) 4.619 5.350 ( 2.243 -0.193 5.239) 5.703 5.859 ( 1.984 -0.296 14.039) 14.182 5.955 ( 11.248 2.310 1.469) 11.577 6.153 ( 8.564 -6.681 3.189) 11.320 6.518 ( -10.915 -7.550 -1.659) 13.375 6.812 ( -2.601 -9.838 14.818) 17.975 7.002 ( -3.328 0.977 -9.218) 9.850 7.788 ( -7.491 -14.750 8.124) 18.431 8.973 ( -0.658 9.109 14.672) 17.283 9.329 ( -8.419 -5.108 14.679) 17.676 9.441 ( -1.938 9.432 -6.435) 11.581 9.802 ( -2.689 -3.843 2.561) 5.344 10.285 ( -5.920 11.939 5.991) 14.611 11.026 ( 11.678 13.585 -15.472) 23.670 11.430 ( 2.203 -0.057 -10.323) 10.556 12.019 ( -10.211 1.492 -3.701) 10.963 12.736 ( -1.340 3.226 8.505) 9.194 12.827 ( 3.557 0.321 0.625) 3.626 13.335 ( -2.553 7.111 0.238) 7.559 14.013 ( 5.071 -7.740 -15.573) 18.115 17.781 ( 6.829 -2.670 -8.340) 11.104 18.585 ( 8.244 -20.217 5.711) 22.568 19.003 ( 1.854 5.567 -5.301) 7.908 19.885 ( -2.629 0.742 -5.009) 5.705 20.221 ( 18.342 9.948 5.407) 21.555 22.644 ( -20.109 -22.972 2.919) 30.670 23.428 ( 8.404 9.162 -6.671) 14.109 24.106 ( -16.535 7.340 -7.558) 19.606 ======================= Grid point 538 (269/361) ======================= q-point: (-0.20 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 0.392 4.911 13.972) 14.815 2.661 ( -5.737 2.771 23.412) 24.263 3.145 ( -7.115 -2.987 -6.281) 9.950 3.544 ( 1.126 -4.263 -7.584) 8.773 3.865 ( -3.403 -4.902 -9.174) 10.944 3.926 ( 8.836 5.034 -3.873) 10.882 4.206 ( 1.769 -6.133 0.178) 6.386 4.758 ( -5.611 4.989 -4.777) 8.899 5.482 ( 2.044 -0.298 10.481) 10.682 5.952 ( -5.001 4.136 12.451) 14.041 6.134 ( 7.838 -0.534 -0.799) 7.896 6.374 ( 8.711 -5.508 2.615) 10.633 6.517 ( 1.197 -6.969 2.882) 7.636 6.801 ( -5.257 2.619 -7.637) 9.634 7.080 ( -3.882 -11.459 17.747) 21.479 7.950 ( -8.518 -21.825 9.771) 25.384 9.049 ( -3.746 9.991 16.315) 19.494 9.244 ( -2.713 6.779 -1.124) 7.388 9.440 ( -1.430 5.489 6.086) 8.319 9.842 ( -4.360 -10.116 2.474) 11.290 10.184 ( -6.350 8.537 8.179) 13.421 10.890 ( 10.744 16.649 -9.174) 21.836 11.284 ( 0.570 0.074 -15.086) 15.097 11.821 ( -10.696 -2.867 -6.082) 12.633 12.785 ( -2.086 6.168 9.397) 11.432 12.891 ( 8.714 3.206 -1.823) 9.462 13.243 ( -3.634 4.486 1.323) 5.923 13.954 ( 4.496 -6.765 -15.252) 17.281 17.816 ( 9.540 -1.623 -6.897) 11.883 18.681 ( -11.068 -9.130 -8.429) 16.640 19.146 ( 17.210 -5.887 3.015) 18.437 19.681 ( -10.831 3.949 -3.915) 12.175 20.583 ( 27.387 7.046 10.198) 30.062 22.506 ( -26.155 -18.429 -4.842) 32.360 23.412 ( 9.768 5.175 -6.024) 12.589 23.707 ( -15.621 9.848 -4.858) 19.094 ======================= Grid point 539 (270/361) ======================= q-point: (-0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( 5.153 1.089 12.112) 13.208 2.860 ( -2.468 -0.931 14.244) 14.487 3.053 ( -1.197 -2.770 1.728) 3.477 3.483 ( -0.229 -4.634 -8.699) 9.859 3.704 ( -1.699 -0.995 -13.752) 13.892 3.937 ( 2.930 1.792 -5.907) 6.833 4.291 ( 2.850 -1.550 2.301) 3.978 4.548 ( -4.956 8.208 -5.793) 11.202 5.652 ( 1.041 -1.045 11.794) 11.886 5.990 ( -6.376 4.059 13.061) 15.091 6.140 ( -2.301 0.487 -2.395) 3.357 6.490 ( 0.259 -0.536 -2.985) 3.043 6.632 ( 1.369 -3.229 -2.134) 4.105 6.684 ( 3.504 -0.562 -1.113) 3.719 7.381 ( -2.509 -9.577 24.883) 26.780 8.155 ( -9.010 -27.667 5.295) 29.575 9.077 ( -8.343 13.220 18.511) 24.229 9.212 ( 3.711 3.902 0.590) 5.417 9.323 ( -4.127 11.038 -2.734) 12.097 9.911 ( -3.329 -8.969 3.948) 10.350 10.173 ( -2.278 3.068 5.521) 6.715 10.863 ( 11.043 12.637 4.007) 17.254 11.110 ( 2.716 1.350 -15.226) 15.526 11.632 ( -5.491 -5.855 -11.255) 13.824 12.769 ( -4.354 8.274 5.450) 10.822 12.959 ( 10.533 4.951 -3.807) 12.246 13.212 ( -3.730 -0.669 5.261) 6.483 13.892 ( 3.674 -5.098 -13.331) 14.738 17.911 ( 10.569 -0.658 -2.428) 10.864 18.419 ( -11.215 -1.571 -14.508) 18.405 19.354 ( -9.753 -3.961 4.216) 11.340 19.555 ( 8.401 -0.058 -1.848) 8.602 21.079 ( 26.704 2.719 15.119) 30.808 22.119 ( -27.591 -7.917 -14.163) 32.008 23.399 ( -7.593 5.354 -0.680) 9.316 23.483 ( 7.430 2.255 -3.873) 8.677 ======================= Grid point 542 (271/361) ======================= q-point: ( 0.20 0.20 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -0.316 -0.000 -9.781) 9.786 2.975 ( -9.128 -0.000 4.941) 10.379 3.130 ( -0.266 -0.000 -13.459) 13.462 3.375 ( -3.344 -0.000 3.300) 4.698 3.569 ( 8.146 0.000 -0.261) 8.151 4.037 ( -0.427 -0.000 13.452) 13.459 4.451 ( 8.991 0.000 7.545) 11.737 4.655 ( -3.034 -0.000 0.013) 3.034 5.258 ( -24.868 -0.000 -1.945) 24.944 5.341 ( -8.500 -0.000 1.220) 8.587 5.832 ( -10.576 -0.000 3.969) 11.296 6.088 ( -7.062 -0.000 3.078) 7.703 6.723 ( 3.219 0.000 -5.280) 6.183 6.849 ( 2.824 0.000 -0.526) 2.872 7.563 ( -2.501 -0.000 -7.449) 7.858 8.195 ( -17.989 -0.000 3.056) 18.247 8.796 ( -9.377 -0.000 15.043) 17.726 9.126 ( -5.025 -0.000 -14.277) 15.136 9.294 ( 5.507 0.000 0.785) 5.562 9.688 ( -6.894 -0.000 14.799) 16.326 11.155 ( 7.072 0.000 11.906) 13.848 11.185 ( 20.100 0.000 -7.159) 21.337 11.486 ( 18.752 0.000 -22.109) 28.991 12.102 ( 3.107 0.000 0.658) 3.175 12.777 ( 12.891 0.000 6.586) 14.476 12.794 ( -5.926 -0.000 -7.135) 9.275 13.238 ( -12.360 -0.000 16.122) 20.314 13.496 ( 7.020 0.000 -13.515) 15.230 17.314 ( -10.275 -0.000 0.835) 10.309 18.681 ( -4.342 -0.000 -5.857) 7.291 18.979 ( 8.096 0.000 15.028) 17.070 19.392 ( -8.556 -0.000 3.183) 9.129 20.498 ( 2.753 0.000 -19.288) 19.484 22.622 ( -10.018 -0.000 6.807) 12.112 23.654 ( 15.213 0.000 10.960) 18.750 23.963 ( 7.331 0.000 0.295) 7.337 ======================= Grid point 543 (272/361) ======================= q-point: (-0.70 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.426 ( 3.173 -1.559 -2.642) 4.414 2.913 ( -12.463 3.071 10.691) 16.705 3.003 ( 6.076 -3.506 -12.692) 14.502 3.365 ( -3.482 -4.017 -0.128) 5.318 3.629 ( -0.782 -1.791 -0.064) 1.955 4.147 ( -3.848 7.526 14.550) 16.827 4.595 ( -7.709 -2.127 -0.092) 7.998 4.646 ( 3.959 1.387 3.330) 5.356 4.928 ( -16.617 -6.823 1.338) 18.013 5.323 ( 1.026 -0.498 3.171) 3.370 5.747 ( -10.216 0.693 7.339) 12.598 6.035 ( -4.286 0.379 1.428) 4.534 6.659 ( -3.738 1.388 -3.002) 4.991 6.849 ( -2.870 -2.660 -2.430) 4.606 7.459 ( 1.567 2.342 -7.798) 8.292 7.899 ( -20.722 0.306 -3.609) 21.036 8.851 ( -5.760 3.613 13.305) 14.942 8.970 ( -2.897 -7.663 -6.653) 10.554 9.440 ( 8.016 -1.899 4.822) 9.545 9.738 ( -10.829 1.016 14.676) 18.267 11.227 ( 7.899 16.720 -2.944) 18.725 11.394 ( 12.436 -1.009 -1.317) 12.546 11.458 ( 18.823 2.675 -21.907) 29.006 12.157 ( 1.739 -4.827 0.212) 5.136 12.640 ( -5.430 -2.602 -4.917) 7.774 12.901 ( -3.975 -0.125 2.152) 4.522 13.377 ( 4.371 2.916 11.525) 12.666 13.498 ( 7.570 -9.430 -5.491) 13.281 17.236 ( -8.019 -0.608 8.036) 11.369 18.501 ( -3.749 -1.812 -13.856) 14.468 19.279 ( 8.984 4.628 13.880) 17.169 19.400 ( 3.838 -0.754 3.003) 4.931 20.311 ( 0.185 -0.780 -14.626) 14.648 22.526 ( -14.040 -4.561 3.223) 15.110 23.866 ( 8.571 15.241 5.176) 18.236 24.138 ( 5.561 -12.266 5.104) 14.403 ======================= Grid point 544 (273/361) ======================= q-point: (-0.60 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( 1.267 4.918 5.866) 7.759 2.807 ( -12.542 8.481 10.324) 18.325 3.098 ( 8.594 -11.912 -3.113) 15.015 3.358 ( -0.559 -5.328 -2.438) 5.886 3.600 ( -5.746 -5.453 -0.653) 7.948 4.152 ( -10.434 2.826 9.399) 14.325 4.333 ( -12.589 6.851 -3.745) 14.814 4.716 ( -0.727 -3.895 3.388) 5.213 5.017 ( 0.851 -9.816 7.830) 12.585 5.432 ( 6.965 0.875 4.836) 8.524 5.739 ( -6.684 0.207 12.286) 13.988 5.995 ( -0.393 1.308 -1.075) 1.738 6.552 ( -7.582 -0.355 1.087) 7.668 6.741 ( -11.663 -4.744 -4.135) 13.252 7.336 ( 0.284 4.147 -10.525) 11.316 7.617 ( -14.170 -5.948 -3.189) 15.695 8.910 ( -0.159 3.034 9.178) 9.668 8.983 ( -4.701 -8.135 3.392) 9.990 9.637 ( 6.593 -0.062 7.396) 9.908 9.733 ( -12.370 0.768 13.154) 18.073 11.053 ( 4.022 23.178 -7.636) 24.733 11.386 ( 15.243 2.379 -22.574) 27.342 11.540 ( 12.377 5.185 -3.268) 13.811 12.221 ( -0.569 -4.758 0.524) 4.820 12.592 ( -1.288 -4.809 -0.683) 5.025 12.827 ( -9.498 1.097 4.765) 10.682 13.453 ( 6.047 -2.158 -5.773) 8.634 13.727 ( 6.562 -7.654 5.260) 11.372 17.319 ( -2.667 -3.843 14.942) 15.658 18.286 ( -0.878 -3.683 -19.384) 19.751 19.420 ( 4.769 12.574 4.726) 14.254 19.572 ( 15.262 0.534 1.923) 15.391 20.187 ( -2.538 -6.097 -7.102) 9.698 22.415 ( -15.479 -8.723 3.533) 18.116 23.834 ( 4.848 16.038 -0.546) 16.763 24.347 ( -1.144 -10.426 4.331) 11.348 ======================= Grid point 545 (274/361) ======================= q-point: (-0.50 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.496 ( -4.211 11.059 12.000) 16.853 2.672 ( -12.082 11.680 12.423) 20.897 3.262 ( -1.594 -11.576 -0.611) 11.702 3.410 ( 5.052 -4.954 -1.398) 7.212 3.587 ( -3.469 -10.775 -2.464) 11.585 4.003 ( -16.724 -7.404 2.354) 18.440 4.202 ( 6.921 12.315 -2.273) 14.309 4.778 ( -3.453 -5.419 4.488) 7.838 5.201 ( 0.873 -6.770 6.800) 9.635 5.611 ( 9.893 1.071 6.526) 11.899 5.847 ( -2.414 -0.442 14.426) 14.634 5.987 ( 2.810 1.709 0.087) 3.290 6.514 ( -8.667 -3.928 5.728) 11.106 6.540 ( -13.756 -7.874 -2.776) 16.092 7.169 ( -1.578 1.892 -9.549) 9.862 7.525 ( -6.506 -10.019 -1.992) 12.111 9.006 ( -2.271 4.981 13.868) 14.909 9.046 ( -3.452 -9.704 4.039) 11.063 9.676 ( -16.003 0.987 13.573) 21.007 9.803 ( 6.993 3.768 3.658) 8.745 10.784 ( 1.161 22.040 -7.323) 23.254 11.289 ( 14.997 3.105 -23.415) 27.979 11.584 ( 10.389 9.333 -5.195) 14.900 12.206 ( -5.918 -1.738 -1.575) 6.366 12.655 ( 1.537 -3.149 3.651) 5.060 12.776 ( -5.960 -0.130 6.876) 9.101 13.466 ( 3.260 -1.234 -5.453) 6.472 13.876 ( 2.148 -6.061 -1.283) 6.557 17.570 ( 2.791 -6.267 15.179) 16.658 18.112 ( 3.104 -8.592 -17.226) 19.499 19.329 ( 0.648 14.611 -3.397) 15.014 19.808 ( 14.844 0.548 -0.808) 14.876 20.182 ( 3.104 -4.192 -1.222) 5.358 22.342 ( -16.187 -12.494 5.202) 21.099 23.729 ( 3.517 13.991 -3.548) 14.856 24.368 ( -9.014 -5.716 -1.484) 10.776 ======================= Grid point 546 (275/361) ======================= q-point: (-0.40 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.421 ( -8.821 14.053 11.822) 20.373 2.632 ( -8.592 6.015 17.338) 20.263 3.225 ( -9.808 -5.486 -2.817) 11.585 3.485 ( 0.638 -4.272 -1.416) 4.545 3.639 ( 1.507 -14.269 -5.714) 15.444 3.990 ( -3.275 -5.429 7.174) 9.574 4.156 ( 10.506 11.444 -8.507) 17.712 4.813 ( -4.701 -6.960 0.898) 8.447 5.339 ( 2.512 -1.294 7.493) 8.008 5.837 ( 7.428 -2.175 8.205) 11.280 5.987 ( 2.300 1.312 7.972) 8.400 6.075 ( 2.759 -1.747 8.978) 9.554 6.385 ( -9.332 -7.155 -0.510) 11.771 6.626 ( -3.967 -9.918 11.118) 15.418 7.018 ( -3.327 0.801 -8.610) 9.265 7.534 ( -6.015 -13.194 0.171) 14.501 9.085 ( -4.699 3.921 14.263) 15.521 9.176 ( -1.534 -9.361 8.549) 12.770 9.570 ( -14.536 4.144 7.741) 16.982 9.862 ( 2.573 7.861 3.939) 9.161 10.549 ( -0.234 16.154 -3.492) 16.528 11.194 ( 16.024 4.176 -22.049) 27.574 11.521 ( 5.952 10.989 -9.663) 15.797 12.048 ( -11.636 1.209 -3.384) 12.179 12.749 ( -0.855 -0.994 7.531) 7.644 12.843 ( 3.898 0.590 5.793) 7.008 13.430 ( -0.379 2.469 -2.878) 3.811 13.879 ( -0.632 -6.060 -7.709) 9.826 17.738 ( 6.210 -1.837 -4.644) 7.969 18.226 ( 5.022 -18.607 4.897) 19.885 19.152 ( 0.735 10.302 -6.510) 12.208 19.863 ( -4.026 -3.097 -4.234) 6.613 20.372 ( 23.846 6.331 2.134) 24.764 22.295 ( -18.360 -15.427 5.135) 24.524 23.611 ( 3.941 10.835 -5.476) 12.764 24.171 ( -14.614 0.211 -6.432) 15.968 ======================= Grid point 547 (276/361) ======================= q-point: (-0.30 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -3.807 7.844 11.453) 14.394 2.709 ( -7.628 3.035 20.233) 21.835 3.084 ( -7.769 -3.731 -4.673) 9.804 3.471 ( -2.040 -4.286 -5.447) 7.225 3.695 ( 1.068 -11.316 -8.847) 14.404 4.053 ( 5.348 7.074 -4.196) 9.810 4.154 ( 7.037 0.096 1.971) 7.308 4.781 ( -3.980 -2.502 -3.422) 5.814 5.490 ( 2.577 0.889 10.704) 11.045 6.013 ( -2.349 0.956 12.349) 12.607 6.107 ( 7.375 -1.686 0.028) 7.565 6.281 ( 3.530 -4.472 11.135) 12.508 6.399 ( 1.878 -5.160 2.537) 6.049 6.833 ( -6.038 -5.703 -0.664) 8.332 6.847 ( -2.851 -6.936 6.633) 10.012 7.591 ( -8.086 -17.646 2.577) 19.581 9.157 ( -5.091 3.301 14.240) 15.479 9.342 ( -8.333 -3.210 12.028) 14.981 9.420 ( -2.606 1.491 0.332) 3.021 9.861 ( -1.265 8.779 7.897) 11.875 10.385 ( -2.341 12.190 -0.878) 12.444 11.129 ( 17.085 7.411 -18.252) 26.076 11.337 ( 2.574 9.039 -13.124) 16.142 11.800 ( -14.078 0.470 -5.782) 15.227 12.837 ( -1.638 -0.363 8.677) 8.838 12.977 ( 9.394 5.765 4.199) 11.794 13.340 ( -4.561 5.346 -0.277) 7.033 13.812 ( 0.207 -8.159 -11.842) 14.382 17.784 ( 9.443 -1.813 -5.995) 11.332 18.476 ( -4.362 -12.841 3.475) 14.000 19.088 ( 8.867 -0.560 -3.887) 9.698 19.710 ( -9.084 -0.716 -6.262) 11.056 20.733 ( 28.550 8.996 6.889) 30.717 22.194 ( -21.987 -15.511 0.363) 26.910 23.526 ( 5.880 7.170 -5.780) 10.927 23.841 ( -15.540 4.944 -6.918) 17.714 ======================= Grid point 548 (277/361) ======================= q-point: (-0.20 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 3.068 2.683 11.106) 11.830 2.840 ( -4.877 -0.968 14.261) 15.103 3.003 ( -0.879 -2.425 -0.238) 2.591 3.389 ( -3.617 -5.674 -7.375) 9.984 3.648 ( 0.071 -4.477 -10.717) 11.615 3.992 ( 4.713 4.072 -8.961) 10.913 4.294 ( 4.470 0.743 5.831) 7.384 4.663 ( -2.709 4.144 -5.999) 7.778 5.649 ( 0.759 0.680 12.110) 12.153 6.073 ( -6.652 4.435 12.908) 15.183 6.146 ( 0.200 0.077 -3.661) 3.667 6.477 ( 3.320 -1.022 1.575) 3.814 6.547 ( 3.453 -5.865 2.523) 7.259 6.673 ( -1.671 -0.469 -2.591) 3.119 7.149 ( -0.094 -15.492 18.822) 24.378 7.683 ( -9.854 -23.689 2.380) 25.767 9.219 ( -6.630 5.031 14.061) 16.339 9.272 ( -4.811 3.432 6.507) 8.790 9.480 ( -3.867 -0.190 1.704) 4.230 9.868 ( -0.145 6.943 6.270) 9.356 10.263 ( -2.292 7.090 3.956) 8.436 11.078 ( 9.078 7.424 -12.797) 17.358 11.180 ( 9.476 9.413 -9.103) 16.164 11.536 ( -8.720 -3.664 -10.699) 14.281 12.902 ( -2.931 3.903 7.692) 9.110 13.078 ( 8.065 8.459 2.242) 11.901 13.225 ( -4.732 3.165 0.655) 5.730 13.762 ( 2.470 -9.016 -12.024) 15.231 17.897 ( 10.303 -0.883 -0.704) 10.364 18.387 ( -9.629 -1.724 -8.280) 12.816 19.242 ( -0.110 -8.158 1.806) 8.356 19.552 ( 1.379 -0.541 -5.401) 5.600 21.155 ( 21.845 5.683 13.181) 26.139 21.952 ( -19.857 -9.815 -8.938) 23.886 23.504 ( 0.659 5.530 -3.555) 6.607 23.539 ( -4.579 3.834 -4.203) 7.303 ======================= Grid point 549 (278/361) ======================= q-point: (-0.10 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.652 ( 6.821 -0.367 9.845) 11.982 2.868 ( 2.145 0.754 -3.499) 4.173 3.133 ( 0.589 -6.271 8.959) 10.951 3.339 ( -1.642 -7.393 -2.078) 7.853 3.550 ( -0.253 0.684 -6.174) 6.217 3.874 ( 0.628 3.471 -11.330) 11.866 4.330 ( -4.404 4.047 0.359) 5.992 4.575 ( 6.314 6.089 -0.646) 8.795 5.769 ( -3.888 0.160 10.294) 11.005 6.013 ( -11.814 0.958 0.466) 11.862 6.095 ( -3.754 4.075 4.566) 7.179 6.389 ( -8.235 0.692 -1.875) 8.474 6.615 ( 3.167 -2.216 -2.155) 4.426 6.742 ( 5.434 0.580 -0.404) 5.480 7.579 ( 3.141 -15.051 23.698) 28.249 7.783 ( -9.839 -26.907 -1.824) 28.708 9.232 ( -11.923 9.031 9.893) 17.933 9.288 ( -2.962 2.412 7.282) 8.223 9.325 ( -3.072 7.753 0.866) 8.384 9.890 ( 2.708 0.117 -2.416) 3.630 10.321 ( 2.766 4.444 11.707) 12.824 10.889 ( -4.405 0.094 -11.852) 12.645 11.269 ( 16.793 8.501 3.148) 19.084 11.424 ( 8.445 -5.427 -13.632) 16.929 12.826 ( -5.777 10.329 1.848) 11.978 13.118 ( 5.795 7.734 -0.396) 9.673 13.199 ( -4.815 -2.939 5.464) 7.854 13.739 ( 4.331 -5.717 -11.196) 13.296 18.034 ( 0.430 -0.212 -1.745) 1.810 18.133 ( -0.728 2.329 -7.602) 7.984 19.182 ( -13.539 -3.005 2.691) 14.127 19.644 ( 7.786 -2.955 -1.396) 8.444 21.343 ( -19.346 -9.427 -2.839) 21.707 21.841 ( 21.015 6.757 3.798) 22.399 23.318 ( -6.812 3.848 -1.432) 7.953 23.589 ( 9.383 0.985 -1.634) 9.575 ======================= Grid point 553 (279/361) ======================= q-point: ( 0.30 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 5.471 0.000 7.225) 9.062 2.885 ( -4.051 -0.000 1.262) 4.242 2.987 ( 3.100 0.000 3.508) 4.682 3.292 ( -1.208 -0.000 -2.561) 2.832 3.554 ( -7.812 -0.000 0.047) 7.812 4.149 ( -21.810 -0.000 6.562) 22.776 4.489 ( -4.391 -0.000 -2.863) 5.242 4.612 ( -3.616 -0.000 4.641) 5.883 4.934 ( 3.788 0.000 10.382) 11.051 5.437 ( 7.733 0.000 3.885) 8.654 5.743 ( -9.342 -0.000 14.646) 17.371 6.008 ( 0.370 0.000 -1.349) 1.399 6.546 ( -8.641 -0.000 -0.482) 8.655 6.697 ( -13.106 -0.000 -2.421) 13.328 7.390 ( 2.282 0.000 -9.617) 9.884 7.547 ( -17.195 -0.000 -7.277) 18.671 8.867 ( 2.544 0.000 -3.717) 4.504 8.977 ( -7.098 -0.000 17.178) 18.587 9.637 ( 10.263 0.000 6.564) 12.182 9.741 ( -15.165 -0.000 15.229) 21.492 11.302 ( 1.008 0.000 -8.529) 8.589 11.405 ( 14.526 0.000 -22.182) 26.515 11.581 ( 20.842 0.000 -9.376) 22.854 12.164 ( -2.708 -0.000 4.484) 5.238 12.541 ( -1.308 -0.000 0.023) 1.309 12.836 ( -9.625 -0.000 4.570) 10.655 13.415 ( 8.083 0.000 -11.128) 13.754 13.667 ( 4.945 0.000 12.442) 13.388 17.284 ( -3.843 -0.000 14.500) 15.001 18.251 ( -1.485 -0.000 -19.390) 19.447 19.558 ( 5.383 0.000 9.883) 11.254 19.577 ( 15.896 0.000 1.972) 16.018 20.110 ( -2.801 -0.000 -12.677) 12.983 22.336 ( -15.362 -0.000 3.795) 15.824 24.077 ( 2.240 0.000 -2.872) 3.642 24.155 ( 0.425 0.000 7.783) 7.795 ======================= Grid point 555 (280/361) ======================= q-point: (-0.60 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.646 ( -2.993 6.061 11.371) 13.229 2.874 ( -2.592 5.522 6.503) 8.916 3.091 ( 0.316 -2.480 3.394) 4.215 3.292 ( 0.758 -8.014 -1.789) 8.246 3.450 ( -6.158 -3.740 -2.075) 7.498 3.909 ( -15.428 -2.773 3.219) 16.002 4.383 ( 1.318 6.489 -2.408) 7.046 4.690 ( -3.529 -3.826 5.403) 7.502 5.120 ( 2.966 -1.820 10.594) 11.151 5.605 ( 8.765 -1.068 3.421) 9.469 5.848 ( -6.535 0.463 20.533) 21.553 6.020 ( 4.908 1.220 -1.518) 5.280 6.443 ( -17.838 -2.467 -1.112) 18.043 6.453 ( -10.330 -2.503 4.932) 11.718 7.230 ( -4.127 4.864 -9.376) 11.340 7.359 ( -2.417 -8.027 -7.844) 11.480 8.912 ( 2.722 -4.081 1.022) 5.011 9.071 ( -8.175 1.786 17.183) 19.113 9.693 ( -17.780 0.685 15.805) 23.799 9.851 ( 9.428 1.428 5.481) 10.998 11.107 ( 1.086 11.139 -14.963) 18.685 11.316 ( 13.227 0.520 -23.135) 26.654 11.729 ( 18.005 5.139 -8.837) 20.704 12.157 ( -6.968 -2.654 2.447) 7.848 12.605 ( 3.695 -1.785 5.061) 6.516 12.771 ( -8.795 -0.353 6.767) 11.103 13.412 ( 6.817 -2.773 -9.053) 11.666 13.819 ( -1.057 -1.019 6.725) 6.883 17.487 ( 1.548 -2.582 18.755) 18.995 18.007 ( 1.338 -2.928 -20.997) 21.242 19.594 ( -0.860 13.435 -1.671) 13.566 19.778 ( 4.857 -4.840 -2.531) 7.308 20.083 ( 16.030 -4.694 -2.644) 16.911 22.197 ( -15.392 -3.897 5.629) 16.846 23.969 ( -0.333 11.764 -3.624) 12.314 24.227 ( -7.007 -8.921 0.755) 11.369 ======================= Grid point 556 (281/361) ======================= q-point: (-0.50 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.622 ( -11.521 7.430 11.003) 17.579 2.802 ( -5.566 13.240 9.365) 17.146 3.114 ( -6.481 -6.383 -0.561) 9.114 3.341 ( -4.043 -13.079 -3.095) 14.036 3.444 ( 3.079 -5.095 -1.468) 6.131 3.922 ( 1.448 -2.392 8.358) 8.813 4.346 ( 8.346 8.567 -6.258) 13.499 4.683 ( -6.866 -6.352 0.555) 9.370 5.312 ( 3.661 -1.205 10.887) 11.550 5.774 ( 4.924 -4.486 3.837) 7.687 6.018 ( -2.386 2.309 17.612) 17.922 6.084 ( 1.025 2.302 7.569) 7.978 6.267 ( -7.734 -5.710 1.070) 9.673 6.474 ( -6.491 -6.742 9.108) 13.059 7.039 ( -4.191 1.657 -8.169) 9.329 7.331 ( -0.352 -8.856 -6.717) 11.121 9.031 ( 2.324 -5.442 5.767) 8.263 9.139 ( -9.408 1.609 17.011) 19.506 9.615 ( -18.648 1.510 14.725) 23.809 9.991 ( 7.307 5.270 2.812) 9.438 10.821 ( 0.446 12.660 -14.335) 19.131 11.222 ( 13.453 0.328 -21.624) 25.469 11.749 ( 12.735 11.751 -11.744) 20.932 12.053 ( -11.074 -0.745 -1.911) 11.262 12.730 ( -2.685 -0.483 8.859) 9.270 12.825 ( 5.558 -2.762 6.613) 9.069 13.420 ( 4.209 -2.355 -6.639) 8.207 13.820 ( -7.126 -0.950 1.830) 7.418 17.725 ( 5.516 0.751 0.222) 5.572 17.943 ( 4.712 -12.455 2.441) 13.538 19.352 ( -4.968 11.273 -8.423) 14.924 19.775 ( -5.456 -6.568 -3.881) 9.379 20.446 ( 31.366 2.245 0.275) 31.448 22.096 ( -16.809 -6.943 5.882) 19.114 23.803 ( -0.940 10.138 -5.176) 11.422 24.127 ( -12.108 -4.637 -4.515) 13.729 ======================= Grid point 557 (282/361) ======================= q-point: (-0.40 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.508 ( -8.939 7.166 9.218) 14.705 2.791 ( -4.956 6.405 13.624) 15.849 3.014 ( -8.060 -3.916 -2.706) 9.361 3.363 ( -2.670 -8.259 -4.810) 9.924 3.522 ( 4.238 -6.784 -3.415) 8.697 4.097 ( 1.419 -0.610 11.049) 11.156 4.254 ( 7.736 8.756 -12.614) 17.194 4.686 ( -0.486 -7.121 -2.147) 7.453 5.500 ( 3.168 0.000 10.797) 11.252 5.925 ( 1.499 -8.389 5.455) 10.118 6.131 ( 1.007 3.056 8.477) 9.067 6.227 ( -2.467 -1.204 16.370) 16.598 6.340 ( 5.283 -2.135 4.177) 7.065 6.601 ( -4.309 -11.628 10.299) 16.120 6.862 ( -6.461 0.911 -6.979) 9.554 7.335 ( -1.794 -10.662 -4.924) 11.880 9.192 ( -7.428 -0.156 16.329) 17.940 9.217 ( -0.428 -5.001 9.974) 11.166 9.497 ( -16.680 3.481 10.488) 20.008 10.037 ( 4.502 9.167 2.648) 10.550 10.577 ( -0.446 8.806 -9.578) 13.018 11.169 ( 14.135 -0.077 -18.779) 23.505 11.597 ( 8.891 16.138 -15.554) 24.112 11.824 ( -14.381 1.779 -4.565) 15.193 12.803 ( -3.840 -2.730 9.092) 10.241 13.054 ( 12.658 1.800 6.589) 14.383 13.397 ( 0.079 0.700 -3.835) 3.899 13.704 ( -9.003 -2.904 -3.552) 10.104 17.756 ( 9.255 -1.187 -5.808) 10.990 18.253 ( 2.450 -11.040 12.306) 16.713 19.115 ( -2.360 3.084 -8.694) 9.522 19.666 ( -6.657 -3.640 -6.601) 10.057 20.881 ( 33.046 6.911 2.812) 33.878 21.968 ( -19.821 -9.346 2.573) 22.064 23.656 ( 0.754 6.886 -5.451) 8.815 23.888 ( -13.616 0.527 -6.572) 15.128 ======================= Grid point 558 (283/361) ======================= q-point: (-0.30 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( 0.318 3.876 9.852) 10.592 2.836 ( -5.793 0.516 10.064) 11.623 2.969 ( 1.517 -1.415 0.720) 2.196 3.285 ( -5.503 -5.549 -6.956) 10.462 3.577 ( 2.864 -2.960 -3.999) 5.741 4.059 ( -3.070 2.626 -6.807) 7.915 4.302 ( 7.629 0.357 2.963) 8.192 4.695 ( 2.902 -0.301 -5.662) 6.370 5.661 ( 0.790 0.057 11.005) 11.033 6.063 ( -1.276 -6.387 1.757) 6.746 6.193 ( -2.200 4.910 8.230) 9.833 6.417 ( 0.897 -4.307 11.087) 11.928 6.492 ( 6.475 -0.202 2.828) 7.069 6.662 ( -6.179 -1.370 -3.526) 7.245 6.857 ( -0.069 -15.385 13.552) 20.502 7.346 ( -4.442 -13.295 -3.773) 14.516 9.271 ( -9.127 1.407 18.006) 20.236 9.338 ( -10.492 2.256 9.500) 14.333 9.408 ( -1.919 -3.717 5.195) 6.670 10.041 ( 1.541 9.560 4.481) 10.670 10.399 ( -2.117 6.591 -5.131) 8.617 11.138 ( 10.287 1.527 -15.635) 18.777 11.418 ( 12.923 13.970 -12.676) 22.866 11.531 ( -11.457 3.506 -7.840) 14.318 12.892 ( -3.527 -3.514 9.174) 10.438 13.234 ( 0.691 6.713 5.512) 8.714 13.323 ( 3.200 6.965 -1.174) 7.755 13.590 ( -1.593 -9.081 -8.797) 12.743 17.882 ( 10.440 -0.682 1.505) 10.570 18.360 ( -6.453 -1.398 -1.296) 6.728 19.083 ( 1.010 -8.695 -0.764) 8.787 19.532 ( -0.301 -1.570 -8.107) 8.263 21.275 ( 17.191 7.383 8.836) 20.691 21.786 ( -10.365 -8.388 -5.616) 14.468 23.581 ( 3.326 3.213 -3.929) 6.068 23.615 ( -11.167 4.126 -4.749) 12.817 ======================= Grid point 559 (284/361) ======================= q-point: (-0.20 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.654 ( 3.455 0.765 9.972) 10.581 2.883 ( 4.092 0.779 0.911) 4.263 3.057 ( 2.421 -1.892 2.962) 4.267 3.205 ( -3.104 -7.180 -1.819) 8.031 3.559 ( 0.435 0.959 -2.970) 3.151 3.913 ( -2.559 0.124 -8.809) 9.174 4.389 ( 0.967 2.337 0.651) 2.612 4.663 ( 5.779 3.765 -3.571) 7.767 5.779 ( -2.981 0.072 9.949) 10.386 6.011 ( -8.488 -1.515 -3.796) 9.421 6.183 ( -5.954 5.658 7.219) 10.935 6.399 ( -10.008 0.323 -0.342) 10.019 6.583 ( 3.967 -1.393 -0.527) 4.238 6.728 ( 6.949 -2.404 2.578) 7.792 7.241 ( 2.585 -21.542 12.781) 25.181 7.382 ( -2.709 -15.817 1.486) 16.116 9.287 ( -7.563 1.121 9.223) 11.980 9.327 ( -7.271 2.024 9.859) 12.416 9.453 ( -7.732 2.790 8.602) 11.898 9.979 ( 0.629 8.711 -1.991) 8.958 10.347 ( 0.873 -1.145 3.652) 3.925 10.968 ( -5.877 8.310 -9.791) 14.123 11.337 ( 7.298 -1.668 -14.223) 16.073 11.457 ( 19.311 10.066 -2.260) 21.894 12.968 ( -4.365 2.246 7.535) 8.993 13.108 ( -11.410 -0.280 3.861) 12.049 13.308 ( 3.234 7.273 -3.949) 8.885 13.636 ( 9.974 -4.038 -6.177) 12.407 18.045 ( 1.249 1.365 1.698) 2.512 18.170 ( -1.724 1.695 -6.867) 7.281 19.113 ( -8.423 -4.562 1.842) 9.754 19.570 ( 10.701 -5.048 -4.073) 12.513 21.202 ( -26.251 -5.904 -2.483) 27.021 21.946 ( 28.619 4.800 2.764) 29.150 23.393 ( -8.077 4.382 -2.489) 9.520 23.608 ( 6.615 1.025 -0.631) 6.723 ======================= Grid point 560 (285/361) ======================= q-point: (-0.10 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.788 ( -1.929 0.406 7.965) 8.205 2.922 ( 6.754 1.328 -5.845) 9.030 3.153 ( 5.950 -3.861 2.894) 7.660 3.277 ( 0.263 -5.795 0.969) 5.882 3.543 ( -0.438 -1.190 2.180) 2.522 3.768 ( -1.071 2.940 -7.481) 8.109 4.317 ( 0.880 6.234 -3.728) 7.317 4.727 ( 5.989 2.168 2.449) 6.824 5.754 ( -14.654 2.778 1.107) 14.956 5.824 ( -10.218 -0.796 0.535) 10.262 6.097 ( -9.148 4.404 3.646) 10.788 6.267 ( -8.826 0.334 1.183) 8.912 6.616 ( 3.843 -1.020 -3.466) 5.275 6.836 ( 6.471 2.189 -0.252) 6.836 7.403 ( -5.609 -23.058 -3.564) 23.996 7.751 ( 6.155 -16.616 15.508) 23.547 9.179 ( -12.735 10.040 1.638) 16.299 9.348 ( -3.101 -2.819 7.298) 8.416 9.399 ( -8.542 6.787 11.963) 16.191 9.897 ( -0.169 6.495 -5.055) 8.231 10.476 ( 2.244 -12.225 1.606) 12.533 10.750 ( -1.337 8.229 2.381) 8.670 11.342 ( 16.003 -2.429 -17.068) 23.523 11.701 ( 20.944 5.528 5.582) 22.369 12.843 ( -5.776 9.854 -0.257) 11.425 13.130 ( -9.319 -7.678 10.772) 16.181 13.208 ( -0.573 5.223 -5.553) 7.645 13.712 ( 11.080 3.757 -7.206) 13.741 17.781 ( -12.018 1.382 -12.166) 17.157 18.323 ( 9.812 1.696 9.066) 13.466 19.026 ( -8.094 -0.629 0.384) 8.127 19.690 ( 1.464 -0.647 0.973) 1.873 20.827 ( -19.175 -9.984 -13.448) 25.460 22.375 ( 24.793 6.165 11.294) 27.932 23.245 ( -4.058 2.322 -2.647) 5.373 23.726 ( 8.687 0.405 2.884) 9.162 ======================= Grid point 565 (286/361) ======================= q-point: ( 0.40 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( -11.978 -0.000 9.592) 15.345 2.985 ( 4.638 0.000 4.146) 6.221 3.099 ( -9.201 -0.000 -4.289) 10.151 3.104 ( -9.590 -0.000 4.510) 10.598 3.401 ( 2.195 0.000 0.754) 2.321 3.900 ( 4.080 0.000 7.186) 8.263 4.428 ( 6.025 0.000 -1.018) 6.111 4.620 ( -6.800 -0.000 -3.548) 7.670 5.303 ( 3.692 0.000 12.092) 12.643 5.722 ( 2.344 0.000 3.927) 4.573 6.050 ( -4.402 -0.000 23.230) 23.643 6.118 ( 8.279 0.000 1.021) 8.342 6.203 ( -13.305 -0.000 4.168) 13.943 6.405 ( -7.745 -0.000 8.788) 11.714 7.063 ( -6.816 -0.000 -7.619) 10.223 7.242 ( 4.908 0.000 -10.054) 11.188 8.981 ( 4.244 0.000 4.850) 6.445 9.153 ( -11.876 -0.000 18.751) 22.195 9.629 ( -19.016 -0.000 15.590) 24.590 10.038 ( 8.367 0.000 2.875) 8.847 10.945 ( 0.486 0.000 -19.646) 19.652 11.224 ( 12.863 0.000 -21.531) 25.081 11.871 ( 15.295 0.000 -12.593) 19.812 12.035 ( -11.231 -0.000 0.585) 11.246 12.742 ( -7.657 -0.000 8.421) 11.382 12.773 ( 10.091 0.000 6.852) 12.198 13.393 ( 5.529 0.000 -6.430) 8.480 13.816 ( -8.888 -0.000 4.737) 10.072 17.767 ( 5.041 0.000 20.447) 21.059 17.794 ( 4.860 0.000 -16.981) 17.663 19.495 ( -11.560 -0.000 -10.851) 15.854 19.676 ( -2.090 -0.000 -2.151) 2.999 20.464 ( 34.676 0.000 -0.292) 34.677 22.035 ( -16.191 -0.000 6.001) 17.267 23.931 ( -3.387 -0.000 -7.066) 7.836 24.048 ( -10.629 -0.000 -1.747) 10.772 ======================= Grid point 567 (287/361) ======================= q-point: (-0.50 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.606 ( -10.550 3.268 7.366) 13.276 2.924 ( -4.720 6.797 3.389) 8.942 2.955 ( -8.008 -2.074 -0.867) 8.318 3.204 ( 2.095 -7.619 2.351) 8.244 3.448 ( 2.913 -1.889 -0.559) 3.516 4.082 ( 2.776 -0.737 10.460) 10.847 4.395 ( -1.556 5.838 -11.415) 12.916 4.565 ( 6.292 -5.216 -1.798) 8.368 5.494 ( 2.845 -0.384 10.709) 11.087 5.795 ( -1.613 -4.586 5.881) 7.630 6.176 ( -0.689 1.406 7.630) 7.789 6.244 ( 0.120 2.730 14.907) 15.156 6.298 ( 3.669 -2.798 10.781) 11.727 6.446 ( -5.697 -4.885 9.380) 12.013 6.874 ( -7.411 0.386 -6.684) 9.987 7.209 ( 4.956 -3.400 -9.939) 11.615 9.133 ( 4.504 -2.104 7.582) 9.066 9.212 ( -13.760 0.290 21.231) 25.302 9.536 ( -18.811 1.011 13.270) 23.043 10.152 ( 7.403 3.273 0.052) 8.095 10.693 ( -0.504 3.635 -17.177) 17.564 11.165 ( 13.646 -0.175 -18.589) 23.061 11.825 ( 8.381 7.410 -15.163) 18.843 11.852 ( -11.734 1.074 -4.010) 12.447 12.762 ( -5.763 -1.374 9.283) 11.012 13.038 ( 14.572 -2.057 4.930) 15.520 13.398 ( 3.832 0.115 -3.623) 5.275 13.691 ( -14.701 0.279 2.812) 14.971 17.743 ( 9.020 -0.297 -6.680) 11.228 18.109 ( 5.664 -4.428 17.386) 18.814 19.173 ( -11.282 2.364 -10.827) 15.814 19.603 ( -2.780 -2.501 -6.449) 7.455 20.967 ( 37.669 2.469 0.132) 37.750 21.859 ( -19.812 -2.946 3.335) 20.306 23.761 ( -4.029 4.270 -6.215) 8.549 23.872 ( -10.748 -1.809 -4.883) 11.943 ======================= Grid point 568 (288/361) ======================= q-point: (-0.40 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.590 ( 0.049 3.936 7.870) 8.799 2.846 ( -6.214 0.252 3.819) 7.298 2.948 ( 2.623 -1.061 2.088) 3.516 3.208 ( -5.008 -2.639 -4.416) 7.180 3.544 ( 5.798 -0.887 2.098) 6.229 4.072 ( -15.984 -0.752 0.063) 16.001 4.318 ( 11.989 1.256 -4.193) 12.763 4.672 ( 8.771 -1.619 -4.859) 10.157 5.644 ( 0.031 -1.572 9.187) 9.321 5.911 ( -0.416 -8.255 3.666) 9.042 6.266 ( -0.339 2.492 8.561) 8.923 6.394 ( 1.567 1.672 10.790) 11.031 6.483 ( 2.231 -1.613 7.259) 7.764 6.559 ( -4.001 -8.104 7.895) 12.000 6.711 ( -5.346 -1.511 0.549) 5.583 7.190 ( 3.823 -4.830 -9.540) 11.356 9.285 ( -12.314 0.280 21.602) 24.867 9.310 ( 1.213 -2.468 9.604) 9.990 9.413 ( -16.041 1.543 9.555) 18.735 10.186 ( 4.272 6.250 -0.958) 7.631 10.473 ( -2.643 1.889 -11.191) 11.653 11.153 ( 14.211 0.335 -15.934) 21.353 11.594 ( -10.186 5.886 -6.576) 13.478 11.675 ( 9.104 9.821 -13.691) 19.151 12.821 ( -5.172 -3.451 9.185) 11.092 13.255 ( 4.428 -3.834 -1.898) 6.157 13.447 ( 8.180 5.616 2.282) 10.181 13.495 ( -11.775 -0.885 0.506) 11.819 17.873 ( 10.916 -0.342 3.268) 11.400 18.336 ( -1.998 -1.215 5.151) 5.657 18.957 ( -3.919 -4.938 -3.912) 7.419 19.502 ( 0.751 -1.524 -9.380) 9.533 21.408 ( 14.273 7.221 3.567) 16.389 21.651 ( -2.698 -6.816 -3.530) 8.136 23.624 ( -3.152 1.554 -4.214) 5.487 23.674 ( -7.599 2.319 -3.910) 8.855 ======================= Grid point 569 (289/361) ======================= q-point: (-0.30 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( 1.754 3.086 8.604) 9.308 2.887 ( 5.219 -0.646 4.118) 6.679 3.052 ( 5.624 0.084 0.347) 5.635 3.096 ( -3.417 -4.160 -3.373) 6.353 3.599 ( -0.428 3.588 1.014) 3.753 3.869 ( -9.920 -4.627 -4.079) 11.681 4.419 ( 6.657 1.212 -1.210) 6.873 4.713 ( 7.364 1.702 -6.227) 9.793 5.749 ( -3.417 -3.241 8.186) 9.444 5.945 ( -5.706 -5.611 -2.878) 8.504 6.289 ( -5.029 5.356 6.742) 9.971 6.406 ( -11.025 0.968 2.120) 11.269 6.562 ( 3.135 -0.982 1.654) 3.679 6.637 ( 1.844 -7.828 4.650) 9.290 6.937 ( 7.373 -10.280 10.683) 16.558 7.185 ( 3.889 -6.733 -5.404) 9.469 9.301 ( -12.201 0.546 8.594) 14.934 9.358 ( -10.418 1.456 16.393) 19.478 9.458 ( -3.060 -1.010 12.241) 12.658 10.131 ( -0.183 6.988 -3.568) 7.849 10.309 ( -5.373 -2.388 -5.493) 8.046 11.127 ( 6.918 6.957 -10.844) 14.624 11.357 ( 0.772 4.790 -9.503) 10.670 11.638 ( 16.364 8.979 -6.416) 19.737 12.900 ( -6.089 -5.829 9.746) 12.886 13.179 ( -11.598 4.321 1.815) 12.509 13.315 ( -4.498 -4.898 -7.345) 9.908 13.667 ( 16.715 6.073 2.451) 17.952 18.078 ( 3.651 2.177 5.229) 6.739 18.191 ( -4.883 0.592 -7.216) 8.733 19.027 ( -0.889 -4.710 4.954) 6.893 19.479 ( 9.898 -4.521 -8.223) 13.640 21.130 ( -29.286 -2.363 -4.374) 29.705 22.012 ( 33.818 2.595 0.545) 33.922 23.471 ( -7.485 4.241 -1.557) 8.743 23.619 ( 2.631 -0.006 0.058) 2.631 ======================= Grid point 570 (290/361) ======================= q-point: (-0.20 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.769 ( -6.614 -1.654 11.586) 13.443 2.989 ( 8.678 5.406 -7.746) 12.827 3.098 ( 9.244 -2.968 2.614) 10.054 3.190 ( 1.605 -3.235 3.949) 5.351 3.528 ( -3.167 -0.972 -2.394) 4.087 3.786 ( -2.178 -0.378 -0.896) 2.385 4.425 ( 4.513 5.124 -5.518) 8.779 4.738 ( 4.575 -0.012 -0.932) 4.669 5.783 ( -10.716 -3.555 -0.048) 11.290 5.790 ( -9.511 -0.026 -0.316) 9.516 6.200 ( -8.866 6.952 3.859) 11.909 6.271 ( -10.068 0.131 2.457) 10.364 6.606 ( 3.351 -0.353 -2.980) 4.498 6.809 ( 4.103 -8.265 3.363) 9.821 7.082 ( 1.497 -8.418 -5.211) 10.013 7.458 ( 11.317 -15.085 9.142) 20.957 9.266 ( -11.578 -2.134 9.495) 15.125 9.340 ( -5.954 4.728 5.209) 9.216 9.516 ( -11.403 4.911 15.541) 19.891 10.012 ( 0.917 6.177 -5.142) 8.089 10.241 ( -6.598 -11.807 -2.426) 13.741 10.977 ( -0.614 14.586 1.189) 14.647 11.316 ( 15.341 -0.360 -16.371) 22.438 11.808 ( 20.302 5.987 1.551) 21.223 12.966 ( -11.741 -4.824 4.799) 13.571 13.012 ( -5.592 3.592 6.851) 9.545 13.222 ( -2.610 -3.144 -6.715) 7.861 13.835 ( 15.155 8.723 -1.391) 17.541 17.804 ( -13.118 1.108 -13.380) 18.771 18.354 ( 8.512 1.603 10.033) 13.255 19.042 ( -1.696 2.572 0.350) 3.101 19.637 ( 9.702 -5.310 -1.003) 11.106 20.672 ( -26.533 -6.760 -10.087) 29.180 22.454 ( 29.231 2.393 2.615) 29.445 23.323 ( -5.989 6.329 0.165) 8.715 23.721 ( 6.524 -1.182 4.889) 8.238 ======================= Grid point 571 (291/361) ======================= q-point: (-0.10 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.816 ( -13.016 -3.890 13.981) 19.494 2.913 ( 2.495 6.905 -9.323) 11.867 3.192 ( -0.815 -3.630 -1.581) 4.043 3.345 ( 10.346 -0.066 3.207) 10.832 3.527 ( 1.012 -4.351 1.392) 4.679 3.780 ( 4.468 4.062 -0.269) 6.045 4.380 ( 8.191 5.574 -5.849) 11.506 4.802 ( -0.655 -2.876 3.298) 4.425 5.517 ( -14.647 3.311 -3.901) 15.515 5.694 ( -13.062 -0.002 2.003) 13.214 6.028 ( -9.686 6.190 0.086) 11.496 6.174 ( -8.602 0.514 2.916) 9.097 6.611 ( 3.449 -1.469 -4.497) 5.855 6.943 ( 6.157 1.007 0.102) 6.239 7.153 ( 1.509 -16.002 -3.216) 16.391 7.816 ( 5.726 -15.332 4.752) 17.042 9.115 ( -14.956 9.170 4.251) 18.051 9.347 ( -5.783 -2.521 7.998) 10.187 9.478 ( -7.350 5.024 10.769) 13.973 9.855 ( -6.344 7.414 -5.176) 11.046 10.323 ( 2.143 -17.179 -0.751) 17.329 10.959 ( 3.742 7.689 8.767) 12.247 11.347 ( 17.239 -1.866 -18.284) 25.198 12.084 ( 18.680 3.617 3.138) 19.284 12.842 ( -3.620 4.774 -0.133) 5.993 13.058 ( -8.768 -4.810 7.710) 12.627 13.136 ( -3.167 -0.021 -1.476) 3.494 13.893 ( 12.344 12.317 -5.332) 18.235 17.483 ( -11.875 -0.454 -8.377) 14.539 18.583 ( 8.213 -0.415 9.743) 12.750 18.967 ( -0.849 5.932 -3.621) 7.001 19.681 ( -8.908 3.397 2.528) 9.863 20.371 ( -6.144 -12.969 -12.578) 19.082 22.845 ( 20.702 1.223 5.670) 21.499 23.183 ( -4.644 5.090 -2.078) 7.196 23.927 ( 9.330 0.495 9.108) 13.048 ======================= Grid point 577 (292/361) ======================= q-point: (-0.50 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( 1.119 0.000 6.632) 6.726 2.845 ( -4.996 -0.000 0.910) 5.078 2.936 ( 0.054 -0.000 2.298) 2.299 3.187 ( -4.037 -0.000 -2.565) 4.783 3.537 ( 7.750 -0.000 4.650) 9.038 4.060 ( -20.670 -0.000 3.028) 20.890 4.332 ( 12.564 0.000 -7.062) 14.413 4.655 ( 10.605 -0.000 -4.364) 11.468 5.626 ( -0.444 -0.000 8.356) 8.368 5.829 ( -0.649 -0.000 4.826) 4.869 6.285 ( 1.145 -0.000 7.741) 7.826 6.418 ( 3.594 0.000 4.906) 6.082 6.469 ( -2.446 0.000 8.575) 8.917 6.477 ( -2.392 -0.000 16.118) 16.295 6.703 ( -6.897 -0.000 -1.657) 7.094 7.150 ( 7.201 -0.000 -11.799) 13.823 9.283 ( 4.191 -0.000 7.956) 8.993 9.290 ( -15.659 0.000 25.327) 29.777 9.427 ( -17.607 -0.000 10.300) 20.398 10.246 ( 5.727 -0.000 -3.064) 6.495 10.486 ( -3.658 -0.000 -13.588) 14.072 11.155 ( 15.300 -0.000 -16.085) 22.199 11.653 ( -9.923 -0.000 -4.116) 10.742 11.772 ( 8.257 -0.000 -15.788) 17.817 12.788 ( -5.521 -0.000 9.061) 10.611 13.200 ( 6.809 0.000 -4.391) 8.102 13.492 ( -18.641 0.000 3.319) 18.934 13.506 ( 12.089 -0.000 4.332) 12.841 17.870 ( 11.175 -0.000 3.919) 11.843 18.323 ( 0.372 -0.000 7.996) 8.005 18.912 ( -7.152 -0.000 -5.544) 9.049 19.487 ( 1.576 -0.000 -9.730) 9.857 21.522 ( 38.802 -0.000 -0.129) 38.803 21.543 ( -25.284 0.000 -1.435) 25.325 23.638 ( -5.203 -0.000 -4.268) 6.730 23.695 ( -6.620 -0.000 -3.425) 7.454 ======================= Grid point 579 (293/361) ======================= q-point: (-0.40 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.762 ( 3.114 4.900 5.807) 8.211 2.847 ( 2.627 -3.817 4.307) 6.326 3.025 ( 3.848 -1.211 5.886) 7.136 3.081 ( 2.311 0.387 -8.496) 8.813 3.677 ( -0.606 4.406 4.044) 6.011 3.776 ( -15.375 -4.842 -1.473) 16.186 4.435 ( 8.829 0.501 -2.540) 9.201 4.725 ( 8.896 -0.024 -6.771) 11.180 5.692 ( -4.238 -2.175 6.586) 8.128 5.850 ( -3.986 -3.537 -0.284) 5.337 6.349 ( -3.189 1.552 4.068) 5.397 6.442 ( -11.213 2.029 3.581) 11.944 6.491 ( 0.069 -4.893 1.918) 5.255 6.566 ( -0.019 -0.092 6.758) 6.759 6.837 ( 10.036 -2.450 11.736) 15.635 7.119 ( 7.953 -1.351 -11.391) 13.958 9.308 ( -15.459 0.154 9.032) 17.905 9.380 ( -14.423 0.819 23.508) 27.592 9.438 ( 1.625 -0.864 9.817) 9.988 10.220 ( 0.282 3.061 -5.751) 6.521 10.272 ( -8.143 -1.725 -8.722) 12.057 11.190 ( 17.347 1.118 -16.245) 23.792 11.475 ( -5.739 5.435 -2.551) 8.305 11.748 ( 13.349 2.893 -8.626) 16.155 12.821 ( -6.745 -2.317 8.580) 11.157 13.182 ( -0.373 -2.803 -5.795) 6.448 13.274 ( -16.305 0.757 2.927) 16.583 13.760 ( 16.184 3.070 4.212) 17.003 18.113 ( 8.563 1.347 9.645) 12.968 18.192 ( -10.773 -0.249 -10.215) 14.849 18.962 ( 5.069 -2.061 8.813) 10.374 19.421 ( 7.823 -1.722 -11.620) 14.113 21.107 ( -29.745 -0.506 -6.263) 30.401 22.041 ( 36.163 0.752 -1.457) 36.201 23.538 ( -4.597 2.854 0.350) 5.422 23.606 ( -1.972 -1.229 -0.169) 2.329 ======================= Grid point 580 (294/361) ======================= q-point: (-0.30 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( -10.361 -0.068 9.405) 13.993 3.046 ( 9.387 -2.347 2.436) 9.978 3.079 ( 11.827 3.856 -7.089) 14.318 3.159 ( 3.263 -0.874 4.059) 5.280 3.494 ( -8.113 -2.630 -2.236) 8.817 3.787 ( -0.845 0.915 4.203) 4.384 4.489 ( 6.208 2.142 -4.289) 7.844 4.745 ( 5.558 0.555 -5.607) 7.915 5.703 ( -8.994 -4.269 4.207) 10.808 5.759 ( -7.941 -2.829 -4.040) 9.348 6.271 ( -11.010 0.104 4.021) 11.722 6.326 ( -7.235 6.103 2.886) 9.895 6.580 ( 4.670 -6.319 -2.569) 8.266 6.626 ( -2.711 -3.967 4.728) 6.741 7.063 ( 9.323 2.202 -6.022) 11.315 7.233 ( 13.738 -9.613 3.913) 17.218 9.221 ( -13.368 -1.998 8.257) 15.839 9.420 ( -11.293 3.469 15.380) 19.394 9.567 ( -5.283 1.156 14.110) 15.110 10.064 ( -14.191 -4.850 -1.733) 15.096 10.122 ( 2.956 2.782 -9.028) 9.899 11.191 ( 10.993 6.588 -11.392) 17.147 11.354 ( 3.055 5.682 -4.996) 8.160 11.893 ( 18.123 2.857 -0.816) 18.365 12.847 ( -9.185 -4.994 8.224) 13.302 13.103 ( -8.762 3.491 4.358) 10.390 13.138 ( -2.596 -4.810 -5.720) 7.912 13.976 ( 15.332 6.002 0.912) 16.490 17.819 ( -14.069 0.501 -14.566) 20.257 18.377 ( 7.487 0.937 10.863) 13.226 19.117 ( 4.757 5.398 4.114) 8.288 19.511 ( 13.926 -7.893 -5.228) 16.840 20.589 ( -30.918 -2.623 -9.428) 32.430 22.470 ( 30.158 -0.095 -4.449) 30.484 23.457 ( -3.855 7.851 3.846) 9.555 23.679 ( 3.806 -3.579 6.214) 8.119 ======================= Grid point 581 (295/361) ======================= q-point: (-0.20 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.742 ( -12.493 -3.026 12.367) 17.837 2.968 ( -13.730 -3.319 -3.037) 14.448 3.177 ( 9.582 2.933 -1.030) 10.074 3.346 ( 14.097 -0.465 1.343) 14.169 3.483 ( 2.052 0.565 -0.216) 2.140 3.834 ( 4.467 1.746 3.084) 5.702 4.477 ( 7.864 4.555 -7.513) 11.792 4.750 ( -0.780 -1.930 0.079) 2.083 5.553 ( -11.163 0.656 -3.103) 11.605 5.661 ( -10.607 -3.299 0.776) 11.135 6.141 ( -9.675 3.237 -0.889) 10.241 6.207 ( -7.699 5.314 5.039) 10.626 6.591 ( 1.482 -0.669 -4.693) 4.967 6.775 ( 3.974 -14.404 2.608) 15.167 7.077 ( 7.611 2.929 -5.650) 9.921 7.560 ( 11.973 -12.499 0.170) 17.309 9.141 ( -16.284 -4.324 6.680) 18.125 9.395 ( -5.919 6.287 9.002) 12.474 9.579 ( -10.818 5.589 12.753) 17.633 9.893 ( -14.535 -3.697 -0.058) 14.998 10.125 ( 7.306 -3.664 -2.797) 8.639 11.132 ( 2.312 9.958 1.259) 10.300 11.327 ( 12.272 0.238 -14.081) 18.680 12.140 ( 17.860 2.065 1.384) 18.032 12.841 ( -8.149 -3.229 4.646) 9.921 13.040 ( -4.573 1.866 3.371) 5.980 13.101 ( -2.010 -3.334 -0.396) 3.913 14.095 ( 13.378 9.425 -3.216) 16.678 17.474 ( -12.294 -0.436 -9.624) 15.619 18.572 ( 6.611 -0.625 5.402) 8.560 19.120 ( 5.008 10.860 -1.676) 12.076 19.703 ( 1.531 -1.882 1.795) 3.018 20.145 ( -17.058 -10.963 -9.625) 22.446 22.786 ( 22.376 -4.974 -7.047) 23.981 23.370 ( -4.331 12.585 5.698) 14.477 23.911 ( 9.109 -2.237 11.311) 14.694 ======================= Grid point 582 (296/361) ======================= q-point: (-0.10 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( -19.795 -4.998 7.875) 21.882 2.769 ( -12.519 -2.165 0.206) 12.706 3.260 ( 7.304 3.239 0.075) 7.990 3.445 ( 3.221 1.961 -1.902) 4.224 3.580 ( 5.733 -2.864 4.856) 8.041 3.935 ( 9.009 6.584 0.976) 11.202 4.485 ( 11.719 3.181 -6.926) 13.980 4.754 ( -6.972 -3.714 5.069) 9.386 5.359 ( -10.881 4.409 0.707) 11.761 5.530 ( -7.478 -0.623 -2.452) 7.895 5.935 ( -9.116 5.540 -3.598) 11.258 6.121 ( -7.301 4.143 4.455) 9.503 6.565 ( -0.057 -3.266 -3.436) 4.741 7.005 ( 6.187 -7.905 1.496) 10.150 7.103 ( 8.816 -1.512 -4.797) 10.150 7.757 ( 2.713 -12.100 -3.010) 12.760 8.987 ( -19.064 0.690 6.012) 20.001 9.367 ( -7.089 4.210 8.878) 12.115 9.551 ( -5.122 3.563 9.363) 11.251 9.742 ( -6.359 -0.759 -2.404) 6.841 10.264 ( 3.918 -7.878 2.075) 9.040 11.143 ( 0.716 3.744 7.170) 8.121 11.331 ( 15.119 -2.225 -18.458) 23.963 12.332 ( 10.765 2.546 -1.490) 11.162 12.807 ( -5.062 -1.485 1.877) 5.599 12.983 ( -3.513 0.572 -2.016) 4.091 13.145 ( -0.217 -1.750 6.767) 6.993 14.105 ( 11.415 13.096 -6.739) 18.634 17.285 ( -7.584 -0.620 1.515) 7.759 18.700 ( 6.763 -5.692 -6.822) 11.166 19.032 ( 0.675 12.868 0.485) 12.895 19.548 ( -13.340 2.680 0.535) 13.617 20.166 ( 5.190 -12.187 -3.031) 13.589 23.033 ( 15.176 -10.929 -8.466) 20.529 23.236 ( -5.693 17.174 6.867) 19.352 24.206 ( 9.850 0.467 11.924) 15.473 ======================= Grid point 589 (297/361) ======================= q-point: (-0.40 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -12.160 -0.000 8.394) 14.776 3.024 ( 10.495 0.000 2.214) 10.726 3.116 ( 14.517 0.000 -7.340) 16.267 3.148 ( 0.699 0.000 3.168) 3.244 3.464 ( -8.848 -0.000 0.201) 8.850 3.801 ( -0.643 -0.000 4.896) 4.938 4.508 ( 6.740 0.000 -3.864) 7.769 4.750 ( 6.243 0.000 -6.611) 9.092 5.661 ( -8.246 -0.000 4.886) 9.585 5.725 ( -7.395 -0.000 -3.992) 8.404 6.272 ( -12.306 -0.000 4.562) 13.124 6.395 ( -4.701 -0.000 2.076) 5.139 6.485 ( 1.728 0.000 -0.026) 1.728 6.617 ( -1.711 -0.000 2.790) 3.273 7.104 ( 9.595 0.000 -10.236) 14.030 7.126 ( 15.830 0.000 5.670) 16.815 9.202 ( -14.676 -0.000 7.932) 16.683 9.454 ( -15.617 -0.000 21.873) 26.876 9.574 ( 0.350 0.000 10.225) 10.231 10.012 ( -15.925 -0.000 -2.232) 16.080 10.157 ( 2.677 0.000 -9.362) 9.737 11.232 ( 18.543 0.000 -19.455) 26.877 11.437 ( -4.957 -0.000 2.680) 5.635 11.913 ( 16.658 0.000 -1.404) 16.717 12.804 ( -7.712 -0.000 7.814) 10.979 13.082 ( -1.981 -0.000 -5.127) 5.496 13.138 ( -10.377 -0.000 5.007) 11.522 14.032 ( 15.129 0.000 1.435) 15.197 17.823 ( -14.427 -0.000 -15.034) 20.836 18.386 ( 7.130 0.000 11.182) 13.262 19.189 ( 7.967 0.000 11.222) 13.763 19.414 ( 14.194 0.000 -12.274) 18.765 20.567 ( -31.942 -0.000 -9.566) 33.343 22.467 ( 30.015 0.000 -6.886) 30.795 23.574 ( -2.203 -0.000 2.918) 3.656 23.603 ( 2.448 0.000 8.964) 9.292 ======================= Grid point 590 (298/361) ======================= q-point: (-0.30 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( -11.875 -0.138 12.239) 17.053 2.882 ( -21.731 -3.881 -1.201) 22.108 3.224 ( 10.060 1.522 -4.513) 11.131 3.317 ( 14.875 -1.754 1.084) 15.017 3.544 ( 9.363 3.679 2.248) 10.308 3.844 ( 2.279 -0.274 3.909) 4.533 4.532 ( 6.650 1.530 -6.019) 9.098 4.737 ( 0.780 -0.024 -3.470) 3.556 5.559 ( -8.700 0.777 -1.470) 8.857 5.597 ( -9.067 -3.230 0.366) 9.632 6.155 ( -10.874 -0.010 1.943) 11.046 6.322 ( -5.971 4.971 3.366) 8.467 6.573 ( 4.023 -7.006 2.131) 8.355 6.586 ( 0.038 -0.001 -4.336) 4.336 7.125 ( 9.257 1.655 -6.918) 11.674 7.394 ( 15.377 -5.179 -2.697) 16.448 9.071 ( -16.884 -2.382 4.692) 17.685 9.479 ( -11.346 2.454 16.054) 19.811 9.659 ( -6.895 2.797 11.203) 13.449 9.806 ( -18.573 -3.606 6.048) 19.863 10.120 ( 9.478 0.754 -8.204) 12.558 11.240 ( 15.776 1.740 -17.202) 23.405 11.376 ( -5.956 3.783 3.242) 7.765 12.150 ( 16.116 -0.457 0.685) 16.137 12.809 ( -4.607 -0.016 6.215) 7.736 13.014 ( -2.402 -3.217 -2.989) 5.005 13.090 ( -5.400 1.079 5.472) 7.763 14.213 ( 13.630 3.377 -2.545) 14.271 17.468 ( -12.464 -0.176 -10.261) 16.146 18.564 ( 6.004 -0.238 2.474) 6.498 19.339 ( 8.702 12.680 2.668) 15.609 19.588 ( 13.878 -10.300 -1.624) 17.358 20.018 ( -30.109 -2.995 -8.273) 31.368 22.717 ( 21.191 -2.147 -10.963) 23.955 23.564 ( -2.352 7.322 6.575) 10.118 23.855 ( 9.548 -3.134 13.123) 16.529 ======================= Grid point 591 (299/361) ======================= q-point: (-0.20 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( -22.451 -6.255 4.417) 23.722 2.717 ( -15.864 -2.777 7.433) 17.738 3.243 ( 0.504 -2.259 -1.320) 2.664 3.534 ( 10.108 -1.120 2.241) 10.414 3.602 ( 9.378 10.175 -2.653) 14.089 4.006 ( 10.338 1.013 5.337) 11.678 4.545 ( 10.505 2.981 -7.556) 13.279 4.704 ( -4.561 -1.679 2.784) 5.601 5.418 ( -10.313 2.377 1.489) 10.688 5.499 ( -4.050 -2.196 -3.976) 6.086 5.988 ( -9.426 0.924 -5.115) 10.765 6.245 ( -6.323 8.050 7.039) 12.423 6.511 ( -2.518 -2.732 -4.088) 5.524 6.802 ( 11.453 -10.066 2.443) 15.442 7.158 ( 8.614 3.634 -4.643) 10.438 7.564 ( 9.143 -8.727 -8.035) 14.977 8.906 ( -19.464 -6.366 4.799) 21.033 9.488 ( -8.157 6.178 12.523) 16.172 9.620 ( -8.286 3.752 8.240) 12.273 9.678 ( -15.192 -3.751 5.971) 16.748 10.210 ( 9.892 -0.559 -1.385) 10.004 11.231 ( 3.012 4.426 -1.340) 5.519 11.311 ( 6.036 0.269 -9.973) 11.661 12.347 ( 10.191 -0.683 -1.233) 10.288 12.795 ( -4.586 1.179 2.599) 5.402 12.985 ( -0.854 -1.611 -3.100) 3.596 13.104 ( -2.486 -1.942 5.669) 6.487 14.289 ( 12.398 7.079 -7.101) 15.945 17.277 ( -6.594 -0.331 2.030) 6.908 18.616 ( 6.959 -3.383 -12.120) 14.379 19.295 ( -0.662 15.995 1.277) 16.059 19.584 ( -13.806 1.356 -0.084) 13.872 19.917 ( 7.340 -15.282 0.535) 16.962 22.877 ( 16.278 -6.063 -10.757) 20.432 23.517 ( -4.448 12.904 7.619) 15.632 24.186 ( 10.842 -2.267 11.442) 15.926 ======================= Grid point 592 (300/361) ======================= q-point: (-0.10 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( -19.764 -6.236 2.525) 20.878 2.530 ( -24.056 -7.365 6.749) 26.048 3.320 ( 2.373 -4.300 4.256) 6.499 3.574 ( 9.202 10.852 -4.967) 15.070 3.687 ( 5.637 -1.884 1.612) 6.158 4.124 ( -0.043 9.337 5.859) 11.023 4.592 ( 9.720 2.833 -5.492) 11.518 4.735 ( -0.347 -0.454 6.150) 6.177 5.277 ( -7.349 2.384 2.746) 8.199 5.435 ( 0.118 -1.364 -6.108) 6.260 5.790 ( -7.542 1.097 -3.374) 8.335 6.144 ( -4.404 8.868 1.399) 10.000 6.499 ( -2.278 -3.328 2.951) 4.997 7.043 ( 5.589 -4.854 -0.654) 7.432 7.199 ( 12.329 2.916 -5.883) 13.969 7.642 ( 1.167 -9.561 -2.032) 9.844 8.760 ( -20.664 -6.309 8.207) 23.112 9.415 ( -8.685 7.314 7.532) 13.625 9.606 ( -4.024 -3.974 1.600) 5.878 9.638 ( -4.118 -0.940 7.573) 8.671 10.320 ( 3.605 0.665 2.493) 4.433 11.190 ( -6.155 0.592 1.938) 6.480 11.324 ( 15.819 -0.639 -13.392) 20.736 12.397 ( 1.309 0.382 -3.493) 3.749 12.733 ( -6.221 -0.890 0.900) 6.348 12.924 ( -1.216 1.807 -4.202) 4.733 13.196 ( 1.240 -6.049 4.579) 7.687 14.267 ( 11.474 10.164 -10.965) 18.846 17.343 ( 1.648 2.448 14.326) 14.627 18.514 ( 3.072 -6.783 -22.108) 23.328 19.176 ( -2.129 10.579 6.148) 12.420 19.480 ( -0.129 3.329 -0.287) 3.344 20.129 ( 3.099 -10.858 1.303) 11.367 23.026 ( 12.328 -6.727 -8.689) 16.514 23.385 ( -6.750 16.252 6.139) 18.638 24.439 ( 5.844 -1.851 6.526) 8.953 ======================= Grid point 600 (301/361) ======================= q-point: (-0.30 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( -23.985 -0.000 2.101) 24.077 2.691 ( -16.361 -0.000 10.864) 19.639 3.221 ( -0.926 -0.000 -2.651) 2.808 3.519 ( 10.732 0.000 2.438) 11.006 3.720 ( 11.572 0.000 -4.305) 12.347 3.999 ( 10.883 0.000 7.194) 13.046 4.574 ( 9.619 0.000 -5.813) 11.239 4.691 ( -3.967 -0.000 0.818) 4.050 5.445 ( -12.249 -0.000 2.685) 12.540 5.470 ( 0.012 0.000 -5.373) 5.373 5.994 ( -9.571 -0.000 -5.143) 10.865 6.339 ( -6.240 -0.000 10.424) 12.149 6.476 ( -4.302 -0.000 -5.791) 7.214 6.702 ( 13.192 0.000 1.775) 13.311 7.196 ( 9.334 0.000 -3.703) 10.041 7.477 ( 11.790 0.000 -11.279) 16.317 8.840 ( -19.728 -0.000 3.147) 19.978 9.542 ( -10.893 -0.000 18.056) 21.087 9.633 ( -17.759 -0.000 9.683) 20.227 9.672 ( -7.873 -0.000 5.033) 9.344 10.206 ( 12.130 0.000 -3.769) 12.702 11.267 ( 17.011 0.000 -16.534) 23.722 11.325 ( -10.876 -0.000 5.861) 12.355 12.335 ( 10.106 0.000 -0.934) 10.149 12.827 ( -1.581 -0.000 0.184) 1.592 12.944 ( -2.358 -0.000 -0.091) 2.360 13.091 ( -3.400 -0.000 4.054) 5.292 14.353 ( 12.760 0.000 -7.381) 14.741 17.274 ( -6.228 -0.000 2.265) 6.627 18.585 ( 6.888 0.000 -14.277) 15.851 19.537 ( -24.273 -0.000 -0.474) 24.277 19.603 ( 3.910 0.000 6.814) 7.856 19.676 ( 13.533 0.000 -3.165) 13.898 22.822 ( 16.455 0.000 -11.516) 20.084 23.646 ( -4.057 -0.000 8.566) 9.478 24.156 ( 11.676 0.000 10.603) 15.772 ======================= Grid point 601 (302/361) ======================= q-point: (-0.20 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( -20.803 -4.935 7.549) 22.674 2.449 ( -27.908 -2.013 1.660) 28.030 3.264 ( 3.192 -1.601 5.703) 6.729 3.656 ( 5.012 -0.468 0.837) 5.103 3.748 ( 9.460 5.594 -8.960) 14.180 4.230 ( 0.832 2.515 11.964) 12.254 4.651 ( 11.353 2.944 -4.748) 12.653 4.711 ( 3.879 -1.681 4.489) 6.166 5.314 ( -8.072 1.355 1.526) 8.326 5.401 ( 0.289 -1.456 -9.418) 9.534 5.795 ( -7.852 -0.108 -4.390) 8.996 6.301 ( -3.332 6.843 -3.137) 8.232 6.445 ( -3.019 -2.667 10.184) 10.952 6.935 ( 11.807 -4.459 0.300) 12.625 7.297 ( 11.293 5.939 -1.358) 12.832 7.482 ( 6.544 -7.487 -10.166) 14.221 8.631 ( -21.885 -5.176 7.684) 23.765 9.528 ( -10.291 -1.877 3.789) 11.126 9.556 ( -9.950 6.098 7.294) 13.761 9.635 ( -8.399 -1.427 13.453) 15.924 10.334 ( 9.436 0.243 -1.415) 9.545 11.223 ( -11.453 1.696 4.031) 12.260 11.327 ( 16.470 0.533 -11.981) 20.374 12.394 ( 1.696 -0.121 -3.400) 3.801 12.732 ( -5.983 0.309 -4.511) 7.499 12.930 ( -1.429 -0.863 -0.504) 1.744 13.110 ( -0.589 -2.526 2.757) 3.785 14.389 ( 12.202 3.438 -12.762) 17.988 17.376 ( 4.510 1.076 16.492) 17.131 18.418 ( 3.264 -3.057 -24.624) 25.027 19.322 ( -9.459 3.810 7.948) 12.929 19.610 ( 2.738 11.403 -0.175) 11.728 19.899 ( 5.583 -13.650 0.556) 14.758 22.927 ( 15.484 -3.083 -9.917) 18.644 23.642 ( -6.662 9.232 8.842) 14.415 24.385 ( 6.285 -2.849 2.928) 7.496 ======================= Grid point 602 (303/361) ======================= q-point: (-0.10 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( -24.865 -5.097 4.421) 25.764 2.247 ( -17.161 -10.423 13.596) 24.249 3.410 ( 5.971 -0.526 3.583) 6.983 3.665 ( -1.717 2.885 -1.194) 3.563 3.742 ( 11.001 0.429 -9.492) 14.537 4.206 ( -16.004 7.638 12.706) 21.815 4.634 ( -1.099 8.896 -4.648) 10.097 4.910 ( 11.660 1.605 1.646) 11.884 5.269 ( 1.864 -1.865 -3.781) 4.610 5.326 ( 2.588 -4.341 -0.247) 5.060 5.724 ( -1.847 -0.633 2.764) 3.384 6.163 ( 0.859 7.132 -4.855) 8.671 6.577 ( -0.944 2.234 14.381) 14.584 7.034 ( 0.393 -0.724 -3.708) 3.798 7.251 ( 5.227 2.806 -15.482) 16.580 7.669 ( 7.025 -3.933 10.723) 13.409 8.538 ( -17.821 -10.274 13.597) 24.658 9.426 ( -5.663 5.202 1.345) 7.806 9.482 ( -5.281 -5.588 -0.808) 7.731 9.721 ( -5.079 0.140 14.268) 15.146 10.397 ( 2.179 3.344 -0.941) 4.101 11.059 ( -10.993 -1.203 -2.813) 11.411 11.418 ( 13.526 1.765 -6.954) 15.311 12.314 ( -5.139 -0.309 -4.492) 6.832 12.623 ( -5.467 -4.492 -1.265) 7.188 12.888 ( -1.729 2.374 -1.212) 3.177 13.187 ( 0.608 -6.733 2.217) 7.115 14.327 ( 11.083 5.935 -16.999) 21.143 17.702 ( 11.616 7.638 18.162) 22.872 18.229 ( 5.061 -8.257 -18.662) 21.026 19.316 ( -0.648 10.055 5.119) 11.301 19.542 ( 5.784 3.646 -3.096) 7.505 20.049 ( -1.738 -12.042 0.289) 12.170 23.063 ( 13.932 -3.814 -7.649) 16.345 23.490 ( -10.203 17.767 5.729) 21.274 24.442 ( -3.528 -6.831 -3.740) 8.549 ======================= Grid point 611 (304/361) ======================= q-point: (-0.20 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( -28.258 -0.000 4.101) 28.554 2.141 ( -15.846 -0.000 14.174) 21.260 3.406 ( 7.296 0.000 4.714) 8.686 3.672 ( -1.162 -0.000 -2.480) 2.739 3.768 ( 9.091 0.000 -11.349) 14.541 4.274 ( -19.092 -0.000 15.390) 24.522 4.738 ( 2.851 0.000 -1.235) 3.107 4.910 ( 13.656 0.000 -3.106) 14.005 5.250 ( 3.069 0.000 -5.990) 6.731 5.278 ( 0.897 0.000 -0.163) 0.912 5.717 ( -2.296 -0.000 2.596) 3.466 6.233 ( 1.820 0.000 -6.857) 7.095 6.607 ( -1.353 -0.000 18.870) 18.918 7.011 ( 6.188 0.000 -5.284) 8.137 7.290 ( -0.111 -0.000 -17.338) 17.339 7.627 ( 15.026 0.000 12.241) 19.381 8.426 ( -21.258 -0.000 13.995) 25.451 9.425 ( -6.928 -0.000 0.067) 6.928 9.493 ( -4.118 -0.000 -3.097) 5.152 9.718 ( -11.196 -0.000 22.217) 24.878 10.423 ( 8.008 0.000 -4.686) 9.278 11.058 ( -17.281 -0.000 -0.041) 17.281 11.442 ( 14.713 0.000 -6.937) 16.266 12.320 ( -4.326 -0.000 -5.479) 6.981 12.563 ( -7.348 -0.000 -2.926) 7.909 12.911 ( -2.273 -0.000 0.791) 2.406 13.123 ( 1.185 0.000 0.921) 1.501 14.381 ( 11.528 0.000 -18.258) 21.593 17.786 ( 16.501 0.000 22.461) 27.871 18.136 ( 2.074 0.000 -22.665) 22.760 19.397 ( 4.150 0.000 7.518) 8.587 19.659 ( -3.850 -0.000 -3.411) 5.144 19.869 ( 1.977 0.000 -1.339) 2.388 23.021 ( 15.766 0.000 -8.512) 17.917 23.692 ( -8.914 -0.000 9.108) 12.744 24.351 ( -4.620 -0.000 -8.156) 9.374 ======================= Grid point 612 (305/361) ======================= q-point: (-0.10 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( -14.246 -3.962 14.548) 20.744 2.194 ( -9.845 -5.235 19.567) 22.521 3.533 ( 4.296 3.220 -2.555) 5.945 3.582 ( -1.858 -1.432 -2.710) 3.585 3.762 ( 10.202 -1.161 -11.603) 15.493 4.131 ( -23.389 2.831 14.666) 27.752 4.644 ( -2.559 12.859 -5.554) 14.239 4.870 ( -2.430 -8.403 -8.393) 12.123 5.304 ( 4.010 1.737 0.103) 4.371 5.536 ( 21.571 -2.338 7.569) 22.980 5.757 ( -1.662 -1.000 6.969) 7.234 6.219 ( 8.208 3.883 -4.057) 9.945 6.813 ( -1.032 4.191 19.101) 19.583 6.945 ( -7.280 5.171 -7.375) 11.581 7.059 ( -0.853 -5.227 -13.983) 14.952 7.966 ( 8.864 6.188 14.451) 18.047 8.428 ( -12.960 -11.760 19.844) 26.458 9.332 ( -3.606 -3.191 -5.234) 7.112 9.406 ( -2.042 1.764 -1.844) 3.268 9.850 ( -6.872 0.620 20.142) 21.291 10.411 ( 0.305 6.470 -6.088) 8.889 10.789 ( -16.448 -6.867 -3.103) 18.092 11.526 ( 8.981 2.177 -6.829) 11.490 12.163 ( -6.868 0.389 -5.289) 8.677 12.527 ( -3.548 -5.107 5.213) 8.115 12.871 ( -1.614 1.456 -1.416) 2.594 13.166 ( 0.969 -3.571 0.680) 3.762 14.279 ( 10.110 2.528 -20.744) 23.215 17.922 ( 4.798 3.314 -14.907) 16.007 18.339 ( 22.763 -2.412 15.628) 27.716 19.409 ( -6.860 14.986 -5.166) 17.272 19.659 ( 15.277 -4.871 3.294) 16.370 19.883 ( -5.729 -9.370 -1.309) 11.060 23.151 ( 14.623 -2.018 -7.206) 16.427 23.555 ( -13.013 18.724 4.484) 23.238 24.116 ( -16.098 -12.940 -11.659) 23.717 ======================= Grid point 622 (306/361) ======================= q-point: (-0.10 -0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( -1.453 -0.000 18.754) 18.810 2.340 ( -4.398 -0.000 23.788) 24.191 3.385 ( -7.964 -0.000 -7.176) 10.720 3.682 ( 11.468 0.000 -3.478) 11.984 3.724 ( 7.067 0.000 -12.793) 14.615 4.013 ( -18.511 -0.000 13.296) 22.791 4.606 ( -1.186 -0.000 -14.542) 14.590 4.671 ( -4.396 -0.000 -1.097) 4.531 5.376 ( 2.003 0.000 4.877) 5.272 5.818 ( -3.824 -0.000 9.849) 10.565 5.917 ( 19.683 0.000 4.700) 20.237 6.344 ( 11.980 0.000 -2.900) 12.326 6.726 ( -11.065 -0.000 -4.887) 12.096 6.877 ( -2.476 -0.000 -7.662) 8.052 7.064 ( -1.514 -0.000 17.804) 17.868 8.324 ( 8.520 0.000 13.082) 15.611 8.443 ( -13.062 -0.000 25.423) 28.582 9.202 ( -3.796 -0.000 -4.266) 5.710 9.368 ( 2.057 0.000 -5.805) 6.159 10.013 ( -8.740 -0.000 21.866) 23.549 10.397 ( 5.046 0.000 -12.173) 13.178 10.454 ( -18.051 -0.000 2.747) 18.259 11.482 ( 0.098 0.000 -12.531) 12.531 12.033 ( -5.134 -0.000 -3.098) 5.996 12.564 ( -1.854 -0.000 9.627) 9.803 12.837 ( 2.084 0.000 -4.683) 5.126 13.171 ( 0.405 0.000 0.929) 1.014 14.169 ( 8.575 0.000 -20.032) 21.790 17.842 ( 7.382 0.000 -12.229) 14.284 18.822 ( 21.595 0.000 7.620) 22.900 19.240 ( -7.219 -0.000 -12.665) 14.578 19.711 ( -13.270 -0.000 4.434) 13.991 20.000 ( 25.240 0.000 5.708) 25.877 23.246 ( 12.427 0.000 -8.398) 14.999 23.516 ( -27.986 -0.000 -14.998) 31.752 23.572 ( -11.890 -0.000 5.380) 13.050 ======================= Grid point 623 (307/361) ======================= q-point: ( 0.00 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( 4.419 0.000 10.226) 11.140 2.820 ( -3.546 -0.000 -7.811) 8.579 3.348 ( 0.473 0.000 4.995) 5.018 3.451 ( -0.701 -0.000 -9.465) 9.491 3.472 ( 4.208 0.000 12.223) 12.927 3.764 ( -3.981 -0.000 -12.322) 12.949 4.337 ( 8.216 0.000 0.259) 8.220 4.357 ( -9.097 -0.000 -1.981) 9.310 5.870 ( 1.172 0.000 8.898) 8.974 6.016 ( 0.527 0.000 -5.531) 5.556 6.231 ( -8.166 -0.000 10.269) 13.120 6.397 ( 2.404 0.000 -6.179) 6.630 6.620 ( 0.344 0.000 -0.750) 0.825 6.640 ( 2.829 0.000 -2.361) 3.685 7.990 ( 3.876 0.000 23.683) 23.999 8.386 ( -7.199 -0.000 -15.510) 17.099 9.072 ( -5.954 -0.000 6.718) 8.977 9.162 ( 3.891 0.000 -3.674) 5.352 9.392 ( -3.788 -0.000 18.773) 19.151 9.783 ( 4.723 0.000 -19.341) 19.910 10.409 ( -7.675 -0.000 18.877) 20.377 10.768 ( 3.906 0.000 -17.281) 17.717 11.073 ( 8.104 0.000 18.529) 20.224 11.424 ( -6.065 -0.000 -16.027) 17.136 12.750 ( -7.433 -0.000 2.606) 7.876 12.810 ( 9.616 0.000 -3.923) 10.385 13.408 ( -3.756 -0.000 11.840) 12.421 13.668 ( 4.778 0.000 -13.645) 14.457 17.939 ( 11.340 0.000 5.361) 12.543 18.126 ( -11.759 -0.000 -13.052) 17.568 19.485 ( -15.017 -0.000 3.943) 15.526 19.540 ( 13.589 0.000 -1.629) 13.686 21.407 ( 29.382 0.000 19.696) 35.373 21.815 ( -29.649 -0.000 -20.562) 36.081 23.373 ( -9.904 -0.000 1.284) 9.987 23.404 ( 10.484 0.000 -2.050) 10.682 ======================= Grid point 624 (308/361) ======================= q-point: ( 0.10 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.689 ( -0.268 -0.708 -9.800) 9.829 2.842 ( 8.213 0.009 7.939) 11.423 3.342 ( -2.303 2.865 0.017) 3.676 3.372 ( -0.956 3.501 0.942) 3.750 3.545 ( -2.807 -3.498 -13.815) 14.525 3.704 ( 3.521 3.114 13.816) 14.593 4.246 ( -6.087 -2.455 0.064) 6.563 4.497 ( 9.156 -4.452 1.665) 10.316 5.891 ( -5.811 0.211 -8.167) 10.026 5.935 ( -5.303 0.014 5.824) 7.877 6.221 ( -11.760 -0.976 9.383) 15.076 6.334 ( -2.319 -0.533 -3.588) 4.305 6.607 ( 0.840 1.983 -1.830) 2.826 6.671 ( 4.380 -2.122 -1.594) 5.121 8.002 ( -8.528 12.015 -15.886) 21.667 8.260 ( 2.985 11.313 18.545) 21.927 9.072 ( -8.872 -6.164 3.431) 11.335 9.198 ( 1.477 -8.359 -1.739) 8.665 9.567 ( -3.358 0.999 15.908) 16.289 9.626 ( 3.275 -4.340 -16.086) 16.979 10.602 ( 0.695 -0.646 18.472) 18.496 10.660 ( 8.307 0.135 -13.412) 15.776 11.178 ( 4.717 4.172 -19.049) 20.063 11.446 ( 14.855 0.189 15.237) 21.281 12.686 ( -7.985 -5.258 1.435) 9.668 12.904 ( 6.829 -5.245 -4.171) 9.568 13.474 ( -6.887 2.312 12.320) 14.303 13.547 ( 3.173 1.128 -13.211) 13.633 17.835 ( -11.388 -0.601 -8.389) 14.157 18.203 ( 11.597 -0.746 10.655) 15.766 19.298 ( -15.973 2.276 2.535) 16.332 19.665 ( 7.511 1.045 -0.968) 7.645 21.163 ( -25.691 1.214 -20.382) 32.817 22.056 ( 26.685 -0.371 20.528) 33.669 23.272 ( -6.627 -0.506 0.516) 6.667 23.545 ( 11.600 -1.338 -1.008) 11.720 ======================= Grid point 625 (309/361) ======================= q-point: ( 0.20 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.584 ( 1.390 -3.904 -11.761) 12.470 3.039 ( 5.938 -0.211 6.376) 8.715 3.224 ( -2.949 1.901 -12.014) 12.516 3.341 ( -0.313 2.096 6.596) 6.928 3.510 ( -0.472 -5.594 0.906) 5.687 3.829 ( 2.257 8.605 9.631) 13.111 4.237 ( 1.139 -0.118 1.834) 2.163 4.693 ( 6.801 -7.405 2.454) 10.349 5.669 ( -11.003 0.993 -7.125) 13.146 5.859 ( -13.621 -1.679 2.751) 13.998 6.137 ( -13.547 -0.136 5.224) 14.520 6.261 ( -3.785 -0.596 -2.378) 4.510 6.577 ( 2.667 2.776 -2.679) 4.690 6.759 ( 5.674 -3.246 -0.032) 6.536 7.615 ( -4.744 13.988 -11.733) 18.863 8.303 ( 0.823 18.056 6.450) 19.191 9.027 ( -9.221 -6.020 2.358) 11.262 9.294 ( -0.756 -10.562 1.123) 10.648 9.503 ( -2.653 -12.034 -12.595) 17.621 9.712 ( -3.104 3.007 13.889) 14.546 10.644 ( 9.383 5.650 -5.718) 12.355 10.874 ( 6.352 0.334 14.499) 15.832 11.024 ( 14.422 4.008 -20.913) 25.718 11.824 ( 16.117 0.146 9.214) 18.565 12.671 ( -4.499 -7.518 1.908) 8.967 12.966 ( 1.613 -7.481 -6.186) 9.840 13.423 ( -0.397 1.554 -5.163) 5.406 13.511 ( -4.595 -0.680 7.679) 8.974 17.610 ( -11.002 0.145 -2.971) 11.397 18.522 ( 11.178 -0.591 13.411) 17.469 19.064 ( -14.142 3.768 -1.275) 14.691 19.715 ( -1.759 -1.296 2.003) 2.964 20.607 ( -15.445 2.309 -19.038) 24.623 22.626 ( 18.579 -0.334 18.434) 26.174 23.201 ( -1.655 2.678 -1.227) 3.379 23.740 ( 12.146 -4.552 2.151) 13.149 ======================= Grid point 626 (310/361) ======================= q-point: ( 0.30 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 3.187 -9.311 -12.147) 15.633 3.023 ( -1.658 -1.086 -13.294) 13.441 3.154 ( -5.705 -1.199 11.581) 12.965 3.452 ( 5.454 1.388 5.111) 7.603 3.580 ( -0.013 -7.786 0.927) 7.841 3.873 ( 2.223 13.504 9.342) 16.570 4.309 ( 8.417 2.811 0.539) 8.890 4.855 ( 2.427 -5.530 2.776) 6.647 5.419 ( -12.657 0.647 -3.711) 13.205 5.674 ( -17.647 -4.216 0.099) 18.144 5.988 ( -12.174 1.475 2.052) 12.434 6.176 ( -4.001 -0.506 -3.528) 5.358 6.583 ( 4.621 3.254 -0.434) 5.668 6.868 ( 4.243 -3.635 0.660) 5.626 7.339 ( 0.596 12.942 -9.279) 15.936 8.157 ( -1.818 16.389 -1.762) 16.584 8.987 ( -9.690 -7.240 2.445) 12.341 9.377 ( 2.648 -7.924 -2.853) 8.829 9.460 ( -9.622 -16.323 -0.971) 18.973 9.775 ( -1.654 7.088 9.648) 12.085 10.634 ( 4.554 13.007 0.772) 13.803 10.959 ( 20.932 2.153 -22.068) 30.493 11.144 ( 5.160 0.418 11.146) 12.289 12.084 ( 10.651 -2.475 1.115) 10.992 12.740 ( 1.230 -4.274 1.614) 4.731 12.938 ( -0.599 -5.682 -6.460) 8.624 13.363 ( -3.397 1.963 2.070) 4.436 13.600 ( 0.117 -8.848 5.134) 10.230 17.459 ( -9.793 1.184 3.879) 10.600 18.795 ( -7.439 -3.892 -3.517) 9.102 18.837 ( 7.308 8.832 7.113) 13.491 19.663 ( -13.888 -4.057 2.701) 14.718 20.280 ( 0.468 2.629 -11.919) 12.215 22.977 ( -3.525 -9.675 11.029) 15.089 23.162 ( 13.417 15.547 -2.363) 20.671 24.030 ( 12.443 -7.432 7.513) 16.325 ======================= Grid point 627 (311/361) ======================= q-point: (-0.60 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.512 ( -0.700 -8.740 -8.994) 12.560 2.910 ( 2.827 -1.259 -7.263) 7.894 3.202 ( -9.548 -3.544 10.680) 14.757 3.498 ( -1.499 2.499 0.503) 2.957 3.705 ( 5.665 -11.046 -0.518) 12.425 3.889 ( 2.282 14.258 8.152) 16.581 4.431 ( 12.829 4.305 -0.215) 13.534 4.884 ( -7.750 -0.557 2.576) 8.186 5.279 ( -5.708 -5.283 0.432) 7.789 5.483 ( -12.481 -2.976 -0.767) 12.854 5.849 ( -8.378 1.153 2.020) 8.695 6.073 ( -3.112 -0.713 -5.828) 6.645 6.616 ( 0.995 3.458 3.341) 4.910 6.943 ( 0.948 -3.626 -0.135) 3.750 7.168 ( 6.366 9.925 -9.766) 15.311 7.968 ( -2.934 10.997 -1.570) 11.490 8.928 ( -9.860 -6.481 0.286) 11.803 9.460 ( -6.250 -18.503 0.633) 19.541 9.498 ( 0.561 -2.129 4.081) 4.637 9.775 ( 0.255 9.894 4.250) 10.771 10.575 ( -0.740 12.165 5.006) 13.176 10.966 ( 18.476 2.033 -20.322) 27.540 11.289 ( 1.886 1.798 6.128) 6.659 12.231 ( 6.205 -4.864 -0.835) 7.928 12.740 ( -1.834 -2.220 -4.138) 5.042 12.933 ( 0.586 -1.114 -2.100) 2.448 13.362 ( -0.893 2.090 5.934) 6.354 13.766 ( 3.139 -11.602 1.486) 12.111 17.435 ( -5.981 -0.330 11.776) 13.212 18.518 ( -5.867 3.042 -16.558) 17.828 19.032 ( 6.823 3.501 6.671) 10.164 19.518 ( -11.165 -2.685 1.118) 11.538 20.242 ( 4.442 0.113 -2.002) 4.873 22.993 ( -9.579 -8.298 0.759) 12.696 23.248 ( 13.202 12.509 1.180) 18.225 24.356 ( 9.255 -5.876 8.426) 13.827 ======================= Grid point 628 (312/361) ======================= q-point: (-0.50 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.436 ( -5.579 0.017 -1.223) 5.711 2.855 ( -9.854 5.888 4.897) 12.480 3.266 ( 5.605 -7.033 -1.156) 9.067 3.456 ( 0.137 0.869 -0.437) 0.982 3.854 ( 0.538 13.250 2.747) 13.543 3.890 ( 3.209 -16.122 -1.214) 16.483 4.536 ( 2.061 1.170 -0.604) 2.446 4.802 ( -3.949 -2.171 2.469) 5.138 5.321 ( 0.753 -3.813 3.416) 5.175 5.367 ( -3.197 1.712 -2.068) 4.175 5.807 ( -3.168 0.990 6.421) 7.228 5.970 ( -0.738 -1.881 -7.679) 7.941 6.637 ( -1.809 0.845 5.567) 5.914 6.954 ( -2.369 -4.606 -2.145) 5.606 7.093 ( 6.767 5.024 -7.898) 11.550 7.868 ( -2.354 4.168 2.758) 5.524 8.860 ( -5.437 -1.486 1.780) 5.911 9.514 ( -10.396 -9.807 6.828) 15.839 9.601 ( 6.569 0.416 -1.234) 6.697 9.715 ( -0.940 6.443 1.344) 6.649 10.535 ( -5.504 6.707 9.695) 13.010 10.934 ( 11.779 0.174 -17.704) 21.265 11.338 ( 1.745 2.169 1.878) 3.358 12.309 ( 1.164 -2.182 -1.391) 2.837 12.687 ( -0.747 -1.023 -2.874) 3.141 12.902 ( -2.975 0.592 0.936) 3.175 13.405 ( 0.370 3.751 3.953) 5.462 13.895 ( 4.433 -7.928 -4.556) 10.162 17.581 ( -0.112 -3.713 13.936) 14.423 18.221 ( -0.209 3.525 -16.454) 16.829 19.124 ( 1.654 -0.097 1.651) 2.339 19.465 ( 0.030 -0.399 0.643) 0.758 20.274 ( 0.564 1.264 0.612) 1.513 22.958 ( -4.181 -6.227 -0.267) 7.505 23.300 ( 4.491 4.667 -0.252) 6.482 24.545 ( 1.927 -1.245 2.946) 3.734 ======================= Grid point 629 (313/361) ======================= q-point: (-0.40 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( -7.818 8.658 7.789) 14.027 2.705 ( -11.988 9.004 11.900) 19.141 3.380 ( 7.232 -1.903 -5.086) 9.044 3.512 ( 5.465 -5.087 -1.354) 7.588 3.728 ( -0.467 11.418 -3.570) 11.972 4.033 ( -0.845 -17.954 -4.385) 18.501 4.432 ( -14.118 -5.628 -0.760) 15.218 4.898 ( 6.151 -1.892 1.406) 6.587 5.288 ( 0.800 5.317 -1.329) 5.538 5.453 ( 11.179 1.882 3.044) 11.738 5.883 ( -0.590 1.136 10.274) 10.353 5.935 ( 4.792 -4.061 -5.340) 8.244 6.695 ( 0.481 -3.832 0.665) 3.919 6.931 ( -6.462 -6.797 2.592) 9.730 7.047 ( 1.650 2.112 -4.396) 5.149 7.896 ( -1.396 -4.161 6.236) 7.625 8.865 ( 1.514 5.075 6.137) 8.106 9.513 ( -8.608 -3.970 1.311) 9.570 9.518 ( 4.532 18.447 -2.175) 19.120 9.775 ( -2.316 -11.282 3.494) 12.036 10.524 ( -9.185 3.498 12.209) 15.674 10.868 ( 3.749 -2.768 -13.149) 13.951 11.360 ( 3.033 0.920 -1.482) 3.499 12.252 ( -4.787 2.334 -2.961) 6.094 12.681 ( 1.734 1.432 1.121) 2.513 12.881 ( -3.956 -0.063 3.314) 5.162 13.385 ( -1.701 6.296 2.136) 6.863 13.912 ( 5.262 -3.323 -11.648) 13.207 17.684 ( 3.122 -1.598 -8.354) 9.061 18.216 ( 9.339 -2.993 8.972) 13.292 19.125 ( -4.029 -5.332 -2.866) 7.272 19.534 ( 10.821 2.292 -0.446) 11.070 20.228 ( -4.087 4.592 0.272) 6.153 22.990 ( 0.346 -6.610 0.431) 6.633 23.287 ( -2.324 -1.799 -2.290) 3.725 24.485 ( -6.967 4.721 -4.378) 9.486 ======================= Grid point 630 (314/361) ======================= q-point: (-0.30 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( -6.413 9.955 13.246) 17.767 2.703 ( -4.541 7.020 17.601) 19.486 3.372 ( 0.318 -0.550 -8.233) 8.258 3.534 ( -3.337 -1.954 -2.635) 4.679 3.643 ( 10.648 7.783 -6.696) 14.792 4.071 ( -4.690 -16.307 -8.123) 18.812 4.303 ( -10.463 -7.025 0.183) 12.604 4.911 ( -2.161 4.725 -2.577) 5.799 5.332 ( 6.171 -0.176 4.289) 7.517 5.669 ( 19.423 4.274 0.899) 19.908 5.995 ( -0.360 0.226 10.353) 10.361 6.050 ( 10.199 -4.415 -1.281) 11.187 6.657 ( -4.654 -5.159 -6.528) 9.534 6.924 ( -1.138 2.399 -4.647) 5.352 7.096 ( -3.661 -9.236 13.991) 17.159 8.051 ( -0.459 -12.478 8.404) 15.051 8.943 ( 4.776 8.425 8.381) 12.807 9.335 ( -1.802 11.635 -3.064) 12.166 9.472 ( -0.008 9.259 1.761) 9.425 9.881 ( -2.563 -14.671 0.071) 14.894 10.509 ( -14.337 2.558 17.278) 22.597 10.759 ( -1.827 -0.106 -8.943) 9.128 11.344 ( 0.776 -1.545 -8.022) 8.206 12.104 ( -7.390 2.589 -1.954) 8.071 12.729 ( 2.954 2.618 3.514) 5.284 12.845 ( -4.425 2.881 2.208) 5.723 13.319 ( -2.724 7.034 2.927) 8.091 13.846 ( 7.253 -1.889 -15.949) 17.623 17.623 ( 7.080 -1.144 -11.529) 13.577 18.591 ( 15.350 -4.841 12.530) 20.398 19.029 ( -9.068 -8.135 -8.163) 14.664 19.707 ( 17.024 3.031 -1.653) 17.371 20.120 ( -5.044 6.226 4.470) 9.175 23.084 ( 2.705 -6.962 0.679) 7.500 23.199 ( -8.678 -6.277 -6.500) 12.528 24.184 ( -13.908 10.224 -7.772) 18.931 ======================= Grid point 631 (315/361) ======================= q-point: (-0.20 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( -1.471 4.253 14.035) 14.738 2.846 ( -1.776 4.570 20.525) 21.103 3.218 ( -6.504 -0.857 -7.709) 10.123 3.485 ( 1.851 -1.210 -7.282) 7.610 3.634 ( 8.930 4.611 -8.621) 13.241 4.006 ( -6.615 -9.927 -7.557) 14.121 4.268 ( -3.133 -6.232 -1.514) 7.137 4.751 ( -5.669 8.266 -3.430) 10.594 5.508 ( 5.941 -0.867 8.515) 10.419 5.898 ( 15.535 2.697 -1.062) 15.804 6.116 ( -0.828 -0.002 10.854) 10.886 6.231 ( 13.821 -3.026 -3.575) 14.593 6.582 ( -2.081 -4.049 -2.612) 5.249 6.797 ( -4.496 2.959 -4.173) 6.811 7.343 ( -0.754 -9.732 15.832) 18.599 8.286 ( -1.231 -19.241 7.213) 20.585 9.032 ( 5.022 7.774 6.072) 11.069 9.218 ( -3.169 7.980 5.402) 10.144 9.379 ( 1.758 15.701 -1.194) 15.844 9.951 ( 0.644 -13.223 -7.935) 15.435 10.487 ( -21.470 0.395 19.163) 28.781 10.652 ( 0.401 4.615 2.081) 5.078 11.192 ( -3.189 -0.928 -14.687) 15.058 11.951 ( -10.134 -1.307 -3.918) 10.943 12.743 ( 3.545 3.307 -4.670) 6.731 12.820 ( -1.197 6.660 8.311) 10.717 13.275 ( -2.851 4.101 5.360) 7.327 13.784 ( 8.562 -2.678 -15.648) 18.037 17.644 ( 9.554 -1.001 -6.020) 11.337 18.794 ( -8.515 -1.137 -12.793) 15.410 18.998 ( 14.930 -8.042 5.028) 17.688 19.759 ( -2.850 2.480 -2.634) 4.606 20.274 ( 18.004 3.465 14.059) 23.104 22.954 ( -20.844 -9.931 -13.330) 26.661 23.194 ( 7.315 -1.878 -1.235) 7.653 23.798 ( -14.782 10.599 -3.733) 18.568 ======================= Grid point 632 (316/361) ======================= q-point: (-0.10 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( 1.033 0.750 12.313) 12.379 2.961 ( -5.778 0.542 0.008) 5.804 3.152 ( 0.286 -1.046 13.340) 13.384 3.430 ( 2.304 -0.827 -6.933) 7.353 3.578 ( 3.667 0.797 -12.026) 12.598 3.912 ( -3.411 -3.441 -6.624) 8.207 4.270 ( 2.053 -2.021 -2.272) 3.668 4.543 ( -8.045 6.490 -3.149) 10.805 5.706 ( 4.449 -0.432 10.300) 11.228 6.012 ( 5.919 1.302 -0.999) 6.142 6.207 ( -3.219 0.181 7.824) 8.462 6.374 ( 11.479 -0.807 -6.016) 12.986 6.609 ( 3.530 -1.836 -1.237) 4.167 6.669 ( -4.609 1.478 -1.813) 5.168 7.640 ( 1.704 -6.976 20.089) 21.334 8.480 ( -2.853 -19.049 -2.678) 19.447 9.083 ( 2.508 6.644 3.991) 8.147 9.217 ( 0.998 11.393 -4.345) 12.234 9.250 ( -4.722 6.232 16.942) 18.660 9.924 ( 3.933 -5.675 -16.188) 17.599 10.384 ( -15.996 2.500 14.388) 21.660 10.781 ( 0.786 0.296 18.102) 18.121 10.962 ( -0.953 0.436 -16.832) 16.865 11.716 ( -12.133 -2.458 -11.127) 16.645 12.742 ( 8.909 3.507 -4.284) 10.489 12.815 ( -4.401 5.278 5.308) 8.683 13.313 ( -2.216 -0.045 9.304) 9.564 13.740 ( 7.255 -2.106 -14.005) 15.913 17.754 ( 10.713 -0.108 -0.305) 10.718 18.470 ( -11.655 -0.145 -15.563) 19.443 19.316 ( 16.889 -3.411 0.686) 17.243 19.633 ( -11.670 0.133 2.246) 11.885 20.780 ( 27.609 1.321 17.259) 32.586 22.460 ( -28.219 -3.601 -19.290) 34.372 23.294 ( 8.665 -0.362 -2.025) 8.906 23.529 ( -12.130 4.088 0.748) 12.822 ======================= Grid point 634 (317/361) ======================= q-point: ( 0.10 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.549 ( -0.545 -0.000 -11.791) 11.803 3.034 ( 6.115 0.000 4.034) 7.326 3.244 ( -2.493 -0.000 -14.613) 14.824 3.369 ( 0.031 0.000 1.885) 1.885 3.445 ( -3.429 -0.000 7.346) 8.107 3.923 ( 3.818 0.000 10.650) 11.314 4.244 ( 1.881 0.000 5.515) 5.827 4.600 ( 6.260 0.000 1.159) 6.367 5.680 ( -10.036 -0.000 -7.394) 12.466 5.844 ( -14.566 -0.000 2.214) 14.733 6.137 ( -13.573 -0.000 7.165) 15.348 6.256 ( -3.496 -0.000 -2.471) 4.282 6.610 ( 2.739 0.000 -2.883) 3.976 6.722 ( 5.111 0.000 0.733) 5.163 7.750 ( -6.201 -0.000 -14.813) 16.058 8.489 ( -4.761 -0.000 9.971) 11.049 9.007 ( -8.853 -0.000 9.121) 12.710 9.135 ( 3.209 0.000 -4.877) 5.838 9.380 ( -2.085 -0.000 -17.864) 17.985 9.749 ( -3.667 -0.000 17.788) 18.162 10.692 ( 16.063 0.000 -9.926) 18.883 10.877 ( 6.028 0.000 17.569) 18.574 11.077 ( 14.921 0.000 -24.108) 28.352 11.828 ( 14.168 0.000 11.012) 17.945 12.597 ( -4.129 -0.000 3.664) 5.520 12.884 ( 2.300 0.000 -5.981) 6.408 13.427 ( 2.544 0.000 -12.512) 12.768 13.521 ( -10.220 -0.000 13.229) 16.717 17.612 ( -10.664 -0.000 -2.376) 10.926 18.516 ( 11.172 0.000 14.120) 18.005 19.103 ( -15.040 -0.000 -0.069) 15.040 19.699 ( -4.311 -0.000 1.859) 4.695 20.629 ( -12.793 -0.000 -21.681) 25.174 22.615 ( 13.496 0.000 20.811) 24.804 23.243 ( 3.404 0.000 1.330) 3.654 23.689 ( 11.699 0.000 -1.042) 11.745 ======================= Grid point 635 (318/361) ======================= q-point: ( 0.20 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( 0.362 -3.575 -12.061) 12.585 2.975 ( 0.863 -2.363 -17.695) 17.873 3.161 ( -5.600 0.874 8.529) 10.241 3.463 ( -0.340 -0.724 5.143) 5.205 3.479 ( 2.749 -2.121 2.868) 4.503 4.084 ( 3.363 7.749 12.751) 15.295 4.368 ( 7.557 3.316 4.738) 9.517 4.711 ( 1.883 -7.777 1.765) 8.194 5.451 ( -10.856 1.961 -4.300) 11.840 5.601 ( -21.487 -2.925 -0.484) 21.691 6.022 ( -12.345 1.456 5.265) 13.500 6.170 ( -3.444 -0.180 -3.777) 5.115 6.633 ( 4.136 1.872 0.198) 4.544 6.813 ( 3.979 -2.057 1.291) 4.662 7.505 ( -2.131 4.893 -11.733) 12.890 8.379 ( -10.608 7.133 -2.181) 12.968 8.969 ( -5.179 5.200 3.938) 8.329 9.154 ( -5.733 -14.198 -7.522) 17.059 9.253 ( 3.436 -5.476 -0.402) 6.477 9.882 ( -4.966 3.372 16.096) 17.179 10.822 ( 17.326 5.938 -6.020) 19.279 10.999 ( 20.458 2.154 -26.515) 33.559 11.159 ( 6.028 0.606 13.071) 14.407 12.053 ( 6.708 -0.892 1.651) 6.966 12.690 ( 5.356 -0.976 6.197) 8.249 12.823 ( -1.571 -5.321 -7.032) 8.957 13.342 ( 3.400 -2.223 -9.119) 9.983 13.535 ( -11.126 -0.215 15.122) 18.775 17.475 ( -9.980 0.464 4.033) 10.774 18.742 ( -5.276 -1.425 0.350) 5.476 18.971 ( 3.007 4.453 9.139) 10.602 19.601 ( -14.300 -2.228 3.278) 14.839 20.306 ( 1.886 0.575 -18.249) 18.355 22.842 ( -8.809 -4.120 10.279) 14.150 23.434 ( 18.361 11.716 7.343) 22.985 23.875 ( 11.370 -8.086 1.428) 14.025 ======================= Grid point 636 (319/361) ======================= q-point: ( 0.30 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( 4.901 -6.619 -8.319) 11.706 2.842 ( 5.743 -5.015 -15.353) 17.142 3.173 ( -11.791 -0.182 13.868) 18.204 3.461 ( -4.965 -4.908 -0.113) 6.982 3.608 ( 5.810 -0.647 1.513) 6.039 4.164 ( 0.274 14.925 12.487) 19.462 4.514 ( 11.452 4.414 2.582) 12.542 4.801 ( -6.401 -8.509 2.797) 11.009 5.219 ( -15.005 -0.926 -0.607) 15.046 5.392 ( -9.694 -5.519 -0.851) 11.187 5.907 ( -9.082 3.895 5.393) 11.257 6.070 ( -2.400 -0.037 -6.001) 6.464 6.674 ( -0.258 2.703 3.929) 4.776 6.882 ( 0.105 -2.954 0.988) 3.116 7.317 ( 2.757 6.105 -11.784) 13.555 8.093 ( -13.051 3.612 -6.458) 15.003 8.893 ( -2.104 0.411 -1.945) 2.894 9.150 ( -7.263 -12.061 3.202) 14.438 9.412 ( 5.546 -6.196 4.080) 9.262 9.940 ( -5.251 6.632 12.578) 15.157 10.825 ( 13.762 12.960 -13.607) 23.292 11.015 ( 18.389 3.669 -14.896) 23.948 11.322 ( 3.103 1.095 4.522) 5.593 12.151 ( 4.638 -3.435 0.660) 5.810 12.692 ( -3.558 -2.987 -4.683) 6.596 12.897 ( 5.039 -2.385 0.468) 5.594 13.338 ( 3.420 -4.552 -4.651) 7.352 13.621 ( -5.230 -3.546 15.433) 16.676 17.432 ( -8.269 -0.044 10.969) 13.737 18.515 ( -10.260 -1.578 -13.219) 16.808 19.179 ( 9.342 9.696 10.755) 17.232 19.472 ( -9.372 -2.214 1.767) 9.791 20.203 ( 4.430 -3.474 -9.338) 10.904 22.812 ( -13.999 -8.016 5.009) 16.892 23.575 ( 14.006 19.904 2.001) 24.420 24.192 ( 9.861 -12.292 7.195) 17.324 ======================= Grid point 637 (320/361) ======================= q-point: ( 0.40 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( 5.234 -0.910 -0.709) 5.360 2.860 ( 7.107 -5.594 -7.438) 11.710 3.182 ( -8.700 -1.328 12.051) 14.923 3.420 ( -4.255 -4.748 -2.118) 6.719 3.687 ( 0.963 -5.678 -0.248) 5.765 4.134 ( -1.310 16.703 7.037) 18.172 4.568 ( -8.609 1.728 -2.696) 9.185 4.750 ( -3.531 -2.998 5.451) 7.153 5.182 ( -2.298 -10.368 4.231) 11.432 5.375 ( 1.796 -0.646 0.383) 1.946 5.859 ( -3.606 4.244 8.119) 9.846 5.965 ( -0.147 0.569 -6.957) 6.982 6.663 ( -4.909 1.719 4.542) 6.905 6.879 ( -6.158 -3.671 0.194) 7.172 7.180 ( 4.286 4.788 -10.892) 12.647 7.846 ( -12.356 -5.229 -4.606) 14.186 8.890 ( 3.544 2.053 2.049) 4.580 9.218 ( -8.492 -13.095 6.492) 16.904 9.590 ( 6.622 -2.520 3.860) 8.069 9.924 ( -4.164 9.824 7.700) 13.158 10.720 ( 7.863 12.273 -8.786) 17.019 10.988 ( 9.925 6.261 -14.611) 18.740 11.377 ( 5.063 1.417 -1.848) 5.573 12.256 ( 2.167 -3.160 2.193) 4.415 12.643 ( -1.681 -3.589 -1.319) 4.177 12.918 ( -1.874 0.849 0.207) 2.068 13.389 ( 3.427 -5.472 -3.702) 7.442 13.787 ( 0.212 -3.194 9.980) 10.481 17.524 ( -4.141 -2.588 16.089) 16.813 18.218 ( -5.685 -2.465 -17.826) 18.873 19.258 ( 4.900 13.047 2.698) 14.196 19.455 ( 2.682 -0.683 1.255) 3.038 20.223 ( 0.781 -6.550 -2.816) 7.172 22.752 ( -14.534 -11.398 4.476) 19.006 23.560 ( 9.824 18.880 -2.043) 21.381 24.458 ( 2.665 -8.318 4.653) 9.896 ======================= Grid point 638 (321/361) ======================= q-point: (-0.50 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( 2.306 7.539 7.612) 10.959 2.835 ( -9.190 5.139 6.347) 12.295 3.313 ( 9.425 -6.285 0.434) 11.337 3.398 ( -2.537 -6.201 -1.536) 6.873 3.738 ( -3.721 -12.115 -1.930) 12.820 3.999 ( -0.255 16.075 -2.070) 16.209 4.337 ( -18.343 -5.079 0.109) 19.033 4.850 ( 2.661 -2.733 3.406) 5.114 5.307 ( -1.593 -5.203 3.614) 6.533 5.463 ( 12.392 1.559 1.512) 12.581 5.898 ( 2.737 0.362 -0.518) 2.809 5.941 ( 2.192 4.078 7.365) 8.699 6.644 ( -2.863 -1.746 0.251) 3.363 6.802 ( -12.246 -6.900 4.342) 14.711 7.082 ( 1.490 1.933 -7.348) 7.743 7.742 ( -8.699 -11.983 -0.807) 14.829 8.991 ( 7.248 6.858 7.315) 12.372 9.293 ( -9.195 -14.082 6.191) 17.921 9.712 ( 3.804 0.906 0.672) 3.968 9.840 ( -0.818 14.113 3.685) 14.609 10.625 ( -2.278 8.728 2.520) 9.366 10.868 ( 8.973 2.336 -18.806) 20.967 11.395 ( 5.127 2.936 -4.099) 7.191 12.280 ( -3.801 0.445 0.488) 3.858 12.676 ( 1.333 -1.648 2.670) 3.409 12.887 ( -3.509 0.571 3.327) 4.869 13.416 ( 1.719 -3.213 -4.403) 5.715 13.882 ( 0.512 0.378 1.888) 1.992 17.660 ( 0.256 -0.969 0.390) 1.075 18.089 ( 1.495 -9.932 0.446) 10.054 19.182 ( 0.124 10.660 -2.345) 10.916 19.571 ( 12.827 1.678 -0.027) 12.936 20.233 ( -2.975 -4.222 -1.955) 5.522 22.731 ( -14.288 -15.310 5.610) 21.680 23.479 ( 7.273 16.284 -4.590) 18.416 24.501 ( -6.043 -2.778 -2.167) 6.996 ======================= Grid point 639 (322/361) ======================= q-point: (-0.40 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.493 ( -6.076 13.562 11.820) 18.989 2.802 ( -4.257 3.746 13.197) 14.364 3.353 ( -3.632 -2.139 -4.943) 6.497 3.473 ( 2.535 -4.539 -1.822) 5.509 3.752 ( -3.114 -13.888 -4.806) 15.022 3.849 ( 6.086 10.217 -8.900) 14.853 4.191 ( -11.615 -5.299 3.595) 13.263 4.916 ( -1.637 -3.418 -0.307) 3.802 5.351 ( 2.742 1.192 4.197) 5.154 5.703 ( 16.752 -0.804 1.625) 16.850 5.975 ( 7.249 -0.619 1.887) 7.517 6.053 ( 2.780 3.926 9.485) 10.635 6.563 ( -6.997 -5.060 -4.441) 9.710 6.871 ( -5.066 -10.477 11.951) 16.681 6.990 ( -2.360 0.516 -5.090) 5.634 7.786 ( -6.099 -16.603 2.998) 17.940 9.115 ( 6.326 10.355 9.210) 15.234 9.369 ( -4.906 -10.681 3.756) 12.339 9.622 ( -6.110 7.814 -0.282) 9.923 9.832 ( 5.915 9.517 2.700) 11.526 10.561 ( -11.631 4.341 12.266) 17.452 10.760 ( 11.367 0.281 -20.004) 23.010 11.351 ( 1.893 2.925 -7.813) 8.554 12.160 ( -9.267 3.088 -1.279) 9.852 12.755 ( 2.984 0.695 3.683) 4.790 12.891 ( -2.614 1.528 5.398) 6.189 13.397 ( 0.479 0.301 -2.766) 2.824 13.845 ( 0.164 2.460 -5.711) 6.220 17.603 ( 5.630 -0.904 -11.123) 12.500 18.391 ( 5.401 -15.539 13.935) 21.559 19.031 ( -2.532 7.486 -5.468) 9.610 19.760 ( 15.551 2.570 -1.194) 15.807 20.184 ( -0.900 0.433 -0.814) 1.289 22.745 ( -16.692 -18.917 5.593) 25.842 23.371 ( 7.001 13.852 -6.734) 16.919 24.300 ( -12.855 2.805 -7.622) 15.206 ======================= Grid point 640 (323/361) ======================= q-point: (-0.30 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( -5.237 8.855 12.475) 16.169 2.921 ( -3.310 2.841 17.579) 18.112 3.194 ( -8.917 -1.706 -6.757) 11.317 3.462 ( 0.646 -1.456 -5.954) 6.163 3.720 ( 0.887 -2.545 -13.323) 13.593 3.809 ( 5.387 -2.928 -4.477) 7.592 4.188 ( -2.114 -3.122 4.017) 5.509 4.844 ( -6.074 1.273 -3.018) 6.901 5.498 ( 6.456 -0.040 8.411) 10.603 5.939 ( 15.059 0.650 -1.239) 15.124 6.122 ( 1.387 0.452 9.245) 9.359 6.189 ( 10.444 0.015 1.885) 10.613 6.499 ( -3.245 -5.026 -0.419) 5.998 6.851 ( -5.052 2.773 -4.161) 7.108 7.108 ( -1.740 -15.326 12.406) 19.795 7.916 ( -6.692 -21.355 4.054) 22.743 9.197 ( 5.839 11.002 5.494) 13.613 9.366 ( -2.816 6.823 2.029) 7.655 9.556 ( -5.263 -4.264 5.562) 8.764 9.841 ( 4.291 8.543 0.318) 9.566 10.504 ( -17.533 1.763 15.789) 23.660 10.710 ( 12.890 1.759 -13.425) 18.694 11.197 ( -1.980 2.460 -12.602) 12.992 11.949 ( -13.410 1.146 -4.209) 14.102 12.819 ( 5.608 4.680 0.713) 7.339 12.922 ( -0.914 3.863 7.886) 8.828 13.360 ( -2.807 3.693 2.067) 5.078 13.740 ( 2.738 -0.807 -11.813) 12.153 17.620 ( 9.641 -1.574 -5.561) 11.240 18.677 ( -6.246 -12.155 -1.078) 13.708 18.931 ( 9.911 2.189 0.670) 10.171 19.791 ( -4.747 0.528 -4.271) 6.408 20.347 ( 22.055 4.162 7.938) 23.807 22.673 ( -23.765 -17.367 -0.728) 29.443 23.293 ( 9.458 9.667 -6.110) 14.840 23.954 ( -15.220 6.337 -7.533) 18.126 ======================= Grid point 641 (324/361) ======================= q-point: (-0.20 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( -0.797 3.209 11.854) 12.306 2.974 ( -7.541 0.677 -2.305) 7.914 3.114 ( -2.244 -3.149 12.217) 12.814 3.399 ( 0.201 -2.713 -7.108) 7.611 3.593 ( 0.556 0.082 -10.117) 10.133 3.831 ( 3.459 -3.076 -7.791) 9.063 4.260 ( 4.226 0.790 3.293) 5.415 4.668 ( -8.042 5.454 -4.178) 10.577 5.698 ( 4.543 -0.235 10.455) 11.402 6.050 ( 6.853 2.210 -3.550) 8.028 6.218 ( -3.142 1.238 9.619) 10.194 6.355 ( 11.662 -0.918 -3.447) 12.195 6.557 ( 4.181 -3.728 0.689) 5.644 6.703 ( -6.425 2.038 -1.988) 7.028 7.416 ( 1.793 -16.697 15.154) 22.619 8.055 ( -8.014 -25.460 0.007) 26.692 9.212 ( 5.699 9.091 0.511) 10.741 9.337 ( -3.024 6.390 9.083) 11.510 9.534 ( -5.280 10.384 4.337) 12.430 9.821 ( 3.616 0.358 -5.757) 6.808 10.433 ( -14.212 2.267 13.677) 19.854 10.788 ( 9.816 0.191 0.996) 9.869 10.989 ( 0.447 3.151 -13.068) 13.450 11.663 ( -15.079 -2.258 -9.872) 18.164 12.859 ( 9.375 8.839 -1.169) 12.938 12.949 ( -3.256 7.505 6.900) 10.702 13.320 ( -5.093 1.377 6.664) 8.500 13.671 ( 5.462 -5.099 -13.611) 15.528 17.750 ( 11.114 -0.296 0.874) 11.152 18.466 ( -11.272 -0.353 -12.373) 16.741 19.213 ( 15.131 -7.278 2.682) 17.003 19.627 ( -11.645 -1.103 -1.420) 11.783 20.823 ( 29.242 3.239 14.021) 32.591 22.340 ( -28.957 -9.172 -11.838) 32.600 23.320 ( 9.892 3.772 -2.817) 10.955 23.628 ( -13.206 5.777 -3.155) 14.756 ======================= Grid point 642 (325/361) ======================= q-point: (-0.10 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.644 ( 3.866 0.565 10.191) 10.914 2.823 ( -3.184 0.417 -7.628) 8.276 3.280 ( -1.636 -6.431 6.972) 9.625 3.379 ( 1.423 -5.413 -4.074) 6.923 3.522 ( 0.402 2.698 3.878) 4.741 3.750 ( -0.201 -0.579 -12.211) 12.226 4.360 ( 3.712 3.536 4.037) 6.525 4.447 ( -4.460 6.692 -4.653) 9.291 5.865 ( 0.936 -0.278 9.408) 9.458 6.024 ( 0.282 0.738 -6.458) 6.506 6.248 ( -7.299 1.796 9.977) 12.492 6.405 ( 3.071 0.834 -5.786) 6.603 6.609 ( -2.339 -0.877 0.480) 2.543 6.646 ( 4.902 0.244 -2.551) 5.532 7.830 ( 5.103 -16.243 19.204) 25.664 8.115 ( -8.649 -23.897 -8.813) 26.899 9.232 ( 4.857 8.404 1.361) 9.802 9.267 ( -4.787 11.551 -2.337) 12.720 9.445 ( -8.246 7.046 18.012) 21.026 9.772 ( 5.652 -0.158 -14.002) 15.101 10.441 ( -7.037 2.803 16.961) 18.576 10.772 ( 3.431 0.554 -15.895) 16.271 11.074 ( 11.333 0.789 13.304) 17.494 11.370 ( -7.984 -4.887 -14.868) 17.569 12.844 ( -7.168 9.446 2.598) 12.139 12.893 ( 9.438 8.591 -2.688) 13.042 13.379 ( -4.535 -3.086 11.121) 12.401 13.628 ( 4.880 -4.277 -13.263) 14.766 17.947 ( 11.202 0.892 6.056) 12.765 18.139 ( -11.421 1.460 -12.683) 17.130 19.443 ( -10.085 -4.693 4.229) 11.900 19.512 ( 9.229 -2.981 -2.728) 10.075 21.415 ( 27.958 0.835 18.435) 33.499 21.789 ( -28.140 -2.751 -18.433) 33.752 23.397 ( -5.142 2.612 0.574) 5.796 23.424 ( 5.313 2.119 -2.109) 6.096 ======================= Grid point 645 (326/361) ======================= q-point: ( 0.20 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( 6.357 0.000 -7.584) 9.896 2.787 ( 5.576 0.000 -17.387) 18.260 3.175 ( -10.547 -0.000 12.541) 16.386 3.409 ( -5.523 -0.000 0.607) 5.557 3.608 ( 4.509 0.000 2.770) 5.293 4.338 ( 1.155 0.000 15.820) 15.862 4.572 ( 9.739 0.000 4.013) 10.533 4.665 ( -4.645 -0.000 1.233) 4.806 5.222 ( -25.715 -0.000 -1.233) 25.744 5.332 ( -2.647 -0.000 -1.558) 3.071 5.948 ( -9.661 -0.000 6.993) 11.927 6.068 ( -2.020 -0.000 -6.372) 6.684 6.701 ( -1.125 -0.000 4.416) 4.557 6.852 ( 0.089 0.000 1.230) 1.234 7.373 ( 1.580 0.000 -12.179) 12.281 8.126 ( -17.871 -0.000 -8.647) 19.853 8.861 ( -0.233 -0.000 -11.820) 11.822 9.091 ( -6.474 -0.000 14.352) 15.745 9.334 ( 8.797 0.000 2.999) 9.294 9.999 ( -8.316 -0.000 15.629) 17.703 10.938 ( 22.794 0.000 -30.455) 38.041 11.082 ( 19.942 0.000 -4.774) 20.506 11.323 ( -0.159 -0.000 4.593) 4.596 12.120 ( 3.270 0.000 2.362) 4.034 12.656 ( -4.171 -0.000 -6.299) 7.555 12.872 ( 6.952 0.000 3.145) 7.630 13.280 ( 4.449 0.000 -8.065) 9.211 13.600 ( -8.306 -0.000 19.513) 21.207 17.431 ( -9.136 -0.000 10.685) 14.058 18.498 ( -11.093 -0.000 -12.349) 16.600 19.284 ( 9.543 0.000 14.546) 17.397 19.448 ( -8.542 -0.000 2.377) 8.866 20.162 ( 4.183 0.000 -14.332) 14.930 22.738 ( -14.405 -0.000 5.637) 15.468 23.896 ( 14.852 0.000 12.828) 19.625 23.942 ( 8.351 0.000 -2.713) 8.781 ======================= Grid point 646 (327/361) ======================= q-point: ( 0.30 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( 13.441 -0.066 0.930) 13.474 2.733 ( 10.672 -5.460 -13.209) 17.838 3.190 ( -11.105 0.953 15.830) 19.360 3.337 ( -5.299 -3.066 -1.731) 6.362 3.646 ( -2.601 -0.397 1.126) 2.862 4.414 ( -5.804 12.825 10.557) 17.596 4.578 ( -17.434 -0.262 -2.519) 17.617 4.688 ( 2.906 -5.007 2.588) 6.341 5.019 ( -4.772 -5.497 7.419) 10.394 5.356 ( 5.541 -0.939 0.364) 5.631 5.930 ( -4.953 2.950 8.477) 10.251 5.969 ( -0.004 -0.394 -6.038) 6.051 6.688 ( -8.042 0.855 5.270) 9.653 6.830 ( -6.664 -1.573 0.854) 6.901 7.255 ( 3.529 2.791 -11.585) 12.428 7.753 ( -18.021 -3.532 -10.133) 20.974 8.816 ( 4.016 -5.904 -4.803) 8.606 9.175 ( -5.055 3.392 14.959) 16.150 9.536 ( 10.341 -2.566 4.252) 11.472 10.033 ( -10.442 2.787 13.818) 17.542 10.862 ( 23.486 2.997 -32.062) 39.857 11.182 ( 2.954 12.899 -3.666) 13.731 11.355 ( 8.120 -4.777 -3.786) 10.153 12.215 ( 1.775 -1.135 4.963) 5.391 12.576 ( -1.875 -2.896 -0.962) 3.582 12.929 ( -1.065 0.374 0.679) 1.318 13.277 ( 4.935 -4.548 -6.825) 9.572 13.765 ( -2.322 -0.189 17.267) 17.423 17.491 ( -6.698 -0.973 17.131) 18.420 18.178 ( -7.754 -1.399 -18.405) 20.021 19.444 ( 4.381 -0.316 1.333) 4.591 19.499 ( 6.097 10.444 7.783) 14.381 20.077 ( 0.310 -7.418 -8.997) 11.665 22.608 ( -15.707 -4.130 5.457) 17.134 23.897 ( 6.827 16.755 -2.021) 18.205 24.260 ( 4.418 -12.596 6.562) 14.875 ======================= Grid point 647 (328/361) ======================= q-point: ( 0.40 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( 9.720 5.346 5.807) 12.521 2.849 ( 8.516 -4.827 -2.988) 10.235 3.213 ( -8.377 -1.699 9.390) 12.698 3.311 ( 0.499 -3.706 0.366) 3.757 3.594 ( -7.359 -4.320 -0.307) 8.539 4.234 ( -20.707 -1.169 -3.871) 21.098 4.300 ( -5.609 11.368 4.040) 13.304 4.797 ( 0.070 -4.046 3.085) 5.088 5.186 ( 1.816 -5.478 8.911) 10.616 5.485 ( 10.833 0.132 0.648) 10.853 5.910 ( 4.489 0.725 -3.764) 5.903 6.016 ( -0.416 3.379 12.491) 12.947 6.628 ( -6.453 -0.455 2.310) 6.869 6.705 ( -15.508 -3.307 2.571) 16.063 7.129 ( 0.447 3.693 -8.192) 8.997 7.514 ( -11.052 -12.286 -6.195) 17.648 8.931 ( 5.014 -9.677 0.283) 10.903 9.252 ( -4.498 5.934 15.483) 17.180 9.730 ( 9.202 0.700 2.016) 9.446 10.002 ( -10.451 4.772 11.161) 16.018 10.772 ( 19.506 4.627 -26.335) 33.097 10.973 ( -2.973 9.384 -9.523) 13.696 11.455 ( 10.112 3.143 -4.520) 11.513 12.270 ( -3.511 -1.085 3.236) 4.896 12.630 ( 1.609 -3.120 4.559) 5.754 12.898 ( -4.000 0.538 2.482) 4.738 13.315 ( 4.579 -6.044 -6.414) 9.932 13.905 ( -2.377 1.421 10.617) 10.972 17.652 ( -2.415 0.028 12.324) 12.558 17.920 ( -2.537 -7.664 -10.932) 13.590 19.446 ( 0.772 17.013 -1.608) 17.106 19.593 ( 14.475 0.786 0.248) 14.499 20.083 ( -1.741 -11.890 -4.404) 12.798 22.517 ( -15.693 -8.089 6.730) 18.894 23.784 ( 4.389 16.414 -4.416) 17.555 24.395 ( -4.762 -8.397 0.319) 9.659 ======================= Grid point 648 (329/361) ======================= q-point: (-0.50 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( -0.898 10.052 9.942) 14.166 2.860 ( -3.759 4.357 6.165) 8.433 3.246 ( -4.287 -9.889 -1.491) 10.881 3.408 ( 5.450 -2.213 0.850) 5.943 3.518 ( -8.258 -9.267 -3.788) 12.978 4.010 ( -3.354 0.320 -4.259) 5.430 4.180 ( -5.110 8.290 3.926) 10.500 4.828 ( -3.818 -5.584 -0.293) 6.771 5.343 ( 2.670 -1.782 7.228) 7.909 5.676 ( 14.046 -1.591 0.777) 14.157 5.984 ( 7.124 0.994 2.831) 7.730 6.147 ( 2.363 5.460 11.787) 13.203 6.486 ( -11.608 -3.173 -1.808) 12.169 6.686 ( -6.496 -8.636 8.518) 13.760 7.014 ( -2.555 1.739 -4.809) 5.717 7.482 ( -7.031 -16.501 -1.366) 17.988 9.110 ( 3.311 -11.149 3.639) 12.186 9.322 ( -3.801 7.752 15.585) 17.817 9.768 ( 0.710 7.843 -3.247) 8.518 9.975 ( -3.278 4.298 9.197) 10.667 10.676 ( 0.211 7.262 -4.359) 8.472 10.771 ( 12.046 1.351 -23.166) 26.146 11.455 ( 6.455 8.076 -6.902) 12.431 12.197 ( -9.892 0.736 -0.311) 9.925 12.755 ( 3.730 -0.811 5.986) 7.099 12.896 ( -2.469 -0.730 4.921) 5.554 13.346 ( 3.994 -4.370 -6.128) 8.520 13.915 ( -5.483 4.202 4.169) 8.069 17.595 ( 4.085 0.136 -11.896) 12.578 18.116 ( 0.818 -13.652 17.418) 22.145 19.236 ( -2.871 14.100 -5.527) 15.414 19.789 ( 10.608 0.172 -1.231) 10.680 20.132 ( 7.850 -5.857 -3.725) 10.479 22.468 ( -16.869 -11.585 7.339) 21.740 23.632 ( 3.329 14.520 -5.989) 16.056 24.293 ( -11.530 -3.295 -6.041) 13.427 ======================= Grid point 649 (330/361) ======================= q-point: (-0.40 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.629 ( -9.032 10.668 9.383) 16.835 2.941 ( -2.972 -0.093 12.603) 12.949 3.157 ( -10.367 -2.559 -4.050) 11.420 3.410 ( -1.801 -6.047 -7.502) 9.802 3.530 ( 1.206 -8.664 -2.967) 9.237 3.947 ( 8.704 8.657 -10.098) 15.895 4.159 ( -1.284 1.130 8.279) 8.454 4.797 ( -5.955 -5.907 -2.091) 8.644 5.503 ( 6.215 0.206 8.089) 10.203 5.901 ( 12.255 -4.284 0.004) 12.982 6.132 ( 6.087 1.226 7.032) 9.382 6.257 ( 4.856 6.293 6.956) 10.563 6.408 ( -4.818 -4.954 2.253) 7.268 6.830 ( -3.023 -13.616 6.822) 15.527 6.896 ( -5.142 1.318 -1.552) 5.531 7.541 ( -7.939 -19.706 0.627) 21.254 9.305 ( 2.757 -10.126 4.895) 11.580 9.388 ( -2.154 8.948 14.606) 17.264 9.595 ( -4.932 9.983 -3.271) 11.606 10.013 ( 0.556 5.942 5.691) 8.246 10.553 ( -11.458 3.473 6.496) 13.621 10.726 ( 20.990 0.264 -22.789) 30.983 11.316 ( 1.094 10.919 -9.830) 14.733 11.980 ( -14.853 1.905 -4.215) 15.556 12.886 ( 4.984 2.024 6.128) 8.154 12.958 ( 1.673 0.374 5.521) 5.781 13.358 ( 2.576 -3.072 -4.876) 6.313 13.789 ( -7.601 5.447 -1.672) 9.499 17.591 ( 9.652 -1.515 -5.325) 11.127 18.442 ( -0.592 -12.582 11.274) 16.904 19.027 ( -0.420 7.757 -5.118) 9.303 19.767 ( -7.454 -3.364 -5.433) 9.818 20.409 ( 28.595 2.468 2.412) 28.803 22.393 ( -21.597 -13.032 4.525) 25.627 23.490 ( 4.578 11.473 -6.364) 13.896 24.022 ( -14.169 1.268 -8.361) 16.501 ======================= Grid point 650 (331/361) ======================= q-point: (-0.30 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.583 ( -4.107 5.398 10.457) 12.465 2.976 ( -8.215 -0.659 -4.730) 9.502 3.049 ( -4.099 -3.648 10.737) 12.058 3.328 ( -1.953 -4.833 -8.828) 10.252 3.565 ( 0.044 -2.550 -1.220) 2.827 3.860 ( 7.215 5.747 -10.910) 14.287 4.277 ( 5.211 0.899 6.489) 8.370 4.706 ( -6.773 -1.394 -3.885) 7.931 5.697 ( 5.198 -0.075 9.737) 11.037 6.054 ( 6.749 -2.638 -3.861) 8.211 6.262 ( -1.395 3.340 10.374) 10.987 6.364 ( 10.365 2.620 -0.258) 10.694 6.481 ( 3.387 -4.458 3.542) 6.625 6.735 ( -8.070 1.262 -2.223) 8.466 7.091 ( 1.567 -17.976 10.493) 20.873 7.610 ( -9.619 -23.170 -1.113) 25.112 9.402 ( 0.929 11.262 -0.562) 11.314 9.428 ( -2.260 0.448 6.178) 6.593 9.516 ( -2.858 -1.666 11.110) 11.592 9.989 ( 1.021 10.081 -1.055) 10.187 10.465 ( -12.476 1.616 11.345) 16.940 10.779 ( 17.979 -1.123 -14.996) 23.439 11.110 ( 2.932 11.002 -8.375) 14.135 11.658 ( -17.141 1.721 -8.324) 19.133 13.004 ( 2.359 2.402 7.694) 8.399 13.049 ( 7.311 7.383 3.282) 10.896 13.347 ( -2.949 -0.687 -0.062) 3.028 13.604 ( -3.928 -0.019 -8.722) 9.565 17.743 ( 11.927 -0.436 2.672) 12.230 18.456 ( -9.338 -0.906 -6.345) 11.326 19.085 ( 9.821 -6.153 3.236) 12.033 19.587 ( -11.099 -3.394 -5.519) 12.852 20.887 ( 32.424 3.480 8.720) 33.756 22.160 ( -27.850 -9.986 -3.817) 29.831 23.422 ( 7.341 7.042 -4.225) 11.015 23.715 ( -12.989 3.698 -5.537) 14.596 ======================= Grid point 651 (332/361) ======================= q-point: (-0.20 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( 2.215 1.749 9.814) 10.212 2.835 ( -2.093 0.805 -6.787) 7.148 3.158 ( -2.835 -6.428 6.787) 9.768 3.267 ( -0.104 -6.676 -5.492) 8.645 3.566 ( -1.961 2.409 5.096) 5.968 3.768 ( 4.425 2.617 -12.271) 13.304 4.421 ( 3.356 2.226 6.476) 7.626 4.546 ( -3.261 3.640 -6.022) 7.756 5.866 ( 1.241 0.129 9.654) 9.734 6.034 ( -0.586 -0.094 -7.256) 7.280 6.295 ( -5.896 3.565 9.042) 11.367 6.431 ( 4.523 2.264 -4.742) 6.933 6.589 ( -3.841 -1.549 2.504) 4.840 6.642 ( 5.077 -0.729 -2.135) 5.556 7.474 ( 6.478 -21.740 13.047) 26.169 7.656 ( -9.473 -25.431 -5.206) 27.633 9.357 ( 1.406 5.462 3.578) 6.679 9.404 ( -4.349 4.369 0.215) 6.168 9.601 ( -5.864 6.657 13.114) 15.833 9.844 ( 2.666 9.024 -8.667) 12.793 10.476 ( -7.917 0.436 15.369) 17.294 10.788 ( 7.667 1.018 -15.490) 17.313 11.130 ( 15.915 5.964 4.133) 17.491 11.305 ( -12.936 -0.782 -11.705) 17.463 13.030 ( -6.024 9.160 4.824) 11.978 13.090 ( 9.592 12.456 -1.296) 15.775 13.312 ( -7.484 -3.455 8.280) 11.684 13.523 ( 4.979 -6.879 -11.944) 14.655 17.970 ( 11.264 1.593 7.761) 13.771 18.175 ( -10.928 2.419 -11.795) 16.261 19.325 ( -2.719 -8.053 5.636) 10.199 19.441 ( 2.853 -4.638 -5.785) 7.945 21.435 ( 23.995 1.241 14.757) 28.197 21.723 ( -23.270 -4.377 -13.611) 27.312 23.460 ( 4.520 4.084 -0.731) 6.135 23.475 ( -5.645 3.403 -2.099) 6.917 ======================= Grid point 652 (333/361) ======================= q-point: (-0.10 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( 1.488 2.600 -9.135) 9.613 2.842 ( 7.562 -0.015 7.821) 10.880 3.244 ( -3.169 -6.918 5.806) 9.571 3.296 ( 1.612 -4.840 -3.603) 6.246 3.612 ( -1.052 1.160 -2.569) 3.008 3.654 ( 1.629 1.030 1.904) 2.710 4.313 ( -7.540 4.217 -1.908) 8.847 4.598 ( 9.697 5.022 2.643) 11.235 5.886 ( -6.585 -0.279 -8.186) 10.509 5.942 ( -5.001 0.820 6.693) 8.395 6.251 ( -10.636 2.301 6.934) 12.903 6.354 ( -3.243 1.811 -3.303) 4.971 6.569 ( -0.564 -2.080 -1.534) 2.645 6.711 ( 6.755 1.962 -1.942) 7.298 7.665 ( -7.456 -22.894 -9.573) 25.911 7.937 ( 7.228 -22.072 11.958) 26.123 9.232 ( -8.363 9.556 -1.620) 12.801 9.379 ( 0.880 8.259 2.461) 8.662 9.564 ( -7.892 2.485 11.616) 14.261 9.752 ( 5.182 8.534 -7.856) 12.704 10.586 ( -1.889 -3.540 7.601) 8.595 10.690 ( 4.266 4.405 -2.244) 6.530 11.082 ( 2.875 -4.547 -16.540) 17.392 11.449 ( 18.337 1.095 10.535) 21.176 12.845 ( -8.291 11.171 0.465) 13.919 13.059 ( 5.619 10.234 -4.254) 12.426 13.395 ( -7.050 -6.340 11.046) 14.557 13.516 ( 6.184 -1.648 -9.629) 11.562 17.854 ( -11.897 1.502 -9.180) 15.102 18.228 ( 11.395 2.030 10.484) 15.617 19.228 ( -14.765 -4.942 1.191) 15.616 19.622 ( 10.784 -3.933 -0.666) 11.498 21.124 ( -29.067 -2.789 -15.255) 32.945 22.063 ( 29.565 0.042 14.770) 33.049 23.298 ( -8.198 2.712 -0.283) 8.640 23.584 ( 11.197 2.697 1.114) 11.571 ======================= Grid point 656 (334/361) ======================= q-point: ( 0.30 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( 13.886 0.000 8.739) 16.407 2.733 ( 12.755 0.000 -8.396) 15.270 3.222 ( -3.917 -0.000 -3.634) 5.344 3.271 ( -7.184 -0.000 16.411) 17.914 3.559 ( -9.766 -0.000 0.108) 9.767 4.197 ( -24.403 -0.000 -0.925) 24.421 4.459 ( -7.406 -0.000 -0.083) 7.406 4.725 ( 0.950 0.000 4.649) 4.745 5.143 ( 3.720 0.000 10.212) 10.868 5.480 ( 10.333 0.000 0.973) 10.379 5.917 ( 5.587 0.000 -5.513) 7.849 6.048 ( -2.090 -0.000 14.622) 14.771 6.621 ( -9.355 -0.000 4.993) 10.605 6.682 ( -15.011 -0.000 0.957) 15.041 7.192 ( 2.189 0.000 -7.758) 8.061 7.368 ( -13.981 -0.000 -9.650) 16.988 8.833 ( 5.949 0.000 -0.032) 5.949 9.317 ( -5.641 -0.000 16.755) 17.679 9.735 ( 12.084 0.000 2.611) 12.363 10.041 ( -13.712 -0.000 13.505) 19.246 10.804 ( 25.160 0.000 -34.619) 42.796 11.085 ( -6.391 -0.000 -10.694) 12.458 11.486 ( 13.493 0.000 -2.874) 13.796 12.258 ( -4.000 -0.000 4.096) 5.725 12.593 ( 2.151 0.000 5.288) 5.709 12.904 ( -4.573 -0.000 2.357) 5.145 13.254 ( 5.667 0.000 -5.632) 7.990 13.919 ( -3.048 -0.000 12.794) 13.152 17.654 ( -3.808 -0.000 22.375) 22.697 17.846 ( -3.293 -0.000 -20.723) 20.983 19.597 ( 13.695 0.000 0.367) 13.700 19.691 ( 1.818 0.000 3.494) 3.938 19.888 ( -1.203 -0.000 -10.213) 10.283 22.444 ( -15.733 -0.000 7.031) 17.232 23.981 ( 2.406 0.000 -6.655) 7.077 24.272 ( -3.786 -0.000 3.628) 5.243 ======================= Grid point 657 (335/361) ======================= q-point: ( 0.40 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.830 ( 7.278 4.221 3.996) 9.314 2.933 ( 1.534 -1.442 4.653) 5.107 3.117 ( -4.460 -0.355 -3.534) 5.702 3.337 ( -8.976 -4.892 3.883) 10.935 3.446 ( -4.895 -0.235 3.320) 5.919 3.957 ( -8.233 -2.727 0.859) 8.715 4.358 ( -1.689 7.382 0.626) 7.598 4.733 ( -6.228 -4.166 -0.634) 7.519 5.318 ( 4.624 -0.585 8.633) 9.811 5.647 ( 10.668 -1.270 0.828) 10.776 5.999 ( 9.022 0.491 1.615) 9.178 6.215 ( 0.553 1.717 14.715) 14.826 6.461 ( -16.753 0.133 2.523) 16.942 6.583 ( -5.871 -2.810 4.751) 8.058 7.068 ( -3.969 4.998 -5.050) 8.138 7.221 ( -4.861 -11.804 -4.216) 13.444 8.962 ( 5.848 -4.400 3.774) 8.234 9.423 ( -7.086 2.958 17.742) 19.332 9.884 ( 7.395 4.491 -1.331) 8.754 9.996 ( -11.506 -0.900 10.641) 15.698 10.741 ( 23.632 0.636 -30.705) 38.751 10.838 ( -6.259 3.943 -10.301) 12.682 11.590 ( 10.993 5.100 -5.683) 13.385 12.192 ( -9.793 -0.690 0.481) 9.829 12.730 ( 4.685 -1.329 6.922) 8.463 12.880 ( -4.204 -0.591 4.342) 6.072 13.284 ( 5.534 -1.897 -4.514) 7.390 13.970 ( -7.133 1.599 7.999) 10.836 17.605 ( 3.089 0.679 -15.138) 15.465 17.935 ( -0.712 -5.673 22.583) 23.296 19.499 ( -7.344 13.602 -6.267) 16.680 19.740 ( -1.183 -6.272 -2.459) 6.840 20.020 ( 24.631 -4.423 -3.767) 25.307 22.332 ( -16.282 -3.696 7.895) 18.469 23.859 ( -0.108 9.107 -7.032) 11.506 24.204 ( -10.080 -5.141 -3.449) 11.830 ======================= Grid point 658 (336/361) ======================= q-point: ( 0.50 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.802 ( -12.743 7.534 6.754) 16.272 2.950 ( -1.399 2.106 5.078) 5.673 3.098 ( -5.278 -3.881 -0.674) 6.586 3.247 ( -2.913 -9.333 -4.542) 10.780 3.464 ( -0.836 -0.884 1.305) 1.784 4.004 ( 8.921 -0.877 -2.994) 9.451 4.283 ( -0.637 10.595 2.947) 11.015 4.665 ( -7.637 -7.935 -1.143) 11.073 5.498 ( 6.164 -0.551 7.726) 9.899 5.815 ( 8.325 -4.538 0.299) 9.487 6.164 ( 7.620 1.926 6.576) 10.248 6.329 ( -5.907 -3.088 5.264) 8.493 6.376 ( 1.430 5.770 10.099) 11.718 6.629 ( -2.744 -7.899 4.870) 9.677 6.924 ( -6.390 1.548 -2.451) 7.017 7.234 ( -5.432 -13.769 -1.958) 14.931 9.154 ( 5.278 -5.946 6.434) 10.228 9.506 ( -8.071 4.239 18.783) 20.878 9.780 ( -6.047 9.198 -1.632) 11.128 10.045 ( 1.959 -1.476 2.048) 3.196 10.619 ( -8.315 3.488 -1.811) 9.198 10.724 ( 23.279 -0.309 -26.370) 35.177 11.540 ( 5.208 11.873 -8.616) 15.567 12.006 ( -14.105 0.742 -3.382) 14.523 12.890 ( 0.586 -0.857 7.166) 7.240 12.933 ( 6.201 -2.957 3.918) 7.908 13.313 ( 4.362 -1.124 -4.924) 6.674 13.884 ( -11.646 4.104 3.916) 12.954 17.569 ( 9.564 -0.900 -5.481) 11.059 18.257 ( 0.701 -7.479 18.115) 19.611 19.189 ( -8.211 9.410 -7.397) 14.515 19.673 ( -7.689 -6.615 -6.523) 12.060 20.435 ( 34.424 0.692 -0.555) 34.436 22.219 ( -20.066 -6.367 6.500) 22.032 23.683 ( -0.276 9.413 -6.502) 11.443 24.007 ( -12.227 -2.495 -7.530) 14.574 ======================= Grid point 659 (337/361) ======================= q-point: (-0.40 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( -7.815 5.015 8.413) 12.530 2.947 ( -5.212 -2.161 -3.808) 6.807 2.996 ( -5.804 -2.246 5.373) 8.222 3.254 ( -2.111 -2.779 -5.295) 6.341 3.518 ( 3.559 -2.529 3.350) 5.503 3.988 ( 6.174 7.144 -12.808) 15.912 4.300 ( 1.533 2.113 8.822) 9.200 4.632 ( -3.935 -6.024 -2.786) 7.716 5.685 ( 5.117 -1.346 8.113) 9.686 5.960 ( 5.205 -6.854 -1.542) 8.743 6.313 ( 1.896 2.121 9.035) 9.473 6.409 ( 3.222 -2.835 5.170) 6.720 6.451 ( 5.497 5.845 2.805) 8.500 6.720 ( -5.465 -5.188 -0.016) 7.535 6.840 ( -3.041 -6.899 6.071) 9.680 7.252 ( -6.897 -16.136 -3.273) 17.851 9.344 ( 3.503 -5.170 5.161) 8.101 9.557 ( -9.461 4.891 7.300) 12.912 9.614 ( -3.931 8.780 10.453) 14.206 10.087 ( 3.741 1.424 -2.945) 4.969 10.494 ( -10.321 1.537 6.265) 12.172 10.756 ( 20.957 -1.265 -21.122) 29.782 11.360 ( 3.851 15.017 -7.935) 17.416 11.712 ( -15.926 3.704 -6.305) 17.525 12.975 ( -2.603 -3.297 8.348) 9.345 13.150 ( 13.911 -0.724 2.478) 14.148 13.303 ( 3.169 0.541 -5.731) 6.571 13.678 ( -14.239 5.802 0.208) 15.377 17.735 ( 12.902 -0.449 4.303) 13.608 18.429 ( -4.898 -1.980 1.966) 5.637 19.014 ( -0.660 -1.521 0.565) 1.752 19.511 ( -8.534 -4.796 -8.612) 13.038 20.940 ( 36.185 2.271 3.492) 36.424 22.005 ( -26.563 -6.854 1.183) 27.458 23.552 ( 2.521 6.832 -4.672) 8.652 23.758 ( -11.100 1.085 -6.260) 12.790 ======================= Grid point 660 (338/361) ======================= q-point: (-0.30 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( 0.067 2.228 8.725) 9.005 2.847 ( -0.435 0.401 -5.183) 5.217 3.064 ( -0.636 -3.861 5.116) 6.441 3.160 ( -2.838 -4.669 -5.316) 7.623 3.615 ( -1.195 3.014 7.724) 8.377 3.832 ( 3.029 3.982 -12.759) 13.706 4.430 ( 0.603 -0.952 7.563) 7.647 4.573 ( 1.174 -0.231 -6.681) 6.788 5.852 ( 1.403 -2.084 8.490) 8.854 6.000 ( -0.678 -3.970 -6.137) 7.341 6.370 ( -4.675 4.178 7.847) 10.044 6.485 ( 5.244 3.315 -3.421) 7.085 6.554 ( -1.495 -1.749 4.834) 5.354 6.624 ( 0.732 -1.231 -2.011) 2.468 7.101 ( 4.401 -18.443 10.006) 21.439 7.254 ( -5.739 -18.260 -5.749) 19.985 9.435 ( -4.300 2.479 2.058) 5.374 9.442 ( -0.285 1.386 1.627) 2.156 9.699 ( -5.802 4.980 18.861) 20.352 10.008 ( 1.842 7.130 -10.559) 12.874 10.460 ( -11.129 -1.580 13.003) 17.188 10.792 ( 16.154 -0.647 -18.267) 24.394 11.287 ( 10.788 10.848 -0.477) 15.307 11.368 ( -11.391 7.194 -7.441) 15.391 13.083 ( -2.826 -3.447 9.791) 10.758 13.251 ( -0.198 -0.578 -5.888) 5.919 13.341 ( 3.203 9.098 4.311) 10.565 13.438 ( -0.883 0.617 -6.094) 6.188 18.001 ( 12.070 1.700 9.709) 15.583 18.222 ( -10.984 2.622 -10.950) 15.729 19.171 ( 0.257 -8.466 8.188) 11.780 19.355 ( 0.323 -4.666 -9.511) 10.599 21.457 ( 18.295 1.250 9.434) 20.622 21.641 ( -15.638 -4.541 -8.657) 18.442 23.529 ( 4.152 3.349 -1.022) 5.431 23.543 ( -7.008 4.023 -2.303) 8.402 ======================= Grid point 661 (339/361) ======================= q-point: (-0.20 -0.70 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.779 ( 4.679 3.884 -8.248) 10.247 2.841 ( 5.710 -0.079 7.574) 9.486 3.121 ( -1.716 -6.354 3.972) 7.688 3.210 ( 3.495 -4.204 0.777) 5.522 3.607 ( -6.001 0.409 2.988) 6.717 3.726 ( 3.177 4.531 -4.800) 7.326 4.377 ( -6.572 2.708 -2.981) 7.707 4.643 ( 9.162 -0.040 1.708) 9.320 5.876 ( -6.753 -1.168 -8.267) 10.738 5.945 ( -4.526 -1.250 6.852) 8.306 6.309 ( -9.355 4.250 4.595) 11.256 6.398 ( -5.840 2.857 -1.971) 6.793 6.536 ( 0.337 -1.487 -3.041) 3.402 6.733 ( 8.960 0.266 -1.044) 9.024 7.250 ( -6.395 -21.591 -5.432) 23.164 7.532 ( 10.572 -21.826 7.137) 25.280 9.382 ( -4.464 6.722 0.929) 8.123 9.424 ( -2.441 -0.541 4.081) 4.786 9.702 ( -9.285 10.062 4.258) 14.338 9.883 ( 4.329 5.151 -1.061) 6.811 10.491 ( -11.420 -6.216 9.500) 16.103 10.782 ( 12.098 3.793 -10.956) 16.756 11.080 ( -2.578 5.974 -7.551) 9.967 11.503 ( 19.577 4.920 6.119) 21.093 13.052 ( -9.758 11.166 0.975) 14.861 13.181 ( 0.593 0.991 -6.708) 6.806 13.258 ( -7.061 -8.259 7.854) 13.408 13.541 ( 13.580 5.828 -2.501) 14.988 17.884 ( -12.913 1.661 -10.576) 16.774 18.272 ( 10.980 2.678 10.328) 15.310 19.141 ( -11.064 -4.197 -0.641) 11.850 19.522 ( 13.743 -7.076 0.235) 15.460 21.072 ( -33.014 -2.842 -9.202) 34.390 22.051 ( 32.088 -1.424 6.520) 32.775 23.373 ( -8.141 5.417 0.653) 9.800 23.630 ( 9.674 2.179 2.812) 10.307 ======================= Grid point 662 (340/361) ======================= q-point: (-0.10 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( 5.591 6.861 -11.320) 14.369 3.029 ( 2.937 -1.478 9.864) 10.397 3.185 ( 0.590 -2.329 -7.007) 7.408 3.302 ( 1.437 -2.323 7.519) 8.000 3.581 ( 0.486 -1.272 0.846) 1.603 3.716 ( -0.314 0.252 3.740) 3.761 4.256 ( 0.047 1.865 -2.924) 3.468 4.783 ( 6.661 1.571 3.021) 7.480 5.656 ( -11.240 -0.320 -7.213) 13.359 5.893 ( -12.200 1.155 3.390) 12.715 6.153 ( -12.965 2.217 1.695) 13.262 6.279 ( -5.029 1.459 -1.806) 5.539 6.529 ( 3.188 -2.383 -4.072) 5.694 6.819 ( 6.946 3.054 -0.452) 7.601 7.301 ( -2.363 -19.497 -7.066) 20.872 7.929 ( 6.860 -22.064 3.338) 23.345 9.201 ( -9.577 11.978 1.327) 15.393 9.450 ( -0.986 4.463 0.194) 4.574 9.572 ( -2.822 -1.354 3.294) 4.544 9.820 ( -4.536 12.579 -0.189) 13.374 10.497 ( -5.345 -9.691 3.951) 11.751 10.865 ( 13.121 -0.818 -3.928) 13.721 11.008 ( 8.677 3.571 -5.390) 10.821 11.836 ( 18.329 1.707 6.986) 19.689 12.832 ( -6.175 9.341 -0.703) 11.219 13.076 ( -0.337 3.263 -7.340) 8.040 13.340 ( -6.622 -6.875 7.322) 12.030 13.604 ( 8.307 9.234 -0.986) 12.460 17.606 ( -11.874 -0.391 -4.442) 12.684 18.532 ( 10.328 0.251 10.677) 14.856 19.000 ( -10.196 -2.385 -3.323) 10.986 19.723 ( 4.453 -0.976 2.510) 5.205 20.554 ( -22.435 -3.385 -12.806) 26.054 22.585 ( 26.260 -5.367 8.349) 28.073 23.220 ( -8.077 5.545 0.828) 9.832 23.817 ( 12.107 3.419 6.013) 13.944 ======================= Grid point 667 (341/361) ======================= q-point: ( 0.40 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.869 ( -15.111 -0.000 7.261) 16.765 3.006 ( -3.431 -0.000 -4.682) 5.804 3.046 ( 6.166 0.000 2.586) 6.686 3.138 ( -7.241 -0.000 0.137) 7.243 3.460 ( -3.431 -0.000 2.729) 4.384 3.988 ( 9.486 0.000 0.121) 9.487 4.426 ( 4.254 0.000 0.751) 4.319 4.554 ( -13.325 -0.000 -0.666) 13.341 5.492 ( 6.192 0.000 7.205) 9.500 5.767 ( 6.182 0.000 0.603) 6.211 6.184 ( 9.727 0.000 5.527) 11.188 6.301 ( -7.505 -0.000 6.257) 9.771 6.437 ( -0.885 -0.000 14.058) 14.085 6.556 ( -2.786 -0.000 2.845) 3.982 6.947 ( -8.036 -0.000 -3.226) 8.659 7.091 ( -1.681 -0.000 -2.944) 3.390 9.100 ( 6.586 0.000 6.717) 9.408 9.544 ( -9.809 -0.000 19.725) 22.029 9.883 ( -14.861 -0.000 6.039) 16.041 10.009 ( 10.771 0.000 -6.072) 12.364 10.655 ( -7.800 -0.000 -4.926) 9.225 10.720 ( 23.639 0.000 -27.204) 36.040 11.662 ( 6.725 0.000 -8.458) 10.806 12.009 ( -13.077 -0.000 -2.894) 13.394 12.882 ( -3.666 -0.000 5.854) 6.907 12.892 ( 9.207 0.000 4.318) 10.170 13.308 ( 5.335 0.000 -3.458) 6.358 13.922 ( -12.472 -0.000 5.451) 13.611 17.561 ( 9.504 0.000 -5.651) 11.057 18.188 ( 0.901 0.000 20.549) 20.569 19.302 ( -14.492 -0.000 -8.305) 16.703 19.586 ( -4.243 -0.000 -6.853) 8.060 20.440 ( 36.624 0.000 -1.333) 36.649 22.162 ( -19.466 -0.000 6.878) 20.645 23.786 ( -2.743 -0.000 -7.203) 7.707 23.967 ( -10.869 -0.000 -6.396) 12.611 ======================= Grid point 668 (342/361) ======================= q-point: ( 0.50 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.746 ( -10.303 1.982 6.816) 12.511 2.924 ( -5.908 -0.047 -2.100) 6.270 2.959 ( -2.982 -1.884 0.258) 3.536 3.230 ( -1.028 -0.312 -1.051) 1.503 3.482 ( 5.506 -1.245 4.634) 7.304 4.078 ( 8.403 2.442 -11.396) 14.368 4.358 ( -9.843 3.588 8.705) 13.621 4.524 ( 2.564 -4.877 -2.103) 5.897 5.658 ( 4.441 -1.143 6.683) 8.105 5.852 ( 3.367 -3.831 -0.090) 5.101 6.332 ( -0.347 0.120 7.666) 7.675 6.383 ( 7.003 -0.197 5.832) 9.115 6.542 ( 1.136 3.049 3.042) 4.455 6.606 ( -0.800 -3.888 7.271) 8.284 6.807 ( -8.577 -0.017 0.675) 8.604 7.047 ( -2.077 -6.240 -5.263) 8.424 9.281 ( 5.403 -1.796 6.822) 8.885 9.614 ( -12.069 1.621 13.739) 18.359 9.736 ( -10.268 3.920 8.005) 13.598 10.081 ( 10.155 -0.899 -7.581) 12.704 10.516 ( -10.168 0.754 3.389) 10.744 10.739 ( 22.000 -0.472 -22.890) 31.752 11.576 ( 2.749 7.226 -8.682) 11.626 11.767 ( -13.262 1.830 -4.822) 14.230 12.922 ( -3.326 -1.940 7.119) 8.094 13.074 ( 10.160 -3.714 -1.793) 10.965 13.358 ( 8.814 2.511 -1.097) 9.230 13.757 ( -16.519 2.463 3.203) 17.005 17.729 ( 13.555 -0.200 5.216) 14.525 18.396 ( -1.317 -1.199 8.163) 8.355 19.016 ( -10.909 0.771 -2.368) 11.190 19.436 ( -4.271 -2.727 -10.231) 11.417 20.966 ( 38.719 0.707 0.408) 38.728 21.922 ( -25.949 -2.312 3.217) 26.250 23.650 ( -2.315 3.532 -4.618) 6.258 23.759 ( -8.086 -0.657 -6.292) 10.266 ======================= Grid point 669 (343/361) ======================= q-point: (-0.40 0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.739 ( -0.750 1.721 6.853) 7.105 2.845 ( 0.375 -0.561 -3.304) 3.373 3.016 ( 3.242 -1.624 4.165) 5.522 3.107 ( -6.719 -1.390 -5.086) 8.541 3.667 ( 3.886 2.505 9.590) 10.646 3.895 ( -4.275 2.666 -12.513) 13.489 4.404 ( -1.903 -1.472 7.944) 8.300 4.556 ( 6.232 -1.227 -6.879) 9.363 5.796 ( 0.500 -3.473 6.613) 7.486 5.905 ( 0.038 -5.481 -3.778) 6.657 6.415 ( -2.014 0.536 6.793) 7.105 6.503 ( 2.663 -1.239 -0.005) 2.937 6.573 ( 1.116 2.856 2.767) 4.130 6.606 ( -4.496 -0.027 -0.247) 4.502 6.858 ( 2.394 -8.025 8.658) 12.045 7.014 ( 0.120 -8.686 -7.919) 11.754 9.434 ( 4.121 -0.373 5.113) 6.577 9.490 ( -9.022 2.078 0.520) 9.273 9.773 ( -10.234 2.995 20.212) 22.853 10.087 ( 5.908 2.136 -11.045) 12.707 10.434 ( -13.739 -1.144 10.225) 17.164 10.777 ( 19.914 -0.775 -20.553) 28.629 11.479 ( 1.138 9.251 -2.262) 9.591 11.512 ( -2.815 7.205 -4.792) 9.099 12.995 ( -4.001 -4.647 8.439) 10.432 13.153 ( 3.177 -6.289 -7.173) 10.054 13.497 ( -1.232 6.464 2.208) 6.940 13.517 ( 0.142 4.954 0.410) 4.973 18.026 ( 13.283 1.070 11.225) 17.424 18.263 ( -11.537 1.809 -10.587) 15.763 19.042 ( 0.110 -5.432 10.687) 11.989 19.284 ( 0.386 -2.992 -12.285) 12.650 21.481 ( 12.063 1.447 3.932) 12.770 21.566 ( -7.549 -3.591 -4.561) 9.523 23.578 ( -1.220 1.966 -0.333) 2.338 23.605 ( -2.959 2.565 -2.737) 4.778 ======================= Grid point 670 (344/361) ======================= q-point: (-0.30 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.841 ( 6.016 1.120 3.408) 7.004 2.845 ( 6.176 2.253 -4.289) 7.850 3.022 ( -1.303 -4.754 1.208) 5.075 3.159 ( 4.557 -1.342 4.465) 6.519 3.621 ( -9.901 0.565 -3.406) 10.485 3.802 ( 1.263 3.902 3.142) 5.167 4.416 ( -2.848 1.836 -1.753) 3.815 4.614 ( 8.872 -2.590 -2.373) 9.542 5.836 ( -5.779 -3.224 -6.995) 9.629 5.885 ( -4.465 -4.979 5.441) 8.621 6.391 ( -7.024 4.127 3.251) 8.772 6.445 ( -10.123 2.040 0.547) 10.341 6.518 ( 3.373 -0.781 -5.267) 6.303 6.704 ( 5.754 -3.697 1.672) 7.040 6.961 ( -1.137 -8.915 -4.947) 10.259 7.190 ( 11.727 -15.484 3.398) 19.719 9.390 ( -5.690 -1.428 1.163) 5.980 9.506 ( -0.267 5.793 4.384) 7.270 9.837 ( -10.499 3.393 14.695) 18.376 9.951 ( 3.557 3.840 -11.050) 12.227 10.389 ( -17.592 -4.673 13.008) 22.372 10.806 ( 18.436 -0.112 -19.143) 26.577 11.274 ( -4.877 13.100 0.679) 13.995 11.610 ( 17.176 6.188 2.846) 18.477 13.088 ( -6.786 -7.926 7.733) 12.987 13.139 ( 0.711 -5.189 -6.615) 8.437 13.232 ( -13.081 7.775 0.426) 15.223 13.687 ( 16.424 8.365 -0.173) 18.432 17.910 ( -14.192 1.117 -12.116) 18.694 18.318 ( 10.286 2.300 10.297) 14.735 19.094 ( -4.508 -0.720 -2.173) 5.056 19.378 ( 13.483 -8.550 1.593) 16.045 21.028 ( -35.347 -1.948 -5.260) 35.789 22.017 ( 32.701 -2.013 -0.114) 32.763 23.480 ( -5.310 6.164 2.270) 8.447 23.655 ( 6.925 0.472 3.672) 7.853 ======================= Grid point 671 (345/361) ======================= q-point: (-0.20 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.806 ( 7.382 5.960 -8.576) 12.789 2.994 ( 1.684 -1.789 8.090) 8.455 3.140 ( 5.230 -2.740 -1.416) 6.072 3.256 ( 2.590 -2.852 5.321) 6.569 3.507 ( -3.607 -3.769 -0.111) 5.218 3.801 ( -0.771 5.810 3.814) 6.993 4.308 ( 1.003 4.061 -6.580) 7.797 4.752 ( 5.771 -4.158 1.910) 7.365 5.652 ( -9.385 -0.437 -7.103) 11.778 5.871 ( -11.013 -3.588 2.888) 11.937 6.223 ( -10.612 4.722 -1.847) 11.761 6.317 ( -7.360 3.043 1.219) 8.057 6.497 ( 4.328 -1.057 -6.760) 8.096 6.841 ( 6.591 -3.658 0.447) 7.552 6.985 ( 0.528 -11.415 -4.800) 12.394 7.547 ( 10.874 -19.675 0.896) 22.498 9.360 ( -7.093 -4.128 0.101) 8.208 9.444 ( -3.507 9.403 5.624) 11.504 9.679 ( -2.851 8.822 -5.455) 10.757 9.972 ( -2.355 3.197 5.138) 6.494 10.338 ( -17.266 -7.198 12.948) 22.750 10.846 ( 18.493 -1.009 -16.958) 25.111 11.161 ( 0.988 12.567 4.276) 13.311 11.882 ( 18.522 3.115 5.099) 19.462 12.969 ( -9.706 4.502 -2.043) 10.892 13.078 ( -0.669 -2.377 -6.491) 6.945 13.218 ( -5.060 -5.053 9.134) 11.600 13.796 ( 12.797 10.727 -1.830) 16.798 17.597 ( -12.849 -0.575 -6.068) 14.222 18.523 ( 7.217 -1.268 4.368) 8.531 19.005 ( -1.836 3.307 -2.771) 4.690 19.666 ( 10.359 -5.500 3.922) 12.367 20.496 ( -30.336 -2.796 -6.804) 31.215 22.461 ( 26.470 -7.272 -1.874) 27.514 23.375 ( -5.759 10.438 4.686) 12.809 23.854 ( 11.060 0.577 8.069) 13.703 ======================= Grid point 672 (346/361) ======================= q-point: (-0.10 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.713 ( 4.716 10.366 -10.438) 15.448 2.994 ( -6.980 -3.513 -3.044) 8.386 3.201 ( -0.735 2.545 7.779) 8.217 3.417 ( 4.104 -2.212 3.563) 5.868 3.610 ( 3.681 -10.043 6.744) 12.645 3.773 ( 1.994 8.027 0.297) 8.276 4.277 ( 8.505 -0.267 -4.717) 9.729 4.872 ( 1.029 -3.107 3.394) 4.715 5.439 ( -8.889 2.295 -4.139) 10.071 5.712 ( -15.983 -0.633 0.130) 15.996 6.006 ( -10.860 3.621 -1.742) 11.580 6.197 ( -5.120 2.429 -2.507) 6.197 6.526 ( 5.013 -2.991 -2.027) 6.179 6.932 ( 5.117 3.078 0.082) 5.973 7.072 ( 3.725 -15.547 -6.344) 17.200 7.831 ( 4.734 -18.958 -1.603) 19.606 9.179 ( -12.796 10.957 1.785) 16.941 9.448 ( 1.477 -2.557 -1.584) 3.351 9.589 ( 0.512 2.788 2.636) 3.871 9.826 ( -11.256 11.634 1.959) 16.306 10.417 ( -5.850 -10.430 11.127) 16.334 10.919 ( 20.132 -2.170 -19.189) 27.897 11.178 ( 1.537 4.987 8.320) 9.821 12.135 ( 13.288 2.923 1.790) 13.723 12.819 ( -2.212 3.841 -2.276) 4.983 12.998 ( -0.939 0.847 -5.553) 5.695 13.290 ( -5.706 -4.901 8.123) 11.071 13.811 ( 7.873 12.638 -1.924) 15.014 17.435 ( -9.339 -1.385 3.783) 10.171 18.645 ( 2.696 -10.425 -7.358) 13.042 18.926 ( 0.942 9.290 3.118) 9.844 19.729 ( -11.797 2.942 2.049) 12.329 20.203 ( -3.540 -6.090 -3.955) 8.078 22.851 ( 20.114 -14.726 -4.136) 25.269 23.234 ( -7.705 14.591 6.253) 17.645 24.122 ( 12.384 2.752 9.911) 16.098 ======================= Grid point 678 (347/361) ======================= q-point: (-0.50 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -0.074 -0.000 5.565) 5.566 2.837 ( -0.242 -0.000 -2.190) 2.203 3.002 ( 4.574 0.000 4.171) 6.190 3.097 ( -8.040 -0.000 -5.247) 9.600 3.692 ( 7.396 0.000 10.135) 12.547 3.919 ( -9.255 -0.000 -12.043) 15.188 4.389 ( -2.007 -0.000 7.970) 8.219 4.543 ( 7.866 0.000 -6.889) 10.457 5.759 ( -0.050 -0.000 5.676) 5.676 5.848 ( 0.347 0.000 -2.598) 2.621 6.415 ( 0.034 0.000 5.793) 5.793 6.481 ( 0.019 0.000 0.276) 0.277 6.602 ( 3.436 0.000 3.787) 5.114 6.616 ( -8.648 -0.000 1.665) 8.807 6.794 ( 3.034 0.000 6.738) 7.389 6.935 ( 2.595 0.000 -8.927) 9.297 9.431 ( 5.566 0.000 6.518) 8.571 9.509 ( -10.769 -0.000 0.122) 10.770 9.801 ( -12.233 -0.000 20.248) 23.656 10.103 ( 8.122 0.000 -11.058) 13.720 10.423 ( -14.726 -0.000 9.188) 17.357 10.770 ( 20.855 0.000 -21.324) 29.827 11.576 ( -8.022 -0.000 -2.802) 8.498 11.578 ( 6.169 0.000 -4.003) 7.354 12.949 ( -4.263 -0.000 7.461) 8.593 13.090 ( 3.841 0.000 -6.534) 7.580 13.554 ( -18.189 -0.000 2.354) 18.340 13.567 ( 16.350 0.000 1.288) 16.400 18.036 ( 13.890 0.000 11.803) 18.228 18.280 ( -11.881 -0.000 -10.553) 15.891 18.991 ( -0.370 -0.000 11.722) 11.728 19.256 ( 0.757 0.000 -13.259) 13.281 21.512 ( 37.627 0.000 -0.448) 37.630 21.516 ( -32.379 -0.000 -0.934) 32.393 23.596 ( -2.064 -0.000 0.021) 2.064 23.629 ( -2.585 -0.000 -2.874) 3.865 ======================= Grid point 679 (348/361) ======================= q-point: (-0.40 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.859 ( 6.464 1.397 2.462) 7.057 2.877 ( 9.795 0.466 -2.706) 10.173 2.955 ( -4.454 -2.311 -1.162) 5.150 3.152 ( 5.330 0.054 6.012) 8.034 3.620 ( -13.316 -0.386 -7.802) 15.438 3.860 ( -0.412 2.091 9.278) 9.520 4.442 ( -0.033 0.848 1.639) 1.846 4.573 ( 9.841 -1.396 -7.959) 12.733 5.781 ( -4.503 -2.049 -5.320) 7.265 5.802 ( -4.416 -3.154 4.162) 6.839 6.439 ( -2.939 1.573 1.079) 3.504 6.468 ( -5.488 -0.117 -2.194) 5.912 6.488 ( -5.325 -1.721 1.967) 5.932 6.663 ( -0.540 -0.029 1.801) 1.881 6.898 ( 7.385 -0.223 -7.120) 10.261 6.991 ( 10.935 -6.411 1.836) 12.808 9.372 ( -7.745 -0.511 -1.286) 7.868 9.588 ( 5.115 2.819 7.498) 9.505 9.842 ( -13.843 -0.984 16.784) 21.779 10.017 ( 3.471 2.349 -14.059) 14.670 10.331 ( -20.237 -1.691 15.006) 25.250 10.801 ( 19.770 -0.221 -20.438) 28.436 11.470 ( -2.933 6.825 2.302) 7.777 11.692 ( 13.641 2.381 1.679) 13.949 12.978 ( -6.878 -3.470 6.974) 10.392 13.056 ( 1.328 -2.948 -6.544) 7.299 13.331 ( -14.290 2.910 2.117) 14.736 13.797 ( 16.791 3.302 -0.366) 17.116 17.923 ( -15.114 0.357 -13.121) 20.018 18.348 ( 9.566 0.901 10.271) 14.065 19.121 ( 3.882 3.564 -4.815) 7.138 19.232 ( 9.078 -7.111 4.451) 12.361 21.004 ( -36.113 -0.683 -3.649) 36.304 21.989 ( 32.463 -0.923 -3.355) 32.649 23.579 ( -1.254 4.443 2.812) 5.406 23.643 ( 3.393 -1.829 4.401) 5.851 ======================= Grid point 680 (349/361) ======================= q-point: (-0.30 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.878 ( 0.252 1.971 0.886) 2.176 2.985 ( 9.707 0.864 -1.218) 9.821 3.091 ( 7.157 -2.467 1.310) 7.683 3.196 ( -2.233 -3.534 0.614) 4.225 3.473 ( -0.194 -0.266 -0.063) 0.335 3.885 ( -4.143 3.163 6.154) 8.065 4.396 ( 2.045 5.129 -5.796) 8.005 4.667 ( 7.349 -4.511 -1.833) 8.816 5.634 ( -7.535 -1.380 -6.344) 9.946 5.789 ( -9.169 -4.544 2.751) 10.597 6.284 ( -9.798 1.856 -4.419) 10.908 6.386 ( -4.413 3.774 2.938) 6.508 6.489 ( 2.611 -0.209 -5.496) 6.089 6.674 ( -1.435 -8.069 -0.114) 8.196 6.944 ( 8.357 0.894 -4.036) 9.323 7.250 ( 12.727 -12.603 -1.820) 18.003 9.262 ( -7.362 -4.278 -3.250) 9.114 9.637 ( -4.360 10.153 9.529) 14.591 9.819 ( -3.982 5.685 -4.995) 8.551 9.947 ( 2.503 -4.583 3.655) 6.374 10.250 ( -23.748 -2.859 18.972) 30.529 10.834 ( 19.033 -0.323 -18.778) 26.739 11.400 ( -2.535 12.061 5.596) 13.536 11.930 ( 16.756 1.718 3.631) 17.231 12.955 ( -9.634 -3.813 1.773) 10.512 13.023 ( 0.453 -3.316 -5.843) 6.734 13.205 ( -6.136 2.165 5.782) 8.704 13.954 ( 14.112 6.299 -2.732) 15.694 17.587 ( -13.480 -0.429 -7.214) 15.295 18.495 ( 4.492 -1.448 -2.525) 5.353 19.112 ( 7.722 7.877 -1.031) 11.078 19.532 ( 11.224 -8.846 6.415) 15.665 20.458 ( -35.095 -1.390 -3.557) 35.302 22.352 ( 25.015 -4.434 -6.750) 26.287 23.557 ( -1.420 9.058 5.908) 10.908 23.838 ( 9.343 -2.188 9.013) 13.165 ======================= Grid point 681 (350/361) ======================= q-point: (-0.20 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.867 ( -0.071 6.041 -3.353) 6.910 2.919 ( -11.434 -4.331 -0.154) 12.228 3.192 ( 5.661 -3.820 3.078) 7.491 3.392 ( 8.114 -1.618 2.613) 8.676 3.482 ( 3.369 -1.030 -0.093) 3.524 3.903 ( 3.221 4.337 4.630) 7.115 4.317 ( 7.379 4.868 -8.189) 12.050 4.787 ( 1.686 -5.257 2.848) 6.212 5.468 ( -5.465 0.438 -5.222) 7.571 5.674 ( -14.466 -2.578 0.457) 14.701 6.068 ( -9.611 2.150 -5.026) 11.056 6.288 ( -5.589 7.705 0.038) 9.519 6.480 ( 5.135 -1.990 -3.813) 6.698 6.794 ( 5.393 -13.353 -1.697) 14.500 6.996 ( 6.307 2.695 -2.262) 7.222 7.505 ( 8.962 -16.657 -3.551) 19.246 9.172 ( -8.653 -8.555 -2.043) 12.339 9.538 ( -4.541 11.992 -0.336) 12.828 9.686 ( -0.485 5.933 0.951) 6.029 9.984 ( -10.758 5.273 6.337) 13.553 10.259 ( -11.196 -7.378 18.251) 22.647 10.890 ( 18.998 -0.753 -16.632) 25.261 11.323 ( -3.737 10.118 6.167) 12.424 12.175 ( 13.767 1.236 1.763) 13.934 12.854 ( -4.731 -0.178 -2.824) 5.513 12.984 ( -0.486 -1.654 -4.378) 4.705 13.220 ( -4.500 -2.458 6.955) 8.641 14.010 ( 10.344 8.903 -4.915) 14.506 17.413 ( -8.701 -1.034 3.835) 9.565 18.479 ( 3.684 -7.670 -14.820) 17.089 19.130 ( 4.731 13.245 4.034) 14.631 19.753 ( -3.959 -0.979 2.469) 4.767 20.068 ( -14.124 -8.153 1.168) 16.350 22.626 ( 18.998 -9.771 -8.379) 22.948 23.501 ( -3.512 14.206 6.928) 16.191 24.131 ( 11.882 -1.616 10.052) 15.648 ======================= Grid point 682 (351/361) ======================= q-point: (-0.10 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( -10.639 4.377 -6.380) 13.155 2.878 ( -6.146 -4.079 2.188) 7.694 3.295 ( 0.232 5.226 2.763) 5.916 3.402 ( 1.984 -5.809 -2.077) 6.481 3.675 ( 5.626 -7.882 4.275) 10.585 3.956 ( 7.476 13.780 1.568) 15.756 4.374 ( 13.972 -1.654 -3.847) 14.586 4.851 ( -4.330 -3.196 3.396) 6.364 5.366 ( -1.945 2.959 -1.197) 3.738 5.477 ( -13.107 -2.097 -1.536) 13.363 5.872 ( -8.746 2.023 -1.405) 9.086 6.122 ( -3.610 5.361 -5.867) 8.729 6.559 ( 1.623 -2.491 4.053) 5.027 6.977 ( 11.604 -9.799 -8.089) 17.208 7.012 ( 2.383 2.964 -0.180) 3.808 7.718 ( 4.128 -15.654 0.252) 16.191 9.057 ( -14.367 2.292 0.613) 14.562 9.425 ( 4.751 -3.568 -5.013) 7.774 9.681 ( -0.641 2.719 4.222) 5.063 9.791 ( -13.846 12.897 6.538) 20.020 10.414 ( -5.638 -6.610 13.540) 16.088 10.950 ( 17.394 0.594 -17.243) 24.499 11.289 ( -3.097 2.401 6.292) 7.413 12.303 ( 6.674 2.689 -1.475) 7.345 12.764 ( -1.680 0.210 -5.032) 5.309 12.936 ( -1.596 -0.337 -1.964) 2.553 13.292 ( -1.925 -4.979 7.233) 8.990 13.974 ( 6.948 10.311 -6.203) 13.895 17.444 ( -3.056 0.762 13.102) 13.475 18.383 ( 1.418 -10.300 -20.210) 22.727 19.110 ( 1.804 11.160 4.689) 12.239 19.562 ( -12.840 2.039 0.743) 13.022 20.180 ( 4.024 -7.081 2.829) 8.622 22.866 ( 14.000 -13.166 -7.851) 20.760 23.370 ( -6.042 16.627 6.298) 18.779 24.403 ( 8.940 -0.437 7.604) 11.745 ======================= Grid point 689 (352/361) ======================= q-point: (-0.40 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.893 ( -3.887 -0.000 5.296) 6.570 3.001 ( 15.134 0.000 -4.783) 15.872 3.064 ( 7.108 0.000 1.167) 7.203 3.157 ( -6.710 -0.000 -1.546) 6.886 3.475 ( 3.580 0.000 0.672) 3.642 3.913 ( -6.076 -0.000 5.949) 8.504 4.453 ( 0.693 0.000 -1.948) 2.068 4.619 ( 10.267 0.000 -5.986) 11.884 5.618 ( -6.814 -0.000 -6.000) 9.079 5.742 ( -8.110 -0.000 3.006) 8.649 6.299 ( -10.311 -0.000 -4.374) 11.200 6.424 ( 5.242 0.000 -5.396) 7.523 6.479 ( -5.810 -0.000 7.689) 9.637 6.614 ( -3.079 -0.000 -4.077) 5.109 6.954 ( 9.474 0.000 -4.112) 10.328 7.129 ( 13.217 0.000 -3.620) 13.704 9.223 ( -8.429 -0.000 -4.429) 9.522 9.795 ( 2.174 0.000 10.794) 11.011 9.804 ( -14.221 -0.000 13.788) 19.807 9.904 ( 7.512 0.000 -15.682) 17.388 10.225 ( -24.914 -0.000 20.878) 32.506 10.832 ( 18.938 0.000 -18.516) 26.485 11.522 ( -3.609 -0.000 5.766) 6.803 11.941 ( 15.286 0.000 3.258) 15.629 12.915 ( -7.431 -0.000 2.460) 7.828 12.985 ( 0.499 0.000 -4.795) 4.821 13.230 ( -7.763 -0.000 4.339) 8.893 14.012 ( 14.388 0.000 -3.150) 14.728 17.583 ( -13.672 -0.000 -7.608) 15.646 18.481 ( 3.738 0.000 -5.252) 6.446 19.224 ( 16.162 0.000 -3.194) 16.475 19.411 ( 6.018 0.000 10.462) 12.069 20.446 ( -36.380 -0.000 -2.694) 36.479 22.311 ( 24.407 0.000 -8.037) 25.696 23.658 ( 0.607 0.000 5.478) 5.511 23.801 ( 8.361 0.000 9.899) 12.957 ======================= Grid point 690 (353/361) ======================= q-point: (-0.30 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.854 ( -18.571 -2.236 -0.540) 18.713 2.927 ( -5.461 1.055 7.525) 9.357 3.128 ( 9.413 -1.976 -5.275) 10.970 3.346 ( 15.632 -1.871 1.232) 15.792 3.539 ( 5.748 3.612 -3.080) 7.455 3.925 ( 3.365 -0.636 3.701) 5.043 4.418 ( 4.345 4.465 -4.982) 7.977 4.709 ( 4.486 -2.875 0.583) 5.360 5.461 ( -4.844 -0.645 -6.134) 7.843 5.639 ( -11.854 -1.129 1.612) 12.016 6.087 ( -10.074 0.306 -6.080) 11.770 6.434 ( -4.025 5.568 -4.041) 7.971 6.462 ( 4.701 1.942 0.986) 5.181 6.598 ( 4.205 -8.464 0.251) 9.454 7.041 ( 8.240 2.209 -1.351) 8.637 7.265 ( 11.047 -8.626 -7.659) 15.972 9.048 ( -9.847 -3.897 -4.319) 11.437 9.716 ( -3.221 5.961 -5.477) 8.712 9.772 ( -6.915 3.152 6.741) 10.159 10.030 ( 3.904 0.488 5.001) 6.364 10.154 ( -22.664 -3.609 24.425) 33.515 10.890 ( 18.087 0.309 -14.092) 22.930 11.481 ( -7.978 5.604 5.604) 11.245 12.178 ( 12.887 -0.526 1.558) 12.992 12.839 ( -3.631 -0.576 -2.841) 4.646 12.953 ( 0.598 -1.415 -3.260) 3.604 13.198 ( -5.576 -0.337 4.866) 7.409 14.119 ( 11.191 3.060 -6.532) 13.314 17.400 ( -8.224 -0.370 3.918) 9.117 18.383 ( 4.077 -2.799 -19.317) 19.940 19.381 ( 10.562 13.388 4.560) 17.652 19.659 ( 7.090 -9.215 5.501) 12.863 19.961 ( -29.978 -2.782 1.169) 30.130 22.508 ( 18.400 -3.315 -9.820) 21.118 23.708 ( -0.881 7.437 7.750) 10.778 24.081 ( 11.459 -2.851 8.993) 14.843 ======================= Grid point 691 (354/361) ======================= q-point: (-0.20 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.644 ( -16.961 -3.371 1.504) 17.358 2.815 ( -16.829 -1.787 1.677) 17.007 3.237 ( 6.114 -5.570 0.696) 8.300 3.474 ( 7.928 7.793 -8.657) 14.090 3.582 ( 8.441 -3.041 0.928) 9.020 4.126 ( 14.090 3.313 6.210) 15.750 4.403 ( 10.856 5.624 -6.205) 13.710 4.788 ( -1.725 -3.676 3.832) 5.583 5.355 ( -0.553 -2.534 -7.499) 7.935 5.472 ( -13.441 0.900 1.262) 13.530 5.887 ( -9.056 -0.047 -2.902) 9.510 6.243 ( -3.140 6.332 -8.569) 11.107 6.542 ( 1.206 1.013 7.366) 7.532 6.805 ( 13.766 -8.237 -2.968) 16.314 7.086 ( 6.067 5.164 -2.809) 8.448 7.441 ( 7.949 -14.569 -1.172) 16.638 8.941 ( -10.148 -9.317 -0.192) 13.778 9.516 ( -1.869 8.612 -9.138) 12.694 9.718 ( -6.979 1.234 2.913) 7.663 9.991 ( -14.886 9.237 16.681) 24.190 10.299 ( -3.217 -6.815 12.863) 14.908 10.984 ( 16.924 2.596 -9.927) 19.791 11.368 ( -8.792 5.251 4.568) 11.213 12.321 ( 6.425 -0.344 -1.727) 6.662 12.749 ( -2.460 -1.418 -6.071) 6.702 12.934 ( -0.122 0.096 -1.633) 1.640 13.206 ( -3.702 -4.003 4.888) 7.323 14.115 ( 8.401 5.297 -10.045) 14.125 17.460 ( -0.502 0.808 14.879) 14.909 18.214 ( 4.112 -7.337 -23.930) 25.365 19.377 ( 0.632 17.289 4.884) 17.976 19.589 ( -13.660 1.007 0.393) 13.702 19.989 ( 3.583 -13.828 4.997) 15.133 22.677 ( 16.037 -7.311 -9.228) 19.894 23.667 ( -4.262 14.767 7.072) 16.919 24.350 ( 8.503 -4.824 5.112) 11.032 ======================= Grid point 692 (355/361) ======================= q-point: (-0.10 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( -15.245 -0.885 -0.174) 15.271 2.689 ( -17.244 -11.274 8.629) 22.337 3.360 ( 3.692 -0.420 -0.612) 3.766 3.440 ( 12.634 2.882 -7.685) 15.066 3.692 ( 1.521 -4.668 -0.531) 4.938 4.206 ( 3.862 17.501 0.577) 17.932 4.530 ( 9.945 0.242 -0.098) 9.949 4.814 ( 0.449 -0.980 0.288) 1.116 5.285 ( -2.930 -5.713 -5.551) 8.487 5.353 ( -2.816 -0.278 1.818) 3.363 5.804 ( -4.292 -0.080 5.479) 6.960 6.049 ( -0.527 6.172 -8.779) 10.744 6.643 ( 0.946 1.767 7.825) 8.078 6.989 ( 11.696 -5.377 -8.303) 15.318 7.051 ( -0.884 5.052 -1.000) 5.225 7.716 ( 7.281 -10.993 7.283) 15.063 8.874 ( -12.038 -4.218 3.188) 13.148 9.383 ( 5.018 -3.852 -7.978) 10.182 9.631 ( -7.858 -1.252 0.000) 7.957 9.892 ( -9.475 14.585 12.204) 21.247 10.444 ( -5.050 -5.251 11.223) 13.381 11.000 ( 7.821 7.651 -10.804) 15.376 11.311 ( -2.060 -0.898 3.904) 4.504 12.325 ( -0.399 -0.262 -3.911) 3.940 12.673 ( -0.995 -2.499 -4.039) 4.853 12.907 ( -2.276 1.125 0.960) 2.714 13.290 ( -1.480 -7.736 5.112) 9.390 14.027 ( 6.695 5.970 -12.773) 15.608 17.657 ( 4.099 4.728 11.977) 13.513 18.094 ( 5.030 -9.235 -14.716) 18.087 19.262 ( -2.081 13.368 2.164) 13.701 19.471 ( -2.097 0.634 -0.533) 2.254 20.175 ( 0.393 -9.630 2.525) 9.963 22.867 ( 14.025 -9.241 -7.064) 18.220 23.494 ( -8.470 18.611 4.588) 20.956 24.504 ( 1.283 -5.651 0.266) 5.801 ======================= Grid point 700 (356/361) ======================= q-point: (-0.30 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( -18.693 -0.000 5.124) 19.383 2.803 ( -21.211 -0.000 0.057) 21.211 3.185 ( 8.085 0.000 -0.462) 8.099 3.549 ( 13.007 0.000 -1.880) 13.142 3.564 ( 6.198 0.000 -8.989) 10.919 4.134 ( 18.114 0.000 5.355) 18.889 4.487 ( 9.259 0.000 -2.878) 9.696 4.741 ( -1.443 -0.000 2.701) 3.063 5.329 ( -1.721 -0.000 -8.450) 8.623 5.481 ( -11.987 -0.000 0.869) 12.019 5.885 ( -9.255 -0.000 -3.115) 9.765 6.302 ( -2.261 -0.000 -10.926) 11.158 6.574 ( -1.382 -0.000 10.195) 10.288 6.714 ( 15.456 0.000 -1.230) 15.504 7.209 ( 10.525 0.000 5.154) 11.719 7.225 ( 7.146 0.000 -10.894) 13.028 8.848 ( -10.687 -0.000 -1.032) 10.737 9.609 ( -0.281 -0.000 -11.021) 11.024 9.724 ( -11.832 -0.000 3.865) 12.447 10.116 ( -26.184 -0.000 32.699) 41.891 10.192 ( 9.306 0.000 -0.790) 9.339 11.013 ( 16.585 0.000 -6.032) 17.648 11.424 ( -11.075 -0.000 3.933) 11.753 12.314 ( 6.577 0.000 -1.607) 6.770 12.733 ( -2.636 -0.000 -7.615) 8.059 12.935 ( 0.913 0.000 -0.928) 1.302 13.168 ( -5.067 -0.000 3.645) 6.242 14.163 ( 8.826 0.000 -11.348) 14.376 17.468 ( 0.564 0.000 15.931) 15.941 18.145 ( 4.633 0.000 -25.812) 26.225 19.595 ( -17.896 -0.000 1.391) 17.950 19.699 ( 1.266 0.000 2.512) 2.813 19.703 ( 6.782 0.000 7.192) 9.885 22.611 ( 16.261 0.000 -9.611) 18.889 23.823 ( -3.037 -0.000 8.855) 9.361 24.286 ( 8.356 0.000 2.635) 8.762 ======================= Grid point 701 (357/361) ======================= q-point: (-0.20 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -20.799 1.388 2.068) 20.948 2.505 ( -19.157 -7.825 8.107) 22.225 3.315 ( 7.697 -1.888 0.741) 7.960 3.503 ( 10.093 1.922 -14.705) 17.939 3.663 ( 3.760 0.252 -0.442) 3.794 4.451 ( 8.297 6.190 8.722) 13.536 4.564 ( 12.963 5.844 -4.412) 14.888 4.758 ( 2.039 -5.321 -1.573) 5.911 5.194 ( -1.556 -3.096 -9.894) 10.483 5.345 ( -7.789 -0.366 1.250) 7.897 5.800 ( -4.543 -0.260 5.583) 7.203 6.141 ( 0.332 3.028 -9.889) 10.347 6.695 ( 3.245 3.114 8.888) 9.961 6.891 ( 10.038 -4.298 -3.753) 11.546 7.149 ( 1.586 4.553 -5.788) 7.533 7.535 ( 14.202 -7.258 10.412) 19.047 8.739 ( -10.716 -6.178 3.711) 12.914 9.440 ( -0.674 5.564 -10.468) 11.874 9.588 ( -10.452 -3.077 -0.765) 10.922 10.119 ( -14.375 10.469 21.572) 27.956 10.322 ( -0.095 -7.894 4.993) 9.341 11.158 ( 9.646 7.410 -2.789) 12.480 11.293 ( -9.012 -1.552 2.429) 9.462 12.317 ( -0.617 -0.239 -4.629) 4.676 12.616 ( -2.651 -2.768 -4.928) 6.243 12.932 ( -0.712 1.197 0.217) 1.409 13.173 ( -2.818 -4.097 3.870) 6.301 14.099 ( 7.695 1.996 -16.069) 17.928 17.747 ( 7.904 4.713 15.473) 18.003 17.938 ( 5.855 -6.870 -18.442) 20.532 19.436 ( -6.112 1.636 2.758) 6.902 19.589 ( -1.248 14.651 -1.958) 14.834 19.949 ( 1.186 -14.109 4.201) 14.769 22.745 ( 16.140 -3.615 -8.184) 18.454 23.803 ( -6.536 12.619 6.910) 15.802 24.370 ( 0.172 -7.225 -3.811) 8.171 ======================= Grid point 702 (358/361) ======================= q-point: (-0.10 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( -14.938 -5.512 7.205) 17.477 2.535 ( -10.834 -8.693 15.180) 20.576 3.404 ( 6.044 1.150 -4.489) 7.616 3.515 ( 12.862 -4.408 -9.978) 16.864 3.640 ( -3.863 1.183 -1.484) 4.304 4.349 ( -4.257 15.629 -2.463) 16.385 4.538 ( -8.694 6.301 -2.140) 10.948 4.875 ( 7.154 -5.691 -3.995) 9.977 5.211 ( 7.682 -1.669 -0.518) 7.878 5.371 ( 8.602 -5.958 1.646) 10.592 5.871 ( -1.759 -0.398 11.062) 11.209 6.037 ( 5.496 5.548 -6.776) 10.340 6.777 ( 3.587 5.020 -0.532) 6.193 6.967 ( 4.956 -3.324 -8.771) 10.609 7.066 ( -7.151 4.300 9.273) 12.475 7.908 ( 10.505 -1.156 11.606) 15.697 8.760 ( -6.019 -8.343 8.995) 13.666 9.305 ( 2.945 -2.395 -8.941) 9.714 9.482 ( -6.862 -4.816 -2.243) 8.678 10.041 ( -6.901 15.032 8.710) 18.693 10.441 ( -7.143 -6.702 11.520) 15.121 10.968 ( -10.649 7.038 -3.993) 13.375 11.357 ( 5.736 0.408 -0.504) 5.772 12.214 ( -5.182 -1.362 -5.027) 7.346 12.621 ( 0.817 -4.753 1.836) 5.160 12.894 ( -3.795 1.246 0.761) 4.066 13.244 ( -2.184 -7.616 3.761) 8.771 13.971 ( 7.894 2.635 -18.351) 20.150 17.711 ( 5.507 1.236 -15.226) 16.239 18.214 ( 14.296 -1.726 15.360) 21.055 19.332 ( -6.295 14.937 -3.968) 16.688 19.496 ( 8.792 -1.623 -1.147) 9.014 20.083 ( -4.513 -10.735 3.346) 12.116 22.923 ( 15.079 -6.144 -6.328) 17.469 23.573 ( -12.029 21.181 2.277) 24.465 24.333 ( -8.481 -11.870 -6.696) 16.052 ======================= Grid point 711 (359/361) ======================= q-point: (-0.20 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( -17.448 -0.000 6.827) 18.736 2.447 ( -10.107 -0.000 16.464) 19.319 3.422 ( 8.257 0.000 -0.807) 8.297 3.461 ( 9.517 0.000 -15.220) 17.950 3.658 ( -2.101 -0.000 -2.293) 3.110 4.501 ( -14.977 -0.000 4.701) 15.698 4.702 ( 5.405 0.000 -2.226) 5.845 4.704 ( 2.331 0.000 -13.014) 13.221 5.218 ( 20.944 0.000 -0.552) 20.951 5.296 ( -0.529 -0.000 1.718) 1.797 5.867 ( -2.093 -0.000 11.456) 11.646 6.092 ( 5.909 0.000 -7.252) 9.355 6.849 ( 6.998 0.000 -4.150) 8.136 6.908 ( 3.074 0.000 -4.379) 5.350 7.110 ( -7.410 -0.000 8.618) 11.366 7.896 ( 16.932 0.000 13.571) 21.699 8.654 ( -8.040 -0.000 9.783) 12.663 9.348 ( 1.937 0.000 -10.858) 11.029 9.395 ( -9.689 -0.000 -2.675) 10.051 10.273 ( 7.577 0.000 -11.017) 13.371 10.284 ( -20.595 -0.000 32.832) 38.757 11.045 ( -19.620 -0.000 -0.210) 19.622 11.365 ( 9.827 0.000 -1.383) 9.924 12.206 ( -4.965 -0.000 -5.701) 7.559 12.562 ( -0.319 -0.000 2.729) 2.747 12.911 ( -3.409 -0.000 -0.875) 3.520 13.166 ( -1.713 -0.000 3.688) 4.066 13.996 ( 8.665 0.000 -20.008) 21.804 17.723 ( 6.490 0.000 -18.245) 19.365 18.194 ( 15.379 0.000 18.111) 23.760 19.474 ( 8.221 0.000 0.456) 8.233 19.529 ( -7.287 -0.000 -9.671) 12.109 19.936 ( -4.013 -0.000 7.986) 8.937 22.864 ( 16.070 0.000 -7.152) 17.590 23.850 ( -8.878 -0.000 6.453) 10.975 24.146 ( -11.259 -0.000 -11.875) 16.364 ======================= Grid point 712 (360/361) ======================= q-point: (-0.10 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.153 ( -5.201 -3.471 13.722) 15.080 2.590 ( -4.582 -4.079 20.051) 20.969 3.380 ( 1.934 0.337 -11.545) 11.711 3.527 ( 6.249 -1.896 -2.582) 7.022 3.579 ( 1.218 -0.187 -6.420) 6.537 4.283 ( -13.135 5.552 -1.896) 14.386 4.464 ( -3.786 10.595 -8.387) 14.034 4.763 ( -1.616 -9.934 -3.558) 10.675 5.357 ( 5.388 1.656 4.488) 7.205 5.591 ( 23.929 -3.143 0.585) 24.142 5.990 ( -2.033 -0.147 12.714) 12.876 6.128 ( 11.459 2.821 -4.964) 12.802 6.738 ( -3.153 3.274 -9.218) 10.278 6.873 ( -1.479 -2.467 -5.163) 5.910 7.217 ( -2.160 3.574 17.434) 17.927 8.232 ( 10.112 7.137 11.376) 16.811 8.775 ( -2.521 -8.997 15.510) 18.107 9.219 ( -0.515 1.103 -6.448) 6.561 9.318 ( -1.050 -7.770 -5.507) 9.582 10.152 ( 1.547 12.154 -6.690) 13.960 10.437 ( -14.303 -5.353 23.617) 28.125 10.760 ( -18.724 -0.012 0.964) 18.749 11.380 ( 1.179 1.584 -8.786) 9.005 12.082 ( -5.077 -0.058 -2.427) 5.628 12.658 ( 1.328 -3.773 7.342) 8.361 12.817 ( -4.527 -0.372 -4.141) 6.147 13.210 ( -1.627 -3.677 4.119) 5.756 13.879 ( 9.909 1.162 -19.070) 21.522 17.639 ( 7.959 0.505 -11.984) 14.394 18.614 ( 17.728 -0.219 10.974) 20.851 19.218 ( -9.689 8.406 -12.555) 17.949 19.663 ( 16.951 -1.555 -2.647) 17.226 20.000 ( -6.353 -5.223 12.012) 14.558 23.009 ( 14.262 -3.485 -7.271) 16.383 23.568 ( -17.506 22.372 -3.973) 28.683 23.933 ( -14.996 -17.492 -5.709) 23.738 ======================= Grid point 722 (361/361) ======================= q-point: (-0.10 -0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.35e-04 3.35e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.292 ( 0.256 0.000 14.382) 14.384 2.798 ( -0.751 -0.000 21.702) 21.715 3.225 ( -5.516 -0.000 -8.005) 9.721 3.500 ( 2.833 0.000 -9.388) 9.806 3.589 ( 8.750 0.000 -6.115) 10.675 4.094 ( -10.138 -0.000 -4.941) 11.278 4.369 ( -2.378 -0.000 -7.899) 8.249 4.632 ( -5.209 -0.000 -2.118) 5.623 5.518 ( 5.562 0.000 8.380) 10.058 5.870 ( 15.402 0.000 -0.429) 15.407 6.117 ( -0.482 -0.000 10.697) 10.708 6.262 ( 14.033 0.000 -5.285) 14.995 6.626 ( -1.525 -0.000 -3.860) 4.151 6.763 ( -4.458 -0.000 -3.749) 5.825 7.433 ( -0.271 -0.000 17.475) 17.477 8.521 ( 7.355 0.000 5.565) 9.223 8.902 ( -4.465 -0.000 20.172) 20.660 9.167 ( -2.983 -0.000 1.653) 3.410 9.203 ( 4.803 0.000 -10.019) 11.111 10.103 ( 5.091 0.000 -16.987) 17.733 10.483 ( -23.238 -0.000 17.590) 29.144 10.589 ( -8.542 -0.000 17.040) 19.061 11.204 ( -3.931 -0.000 -15.290) 15.787 11.972 ( -8.199 -0.000 -4.106) 9.169 12.712 ( 2.311 0.000 -7.074) 7.442 12.745 ( -0.990 -0.000 8.221) 8.281 13.237 ( -1.302 -0.000 6.225) 6.359 13.810 ( 9.727 0.000 -16.116) 18.824 17.653 ( 9.507 0.000 -6.251) 11.378 18.798 ( -4.202 -0.000 -11.598) 12.336 19.087 ( 11.606 0.000 -0.325) 11.611 19.730 ( -2.550 -0.000 -1.067) 2.764 20.240 ( 16.938 0.000 16.840) 23.885 23.000 ( -3.054 -0.000 -16.920) 17.194 23.304 ( -12.562 -0.000 -5.793) 13.833 23.653 ( -12.269 -0.000 2.800) 12.584 =================== 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 3/46800 10.0 1399.392 1662.811 1428.563 -0.000 -49.907 -0.000 3/46800 20.0 485.037 543.781 539.824 -0.000 -3.448 -0.000 3/46800 30.0 180.078 187.428 202.360 -0.000 -1.377 -0.000 3/46800 40.0 90.847 88.006 101.039 -0.000 -1.049 -0.000 3/46800 50.0 55.985 51.545 61.731 -0.000 -0.911 -0.000 3/46800 60.0 39.065 34.760 42.833 -0.000 -0.826 -0.000 3/46800 70.0 29.523 25.677 32.262 -0.000 -0.769 -0.000 3/46800 80.0 23.547 20.170 25.683 -0.000 -0.724 -0.000 3/46800 90.0 19.514 16.546 21.264 -0.000 -0.686 -0.000 3/46800 100.0 16.638 14.012 18.121 -0.000 -0.652 -0.000 3/46800 110.0 14.500 12.155 15.788 -0.000 -0.620 -0.000 3/46800 120.0 12.855 10.742 13.995 -0.000 -0.591 -0.000 3/46800 130.0 11.555 9.634 12.578 -0.000 -0.563 -0.000 3/46800 140.0 10.504 8.743 11.432 -0.000 -0.536 -0.000 3/46800 150.0 9.638 8.011 10.487 -0.000 -0.511 -0.000 3/46800 160.0 8.912 7.400 9.694 -0.000 -0.487 -0.000 3/46800 170.0 8.296 6.880 9.020 -0.000 -0.464 -0.000 3/46800 180.0 7.766 6.434 8.440 -0.000 -0.443 -0.000 3/46800 190.0 7.306 6.046 7.935 -0.000 -0.423 -0.000 3/46800 200.0 6.901 5.705 7.490 -0.000 -0.404 -0.000 3/46800 210.0 6.543 5.403 7.097 -0.000 -0.386 -0.000 3/46800 220.0 6.224 5.133 6.745 -0.000 -0.369 -0.000 3/46800 230.0 5.937 4.891 6.429 -0.000 -0.354 -0.000 3/46800 240.0 5.678 4.672 6.143 -0.000 -0.339 -0.000 3/46800 250.0 5.442 4.473 5.883 -0.000 -0.325 -0.000 3/46800 260.0 5.227 4.292 5.645 -0.000 -0.312 -0.000 3/46800 270.0 5.029 4.125 5.427 -0.000 -0.300 -0.000 3/46800 280.0 4.847 3.971 5.226 -0.000 -0.289 -0.000 3/46800 290.0 4.679 3.829 5.040 -0.000 -0.279 -0.000 3/46800 300.0 4.522 3.698 4.867 -0.000 -0.269 -0.000 3/46800 310.0 4.377 3.575 4.707 -0.000 -0.259 -0.000 3/46800 320.0 4.241 3.461 4.557 -0.000 -0.251 -0.000 3/46800 330.0 4.114 3.354 4.417 -0.000 -0.242 -0.000 3/46800 340.0 3.994 3.253 4.285 -0.000 -0.235 -0.000 3/46800 350.0 3.882 3.159 4.161 -0.000 -0.227 -0.000 3/46800 360.0 3.776 3.070 4.045 -0.000 -0.220 -0.000 3/46800 370.0 3.676 2.987 3.934 -0.000 -0.214 -0.000 3/46800 380.0 3.581 2.907 3.830 -0.000 -0.208 -0.000 3/46800 390.0 3.491 2.832 3.732 -0.000 -0.202 -0.000 3/46800 400.0 3.406 2.761 3.638 -0.000 -0.196 -0.000 3/46800 410.0 3.325 2.694 3.549 -0.000 -0.191 -0.000 3/46800 420.0 3.247 2.629 3.465 -0.000 -0.186 -0.000 3/46800 430.0 3.174 2.568 3.384 -0.000 -0.181 -0.000 3/46800 440.0 3.103 2.510 3.308 -0.000 -0.177 -0.000 3/46800 450.0 3.036 2.454 3.234 -0.000 -0.172 -0.000 3/46800 460.0 2.972 2.401 3.164 -0.000 -0.168 -0.000 3/46800 470.0 2.910 2.350 3.097 -0.000 -0.164 -0.000 3/46800 480.0 2.851 2.301 3.033 -0.000 -0.160 -0.000 3/46800 490.0 2.794 2.254 2.971 -0.000 -0.157 -0.000 3/46800 500.0 2.740 2.209 2.912 -0.000 -0.153 -0.000 3/46800 510.0 2.687 2.166 2.855 -0.000 -0.150 -0.000 3/46800 520.0 2.637 2.125 2.801 -0.000 -0.147 -0.000 3/46800 530.0 2.588 2.085 2.748 -0.000 -0.144 -0.000 3/46800 540.0 2.542 2.046 2.697 -0.000 -0.141 -0.000 3/46800 550.0 2.497 2.009 2.649 -0.000 -0.138 -0.000 3/46800 560.0 2.453 1.974 2.602 -0.000 -0.136 -0.000 3/46800 570.0 2.411 1.939 2.556 -0.000 -0.133 -0.000 3/46800 580.0 2.370 1.906 2.512 -0.000 -0.131 -0.000 3/46800 590.0 2.331 1.874 2.470 -0.000 -0.128 -0.000 3/46800 600.0 2.293 1.843 2.429 -0.000 -0.126 -0.000 3/46800 610.0 2.256 1.813 2.390 -0.000 -0.124 -0.000 3/46800 620.0 2.221 1.784 2.351 -0.000 -0.121 -0.000 3/46800 630.0 2.186 1.755 2.314 -0.000 -0.119 -0.000 3/46800 640.0 2.153 1.728 2.278 -0.000 -0.117 -0.000 3/46800 650.0 2.121 1.702 2.243 -0.000 -0.115 -0.000 3/46800 660.0 2.089 1.676 2.210 -0.000 -0.114 -0.000 3/46800 670.0 2.059 1.651 2.177 -0.000 -0.112 -0.000 3/46800 680.0 2.029 1.627 2.145 -0.000 -0.110 -0.000 3/46800 690.0 2.000 1.604 2.114 -0.000 -0.108 -0.000 3/46800 700.0 1.972 1.581 2.084 -0.000 -0.107 -0.000 3/46800 710.0 1.945 1.559 2.055 -0.000 -0.105 -0.000 3/46800 720.0 1.918 1.537 2.027 -0.000 -0.104 -0.000 3/46800 730.0 1.892 1.516 1.999 -0.000 -0.102 -0.000 3/46800 740.0 1.867 1.496 1.972 -0.000 -0.101 -0.000 3/46800 750.0 1.843 1.476 1.946 -0.000 -0.099 -0.000 3/46800 760.0 1.819 1.457 1.921 -0.000 -0.098 -0.000 3/46800 770.0 1.796 1.438 1.896 -0.000 -0.096 -0.000 3/46800 780.0 1.773 1.420 1.872 -0.000 -0.095 -0.000 3/46800 790.0 1.751 1.402 1.848 -0.000 -0.094 -0.000 3/46800 800.0 1.730 1.384 1.825 -0.000 -0.093 -0.000 3/46800 810.0 1.709 1.367 1.803 -0.000 -0.091 -0.000 3/46800 820.0 1.688 1.351 1.781 -0.000 -0.090 -0.000 3/46800 830.0 1.668 1.335 1.759 -0.000 -0.089 -0.000 3/46800 840.0 1.649 1.319 1.739 -0.000 -0.088 -0.000 3/46800 850.0 1.629 1.303 1.718 -0.000 -0.087 -0.000 3/46800 860.0 1.611 1.288 1.698 -0.000 -0.086 -0.000 3/46800 870.0 1.593 1.274 1.679 -0.000 -0.085 -0.000 3/46800 880.0 1.575 1.259 1.660 -0.000 -0.084 -0.000 3/46800 890.0 1.557 1.245 1.641 -0.000 -0.083 -0.000 3/46800 900.0 1.540 1.231 1.623 -0.000 -0.082 -0.000 3/46800 910.0 1.524 1.218 1.606 -0.000 -0.081 -0.000 3/46800 920.0 1.507 1.205 1.588 -0.000 -0.080 -0.000 3/46800 930.0 1.491 1.192 1.571 -0.000 -0.079 -0.000 3/46800 940.0 1.476 1.179 1.555 -0.000 -0.078 -0.000 3/46800 950.0 1.460 1.167 1.538 -0.000 -0.077 -0.000 3/46800 960.0 1.445 1.155 1.522 -0.000 -0.077 -0.000 3/46800 970.0 1.431 1.143 1.507 -0.000 -0.076 -0.000 3/46800 980.0 1.416 1.131 1.491 -0.000 -0.075 -0.000 3/46800 990.0 1.402 1.120 1.476 -0.000 -0.074 -0.000 3/46800 1000.0 1.388 1.109 1.462 -0.000 -0.073 -0.000 3/46800 Thermal conductivity related properties were written into "kappa-m101013.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:29:21]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|