----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 23:27:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.035005830022195 0.000000000000000 0.000000000000000 b 0.000000000000000 5.290499780000000 0.000000000000000 c -0.461343575744006 0.000000000000000 5.198098939849819 Atomic positions (fractional): *1 Lu 0.50000000000000 0.75796418498839 0.25000000000000 174.967 2 Lu 0.50000000000000 0.24203581501161 0.75000000000000 174.967 *3 Nb 0.00000000000000 0.28664283712975 0.25000000000000 92.906 4 Nb 0.00000000000000 0.71335716287025 0.75000000000000 92.906 *5 O 0.24365538221490 0.55450671714999 0.52307275660332 15.999 *6 O 0.25232909644692 0.06533722261538 0.41664211772387 15.999 7 O 0.74767090355308 0.06533722261538 0.08335788227613 15.999 8 O 0.75634461778510 0.55450671714999 0.97692724339668 15.999 9 O 0.24365538221490 0.44549328285001 0.02307275660332 15.999 10 O 0.25232909644692 0.93466277738462 0.91664211772387 15.999 11 O 0.74767090355308 0.93466277738462 0.58335788227613 15.999 12 O 0.75634461778510 0.44549328285001 0.47692724339668 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.035005830022195 0.000000000000000 0.000000000000000 b 0.000000000000000 5.290499780000000 0.000000000000000 c -0.461343575744006 0.000000000000000 5.198098939849819 Atomic positions (fractional): *1 Lu 0.50000000000000 0.75796418498839 0.25000000000000 174.967 > 1 2 Lu 0.50000000000000 0.24203581501161 0.75000000000000 174.967 > 2 *3 Nb 0.00000000000000 0.28664283712975 0.25000000000000 92.906 > 3 4 Nb 0.00000000000000 0.71335716287025 0.75000000000000 92.906 > 4 *5 O 0.24365538221490 0.55450671714999 0.52307275660332 15.999 > 5 *6 O 0.25232909644692 0.06533722261538 0.41664211772387 15.999 > 6 7 O 0.74767090355308 0.06533722261538 0.08335788227613 15.999 > 7 8 O 0.75634461778510 0.55450671714999 0.97692724339668 15.999 > 8 9 O 0.24365538221490 0.44549328285001 0.02307275660332 15.999 > 9 10 O 0.25232909644692 0.93466277738462 0.91664211772387 15.999 > 10 11 O 0.74767090355308 0.93466277738462 0.58335788227613 15.999 > 11 12 O 0.75634461778510 0.44549328285001 0.47692724339668 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 15.105017490066585 0.000000000000000 0.000000000000000 b 0.000000000000000 10.580999560000000 0.000000000000000 c -0.922687151488012 0.000000000000000 10.396197879699638 Atomic positions (fractional): *1 Lu 0.16666666666667 0.37898209249419 0.12500000000000 174.967 > 1 2 Lu 0.50000000000000 0.37898209249419 0.12500000000000 174.967 > 1 3 Lu 0.83333333333333 0.37898209249419 0.12500000000000 174.967 > 1 4 Lu 0.16666666666667 0.87898209249419 0.12500000000000 174.967 > 1 5 Lu 0.50000000000000 0.87898209249419 0.12500000000000 174.967 > 1 6 Lu 0.83333333333333 0.87898209249419 0.12500000000000 174.967 > 1 7 Lu 0.16666666666667 0.37898209249419 0.62500000000000 174.967 > 1 8 Lu 0.50000000000000 0.37898209249419 0.62500000000000 174.967 > 1 9 Lu 0.83333333333333 0.37898209249419 0.62500000000000 174.967 > 1 10 Lu 0.16666666666667 0.87898209249419 0.62500000000000 174.967 > 1 11 Lu 0.50000000000000 0.87898209249419 0.62500000000000 174.967 > 1 12 Lu 0.83333333333333 0.87898209249419 0.62500000000000 174.967 > 1 13 Lu 0.16666666666667 0.12101790750581 0.37500000000000 174.967 > 2 14 Lu 0.50000000000000 0.12101790750581 0.37500000000000 174.967 > 2 15 Lu 0.83333333333333 0.12101790750581 0.37500000000000 174.967 > 2 16 Lu 0.16666666666667 0.62101790750581 0.37500000000000 174.967 > 2 17 Lu 0.50000000000000 0.62101790750581 0.37500000000000 174.967 > 2 18 Lu 0.83333333333333 0.62101790750581 0.37500000000000 174.967 > 2 19 Lu 0.16666666666667 0.12101790750581 0.87500000000000 174.967 > 2 20 Lu 0.50000000000000 0.12101790750581 0.87500000000000 174.967 > 2 21 Lu 0.83333333333333 0.12101790750581 0.87500000000000 174.967 > 2 22 Lu 0.16666666666667 0.62101790750581 0.87500000000000 174.967 > 2 23 Lu 0.50000000000000 0.62101790750581 0.87500000000000 174.967 > 2 24 Lu 0.83333333333333 0.62101790750581 0.87500000000000 174.967 > 2 *25 Nb 0.00000000000000 0.14332141856488 0.12500000000000 92.906 > 3 26 Nb 0.33333333333333 0.14332141856488 0.12500000000000 92.906 > 3 27 Nb 0.66666666666667 0.14332141856488 0.12500000000000 92.906 > 3 28 Nb 0.00000000000000 0.64332141856488 0.12500000000000 92.906 > 3 29 Nb 0.33333333333333 0.64332141856488 0.12500000000000 92.906 > 3 30 Nb 0.66666666666667 0.64332141856488 0.12500000000000 92.906 > 3 31 Nb 0.00000000000000 0.14332141856488 0.62500000000000 92.906 > 3 32 Nb 0.33333333333333 0.14332141856488 0.62500000000000 92.906 > 3 33 Nb 0.66666666666667 0.14332141856488 0.62500000000000 92.906 > 3 34 Nb 0.00000000000000 0.64332141856488 0.62500000000000 92.906 > 3 35 Nb 0.33333333333333 0.64332141856488 0.62500000000000 92.906 > 3 36 Nb 0.66666666666667 0.64332141856488 0.62500000000000 92.906 > 3 37 Nb 0.00000000000000 0.35667858143512 0.37500000000000 92.906 > 4 38 Nb 0.33333333333333 0.35667858143512 0.37500000000000 92.906 > 4 39 Nb 0.66666666666667 0.35667858143512 0.37500000000000 92.906 > 4 40 Nb 0.00000000000000 0.85667858143512 0.37500000000000 92.906 > 4 41 Nb 0.33333333333333 0.85667858143512 0.37500000000000 92.906 > 4 42 Nb 0.66666666666667 0.85667858143512 0.37500000000000 92.906 > 4 43 Nb 0.00000000000000 0.35667858143512 0.87500000000000 92.906 > 4 44 Nb 0.33333333333333 0.35667858143512 0.87500000000000 92.906 > 4 45 Nb 0.66666666666667 0.35667858143512 0.87500000000000 92.906 > 4 46 Nb 0.00000000000000 0.85667858143512 0.87500000000000 92.906 > 4 47 Nb 0.33333333333333 0.85667858143512 0.87500000000000 92.906 > 4 48 Nb 0.66666666666667 0.85667858143512 0.87500000000000 92.906 > 4 *49 O 0.08121846073830 0.27725335857499 0.26153637830166 15.999 > 5 50 O 0.41455179407163 0.27725335857499 0.26153637830166 15.999 > 5 51 O 0.74788512740497 0.27725335857499 0.26153637830166 15.999 > 5 52 O 0.08121846073830 0.77725335857499 0.26153637830166 15.999 > 5 53 O 0.41455179407163 0.77725335857499 0.26153637830166 15.999 > 5 54 O 0.74788512740497 0.77725335857499 0.26153637830166 15.999 > 5 55 O 0.08121846073830 0.27725335857499 0.76153637830166 15.999 > 5 56 O 0.41455179407163 0.27725335857499 0.76153637830166 15.999 > 5 57 O 0.74788512740497 0.27725335857499 0.76153637830166 15.999 > 5 58 O 0.08121846073830 0.77725335857499 0.76153637830166 15.999 > 5 59 O 0.41455179407163 0.77725335857499 0.76153637830166 15.999 > 5 60 O 0.74788512740497 0.77725335857499 0.76153637830166 15.999 > 5 *61 O 0.08410969881564 0.03266861130769 0.20832105886193 15.999 > 6 62 O 0.41744303214897 0.03266861130769 0.20832105886193 15.999 > 6 63 O 0.75077636548231 0.03266861130769 0.20832105886193 15.999 > 6 64 O 0.08410969881564 0.53266861130769 0.20832105886193 15.999 > 6 65 O 0.41744303214897 0.53266861130769 0.20832105886193 15.999 > 6 66 O 0.75077636548231 0.53266861130769 0.20832105886193 15.999 > 6 67 O 0.08410969881564 0.03266861130769 0.70832105886193 15.999 > 6 68 O 0.41744303214897 0.03266861130769 0.70832105886193 15.999 > 6 69 O 0.75077636548231 0.03266861130769 0.70832105886193 15.999 > 6 70 O 0.08410969881564 0.53266861130769 0.70832105886193 15.999 > 6 71 O 0.41744303214897 0.53266861130769 0.70832105886193 15.999 > 6 72 O 0.75077636548231 0.53266861130769 0.70832105886193 15.999 > 6 73 O 0.24922363451769 0.03266861130769 0.04167894113807 15.999 > 7 74 O 0.58255696785103 0.03266861130769 0.04167894113807 15.999 > 7 75 O 0.91589030118436 0.03266861130769 0.04167894113807 15.999 > 7 76 O 0.24922363451769 0.53266861130769 0.04167894113807 15.999 > 7 77 O 0.58255696785103 0.53266861130769 0.04167894113807 15.999 > 7 78 O 0.91589030118436 0.53266861130769 0.04167894113807 15.999 > 7 79 O 0.24922363451769 0.03266861130769 0.54167894113807 15.999 > 7 80 O 0.58255696785103 0.03266861130769 0.54167894113807 15.999 > 7 81 O 0.91589030118436 0.03266861130769 0.54167894113807 15.999 > 7 82 O 0.24922363451769 0.53266861130769 0.54167894113807 15.999 > 7 83 O 0.58255696785103 0.53266861130769 0.54167894113807 15.999 > 7 84 O 0.91589030118436 0.53266861130769 0.54167894113807 15.999 > 7 85 O 0.25211487259503 0.27725335857499 0.48846362169834 15.999 > 8 86 O 0.58544820592837 0.27725335857499 0.48846362169834 15.999 > 8 87 O 0.91878153926170 0.27725335857499 0.48846362169834 15.999 > 8 88 O 0.25211487259503 0.77725335857499 0.48846362169834 15.999 > 8 89 O 0.58544820592837 0.77725335857499 0.48846362169834 15.999 > 8 90 O 0.91878153926170 0.77725335857499 0.48846362169834 15.999 > 8 91 O 0.25211487259503 0.27725335857499 0.98846362169834 15.999 > 8 92 O 0.58544820592837 0.27725335857499 0.98846362169834 15.999 > 8 93 O 0.91878153926170 0.27725335857499 0.98846362169834 15.999 > 8 94 O 0.25211487259503 0.77725335857499 0.98846362169834 15.999 > 8 95 O 0.58544820592837 0.77725335857499 0.98846362169834 15.999 > 8 96 O 0.91878153926170 0.77725335857499 0.98846362169834 15.999 > 8 97 O 0.08121846073830 0.22274664142501 0.01153637830166 15.999 > 9 98 O 0.41455179407163 0.22274664142501 0.01153637830166 15.999 > 9 99 O 0.74788512740497 0.22274664142501 0.01153637830166 15.999 > 9 100 O 0.08121846073830 0.72274664142501 0.01153637830166 15.999 > 9 101 O 0.41455179407163 0.72274664142501 0.01153637830166 15.999 > 9 102 O 0.74788512740497 0.72274664142501 0.01153637830166 15.999 > 9 103 O 0.08121846073830 0.22274664142501 0.51153637830166 15.999 > 9 104 O 0.41455179407163 0.22274664142501 0.51153637830166 15.999 > 9 105 O 0.74788512740497 0.22274664142501 0.51153637830166 15.999 > 9 106 O 0.08121846073830 0.72274664142501 0.51153637830166 15.999 > 9 107 O 0.41455179407163 0.72274664142501 0.51153637830166 15.999 > 9 108 O 0.74788512740497 0.72274664142501 0.51153637830166 15.999 > 9 109 O 0.08410969881564 0.46733138869231 0.45832105886193 15.999 > 10 110 O 0.41744303214897 0.46733138869231 0.45832105886193 15.999 > 10 111 O 0.75077636548231 0.46733138869231 0.45832105886193 15.999 > 10 112 O 0.08410969881564 0.96733138869231 0.45832105886193 15.999 > 10 113 O 0.41744303214897 0.96733138869231 0.45832105886193 15.999 > 10 114 O 0.75077636548231 0.96733138869231 0.45832105886193 15.999 > 10 115 O 0.08410969881564 0.46733138869231 0.95832105886193 15.999 > 10 116 O 0.41744303214897 0.46733138869231 0.95832105886193 15.999 > 10 117 O 0.75077636548231 0.46733138869231 0.95832105886193 15.999 > 10 118 O 0.08410969881564 0.96733138869231 0.95832105886193 15.999 > 10 119 O 0.41744303214897 0.96733138869231 0.95832105886193 15.999 > 10 120 O 0.75077636548231 0.96733138869231 0.95832105886193 15.999 > 10 121 O 0.24922363451769 0.46733138869231 0.29167894113807 15.999 > 11 122 O 0.58255696785103 0.46733138869231 0.29167894113807 15.999 > 11 123 O 0.91589030118436 0.46733138869231 0.29167894113807 15.999 > 11 124 O 0.24922363451769 0.96733138869231 0.29167894113807 15.999 > 11 125 O 0.58255696785103 0.96733138869231 0.29167894113807 15.999 > 11 126 O 0.91589030118436 0.96733138869231 0.29167894113807 15.999 > 11 127 O 0.24922363451769 0.46733138869231 0.79167894113807 15.999 > 11 128 O 0.58255696785103 0.46733138869231 0.79167894113807 15.999 > 11 129 O 0.91589030118436 0.46733138869231 0.79167894113807 15.999 > 11 130 O 0.24922363451769 0.96733138869231 0.79167894113807 15.999 > 11 131 O 0.58255696785103 0.96733138869231 0.79167894113807 15.999 > 11 132 O 0.91589030118436 0.96733138869231 0.79167894113807 15.999 > 11 133 O 0.25211487259503 0.22274664142501 0.23846362169834 15.999 > 12 134 O 0.58544820592837 0.22274664142501 0.23846362169834 15.999 > 12 135 O 0.91878153926170 0.22274664142501 0.23846362169834 15.999 > 12 136 O 0.25211487259503 0.72274664142501 0.23846362169834 15.999 > 12 137 O 0.58544820592837 0.72274664142501 0.23846362169834 15.999 > 12 138 O 0.91878153926170 0.72274664142501 0.23846362169834 15.999 > 12 139 O 0.25211487259503 0.22274664142501 0.73846362169834 15.999 > 12 140 O 0.58544820592837 0.22274664142501 0.73846362169834 15.999 > 12 141 O 0.91878153926170 0.22274664142501 0.73846362169834 15.999 > 12 142 O 0.25211487259503 0.72274664142501 0.73846362169834 15.999 > 12 143 O 0.58544820592837 0.72274664142501 0.73846362169834 15.999 > 12 144 O 0.91878153926170 0.72274664142501 0.73846362169834 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.3070247 0.0000000 0.1354283 0.0000000 5.1588420 0.0000000 0.1354268 0.0000000 5.0981216 -------------------------- Born effective charges -------------------------- 1 Lu 4.9449525 0.0000000 0.1494371 0.0000000 3.8585060 0.0000000 0.1601733 0.0000000 3.9498030 2 Lu 4.9449525 0.0000000 0.1494371 0.0000000 3.8585060 0.0000000 0.1601733 0.0000000 3.9498030 3 Nb 5.3567189 0.0000000 0.2224091 0.0000000 5.8809240 0.0000000 0.3431417 0.0000000 5.5846989 4 Nb 5.3567189 0.0000000 0.2224091 0.0000000 5.8809240 0.0000000 0.3431417 0.0000000 5.5846989 5 O -2.5553714 0.3303285 0.6067990 0.3115251 -2.2250770 -0.5527156 0.6407003 -0.4811825 -2.5478488 6 O -2.5954643 0.9778338 -0.7927221 1.1329433 -2.6446380 0.4000731 -0.8923578 0.3939145 -2.2194022 7 O -2.5954643 -0.9778338 -0.7927221 -1.1329433 -2.6446380 -0.4000731 -0.8923578 -0.3939145 -2.2194022 8 O -2.5553714 -0.3303285 0.6067990 -0.3115251 -2.2250770 0.5527156 0.6407003 0.4811825 -2.5478488 9 O -2.5553714 -0.3303285 0.6067990 -0.3115251 -2.2250770 0.5527156 0.6407003 0.4811825 -2.5478488 10 O -2.5954643 -0.9778338 -0.7927221 -1.1329433 -2.6446380 -0.4000731 -0.8923578 -0.3939145 -2.2194022 11 O -2.5954643 0.9778338 -0.7927221 1.1329433 -2.6446380 0.4000731 -0.8923578 0.3939145 -2.2194022 12 O -2.5553714 0.3303285 0.6067990 0.3115251 -2.2250770 -0.5527156 0.6407003 -0.4811825 -2.5478488 ---------------------------------------------------------------------------- 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: 8352/8352 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: 0.923 Solver_block: 200 / 400 - Time: 0.746 Solver_block: 300 / 400 - Time: 0.763 Solver_block: 400 / 400 - Time: 0.745 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.252 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 8352/8352 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 23:28:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:28:14]------------------------- 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): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.035005830022195 0.000000000000000 0.000000000000000 b 0.000000000000000 5.290499780000000 0.000000000000000 c -0.461343575744006 0.000000000000000 5.198098939849819 Atomic positions (fractional): 1 Lu 0.50000000000000 0.75796418498839 0.25000000000000 174.967 2 Lu 0.50000000000000 0.24203581501161 0.75000000000000 174.967 3 Nb 0.00000000000000 0.28664283712975 0.25000000000000 92.906 4 Nb 0.00000000000000 0.71335716287025 0.75000000000000 92.906 5 O 0.24365538221490 0.55450671714999 0.52307275660332 15.999 6 O 0.25232909644692 0.06533722261538 0.41664211772387 15.999 7 O 0.74767090355308 0.06533722261538 0.08335788227613 15.999 8 O 0.75634461778510 0.55450671714999 0.97692724339668 15.999 9 O 0.24365538221490 0.44549328285001 0.02307275660332 15.999 10 O 0.25232909644692 0.93466277738462 0.91664211772387 15.999 11 O 0.74767090355308 0.93466277738462 0.58335788227613 15.999 12 O 0.75634461778510 0.44549328285001 0.47692724339668 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 15.105017490066585 0.000000000000000 0.000000000000000 b 0.000000000000000 10.580999560000000 0.000000000000000 c -0.922687151488012 0.000000000000000 10.396197879699638 Atomic positions (fractional): 1 Lu 0.16666666666667 0.37898209249419 0.12500000000000 174.967 > 1 2 Lu 0.50000000000000 0.37898209249419 0.12500000000000 174.967 > 1 3 Lu 0.83333333333333 0.37898209249419 0.12500000000000 174.967 > 1 4 Lu 0.16666666666667 0.87898209249419 0.12500000000000 174.967 > 1 5 Lu 0.50000000000000 0.87898209249419 0.12500000000000 174.967 > 1 6 Lu 0.83333333333333 0.87898209249419 0.12500000000000 174.967 > 1 7 Lu 0.16666666666667 0.37898209249419 0.62500000000000 174.967 > 1 8 Lu 0.50000000000000 0.37898209249419 0.62500000000000 174.967 > 1 9 Lu 0.83333333333333 0.37898209249419 0.62500000000000 174.967 > 1 10 Lu 0.16666666666667 0.87898209249419 0.62500000000000 174.967 > 1 11 Lu 0.50000000000000 0.87898209249419 0.62500000000000 174.967 > 1 12 Lu 0.83333333333333 0.87898209249419 0.62500000000000 174.967 > 1 13 Lu 0.16666666666667 0.12101790750581 0.37500000000000 174.967 > 13 14 Lu 0.50000000000000 0.12101790750581 0.37500000000000 174.967 > 13 15 Lu 0.83333333333333 0.12101790750581 0.37500000000000 174.967 > 13 16 Lu 0.16666666666667 0.62101790750581 0.37500000000000 174.967 > 13 17 Lu 0.50000000000000 0.62101790750581 0.37500000000000 174.967 > 13 18 Lu 0.83333333333333 0.62101790750581 0.37500000000000 174.967 > 13 19 Lu 0.16666666666667 0.12101790750581 0.87500000000000 174.967 > 13 20 Lu 0.50000000000000 0.12101790750581 0.87500000000000 174.967 > 13 21 Lu 0.83333333333333 0.12101790750581 0.87500000000000 174.967 > 13 22 Lu 0.16666666666667 0.62101790750581 0.87500000000000 174.967 > 13 23 Lu 0.50000000000000 0.62101790750581 0.87500000000000 174.967 > 13 24 Lu 0.83333333333333 0.62101790750581 0.87500000000000 174.967 > 13 25 Nb 0.00000000000000 0.14332141856488 0.12500000000000 92.906 > 25 26 Nb 0.33333333333333 0.14332141856488 0.12500000000000 92.906 > 25 27 Nb 0.66666666666667 0.14332141856488 0.12500000000000 92.906 > 25 28 Nb 0.00000000000000 0.64332141856488 0.12500000000000 92.906 > 25 29 Nb 0.33333333333333 0.64332141856488 0.12500000000000 92.906 > 25 30 Nb 0.66666666666667 0.64332141856488 0.12500000000000 92.906 > 25 31 Nb 0.00000000000000 0.14332141856488 0.62500000000000 92.906 > 25 32 Nb 0.33333333333333 0.14332141856488 0.62500000000000 92.906 > 25 33 Nb 0.66666666666667 0.14332141856488 0.62500000000000 92.906 > 25 34 Nb 0.00000000000000 0.64332141856488 0.62500000000000 92.906 > 25 35 Nb 0.33333333333333 0.64332141856488 0.62500000000000 92.906 > 25 36 Nb 0.66666666666667 0.64332141856488 0.62500000000000 92.906 > 25 37 Nb 0.00000000000000 0.35667858143512 0.37500000000000 92.906 > 37 38 Nb 0.33333333333333 0.35667858143512 0.37500000000000 92.906 > 37 39 Nb 0.66666666666667 0.35667858143512 0.37500000000000 92.906 > 37 40 Nb 0.00000000000000 0.85667858143512 0.37500000000000 92.906 > 37 41 Nb 0.33333333333333 0.85667858143512 0.37500000000000 92.906 > 37 42 Nb 0.66666666666667 0.85667858143512 0.37500000000000 92.906 > 37 43 Nb 0.00000000000000 0.35667858143512 0.87500000000000 92.906 > 37 44 Nb 0.33333333333333 0.35667858143512 0.87500000000000 92.906 > 37 45 Nb 0.66666666666667 0.35667858143512 0.87500000000000 92.906 > 37 46 Nb 0.00000000000000 0.85667858143512 0.87500000000000 92.906 > 37 47 Nb 0.33333333333333 0.85667858143512 0.87500000000000 92.906 > 37 48 Nb 0.66666666666667 0.85667858143512 0.87500000000000 92.906 > 37 49 O 0.08121846073830 0.27725335857499 0.26153637830166 15.999 > 49 50 O 0.41455179407163 0.27725335857499 0.26153637830166 15.999 > 49 51 O 0.74788512740497 0.27725335857499 0.26153637830166 15.999 > 49 52 O 0.08121846073830 0.77725335857499 0.26153637830166 15.999 > 49 53 O 0.41455179407163 0.77725335857499 0.26153637830166 15.999 > 49 54 O 0.74788512740497 0.77725335857499 0.26153637830166 15.999 > 49 55 O 0.08121846073830 0.27725335857499 0.76153637830166 15.999 > 49 56 O 0.41455179407163 0.27725335857499 0.76153637830166 15.999 > 49 57 O 0.74788512740497 0.27725335857499 0.76153637830166 15.999 > 49 58 O 0.08121846073830 0.77725335857499 0.76153637830166 15.999 > 49 59 O 0.41455179407163 0.77725335857499 0.76153637830166 15.999 > 49 60 O 0.74788512740497 0.77725335857499 0.76153637830166 15.999 > 49 61 O 0.08410969881564 0.03266861130769 0.20832105886193 15.999 > 61 62 O 0.41744303214897 0.03266861130769 0.20832105886193 15.999 > 61 63 O 0.75077636548231 0.03266861130769 0.20832105886193 15.999 > 61 64 O 0.08410969881564 0.53266861130769 0.20832105886193 15.999 > 61 65 O 0.41744303214897 0.53266861130769 0.20832105886193 15.999 > 61 66 O 0.75077636548231 0.53266861130769 0.20832105886193 15.999 > 61 67 O 0.08410969881564 0.03266861130769 0.70832105886193 15.999 > 61 68 O 0.41744303214897 0.03266861130769 0.70832105886193 15.999 > 61 69 O 0.75077636548231 0.03266861130769 0.70832105886193 15.999 > 61 70 O 0.08410969881564 0.53266861130769 0.70832105886193 15.999 > 61 71 O 0.41744303214897 0.53266861130769 0.70832105886193 15.999 > 61 72 O 0.75077636548231 0.53266861130769 0.70832105886193 15.999 > 61 73 O 0.24922363451769 0.03266861130769 0.04167894113807 15.999 > 73 74 O 0.58255696785103 0.03266861130769 0.04167894113807 15.999 > 73 75 O 0.91589030118436 0.03266861130769 0.04167894113807 15.999 > 73 76 O 0.24922363451769 0.53266861130769 0.04167894113807 15.999 > 73 77 O 0.58255696785103 0.53266861130769 0.04167894113807 15.999 > 73 78 O 0.91589030118436 0.53266861130769 0.04167894113807 15.999 > 73 79 O 0.24922363451769 0.03266861130769 0.54167894113807 15.999 > 73 80 O 0.58255696785103 0.03266861130769 0.54167894113807 15.999 > 73 81 O 0.91589030118436 0.03266861130769 0.54167894113807 15.999 > 73 82 O 0.24922363451769 0.53266861130769 0.54167894113807 15.999 > 73 83 O 0.58255696785103 0.53266861130769 0.54167894113807 15.999 > 73 84 O 0.91589030118436 0.53266861130769 0.54167894113807 15.999 > 73 85 O 0.25211487259503 0.27725335857499 0.48846362169834 15.999 > 85 86 O 0.58544820592837 0.27725335857499 0.48846362169834 15.999 > 85 87 O 0.91878153926170 0.27725335857499 0.48846362169834 15.999 > 85 88 O 0.25211487259503 0.77725335857499 0.48846362169834 15.999 > 85 89 O 0.58544820592837 0.77725335857499 0.48846362169834 15.999 > 85 90 O 0.91878153926170 0.77725335857499 0.48846362169834 15.999 > 85 91 O 0.25211487259503 0.27725335857499 0.98846362169834 15.999 > 85 92 O 0.58544820592837 0.27725335857499 0.98846362169834 15.999 > 85 93 O 0.91878153926170 0.27725335857499 0.98846362169834 15.999 > 85 94 O 0.25211487259503 0.77725335857499 0.98846362169834 15.999 > 85 95 O 0.58544820592837 0.77725335857499 0.98846362169834 15.999 > 85 96 O 0.91878153926170 0.77725335857499 0.98846362169834 15.999 > 85 97 O 0.08121846073830 0.22274664142501 0.01153637830166 15.999 > 97 98 O 0.41455179407163 0.22274664142501 0.01153637830166 15.999 > 97 99 O 0.74788512740497 0.22274664142501 0.01153637830166 15.999 > 97 100 O 0.08121846073830 0.72274664142501 0.01153637830166 15.999 > 97 101 O 0.41455179407163 0.72274664142501 0.01153637830166 15.999 > 97 102 O 0.74788512740497 0.72274664142501 0.01153637830166 15.999 > 97 103 O 0.08121846073830 0.22274664142501 0.51153637830166 15.999 > 97 104 O 0.41455179407163 0.22274664142501 0.51153637830166 15.999 > 97 105 O 0.74788512740497 0.22274664142501 0.51153637830166 15.999 > 97 106 O 0.08121846073830 0.72274664142501 0.51153637830166 15.999 > 97 107 O 0.41455179407163 0.72274664142501 0.51153637830166 15.999 > 97 108 O 0.74788512740497 0.72274664142501 0.51153637830166 15.999 > 97 109 O 0.08410969881564 0.46733138869231 0.45832105886193 15.999 > 109 110 O 0.41744303214897 0.46733138869231 0.45832105886193 15.999 > 109 111 O 0.75077636548231 0.46733138869231 0.45832105886193 15.999 > 109 112 O 0.08410969881564 0.96733138869231 0.45832105886193 15.999 > 109 113 O 0.41744303214897 0.96733138869231 0.45832105886193 15.999 > 109 114 O 0.75077636548231 0.96733138869231 0.45832105886193 15.999 > 109 115 O 0.08410969881564 0.46733138869231 0.95832105886193 15.999 > 109 116 O 0.41744303214897 0.46733138869231 0.95832105886193 15.999 > 109 117 O 0.75077636548231 0.46733138869231 0.95832105886193 15.999 > 109 118 O 0.08410969881564 0.96733138869231 0.95832105886193 15.999 > 109 119 O 0.41744303214897 0.96733138869231 0.95832105886193 15.999 > 109 120 O 0.75077636548231 0.96733138869231 0.95832105886193 15.999 > 109 121 O 0.24922363451769 0.46733138869231 0.29167894113807 15.999 > 121 122 O 0.58255696785103 0.46733138869231 0.29167894113807 15.999 > 121 123 O 0.91589030118436 0.46733138869231 0.29167894113807 15.999 > 121 124 O 0.24922363451769 0.96733138869231 0.29167894113807 15.999 > 121 125 O 0.58255696785103 0.96733138869231 0.29167894113807 15.999 > 121 126 O 0.91589030118436 0.96733138869231 0.29167894113807 15.999 > 121 127 O 0.24922363451769 0.46733138869231 0.79167894113807 15.999 > 121 128 O 0.58255696785103 0.46733138869231 0.79167894113807 15.999 > 121 129 O 0.91589030118436 0.46733138869231 0.79167894113807 15.999 > 121 130 O 0.24922363451769 0.96733138869231 0.79167894113807 15.999 > 121 131 O 0.58255696785103 0.96733138869231 0.79167894113807 15.999 > 121 132 O 0.91589030118436 0.96733138869231 0.79167894113807 15.999 > 121 133 O 0.25211487259503 0.22274664142501 0.23846362169834 15.999 > 133 134 O 0.58544820592837 0.22274664142501 0.23846362169834 15.999 > 133 135 O 0.91878153926170 0.22274664142501 0.23846362169834 15.999 > 133 136 O 0.25211487259503 0.72274664142501 0.23846362169834 15.999 > 133 137 O 0.58544820592837 0.72274664142501 0.23846362169834 15.999 > 133 138 O 0.91878153926170 0.72274664142501 0.23846362169834 15.999 > 133 139 O 0.25211487259503 0.22274664142501 0.73846362169834 15.999 > 133 140 O 0.58544820592837 0.22274664142501 0.73846362169834 15.999 > 133 141 O 0.91878153926170 0.22274664142501 0.73846362169834 15.999 > 133 142 O 0.25211487259503 0.72274664142501 0.73846362169834 15.999 > 133 143 O 0.58544820592837 0.72274664142501 0.73846362169834 15.999 > 133 144 O 0.91878153926170 0.72274664142501 0.73846362169834 15.999 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.3070247 0.0000000 0.1354283 0.0000000 5.1588420 0.0000000 0.1354268 0.0000000 5.0981216 -------------------------- Born effective charges -------------------------- 1 Lu 4.9449525 0.0000000 0.1494371 0.0000000 3.8585060 0.0000000 0.1601733 0.0000000 3.9498030 2 Lu 4.9449525 0.0000000 0.1494371 0.0000000 3.8585060 0.0000000 0.1601733 0.0000000 3.9498030 3 Nb 5.3567189 0.0000000 0.2224091 0.0000000 5.8809240 0.0000000 0.3431417 0.0000000 5.5846989 4 Nb 5.3567189 0.0000000 0.2224091 0.0000000 5.8809240 0.0000000 0.3431417 0.0000000 5.5846989 5 O -2.5553714 0.3303285 0.6067990 0.3115251 -2.2250770 -0.5527156 0.6407003 -0.4811825 -2.5478488 6 O -2.5954643 0.9778338 -0.7927221 1.1329433 -2.6446380 0.4000731 -0.8923578 0.3939145 -2.2194022 7 O -2.5954643 -0.9778338 -0.7927221 -1.1329433 -2.6446380 -0.4000731 -0.8923578 -0.3939145 -2.2194022 8 O -2.5553714 -0.3303285 0.6067990 -0.3115251 -2.2250770 0.5527156 0.6407003 0.4811825 -2.5478488 9 O -2.5553714 -0.3303285 0.6067990 -0.3115251 -2.2250770 0.5527156 0.6407003 0.4811825 -2.5478488 10 O -2.5954643 -0.9778338 -0.7927221 -1.1329433 -2.6446380 -0.4000731 -0.8923578 -0.3939145 -2.2194022 11 O -2.5954643 0.9778338 -0.7927221 1.1329433 -2.6446380 0.4000731 -0.8923578 0.3939145 -2.2194022 12 O -2.5553714 0.3303285 0.6067990 0.3115251 -2.2250770 -0.5527156 0.6407003 -0.4811825 -2.5478488 ---------------------------------------------------------------------------- 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 61, 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000016 (yyy) -0.00000016 (yyy) -0.00000016 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000002 (xz) 0.00000002 (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 23:28:39]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:28:39]------------------------- 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): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.035005830022195 0.000000000000000 0.000000000000000 b 0.000000000000000 5.290499780000000 0.000000000000000 c -0.461343575744006 0.000000000000000 5.198098939849819 Atomic positions (fractional): 1 Lu 0.50000000000000 0.75796418498839 0.25000000000000 174.967 2 Lu 0.50000000000000 0.24203581501161 0.75000000000000 174.967 3 Nb 0.00000000000000 0.28664283712975 0.25000000000000 92.906 4 Nb 0.00000000000000 0.71335716287025 0.75000000000000 92.906 5 O 0.24365538221490 0.55450671714999 0.52307275660332 15.999 6 O 0.25232909644692 0.06533722261538 0.41664211772387 15.999 7 O 0.74767090355308 0.06533722261538 0.08335788227613 15.999 8 O 0.75634461778510 0.55450671714999 0.97692724339668 15.999 9 O 0.24365538221490 0.44549328285001 0.02307275660332 15.999 10 O 0.25232909644692 0.93466277738462 0.91664211772387 15.999 11 O 0.74767090355308 0.93466277738462 0.58335788227613 15.999 12 O 0.75634461778510 0.44549328285001 0.47692724339668 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 15.105017490066585 0.000000000000000 0.000000000000000 b 0.000000000000000 10.580999560000000 0.000000000000000 c -0.922687151488012 0.000000000000000 10.396197879699638 Atomic positions (fractional): 1 Lu 0.16666666666667 0.37898209249419 0.12500000000000 174.967 > 1 2 Lu 0.50000000000000 0.37898209249419 0.12500000000000 174.967 > 1 3 Lu 0.83333333333333 0.37898209249419 0.12500000000000 174.967 > 1 4 Lu 0.16666666666667 0.87898209249419 0.12500000000000 174.967 > 1 5 Lu 0.50000000000000 0.87898209249419 0.12500000000000 174.967 > 1 6 Lu 0.83333333333333 0.87898209249419 0.12500000000000 174.967 > 1 7 Lu 0.16666666666667 0.37898209249419 0.62500000000000 174.967 > 1 8 Lu 0.50000000000000 0.37898209249419 0.62500000000000 174.967 > 1 9 Lu 0.83333333333333 0.37898209249419 0.62500000000000 174.967 > 1 10 Lu 0.16666666666667 0.87898209249419 0.62500000000000 174.967 > 1 11 Lu 0.50000000000000 0.87898209249419 0.62500000000000 174.967 > 1 12 Lu 0.83333333333333 0.87898209249419 0.62500000000000 174.967 > 1 13 Lu 0.16666666666667 0.12101790750581 0.37500000000000 174.967 > 13 14 Lu 0.50000000000000 0.12101790750581 0.37500000000000 174.967 > 13 15 Lu 0.83333333333333 0.12101790750581 0.37500000000000 174.967 > 13 16 Lu 0.16666666666667 0.62101790750581 0.37500000000000 174.967 > 13 17 Lu 0.50000000000000 0.62101790750581 0.37500000000000 174.967 > 13 18 Lu 0.83333333333333 0.62101790750581 0.37500000000000 174.967 > 13 19 Lu 0.16666666666667 0.12101790750581 0.87500000000000 174.967 > 13 20 Lu 0.50000000000000 0.12101790750581 0.87500000000000 174.967 > 13 21 Lu 0.83333333333333 0.12101790750581 0.87500000000000 174.967 > 13 22 Lu 0.16666666666667 0.62101790750581 0.87500000000000 174.967 > 13 23 Lu 0.50000000000000 0.62101790750581 0.87500000000000 174.967 > 13 24 Lu 0.83333333333333 0.62101790750581 0.87500000000000 174.967 > 13 25 Nb 0.00000000000000 0.14332141856488 0.12500000000000 92.906 > 25 26 Nb 0.33333333333333 0.14332141856488 0.12500000000000 92.906 > 25 27 Nb 0.66666666666667 0.14332141856488 0.12500000000000 92.906 > 25 28 Nb 0.00000000000000 0.64332141856488 0.12500000000000 92.906 > 25 29 Nb 0.33333333333333 0.64332141856488 0.12500000000000 92.906 > 25 30 Nb 0.66666666666667 0.64332141856488 0.12500000000000 92.906 > 25 31 Nb 0.00000000000000 0.14332141856488 0.62500000000000 92.906 > 25 32 Nb 0.33333333333333 0.14332141856488 0.62500000000000 92.906 > 25 33 Nb 0.66666666666667 0.14332141856488 0.62500000000000 92.906 > 25 34 Nb 0.00000000000000 0.64332141856488 0.62500000000000 92.906 > 25 35 Nb 0.33333333333333 0.64332141856488 0.62500000000000 92.906 > 25 36 Nb 0.66666666666667 0.64332141856488 0.62500000000000 92.906 > 25 37 Nb 0.00000000000000 0.35667858143512 0.37500000000000 92.906 > 37 38 Nb 0.33333333333333 0.35667858143512 0.37500000000000 92.906 > 37 39 Nb 0.66666666666667 0.35667858143512 0.37500000000000 92.906 > 37 40 Nb 0.00000000000000 0.85667858143512 0.37500000000000 92.906 > 37 41 Nb 0.33333333333333 0.85667858143512 0.37500000000000 92.906 > 37 42 Nb 0.66666666666667 0.85667858143512 0.37500000000000 92.906 > 37 43 Nb 0.00000000000000 0.35667858143512 0.87500000000000 92.906 > 37 44 Nb 0.33333333333333 0.35667858143512 0.87500000000000 92.906 > 37 45 Nb 0.66666666666667 0.35667858143512 0.87500000000000 92.906 > 37 46 Nb 0.00000000000000 0.85667858143512 0.87500000000000 92.906 > 37 47 Nb 0.33333333333333 0.85667858143512 0.87500000000000 92.906 > 37 48 Nb 0.66666666666667 0.85667858143512 0.87500000000000 92.906 > 37 49 O 0.08121846073830 0.27725335857499 0.26153637830166 15.999 > 49 50 O 0.41455179407163 0.27725335857499 0.26153637830166 15.999 > 49 51 O 0.74788512740497 0.27725335857499 0.26153637830166 15.999 > 49 52 O 0.08121846073830 0.77725335857499 0.26153637830166 15.999 > 49 53 O 0.41455179407163 0.77725335857499 0.26153637830166 15.999 > 49 54 O 0.74788512740497 0.77725335857499 0.26153637830166 15.999 > 49 55 O 0.08121846073830 0.27725335857499 0.76153637830166 15.999 > 49 56 O 0.41455179407163 0.27725335857499 0.76153637830166 15.999 > 49 57 O 0.74788512740497 0.27725335857499 0.76153637830166 15.999 > 49 58 O 0.08121846073830 0.77725335857499 0.76153637830166 15.999 > 49 59 O 0.41455179407163 0.77725335857499 0.76153637830166 15.999 > 49 60 O 0.74788512740497 0.77725335857499 0.76153637830166 15.999 > 49 61 O 0.08410969881564 0.03266861130769 0.20832105886193 15.999 > 61 62 O 0.41744303214897 0.03266861130769 0.20832105886193 15.999 > 61 63 O 0.75077636548231 0.03266861130769 0.20832105886193 15.999 > 61 64 O 0.08410969881564 0.53266861130769 0.20832105886193 15.999 > 61 65 O 0.41744303214897 0.53266861130769 0.20832105886193 15.999 > 61 66 O 0.75077636548231 0.53266861130769 0.20832105886193 15.999 > 61 67 O 0.08410969881564 0.03266861130769 0.70832105886193 15.999 > 61 68 O 0.41744303214897 0.03266861130769 0.70832105886193 15.999 > 61 69 O 0.75077636548231 0.03266861130769 0.70832105886193 15.999 > 61 70 O 0.08410969881564 0.53266861130769 0.70832105886193 15.999 > 61 71 O 0.41744303214897 0.53266861130769 0.70832105886193 15.999 > 61 72 O 0.75077636548231 0.53266861130769 0.70832105886193 15.999 > 61 73 O 0.24922363451769 0.03266861130769 0.04167894113807 15.999 > 73 74 O 0.58255696785103 0.03266861130769 0.04167894113807 15.999 > 73 75 O 0.91589030118436 0.03266861130769 0.04167894113807 15.999 > 73 76 O 0.24922363451769 0.53266861130769 0.04167894113807 15.999 > 73 77 O 0.58255696785103 0.53266861130769 0.04167894113807 15.999 > 73 78 O 0.91589030118436 0.53266861130769 0.04167894113807 15.999 > 73 79 O 0.24922363451769 0.03266861130769 0.54167894113807 15.999 > 73 80 O 0.58255696785103 0.03266861130769 0.54167894113807 15.999 > 73 81 O 0.91589030118436 0.03266861130769 0.54167894113807 15.999 > 73 82 O 0.24922363451769 0.53266861130769 0.54167894113807 15.999 > 73 83 O 0.58255696785103 0.53266861130769 0.54167894113807 15.999 > 73 84 O 0.91589030118436 0.53266861130769 0.54167894113807 15.999 > 73 85 O 0.25211487259503 0.27725335857499 0.48846362169834 15.999 > 85 86 O 0.58544820592837 0.27725335857499 0.48846362169834 15.999 > 85 87 O 0.91878153926170 0.27725335857499 0.48846362169834 15.999 > 85 88 O 0.25211487259503 0.77725335857499 0.48846362169834 15.999 > 85 89 O 0.58544820592837 0.77725335857499 0.48846362169834 15.999 > 85 90 O 0.91878153926170 0.77725335857499 0.48846362169834 15.999 > 85 91 O 0.25211487259503 0.27725335857499 0.98846362169834 15.999 > 85 92 O 0.58544820592837 0.27725335857499 0.98846362169834 15.999 > 85 93 O 0.91878153926170 0.27725335857499 0.98846362169834 15.999 > 85 94 O 0.25211487259503 0.77725335857499 0.98846362169834 15.999 > 85 95 O 0.58544820592837 0.77725335857499 0.98846362169834 15.999 > 85 96 O 0.91878153926170 0.77725335857499 0.98846362169834 15.999 > 85 97 O 0.08121846073830 0.22274664142501 0.01153637830166 15.999 > 97 98 O 0.41455179407163 0.22274664142501 0.01153637830166 15.999 > 97 99 O 0.74788512740497 0.22274664142501 0.01153637830166 15.999 > 97 100 O 0.08121846073830 0.72274664142501 0.01153637830166 15.999 > 97 101 O 0.41455179407163 0.72274664142501 0.01153637830166 15.999 > 97 102 O 0.74788512740497 0.72274664142501 0.01153637830166 15.999 > 97 103 O 0.08121846073830 0.22274664142501 0.51153637830166 15.999 > 97 104 O 0.41455179407163 0.22274664142501 0.51153637830166 15.999 > 97 105 O 0.74788512740497 0.22274664142501 0.51153637830166 15.999 > 97 106 O 0.08121846073830 0.72274664142501 0.51153637830166 15.999 > 97 107 O 0.41455179407163 0.72274664142501 0.51153637830166 15.999 > 97 108 O 0.74788512740497 0.72274664142501 0.51153637830166 15.999 > 97 109 O 0.08410969881564 0.46733138869231 0.45832105886193 15.999 > 109 110 O 0.41744303214897 0.46733138869231 0.45832105886193 15.999 > 109 111 O 0.75077636548231 0.46733138869231 0.45832105886193 15.999 > 109 112 O 0.08410969881564 0.96733138869231 0.45832105886193 15.999 > 109 113 O 0.41744303214897 0.96733138869231 0.45832105886193 15.999 > 109 114 O 0.75077636548231 0.96733138869231 0.45832105886193 15.999 > 109 115 O 0.08410969881564 0.46733138869231 0.95832105886193 15.999 > 109 116 O 0.41744303214897 0.46733138869231 0.95832105886193 15.999 > 109 117 O 0.75077636548231 0.46733138869231 0.95832105886193 15.999 > 109 118 O 0.08410969881564 0.96733138869231 0.95832105886193 15.999 > 109 119 O 0.41744303214897 0.96733138869231 0.95832105886193 15.999 > 109 120 O 0.75077636548231 0.96733138869231 0.95832105886193 15.999 > 109 121 O 0.24922363451769 0.46733138869231 0.29167894113807 15.999 > 121 122 O 0.58255696785103 0.46733138869231 0.29167894113807 15.999 > 121 123 O 0.91589030118436 0.46733138869231 0.29167894113807 15.999 > 121 124 O 0.24922363451769 0.96733138869231 0.29167894113807 15.999 > 121 125 O 0.58255696785103 0.96733138869231 0.29167894113807 15.999 > 121 126 O 0.91589030118436 0.96733138869231 0.29167894113807 15.999 > 121 127 O 0.24922363451769 0.46733138869231 0.79167894113807 15.999 > 121 128 O 0.58255696785103 0.46733138869231 0.79167894113807 15.999 > 121 129 O 0.91589030118436 0.46733138869231 0.79167894113807 15.999 > 121 130 O 0.24922363451769 0.96733138869231 0.79167894113807 15.999 > 121 131 O 0.58255696785103 0.96733138869231 0.79167894113807 15.999 > 121 132 O 0.91589030118436 0.96733138869231 0.79167894113807 15.999 > 121 133 O 0.25211487259503 0.22274664142501 0.23846362169834 15.999 > 133 134 O 0.58544820592837 0.22274664142501 0.23846362169834 15.999 > 133 135 O 0.91878153926170 0.22274664142501 0.23846362169834 15.999 > 133 136 O 0.25211487259503 0.72274664142501 0.23846362169834 15.999 > 133 137 O 0.58544820592837 0.72274664142501 0.23846362169834 15.999 > 133 138 O 0.91878153926170 0.72274664142501 0.23846362169834 15.999 > 133 139 O 0.25211487259503 0.22274664142501 0.73846362169834 15.999 > 133 140 O 0.58544820592837 0.22274664142501 0.73846362169834 15.999 > 133 141 O 0.91878153926170 0.22274664142501 0.73846362169834 15.999 > 133 142 O 0.25211487259503 0.72274664142501 0.73846362169834 15.999 > 133 143 O 0.58544820592837 0.72274664142501 0.73846362169834 15.999 > 133 144 O 0.91878153926170 0.72274664142501 0.73846362169834 15.999 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.3070247 0.0000000 0.1354283 0.0000000 5.1588420 0.0000000 0.1354268 0.0000000 5.0981216 -------------------------- Born effective charges -------------------------- 1 Lu 4.9449525 0.0000000 0.1494371 0.0000000 3.8585060 0.0000000 0.1601733 0.0000000 3.9498030 2 Lu 4.9449525 0.0000000 0.1494371 0.0000000 3.8585060 0.0000000 0.1601733 0.0000000 3.9498030 3 Nb 5.3567189 0.0000000 0.2224091 0.0000000 5.8809240 0.0000000 0.3431417 0.0000000 5.5846989 4 Nb 5.3567189 0.0000000 0.2224091 0.0000000 5.8809240 0.0000000 0.3431417 0.0000000 5.5846989 5 O -2.5553714 0.3303285 0.6067990 0.3115251 -2.2250770 -0.5527156 0.6407003 -0.4811825 -2.5478488 6 O -2.5954643 0.9778338 -0.7927221 1.1329433 -2.6446380 0.4000731 -0.8923578 0.3939145 -2.2194022 7 O -2.5954643 -0.9778338 -0.7927221 -1.1329433 -2.6446380 -0.4000731 -0.8923578 -0.3939145 -2.2194022 8 O -2.5553714 -0.3303285 0.6067990 -0.3115251 -2.2250770 0.5527156 0.6407003 0.4811825 -2.5478488 9 O -2.5553714 -0.3303285 0.6067990 -0.3115251 -2.2250770 0.5527156 0.6407003 0.4811825 -2.5478488 10 O -2.5954643 -0.9778338 -0.7927221 -1.1329433 -2.6446380 -0.4000731 -0.8923578 -0.3939145 -2.2194022 11 O -2.5954643 0.9778338 -0.7927221 1.1329433 -2.6446380 0.4000731 -0.8923578 0.3939145 -2.2194022 12 O -2.5553714 0.3303285 0.6067990 0.3115251 -2.2250770 -0.5527156 0.6407003 -0.4811825 -2.5478488 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000016 (yyy) -0.00000016 (yyy) -0.00000016 (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 9 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.80, Number of G-points: 293, Lambda: 0.19 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/260) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 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 3.416 ( 0.000 0.000 0.000) 0.000 3.491 ( 0.000 0.000 0.000) 0.000 3.687 ( 0.000 0.000 0.000) 0.000 4.084 ( 0.000 0.000 0.000) 0.000 4.498 ( 0.000 0.000 0.000) 0.000 4.797 ( 0.000 0.000 0.000) 0.000 5.092 ( 0.000 0.000 0.000) 0.000 5.181 ( 0.000 0.000 0.000) 0.000 5.645 ( 0.000 0.000 0.000) 0.000 5.932 ( 0.000 0.000 0.000) 0.000 6.622 ( 0.000 0.000 0.000) 0.000 6.763 ( 0.000 0.000 0.000) 0.000 7.662 ( 0.000 0.000 0.000) 0.000 8.596 ( 0.000 0.000 0.000) 0.000 9.051 ( 0.000 0.000 0.000) 0.000 9.311 ( 0.000 0.000 0.000) 0.000 9.588 ( 0.000 0.000 0.000) 0.000 11.438 ( 0.000 0.000 0.000) 0.000 11.590 ( 0.000 0.000 0.000) 0.000 11.755 ( 0.000 0.000 0.000) 0.000 12.046 ( 0.000 0.000 0.000) 0.000 12.886 ( 0.000 0.000 0.000) 0.000 14.048 ( 0.000 0.000 0.000) 0.000 14.170 ( 0.000 0.000 0.000) 0.000 16.290 ( 0.000 0.000 0.000) 0.000 16.915 ( 0.000 0.000 0.000) 0.000 18.139 ( 0.000 0.000 0.000) 0.000 19.734 ( 0.000 0.000 0.000) 0.000 19.875 ( 0.000 0.000 0.000) 0.000 20.100 ( 0.000 0.000 0.000) 0.000 21.114 ( 0.000 0.000 0.000) 0.000 22.997 ( 0.000 0.000 0.000) 0.000 23.630 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/260) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.463 ( 21.840 0.000 12.114) 24.974 0.555 ( 27.280 0.000 2.319) 27.378 1.318 ( 64.028 0.000 15.086) 65.782 3.430 ( 1.048 0.000 2.618) 2.820 3.519 ( 2.872 0.000 -3.537) 4.556 3.743 ( 5.285 0.000 2.345) 5.782 4.211 ( 10.628 0.000 -5.101) 11.789 4.452 ( -4.720 0.000 -1.208) 4.872 4.713 ( -6.648 0.000 -4.838) 8.222 5.145 ( 3.982 0.000 2.702) 4.812 5.190 ( 1.095 0.000 -3.044) 3.235 5.879 ( -5.172 0.000 4.309) 6.732 6.681 ( 5.616 0.000 -1.470) 5.805 6.758 ( -0.203 0.000 -2.285) 2.294 7.494 ( 0.787 0.000 -16.043) 16.062 7.868 ( 1.722 0.000 -34.925) 34.968 9.106 ( 5.593 0.000 -4.028) 6.893 9.255 ( -5.116 0.000 -2.083) 5.523 9.529 ( -5.471 0.000 0.711) 5.517 10.022 ( -11.887 0.000 115.638) 116.247 11.398 ( -3.537 0.000 0.718) 3.609 11.549 ( -4.866 0.000 18.220) 18.858 11.819 ( 5.842 0.000 -2.286) 6.273 12.122 ( 8.029 0.000 -13.441) 15.656 12.963 ( 7.694 0.000 -0.389) 7.704 14.011 ( -3.687 0.000 0.711) 3.755 14.179 ( 0.868 0.000 1.172) 1.458 16.240 ( -5.138 0.000 -0.094) 5.139 17.557 ( 14.500 0.000 -75.702) 77.078 18.193 ( 4.961 0.000 5.558) 7.450 19.741 ( -13.518 0.000 1.945) 13.658 20.041 ( -6.087 0.000 2.623) 6.628 20.965 ( -12.863 0.000 -7.481) 14.880 23.130 ( 11.697 0.000 2.680) 12.000 23.526 ( -9.691 0.000 1.957) 9.886 24.625 ( 3.659 0.000 41.880) 42.040 ======================= Grid point 2 (3/260) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.902 ( 20.125 0.000 10.823) 22.850 1.082 ( 25.201 0.000 2.165) 25.294 2.573 ( 58.905 0.000 15.216) 60.839 3.462 ( 1.487 0.000 3.852) 4.129 3.577 ( 3.359 0.000 -6.371) 7.202 3.892 ( 8.597 0.000 4.683) 9.790 4.299 ( -10.163 0.000 -3.009) 10.599 4.455 ( 8.134 0.000 -0.962) 8.190 4.584 ( 0.824 0.000 -8.251) 8.293 5.201 ( 0.196 0.000 -5.037) 5.041 5.232 ( 4.042 0.000 2.485) 4.745 5.781 ( -4.549 0.000 6.593) 8.010 6.753 ( 0.446 0.000 -3.899) 3.924 6.814 ( 7.291 0.000 -1.391) 7.422 7.461 ( -2.369 0.000 -6.143) 6.584 7.809 ( -3.416 0.000 -17.954) 18.276 9.119 ( -7.410 0.000 -4.400) 8.618 9.195 ( -0.295 0.000 -7.691) 7.697 9.452 ( 2.568 0.000 1.381) 2.916 9.979 ( -6.979 0.000 50.489) 50.969 11.314 ( -4.979 0.000 0.601) 5.015 11.488 ( -4.450 0.000 21.741) 22.192 11.945 ( 6.774 0.000 -3.155) 7.473 12.286 ( 10.448 0.000 -14.398) 17.789 13.183 ( 14.131 0.000 0.157) 14.131 13.911 ( -6.353 0.000 1.416) 6.509 14.212 ( 2.238 0.000 1.840) 2.897 16.084 ( -10.439 0.000 -0.068) 10.439 17.779 ( 17.601 0.000 -37.690) 41.598 18.354 ( 9.689 0.000 9.750) 13.745 19.368 ( -23.335 0.000 3.209) 23.555 19.872 ( -11.405 0.000 5.451) 12.641 20.644 ( -16.537 0.000 -11.952) 20.405 23.293 ( -13.162 0.000 1.111) 13.209 23.404 ( 14.034 0.000 3.210) 14.396 24.796 ( 7.449 0.000 18.040) 19.517 ======================= Grid point 3 (4/260) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 16.780 0.000 8.728) 18.914 1.551 ( 21.201 0.000 1.895) 21.286 3.498 ( 1.405 0.000 3.593) 3.858 3.576 ( 8.146 0.000 5.360) 9.751 3.706 ( 40.039 0.000 2.333) 40.107 4.032 ( -7.750 0.000 -1.253) 7.851 4.100 ( 3.107 0.000 2.999) 4.318 4.383 ( -4.207 0.000 -5.867) 7.220 4.856 ( 16.963 0.000 -2.368) 17.128 5.168 ( -2.466 0.000 -4.786) 5.384 5.314 ( 4.098 0.000 1.090) 4.240 5.749 ( 0.207 0.000 5.660) 5.664 6.761 ( 0.833 0.000 -4.429) 4.507 6.943 ( 5.498 0.000 -0.662) 5.538 7.372 ( -5.711 0.000 -2.716) 6.324 7.658 ( -9.150 0.000 -11.076) 14.366 8.968 ( -6.459 0.000 -5.386) 8.410 9.043 ( -10.098 0.000 -3.811) 10.793 9.666 ( 15.239 0.000 -4.019) 15.760 9.935 ( -4.110 0.000 26.901) 27.213 11.205 ( -6.003 0.000 0.732) 6.048 11.452 ( -2.713 0.000 17.362) 17.573 12.062 ( 5.260 0.000 -2.789) 5.954 12.471 ( 10.143 0.000 -10.956) 14.930 13.502 ( 17.049 0.000 1.240) 17.094 13.775 ( -7.311 0.000 1.910) 7.557 14.272 ( 3.471 0.000 1.370) 3.732 15.834 ( -14.335 0.000 0.175) 14.336 18.107 ( 20.553 0.000 -24.929) 32.309 18.583 ( 8.523 0.000 9.146) 12.502 18.906 ( -19.454 0.000 6.120) 20.394 19.616 ( -15.446 0.000 8.465) 17.614 20.286 ( -17.066 0.000 -13.832) 21.967 23.036 ( -12.128 0.000 -0.209) 12.130 23.663 ( 11.029 0.000 2.545) 11.318 24.963 ( 6.564 0.000 9.667) 11.685 ======================= Grid point 4 (5/260) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( 10.377 0.000 5.293) 11.649 1.908 ( 13.614 0.000 1.306) 13.677 3.526 ( 0.804 0.000 2.124) 2.271 3.553 ( -2.751 0.000 -3.434) 4.400 3.791 ( -10.455 0.000 -2.861) 10.840 4.238 ( 5.315 0.000 4.109) 6.718 4.244 ( 1.623 0.000 -0.007) 1.623 4.576 ( 26.480 0.000 5.827) 27.114 5.109 ( -2.165 0.000 -2.847) 3.577 5.138 ( 10.635 0.000 -2.987) 11.047 5.415 ( 6.426 0.000 1.269) 6.550 5.785 ( 1.855 0.000 2.909) 3.450 6.748 ( -2.154 0.000 -3.475) 4.089 7.022 ( 2.576 0.000 -0.208) 2.585 7.254 ( -4.089 0.000 -2.980) 5.059 7.434 ( -10.803 0.000 -4.017) 11.526 8.857 ( -7.141 0.000 -1.797) 7.364 8.859 ( -3.506 0.000 -3.716) 5.109 9.913 ( -1.621 0.000 12.293) 12.399 9.952 ( 12.562 0.000 -4.250) 13.262 11.089 ( -5.267 0.000 1.020) 5.365 11.438 ( -1.213 0.000 9.389) 9.467 12.140 ( 2.863 0.000 -1.518) 3.240 12.633 ( 7.055 0.000 -6.045) 9.290 13.645 ( -5.572 0.000 1.633) 5.807 13.817 ( 12.849 0.000 1.798) 12.974 14.348 ( 3.815 0.000 -0.109) 3.816 15.550 ( -12.915 0.000 0.400) 12.921 18.415 ( -14.510 0.000 0.434) 14.517 18.486 ( 20.795 0.000 -18.149) 27.601 18.972 ( 13.246 0.000 13.632) 19.008 19.299 ( -17.735 0.000 11.092) 20.919 19.930 ( -15.682 0.000 -13.114) 20.443 22.836 ( -7.357 0.000 -0.605) 7.382 23.837 ( 5.904 0.000 1.375) 6.062 25.079 ( 3.719 0.000 4.456) 5.804 ======================= Grid point 5 (6/260) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 0.000 0.000 -0.000) 0.000 2.053 ( 0.000 0.000 -0.000) 0.000 3.514 ( 0.000 0.000 0.000) 0.000 3.536 ( 0.000 0.000 0.000) 0.000 3.674 ( 0.000 0.000 0.000) 0.000 4.245 ( 0.000 0.000 0.000) 0.000 4.297 ( 0.000 0.000 0.000) 0.000 4.867 ( 0.000 0.000 -0.000) 0.000 5.084 ( 0.000 0.000 -0.000) 0.000 5.241 ( 0.000 0.000 0.000) 0.000 5.518 ( 0.000 0.000 -0.000) 0.000 5.809 ( 0.000 0.000 -0.000) 0.000 6.696 ( 0.000 0.000 -0.000) 0.000 7.047 ( 0.000 0.000 -0.000) 0.000 7.256 ( 0.000 0.000 -0.000) 0.000 7.267 ( -0.000 0.000 0.000) 0.000 8.781 ( 0.000 0.000 0.000) 0.000 8.820 ( 0.000 0.000 0.000) 0.000 9.909 ( 0.000 0.000 0.000) 0.000 10.085 ( 0.000 0.000 0.000) 0.000 11.030 ( 0.000 0.000 -0.000) 0.000 11.435 ( 0.000 0.000 -0.000) 0.000 12.167 ( 0.000 0.000 0.000) 0.000 12.703 ( 0.000 0.000 0.000) 0.000 13.586 ( 0.000 0.000 -0.000) 0.000 13.956 ( 0.000 0.000 -0.000) 0.000 14.397 ( 0.000 0.000 -0.000) 0.000 15.402 ( 0.000 0.000 -0.000) 0.000 18.260 ( 0.000 0.000 0.000) 0.000 18.776 ( -0.000 0.000 0.000) 0.000 19.035 ( 0.000 0.000 -0.000) 0.000 19.171 ( 0.000 0.000 -0.000) 0.000 19.713 ( 0.000 0.000 0.000) 0.000 22.760 ( 0.000 0.000 0.000) 0.000 23.897 ( 0.000 0.000 -0.000) 0.000 25.121 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/260) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.501 ( 0.000 23.979 0.000) 23.979 0.624 ( 0.000 29.234 0.000) 29.234 1.104 ( 0.000 51.636 0.000) 51.636 3.387 ( 0.000 -2.930 0.000) 2.930 3.501 ( 0.000 0.847 0.000) 0.847 3.547 ( 0.000 -11.254 0.000) 11.254 4.164 ( 0.000 6.318 0.000) 6.318 4.490 ( 0.000 -3.411 0.000) 3.411 4.763 ( 0.000 -2.632 0.000) 2.632 5.255 ( 0.000 13.970 0.000) 13.970 5.294 ( 0.000 8.087 0.000) 8.087 5.631 ( 0.000 -0.258 0.000) 0.258 6.155 ( 0.000 20.060 0.000) 20.060 6.943 ( 0.000 16.208 0.000) 16.208 7.724 ( 0.000 5.889 0.000) 5.889 7.905 ( 0.000 -1.841 0.000) 1.841 8.649 ( 0.000 4.943 0.000) 4.943 8.880 ( 0.000 -12.653 0.000) 12.653 9.391 ( 0.000 3.711 0.000) 3.711 9.613 ( 0.000 2.668 0.000) 2.668 11.416 ( 0.000 -2.525 0.000) 2.525 11.591 ( 0.000 0.550 0.000) 0.550 11.878 ( 0.000 -14.089 0.000) 14.089 12.968 ( 0.000 6.313 0.000) 6.313 13.742 ( 0.000 -10.372 0.000) 10.372 14.135 ( 0.000 -3.191 0.000) 3.191 14.313 ( 0.000 14.463 0.000) 14.463 16.309 ( 0.000 -15.423 0.000) 15.423 16.897 ( 0.000 -1.696 0.000) 1.696 19.684 ( 0.000 -3.970 0.000) 3.970 19.901 ( 0.000 1.771 0.000) 1.771 20.155 ( 0.000 4.996 0.000) 4.996 21.105 ( 0.000 -0.893 0.000) 0.893 21.484 ( 0.000 -3.379 0.000) 3.379 23.652 ( 0.000 1.979 0.000) 1.979 24.132 ( 0.000 -0.451 0.000) 0.451 ======================= Grid point 12 (8/260) ======================= q-point: ( 0.10 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( 16.431 19.815 4.395) 26.113 0.916 ( 19.817 23.220 0.181) 30.527 1.634 ( 45.825 28.833 12.402) 55.544 3.402 ( 0.910 -2.715 2.296) 3.670 3.522 ( 2.341 -0.204 -3.945) 4.592 3.622 ( 6.860 -9.785 2.478) 12.204 4.257 ( 8.597 4.287 -2.184) 9.852 4.438 ( -4.340 -1.540 0.163) 4.608 4.707 ( -4.856 -0.784 -4.675) 6.786 5.250 ( 0.063 8.464 0.136) 8.465 5.328 ( 2.767 12.053 -1.924) 12.515 6.098 ( -1.057 17.005 5.421) 17.879 6.250 ( 28.859 -17.330 1.550) 33.698 6.939 ( -0.159 16.309 -2.153) 16.451 7.697 ( -2.639 11.465 -1.456) 11.854 7.827 ( -1.664 -2.981 -25.224) 25.454 8.938 ( 5.827 -11.271 -4.535) 13.474 9.127 ( 24.668 -19.682 42.644) 53.051 9.365 ( -0.700 1.544 6.003) 6.238 9.567 ( -3.686 2.969 0.329) 4.744 11.432 ( 0.117 -1.463 -1.956) 2.445 11.490 ( -7.450 0.004 3.305) 8.150 11.954 ( 5.790 -13.284 2.144) 14.648 13.010 ( -1.184 11.089 -8.630) 14.101 13.160 ( -33.475 32.598 19.160) 50.500 14.080 ( -6.162 5.064 -5.570) 9.728 14.187 ( -0.359 5.157 6.471) 8.282 16.158 ( -9.104 -10.284 1.054) 13.776 17.204 ( 21.891 -14.635 -26.651) 37.465 18.795 ( -28.292 28.244 -22.438) 45.844 19.742 ( -14.230 0.529 2.372) 14.436 20.111 ( -4.822 6.061 0.661) 7.773 20.952 ( -13.207 -1.169 -7.349) 15.159 22.545 ( 40.575 -35.992 19.555) 57.655 23.609 ( -4.716 3.879 -1.374) 6.259 24.322 ( 13.007 -11.832 17.983) 25.151 ======================= Grid point 13 (9/260) ======================= q-point: ( 0.20 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( 19.351 16.452 6.216) 26.149 1.333 ( 21.765 18.924 0.090) 28.842 2.657 ( 50.739 8.758 13.835) 53.316 3.428 ( 1.183 -2.911 2.651) 4.111 3.563 ( 2.167 -1.377 -5.560) 6.125 3.810 ( 10.966 -7.127 4.768) 13.921 4.305 ( -8.369 -0.325 1.290) 8.475 4.463 ( 7.743 1.754 0.002) 7.939 4.593 ( -1.805 0.902 -9.518) 9.730 5.252 ( 0.209 5.402 -2.864) 6.118 5.388 ( 3.481 13.068 -1.722) 13.633 6.047 ( -2.352 23.087 7.544) 24.402 6.674 ( 14.605 -10.237 -0.952) 17.861 6.933 ( 0.212 16.159 -3.618) 16.561 7.616 ( -4.853 11.467 -4.477) 13.232 7.757 ( -2.872 -3.924 -13.432) 14.285 9.027 ( 1.192 -6.337 -7.242) 9.697 9.235 ( -4.241 1.459 -3.460) 5.665 9.454 ( 1.740 -1.278 3.460) 4.079 9.708 ( 12.024 -12.027 35.177) 39.073 11.285 ( -9.288 -0.079 5.430) 10.759 11.469 ( -0.038 -0.321 -1.961) 1.987 12.080 ( 5.763 -10.803 7.804) 14.520 12.622 ( -11.443 34.260 -5.259) 36.501 13.232 ( 12.062 3.947 1.904) 12.834 13.948 ( -6.444 3.836 -3.127) 8.125 14.218 ( 1.752 1.382 4.872) 5.359 15.958 ( -11.625 -12.005 0.000) 16.711 17.585 ( 21.379 -12.702 -22.492) 33.530 18.557 ( 0.581 13.265 -3.759) 13.799 19.360 ( -23.573 -0.045 3.691) 23.860 19.964 ( -10.314 7.890 3.929) 13.567 20.622 ( -17.076 -2.086 -11.800) 20.861 23.017 ( 7.225 -18.809 8.122) 21.725 23.544 ( 2.318 6.467 -0.669) 6.903 24.587 ( 10.234 -15.181 13.928) 23.004 ======================= Grid point 14 (10/260) ======================= q-point: ( 0.30 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 17.201 15.976 5.727) 24.165 1.757 ( 20.226 16.237 0.330) 25.939 3.443 ( 2.817 -5.403 -0.210) 6.097 3.552 ( 9.983 -2.720 7.355) 12.694 3.608 ( 22.225 -4.753 0.519) 22.734 4.060 ( 13.401 -1.933 6.221) 14.900 4.126 ( -7.169 4.138 2.377) 8.612 4.408 ( -4.590 2.043 -3.894) 6.357 4.755 ( 10.898 -5.842 -5.940) 13.717 5.256 ( 1.298 7.590 -2.460) 8.084 5.459 ( 4.034 12.906 -2.416) 13.736 6.056 ( 1.889 25.526 6.451) 26.397 6.860 ( 3.132 -1.147 -3.006) 4.490 6.957 ( 4.563 11.694 -1.901) 12.695 7.492 ( -6.733 9.080 -3.466) 11.823 7.643 ( -6.870 -0.236 -7.606) 10.252 8.949 ( -5.622 -1.953 -5.236) 7.927 9.081 ( -9.275 3.366 -3.712) 10.542 9.646 ( 14.877 -1.840 -2.768) 15.243 9.912 ( 3.912 -0.613 23.386) 23.719 11.152 ( -4.957 -2.838 6.021) 8.299 11.431 ( -3.519 0.698 0.245) 3.596 12.208 ( 5.482 -3.768 9.406) 11.521 12.524 ( 0.503 14.591 -10.957) 18.254 13.518 ( 15.593 1.358 1.534) 15.727 13.816 ( -6.102 4.018 -1.422) 7.443 14.267 ( 2.381 -0.137 3.283) 4.058 15.693 ( -14.756 -12.914 0.155) 19.609 17.979 ( 21.600 -9.936 -18.938) 30.396 18.664 ( 6.242 5.334 2.749) 8.659 18.896 ( -19.755 0.058 6.280) 20.729 19.723 ( -14.673 9.420 7.603) 19.022 20.256 ( -17.259 -2.876 -13.879) 22.333 22.968 ( -8.215 -6.022 1.711) 10.328 23.710 ( 10.616 3.533 1.507) 11.289 24.777 ( 6.936 -15.842 8.626) 19.326 ======================= Grid point 15 (11/260) ======================= q-point: ( 0.40 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( 10.941 16.632 3.681) 20.246 2.106 ( 13.713 15.730 0.613) 20.878 3.458 ( 0.662 -6.034 -4.932) 7.821 3.538 ( -1.964 -1.946 0.869) 2.898 3.762 ( -7.727 -3.442 2.105) 8.717 4.191 ( 7.133 -2.521 4.668) 8.889 4.240 ( -1.351 0.007 0.886) 1.616 4.575 ( 21.568 -0.406 4.561) 22.048 4.894 ( 3.784 -11.364 -4.293) 12.724 5.302 ( 2.856 10.431 -0.945) 10.856 5.547 ( 5.256 12.051 -1.629) 13.248 6.125 ( 3.477 27.140 3.162) 27.544 6.824 ( -4.139 3.771 -3.472) 6.589 7.079 ( 6.223 7.684 0.700) 9.912 7.358 ( -5.123 8.552 -4.295) 10.855 7.472 ( -8.763 4.239 -2.097) 9.958 8.842 ( -3.708 -1.689 -2.862) 4.980 8.908 ( -6.665 4.491 -2.378) 8.381 9.915 ( 8.392 0.384 3.820) 9.228 9.998 ( 4.894 4.706 3.628) 7.698 11.099 ( -1.791 -0.125 4.782) 5.108 11.349 ( -4.091 -3.379 0.618) 5.341 12.318 ( 3.776 6.964 6.606) 10.315 12.540 ( 2.032 -3.686 -8.299) 9.306 13.700 ( -3.302 5.710 -0.977) 6.668 13.826 ( 11.802 0.216 2.453) 12.056 14.321 ( 2.697 -2.105 0.742) 3.501 15.403 ( -13.206 -13.406 0.346) 18.821 18.275 ( 2.896 -7.017 -11.363) 13.666 18.560 ( 3.587 -2.179 -3.052) 5.189 18.945 ( 9.454 2.781 11.352) 15.033 19.435 ( -14.156 10.464 9.135) 19.833 19.899 ( -15.645 -2.958 -13.031) 20.575 22.812 ( -6.323 -1.914 -0.053) 6.607 23.889 ( 6.417 4.288 1.026) 7.786 24.893 ( 3.547 -16.871 4.188) 17.741 ======================= Grid point 16 (12/260) ======================= q-point: (-0.50 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( 0.000 17.109 0.000) 17.109 2.253 ( 0.000 15.994 0.000) 15.994 3.470 ( -0.000 -4.127 0.000) 4.127 3.504 ( 0.000 -5.144 -0.000) 5.144 3.663 ( 0.000 0.176 0.000) 0.176 4.215 ( 0.000 -1.929 0.000) 1.929 4.271 ( 0.000 -1.478 -0.000) 1.478 4.836 ( 0.000 -2.994 0.000) 2.994 4.913 ( 0.000 -13.201 0.000) 13.201 5.331 ( 0.000 10.300 -0.000) 10.300 5.619 ( 0.000 10.088 0.000) 10.088 6.169 ( 0.000 27.964 0.000) 27.964 6.758 ( 0.000 4.052 0.000) 4.052 7.163 ( 0.000 9.462 -0.000) 9.462 7.317 ( 0.000 7.368 -0.000) 7.368 7.338 ( -0.000 6.336 0.000) 6.336 8.804 ( 0.000 -1.983 0.000) 1.983 8.834 ( 0.000 4.987 0.000) 4.987 9.968 ( 0.000 5.905 0.000) 5.905 10.094 ( 0.000 1.071 -0.000) 1.071 11.086 ( 0.000 4.745 -0.000) 4.745 11.302 ( 0.000 -8.358 0.000) 8.358 12.364 ( 0.000 13.940 0.000) 13.940 12.556 ( 0.000 -13.317 0.000) 13.317 13.661 ( 0.000 7.101 0.000) 7.101 13.961 ( 0.000 0.090 0.000) 0.090 14.358 ( 0.000 -3.172 -0.000) 3.172 15.251 ( 0.000 -13.825 -0.000) 13.825 18.211 ( 0.000 -2.074 0.000) 2.074 18.747 ( 0.000 -18.018 -0.000) 18.018 19.003 ( 0.000 18.228 -0.000) 18.228 19.326 ( 0.000 5.821 -0.000) 5.821 19.680 ( 0.000 -2.897 0.000) 2.897 22.745 ( 0.000 -0.939 -0.000) 0.939 23.955 ( 0.000 4.913 -0.000) 4.913 24.932 ( 0.000 -17.389 0.000) 17.389 ======================= Grid point 22 (13/260) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( 0.000 23.797 0.000) 23.797 1.218 ( 0.000 27.106 0.000) 27.106 2.142 ( 0.000 46.438 0.000) 46.438 3.237 ( 0.000 -14.067 0.000) 14.067 3.315 ( 0.000 -7.802 0.000) 7.802 3.522 ( 0.000 1.029 0.000) 1.029 4.311 ( 0.000 6.779 0.000) 6.779 4.416 ( 0.000 -3.700 0.000) 3.700 4.716 ( 0.000 -0.936 0.000) 0.936 5.430 ( 0.000 4.331 0.000) 4.331 5.623 ( 0.000 20.210 0.000) 20.210 5.641 ( 0.000 0.605 0.000) 0.605 6.705 ( 0.000 29.557 0.000) 29.557 7.361 ( 0.000 20.371 0.000) 20.371 7.851 ( 0.000 -2.284 0.000) 2.284 7.912 ( 0.000 12.317 0.000) 12.317 8.604 ( 0.000 -12.931 0.000) 12.931 8.786 ( 0.000 7.393 0.000) 7.393 9.405 ( 0.000 -2.566 0.000) 2.566 9.724 ( 0.000 8.522 0.000) 8.522 11.266 ( 0.000 -14.735 0.000) 14.735 11.567 ( 0.000 -12.012 0.000) 12.012 11.649 ( 0.000 6.176 0.000) 6.176 13.097 ( 0.000 5.330 0.000) 5.330 13.561 ( 0.000 -7.132 0.000) 7.132 14.044 ( 0.000 -5.138 0.000) 5.138 14.596 ( 0.000 11.863 0.000) 11.863 15.872 ( 0.000 -24.783 0.000) 24.783 16.850 ( 0.000 -2.576 0.000) 2.576 19.591 ( 0.000 -4.563 0.000) 4.563 19.933 ( 0.000 1.168 0.000) 1.168 20.289 ( 0.000 7.202 0.000) 7.202 21.080 ( 0.000 -1.367 0.000) 1.367 21.389 ( 0.000 -5.314 0.000) 5.314 23.706 ( 0.000 2.993 0.000) 2.993 24.118 ( 0.000 -0.899 0.000) 0.899 ======================= Grid point 23 (14/260) ======================= q-point: ( 0.10 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.170 ( 14.163 22.479 0.087) 26.569 1.395 ( 14.872 22.433 0.962) 26.932 2.372 ( 22.085 37.508 6.716) 44.042 3.294 ( 3.774 -9.505 -0.798) 10.258 3.369 ( 6.224 -10.577 3.761) 12.836 3.534 ( 1.376 -0.054 -2.743) 3.069 4.354 ( 0.537 2.054 -1.274) 2.476 4.404 ( 2.335 0.509 1.898) 3.052 4.694 ( -2.266 0.284 -3.444) 4.132 5.419 ( -1.222 6.791 -3.510) 7.742 5.667 ( 3.502 19.436 1.154) 19.783 5.946 ( 25.460 -8.468 2.398) 26.938 6.674 ( -2.735 29.419 5.219) 30.003 7.362 ( 0.106 20.884 -1.394) 20.931 7.746 ( -4.865 -3.383 -12.675) 13.991 7.962 ( 0.019 14.275 3.507) 14.700 8.697 ( 9.391 -11.189 -4.712) 15.348 8.977 ( 14.504 0.169 19.268) 24.117 9.370 ( -2.880 -2.393 0.817) 3.833 9.696 ( -2.043 9.893 -0.340) 10.108 11.297 ( 2.921 -14.130 -4.063) 14.990 11.519 ( -5.228 1.016 6.654) 8.523 11.689 ( 4.387 -5.857 -3.827) 8.258 13.138 ( 3.818 4.238 -2.603) 6.270 13.415 ( -13.399 0.258 9.607) 16.489 14.050 ( 0.146 -4.184 -2.443) 4.847 14.490 ( -8.648 15.502 3.434) 18.080 15.792 ( -7.422 -22.823 0.168) 24.000 17.007 ( 15.181 -5.787 -10.013) 19.085 19.148 ( -26.663 7.804 -15.399) 31.764 19.777 ( -14.260 2.765 1.415) 14.594 20.263 ( -2.822 7.664 -2.583) 8.566 20.919 ( -14.226 -1.821 -6.519) 15.754 21.955 ( 37.138 -20.774 18.803) 46.523 23.682 ( -2.222 3.327 -1.495) 4.271 24.183 ( 5.514 -3.632 5.939) 8.881 ======================= Grid point 24 (15/260) ======================= q-point: ( 0.20 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 18.618 21.549 2.241) 28.566 1.727 ( 18.061 17.479 -1.598) 25.185 2.941 ( 29.719 16.678 9.696) 35.432 3.345 ( 1.959 -5.427 1.411) 5.940 3.513 ( 2.306 -3.595 -4.961) 6.546 3.630 ( 12.914 -8.646 5.746) 16.570 4.284 ( -5.280 -0.922 4.602) 7.064 4.535 ( 6.397 4.046 -1.096) 7.648 4.613 ( -3.628 1.304 -7.489) 8.423 5.405 ( 1.336 8.506 -5.402) 10.165 5.743 ( 3.768 19.961 0.050) 20.314 6.422 ( 18.905 -8.833 -0.304) 20.869 6.656 ( 0.910 27.364 8.152) 28.567 7.354 ( -0.705 21.139 -2.982) 21.359 7.646 ( -2.653 -4.335 -12.353) 13.357 7.916 ( -4.937 15.894 4.996) 17.377 8.880 ( 6.835 -7.720 -7.595) 12.806 9.216 ( 2.085 -2.690 6.936) 7.726 9.376 ( 5.563 -3.684 4.915) 8.288 9.729 ( 7.807 10.759 9.969) 16.615 11.303 ( -4.954 -3.730 5.042) 7.992 11.439 ( -0.101 0.014 -9.295) 9.296 11.802 ( 6.715 -11.104 3.378) 13.410 13.070 ( -12.901 7.207 1.889) 14.898 13.324 ( 7.067 4.559 6.009) 10.336 14.018 ( -2.708 0.424 -6.861) 7.388 14.353 ( -5.078 12.145 6.917) 14.871 15.598 ( -11.829 -21.110 -0.134) 24.198 17.358 ( 21.071 -8.416 -12.937) 26.119 18.777 ( -8.239 6.802 -7.900) 13.288 19.400 ( -22.863 4.395 1.925) 23.361 20.159 ( -7.399 9.572 -0.360) 12.104 20.561 ( -18.976 -3.456 -9.588) 21.540 22.580 ( 20.493 -21.445 13.567) 32.618 23.648 ( 0.866 3.554 -1.922) 4.132 24.318 ( 5.899 -9.259 6.944) 12.990 ======================= Grid point 25 (16/260) ======================= q-point: ( 0.30 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( 18.095 21.647 2.609) 28.334 2.093 ( 18.549 13.961 -2.358) 23.335 3.316 ( 2.322 -5.986 0.488) 6.439 3.460 ( 3.703 -5.146 4.038) 7.517 3.547 ( 9.982 -2.254 0.067) 10.234 3.954 ( 13.552 -7.680 7.602) 17.333 4.234 ( 3.329 6.238 6.977) 9.934 4.461 ( -6.669 3.087 0.738) 7.386 4.680 ( 5.160 -1.412 -11.064) 12.289 5.464 ( 5.199 11.459 -4.472) 13.354 5.816 ( 3.817 20.314 -1.424) 20.719 6.638 ( 5.453 17.473 1.426) 18.360 6.770 ( 6.528 4.006 3.391) 8.376 7.328 ( -0.734 17.782 -3.337) 18.107 7.598 ( -0.777 2.362 -9.688) 10.002 7.799 ( -7.419 15.552 6.026) 18.254 8.870 ( -4.862 -6.103 -4.361) 8.939 9.159 ( -6.307 3.307 -0.565) 7.143 9.607 ( 16.935 -1.256 -3.262) 17.292 9.982 ( 11.435 8.485 16.283) 21.631 11.171 ( -6.988 4.410 7.632) 11.248 11.432 ( -0.712 -3.044 -12.845) 13.220 11.957 ( 7.882 -12.913 6.013) 16.280 12.836 ( -10.224 8.409 2.597) 13.490 13.542 ( 12.861 0.704 2.937) 13.211 13.934 ( -3.664 5.417 -7.993) 10.327 14.306 ( -1.613 5.107 7.665) 9.351 15.329 ( -14.903 -20.297 -0.225) 25.182 17.763 ( 21.218 -9.585 -13.355) 26.841 18.721 ( -2.104 -0.300 0.923) 2.317 18.966 ( -15.294 7.037 1.083) 16.870 19.969 ( -11.886 12.623 3.671) 17.722 20.167 ( -18.401 -5.126 -11.025) 22.055 22.801 ( 1.738 -9.773 5.871) 11.533 23.760 ( 9.930 -0.054 -0.109) 9.930 24.418 ( 2.790 -15.193 5.394) 16.362 ======================= Grid point 26 (17/260) ======================= q-point: ( 0.40 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 12.258 22.743 1.800) 25.899 2.424 ( 14.023 12.396 -1.438) 18.772 3.310 ( -0.608 -7.894 -5.918) 9.885 3.421 ( -4.500 -8.434 5.150) 10.859 3.686 ( 0.567 -2.735 2.210) 3.562 4.122 ( 6.463 -5.166 1.689) 8.444 4.282 ( -4.941 3.725 8.063) 10.164 4.558 ( 14.183 -0.838 3.155) 14.554 4.719 ( 1.121 -4.514 -8.017) 9.268 5.562 ( 4.170 13.517 -2.699) 14.401 5.890 ( 3.673 19.765 -1.377) 20.150 6.740 ( 4.387 17.857 -1.687) 18.466 6.830 ( -0.021 8.087 2.534) 8.475 7.339 ( 2.052 12.470 -0.942) 12.673 7.550 ( -3.099 8.776 -5.286) 10.703 7.674 ( -4.963 17.652 3.506) 18.669 8.757 ( -4.619 -7.069 -2.413) 8.783 9.032 ( -5.287 6.533 -0.860) 8.448 9.945 ( 15.506 2.553 -2.504) 15.913 10.166 ( 4.243 11.811 7.864) 14.810 11.104 ( -0.611 2.300 9.136) 9.441 11.343 ( -5.937 -0.465 -10.867) 12.391 12.121 ( 7.112 -14.910 4.251) 17.058 12.671 ( -6.771 5.841 0.640) 8.965 13.804 ( 11.464 -2.101 2.815) 11.990 13.868 ( -1.429 7.826 -5.449) 9.643 14.303 ( 0.263 1.865 4.352) 4.742 15.030 ( -14.060 -20.612 -0.310) 24.952 18.109 ( 14.489 -9.403 -13.463) 21.900 18.482 ( -13.451 -1.235 6.123) 14.831 19.039 ( 13.714 3.027 4.088) 14.627 19.709 ( -14.802 12.474 0.224) 19.358 19.814 ( -14.176 -1.963 -5.898) 15.479 22.774 ( -2.860 -1.468 1.452) 3.527 23.969 ( 9.300 1.274 0.384) 9.395 24.446 ( -0.422 -22.438 3.076) 22.652 ======================= Grid point 27 (18/260) ======================= q-point: (-0.50 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( 0.000 23.579 0.000) 23.579 2.579 ( 0.000 12.652 0.000) 12.652 3.306 ( -0.000 -12.099 0.000) 12.099 3.352 ( 0.000 -6.701 -0.000) 6.701 3.680 ( 0.000 0.566 -0.000) 0.566 4.174 ( 0.000 -2.505 0.000) 2.505 4.262 ( 0.000 0.168 -0.000) 0.168 4.680 ( 0.000 -7.280 0.000) 7.280 4.757 ( 0.000 -3.793 0.000) 3.793 5.600 ( 0.000 14.151 -0.000) 14.151 5.933 ( -0.000 18.832 0.000) 18.832 6.767 ( 0.000 2.422 0.000) 2.422 6.845 ( 0.000 27.405 -0.000) 27.405 7.366 ( 0.000 8.637 -0.000) 8.637 7.500 ( 0.000 8.165 0.000) 8.165 7.627 ( 0.000 22.484 -0.000) 22.484 8.706 ( 0.000 -8.080 -0.000) 8.080 8.975 ( 0.000 7.685 0.000) 7.685 10.141 ( 0.000 3.440 -0.000) 3.440 10.180 ( -0.000 14.893 0.000) 14.893 11.165 ( -0.000 -0.192 -0.000) 0.192 11.209 ( 0.000 1.060 0.000) 1.060 12.210 ( 0.000 -16.836 0.000) 16.836 12.593 ( 0.000 5.673 0.000) 5.673 13.845 ( 0.000 7.752 0.000) 7.752 13.943 ( 0.000 -2.089 0.000) 2.089 14.321 ( 0.000 2.213 -0.000) 2.213 14.859 ( 0.000 -22.334 -0.000) 22.334 18.230 ( 0.000 4.053 0.000) 4.053 18.368 ( 0.000 -16.868 -0.000) 16.868 19.366 ( -0.000 -1.780 -0.000) 1.780 19.377 ( 0.000 9.372 0.000) 9.372 19.661 ( 0.000 7.824 -0.000) 7.824 22.742 ( 0.000 0.875 -0.000) 0.875 24.073 ( 0.000 5.698 0.000) 5.698 24.436 ( 0.000 -28.308 0.000) 28.308 ======================= Grid point 33 (19/260) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 0.000 22.487 0.000) 22.487 1.748 ( 0.000 22.904 0.000) 22.904 2.893 ( 0.000 -17.643 0.000) 17.643 3.018 ( 0.000 35.970 0.000) 35.970 3.135 ( 0.000 -9.960 0.000) 9.960 3.542 ( 0.000 0.987 0.000) 0.987 4.324 ( 0.000 -5.473 0.000) 5.473 4.404 ( 0.000 1.660 0.000) 1.660 4.759 ( 0.000 4.959 0.000) 4.959 5.490 ( 0.000 1.789 0.000) 1.789 5.632 ( 0.000 -1.609 0.000) 1.609 6.066 ( 0.000 20.669 0.000) 20.669 7.262 ( 0.000 20.891 0.000) 20.891 7.571 ( 0.000 -1.818 0.000) 1.818 7.955 ( 0.000 12.644 0.000) 12.644 8.242 ( 0.000 17.523 0.000) 17.523 8.349 ( 0.000 -11.302 0.000) 11.302 8.959 ( 0.000 10.719 0.000) 10.719 9.300 ( 0.000 -6.415 0.000) 6.415 9.970 ( 0.000 13.368 0.000) 13.368 10.811 ( 0.000 -25.131 0.000) 25.131 11.379 ( 0.000 -8.280 0.000) 8.280 11.889 ( 0.000 16.860 0.000) 16.860 13.182 ( 0.000 2.736 0.000) 2.736 13.410 ( 0.000 -8.314 0.000) 8.314 13.936 ( 0.000 -4.786 0.000) 4.786 14.773 ( 0.000 3.288 0.000) 3.288 15.361 ( 0.000 -20.438 0.000) 20.438 16.797 ( 0.000 -2.233 0.000) 2.233 19.504 ( 0.000 -3.502 0.000) 3.502 19.950 ( 0.000 0.488 0.000) 0.488 20.437 ( 0.000 6.408 0.000) 6.408 21.052 ( 0.000 -1.201 0.000) 1.201 21.275 ( 0.000 -5.148 0.000) 5.148 23.769 ( 0.000 2.748 0.000) 2.748 24.096 ( 0.000 -1.118 0.000) 1.118 ======================= Grid point 34 (20/260) ======================= q-point: ( 0.10 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( 13.195 21.550 -2.055) 25.353 1.848 ( 8.793 20.037 1.779) 21.953 2.970 ( 7.754 -10.527 -1.136) 13.124 3.108 ( 5.906 14.033 1.032) 15.260 3.200 ( 8.113 1.117 6.572) 10.501 3.537 ( -0.399 0.441 -3.004) 3.063 4.304 ( -1.949 -4.133 5.435) 7.101 4.461 ( 5.746 1.716 -6.676) 8.974 4.747 ( -1.767 4.599 0.694) 4.976 5.530 ( 2.233 3.921 -3.790) 5.893 5.798 ( 16.752 -6.074 1.755) 17.905 6.107 ( 3.837 20.758 0.797) 21.125 7.229 ( -2.981 20.934 4.615) 21.643 7.568 ( 0.105 -2.823 -3.351) 4.383 7.824 ( -7.637 11.690 -5.781) 15.113 8.307 ( 1.903 10.575 8.587) 13.754 8.517 ( 13.811 0.788 -2.789) 14.112 9.031 ( 6.337 5.472 7.755) 11.412 9.277 ( -1.526 -5.454 -0.344) 5.674 9.974 ( 0.746 14.712 1.029) 14.767 10.847 ( 3.831 -25.368 -4.872) 26.114 11.433 ( 4.843 -6.998 3.358) 9.149 11.850 ( -3.517 16.709 -3.008) 17.338 13.174 ( -1.859 -1.731 -3.606) 4.410 13.373 ( -2.544 -2.617 7.820) 8.629 13.952 ( 1.276 -4.797 0.244) 4.970 14.715 ( -5.690 4.301 1.810) 7.358 15.312 ( -4.825 -19.007 -0.210) 19.611 16.919 ( 12.197 -2.997 -5.713) 13.798 19.222 ( -20.670 0.870 -9.199) 22.642 19.842 ( -10.710 2.975 0.054) 11.116 20.409 ( -2.546 5.794 -5.496) 8.382 20.883 ( -15.311 -1.440 -4.040) 15.900 21.620 ( 26.442 -11.862 14.695) 32.493 23.747 ( -1.970 2.677 -1.334) 3.581 24.129 ( 2.743 -1.876 2.633) 4.239 ======================= Grid point 35 (21/260) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.955 ( 18.260 20.518 -0.790) 27.478 2.064 ( 12.424 14.637 0.232) 19.200 3.169 ( 4.762 -10.555 -1.583) 11.687 3.188 ( 9.459 -0.486 3.881) 10.236 3.448 ( 6.418 1.413 -0.022) 6.572 3.541 ( 6.856 1.263 5.128) 8.655 4.291 ( 0.476 1.774 6.031) 6.305 4.580 ( 6.883 0.454 -10.854) 12.860 4.678 ( -5.659 4.207 4.185) 8.200 5.586 ( 5.156 8.457 -6.287) 11.731 6.154 ( 11.492 4.162 -1.850) 12.362 6.229 ( 12.286 5.839 1.729) 13.712 7.193 ( -1.098 20.096 6.681) 21.206 7.568 ( 0.465 -2.983 -6.832) 7.469 7.701 ( -3.545 10.817 -1.442) 11.474 8.322 ( -2.114 17.783 9.943) 20.483 8.738 ( 6.456 -0.667 -5.595) 8.569 9.171 ( 4.129 -1.205 8.565) 9.585 9.314 ( 7.877 -1.941 -2.049) 8.368 10.044 ( 6.731 16.418 6.244) 18.811 10.931 ( 5.288 -25.140 -7.629) 26.799 11.548 ( 3.973 0.243 5.933) 7.145 11.766 ( -2.474 12.051 -5.151) 13.337 13.048 ( -9.511 -6.759 -0.821) 11.696 13.412 ( 4.918 3.706 7.043) 9.355 13.972 ( 0.553 -4.005 -0.675) 4.099 14.573 ( -8.502 4.290 3.487) 10.141 15.172 ( -9.027 -15.359 -0.610) 17.826 17.227 ( 19.112 -4.269 -9.029) 21.564 18.853 ( -13.207 1.209 -4.656) 14.056 19.540 ( -18.601 8.228 -2.761) 20.526 20.293 ( -8.663 0.731 -16.511) 18.660 20.523 ( -17.686 1.886 5.540) 18.629 22.169 ( 23.694 -16.649 14.732) 32.490 23.699 ( -1.962 1.396 -2.391) 3.393 24.192 ( 2.573 -3.331 3.072) 5.211 ======================= Grid point 36 (22/260) ======================= q-point: ( 0.30 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( 17.927 18.517 1.895) 25.843 2.333 ( 14.809 10.334 -2.735) 18.264 3.179 ( -1.110 -6.867 0.904) 7.014 3.360 ( -1.743 -4.524 -2.014) 5.250 3.484 ( 8.777 -4.355 0.246) 9.801 3.783 ( 9.737 -7.092 10.595) 16.042 4.383 ( 7.932 7.356 6.337) 12.537 4.532 ( -9.125 3.321 4.590) 10.741 4.672 ( 3.620 0.135 -11.937) 12.474 5.714 ( 8.161 12.023 -6.501) 15.919 6.263 ( 3.947 20.176 -1.723) 20.630 6.508 ( 11.142 -10.170 -2.029) 15.221 7.215 ( 2.130 18.130 6.465) 19.365 7.543 ( -1.407 3.931 -5.200) 6.669 7.690 ( 1.712 4.885 -1.981) 5.542 8.273 ( -4.035 24.797 11.662) 27.698 8.720 ( -5.543 -3.284 -4.989) 8.148 9.204 ( -2.040 1.111 5.124) 5.626 9.597 ( 20.134 0.012 -6.894) 21.281 10.257 ( 11.549 14.740 12.234) 22.368 11.006 ( 2.842 -22.095 -7.403) 23.475 11.521 ( -5.146 14.867 -3.995) 16.232 11.816 ( 5.833 -1.346 4.627) 7.566 12.841 ( -10.578 -6.605 0.530) 12.483 13.565 ( 8.945 1.997 4.941) 10.412 13.965 ( -0.940 -2.192 -3.232) 4.017 14.417 ( -7.354 -0.329 6.389) 9.747 14.957 ( -12.284 -10.310 -1.667) 16.124 17.602 ( 19.270 -5.475 -9.878) 22.335 18.684 ( -5.513 -2.521 3.096) 6.807 19.164 ( -15.222 11.296 -6.538) 20.051 19.975 ( -17.414 -9.350 -19.432) 27.718 20.284 ( -9.824 12.810 11.937) 20.077 22.563 ( 13.275 -12.269 10.153) 20.732 23.687 ( 1.719 -5.612 -2.244) 6.284 24.225 ( 0.108 -3.559 2.079) 4.123 ======================= Grid point 37 (23/260) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.604 ( 12.405 5.458 -2.238) 13.736 2.653 ( 13.011 18.175 1.918) 22.434 3.134 ( -3.358 -7.053 -0.679) 7.841 3.266 ( -5.116 -5.747 -1.371) 7.815 3.634 ( 4.329 -2.713 2.260) 5.586 3.981 ( 9.307 -7.365 5.432) 13.053 4.348 ( -9.564 1.688 7.405) 12.213 4.567 ( 6.874 1.884 4.373) 8.363 4.689 ( 1.014 0.673 -11.247) 11.313 5.847 ( 5.317 13.250 -4.547) 14.984 6.328 ( 2.752 20.409 -1.272) 20.633 6.648 ( 3.799 -8.039 -2.153) 9.149 7.299 ( 5.212 17.028 3.936) 18.238 7.516 ( -0.577 5.370 -2.467) 5.938 7.697 ( -1.627 5.098 -2.264) 5.811 8.242 ( -0.198 29.728 10.119) 31.403 8.568 ( -7.676 -5.448 -5.226) 10.766 9.150 ( -2.917 4.343 2.099) 5.637 10.001 ( 19.097 1.918 -4.917) 19.813 10.481 ( 7.878 14.195 9.901) 19.015 10.998 ( -2.594 -16.741 -3.460) 17.290 11.416 ( -3.529 13.942 -7.547) 16.241 11.933 ( 4.226 -2.900 6.831) 8.540 12.653 ( -7.673 -7.242 -0.404) 10.558 13.759 ( 8.853 -1.356 3.374) 9.571 13.932 ( -1.339 -1.216 -4.628) 4.968 14.331 ( -1.850 -8.152 8.433) 11.874 14.693 ( -13.095 -3.311 -3.655) 13.992 17.922 ( 13.857 -7.108 -8.191) 17.596 18.522 ( -11.517 3.572 4.131) 12.746 19.067 ( 6.231 1.152 -0.616) 6.367 19.608 ( -16.030 -10.191 -14.402) 23.838 20.129 ( -7.278 18.591 8.236) 21.597 22.740 ( 4.117 -2.318 4.415) 6.467 23.758 ( 4.840 -19.262 -0.745) 19.875 24.205 ( -2.100 -0.554 0.837) 2.328 ======================= Grid point 38 (24/260) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( 0.000 4.401 -0.000) 4.401 2.794 ( 0.000 16.779 0.000) 16.779 3.082 ( 0.000 -5.548 0.000) 5.548 3.200 ( 0.000 -7.474 -0.000) 7.474 3.678 ( 0.000 -0.647 -0.000) 0.647 4.113 ( 0.000 -2.480 0.000) 2.480 4.230 ( 0.000 -3.978 -0.000) 3.978 4.615 ( 0.000 -0.046 -0.000) 0.046 4.708 ( 0.000 -0.445 0.000) 0.445 5.896 ( 0.000 13.469 -0.000) 13.469 6.357 ( -0.000 20.088 0.000) 20.088 6.678 ( 0.000 -6.311 0.000) 6.311 7.382 ( 0.000 17.765 0.000) 17.765 7.507 ( 0.000 4.743 -0.000) 4.743 7.653 ( 0.000 6.229 0.000) 6.229 8.275 ( 0.000 38.635 0.000) 38.635 8.460 ( 0.000 -14.622 -0.000) 14.622 9.120 ( 0.000 5.658 0.000) 5.658 10.219 ( 0.000 3.285 -0.000) 3.285 10.571 ( 0.000 16.615 0.000) 16.615 10.947 ( 0.000 -17.236 -0.000) 17.236 11.371 ( 0.000 13.853 0.000) 13.853 11.987 ( 0.000 -3.817 -0.000) 3.817 12.568 ( 0.000 -7.775 -0.000) 7.775 13.876 ( 0.000 -3.738 0.000) 3.738 13.900 ( 0.000 -0.996 0.000) 0.996 14.365 ( -0.000 -23.182 -0.000) 23.182 14.501 ( 0.000 12.012 0.000) 12.012 18.080 ( 0.000 -9.994 -0.000) 9.994 18.371 ( 0.000 8.876 0.000) 8.876 19.277 ( -0.000 -5.785 -0.000) 5.785 19.307 ( 0.000 -8.963 -0.000) 8.963 20.056 ( 0.000 21.795 -0.000) 21.795 22.779 ( 0.000 2.283 -0.000) 2.283 23.819 ( 0.000 -28.311 0.000) 28.311 24.175 ( 0.000 3.798 0.000) 3.798 ======================= Grid point 44 (25/260) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( 0.000 17.267 0.000) 17.267 2.132 ( 0.000 10.999 0.000) 10.999 2.533 ( 0.000 -14.311 0.000) 14.311 2.925 ( 0.000 -8.021 0.000) 8.021 3.517 ( 0.000 3.869 0.000) 3.869 3.654 ( 0.000 15.458 0.000) 15.458 4.178 ( 0.000 -7.599 0.000) 7.599 4.410 ( 0.000 -0.247 0.000) 0.247 4.867 ( 0.000 3.628 0.000) 3.628 5.513 ( 0.000 0.530 0.000) 0.530 5.589 ( 0.000 -1.676 0.000) 1.676 6.412 ( 0.000 9.962 0.000) 9.962 7.504 ( 0.000 -2.011 0.000) 2.011 7.547 ( 0.000 6.610 0.000) 6.610 8.136 ( 0.000 -4.298 0.000) 4.298 8.179 ( 0.000 3.281 0.000) 3.281 8.497 ( 0.000 5.085 0.000) 5.085 9.186 ( 0.000 -3.336 0.000) 3.336 9.343 ( 0.000 24.838 0.000) 24.838 9.997 ( 0.000 -19.297 0.000) 19.297 10.486 ( 0.000 1.445 0.000) 1.445 11.202 ( 0.000 -6.938 0.000) 6.938 12.288 ( 0.000 16.553 0.000) 16.553 13.191 ( 0.000 -10.733 0.000) 10.733 13.217 ( 0.000 0.785 0.000) 0.785 13.861 ( 0.000 -1.976 0.000) 1.976 14.697 ( 0.000 -6.216 0.000) 6.216 15.148 ( 0.000 -1.854 0.000) 1.854 16.763 ( 0.000 -0.871 0.000) 0.871 19.452 ( 0.000 -1.311 0.000) 1.311 19.955 ( 0.000 0.113 0.000) 0.113 20.538 ( 0.000 2.762 0.000) 2.762 21.033 ( 0.000 -0.474 0.000) 0.474 21.192 ( 0.000 -2.340 0.000) 2.340 23.812 ( 0.000 1.188 0.000) 1.188 24.076 ( 0.000 -0.592 0.000) 0.592 ======================= Grid point 45 (26/260) ======================= q-point: ( 0.10 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( 11.834 16.321 -3.797) 20.514 2.187 ( 4.825 9.896 2.904) 11.386 2.645 ( 10.523 -13.766 -1.493) 17.392 2.974 ( 4.204 -7.114 3.204) 8.863 3.516 ( -0.310 1.968 -4.810) 5.206 3.646 ( -0.904 12.590 4.058) 13.258 4.205 ( 2.952 -4.438 9.504) 10.897 4.474 ( 6.250 0.062 -10.611) 12.315 4.842 ( -3.176 3.112 3.239) 5.501 5.596 ( 7.018 2.623 -3.636) 8.328 5.684 ( 10.295 -4.329 1.413) 11.258 6.460 ( 4.420 10.219 -0.795) 11.162 7.487 ( -1.215 0.626 -2.187) 2.579 7.530 ( -1.400 4.232 2.527) 5.124 8.006 ( -9.835 4.541 -4.483) 11.724 8.213 ( 6.266 -6.417 1.809) 9.150 8.738 ( 15.164 5.678 16.536) 23.143 9.171 ( -0.735 -2.014 -2.331) 3.167 9.353 ( 1.119 23.398 -1.175) 23.455 10.022 ( 2.542 -18.904 -0.236) 19.075 10.510 ( 2.950 1.110 -3.877) 4.996 11.272 ( 6.710 -6.486 1.257) 9.416 12.252 ( -3.288 16.955 -2.884) 17.510 13.040 ( -8.786 -9.081 -3.624) 13.145 13.341 ( 5.972 -0.482 6.698) 8.987 13.867 ( 0.389 -2.577 1.692) 3.107 14.647 ( -5.116 -5.990 0.495) 7.893 15.125 ( -2.389 -1.269 0.384) 2.732 16.876 ( 11.382 -1.024 -4.636) 12.333 19.225 ( -18.118 -0.150 -6.830) 19.363 19.888 ( -6.541 1.239 -0.424) 6.671 20.492 ( -4.727 2.033 -8.330) 9.791 20.864 ( -15.064 -0.322 -0.251) 15.069 21.448 ( 20.747 -4.264 11.619) 24.158 23.788 ( -2.340 1.078 -1.242) 2.860 24.101 ( 2.158 -0.704 1.596) 2.775 ======================= Grid point 46 (27/260) ======================= q-point: ( 0.20 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( 8.172 8.223 6.370) 13.228 2.342 ( 15.746 13.499 -7.753) 22.142 2.902 ( 14.207 -11.697 -1.175) 18.441 3.076 ( 4.948 -5.322 3.748) 8.177 3.468 ( -3.515 0.055 -5.766) 6.753 3.642 ( -0.199 3.949 7.853) 8.792 4.342 ( 8.340 2.133 8.816) 12.322 4.583 ( 6.323 0.032 -13.117) 14.562 4.747 ( -7.182 1.839 6.767) 10.038 5.762 ( 10.412 8.438 -5.776) 14.594 5.960 ( 15.500 -9.944 -1.358) 18.466 6.560 ( 5.213 10.619 -1.175) 11.888 7.463 ( -0.975 6.295 1.103) 6.465 7.528 ( 1.662 -1.083 -1.619) 2.560 7.838 ( -6.509 2.983 -0.438) 7.174 8.344 ( 4.113 -5.588 8.938) 11.315 9.016 ( 7.929 9.069 15.678) 19.771 9.188 ( 4.002 2.324 -4.490) 6.448 9.397 ( 4.674 16.564 -3.374) 17.539 10.095 ( 4.704 -19.775 0.174) 20.328 10.605 ( 7.848 2.114 -5.421) 9.770 11.451 ( 10.052 -5.339 4.375) 12.194 12.152 ( -5.761 17.620 -6.256) 19.565 12.842 ( -10.478 -10.895 -2.210) 15.277 13.475 ( 6.444 2.003 7.202) 9.870 13.878 ( 0.162 -3.781 2.533) 4.555 14.496 ( -10.074 -5.842 1.254) 11.713 15.052 ( -4.955 0.225 0.062) 4.960 17.170 ( 18.279 -1.300 -7.614) 19.844 18.860 ( -15.581 -0.064 -2.168) 15.731 19.700 ( -11.770 5.465 -4.689) 13.798 20.226 ( -20.093 -3.873 -24.997) 32.305 20.604 ( -9.139 3.132 13.416) 16.532 21.917 ( 22.243 -6.547 13.797) 26.981 23.715 ( -4.675 0.285 -2.677) 5.395 24.154 ( 2.547 -0.702 1.750) 3.170 ======================= Grid point 47 (28/260) ======================= q-point: ( 0.30 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( 9.406 4.862 4.461) 11.490 2.647 ( 13.835 8.774 -4.392) 16.961 3.088 ( 3.814 0.708 -1.352) 4.108 3.225 ( 7.086 -8.870 -2.168) 11.558 3.396 ( 0.741 -2.314 -1.346) 2.777 3.690 ( 3.934 -1.931 11.553) 12.356 4.512 ( 6.203 4.010 6.001) 9.517 4.582 ( -9.937 1.121 7.264) 12.360 4.673 ( 4.326 -0.160 -12.202) 12.948 5.960 ( 9.815 10.792 -8.623) 16.946 6.248 ( 13.288 -10.643 -2.089) 17.152 6.644 ( 3.294 10.493 -0.929) 11.037 7.461 ( 1.051 6.454 1.486) 6.706 7.578 ( 2.459 -0.435 -2.270) 3.375 7.752 ( -1.672 1.202 0.359) 2.090 8.358 ( -4.617 -5.470 12.318) 14.247 9.106 ( 0.092 17.974 9.352) 20.262 9.265 ( 2.406 13.309 -0.486) 13.534 9.592 ( 16.303 -1.233 -6.056) 17.435 10.193 ( 4.732 -22.908 -1.191) 23.422 10.804 ( 12.354 6.619 -3.126) 14.360 11.651 ( 7.739 -2.955 9.843) 12.865 12.015 ( -5.919 16.747 -10.455) 20.611 12.623 ( -10.957 -11.838 -1.909) 16.243 13.625 ( 7.299 3.058 6.770) 10.415 13.879 ( -0.359 -4.607 1.853) 4.978 14.266 ( -12.720 -7.057 2.677) 14.791 14.929 ( -7.233 2.142 -1.064) 7.618 17.532 ( 18.404 -1.486 -8.092) 20.159 18.639 ( -6.814 -1.358 4.198) 8.117 19.417 ( -14.657 11.704 -9.928) 21.222 19.748 ( -20.907 -11.046 -19.937) 30.929 20.499 ( -4.822 6.142 12.138) 14.433 22.345 ( 18.189 -6.562 12.055) 22.787 23.595 ( -6.692 -2.375 -4.147) 8.223 24.199 ( 1.653 -0.131 1.004) 1.938 ======================= Grid point 48 (29/260) ======================= q-point: ( 0.40 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 9.140 2.818 2.588) 9.909 2.815 ( 3.191 -1.638 2.161) 4.187 3.138 ( -1.063 2.188 -6.669) 7.099 3.207 ( 0.683 3.774 -4.450) 5.875 3.556 ( 8.596 -4.413 3.615) 10.316 3.853 ( 10.432 -3.769 8.316) 13.863 4.361 ( -12.829 0.094 6.736) 14.490 4.609 ( 2.293 1.312 3.178) 4.133 4.713 ( 1.723 0.969 -9.692) 9.892 6.095 ( 5.033 9.084 -7.128) 12.596 6.460 ( 7.828 -7.054 -1.145) 10.599 6.688 ( 1.252 9.996 -0.221) 10.077 7.524 ( 4.898 5.620 0.021) 7.455 7.586 ( -0.667 1.196 -0.812) 1.591 7.766 ( 1.459 1.455 -0.776) 2.202 8.241 ( -7.561 -7.948 8.518) 13.888 9.085 ( -2.503 19.386 5.605) 20.335 9.291 ( 0.794 22.564 -0.478) 22.583 9.946 ( 17.060 -14.942 -0.465) 22.683 10.261 ( 2.272 -19.589 -5.078) 20.364 11.039 ( 10.164 12.492 -0.240) 16.106 11.744 ( -0.859 8.516 8.709) 12.211 11.925 ( -0.299 5.363 -7.686) 9.377 12.417 ( -8.690 -12.732 -2.332) 15.590 13.772 ( 5.467 2.803 4.574) 7.659 13.875 ( 0.064 -3.824 -0.977) 3.947 14.043 ( -9.055 -10.592 4.682) 14.700 14.779 ( -6.824 4.115 -1.893) 8.191 17.831 ( 11.961 -1.831 -5.473) 13.280 18.575 ( -1.754 1.038 5.996) 6.333 19.153 ( -7.838 7.740 -7.971) 13.597 19.371 ( -14.160 -11.615 -12.048) 21.922 20.442 ( -2.677 9.034 7.585) 12.096 22.671 ( 12.399 -3.184 8.440) 15.333 23.446 ( -6.947 -7.866 -4.544) 11.436 24.222 ( 0.623 0.788 0.314) 1.052 ======================= Grid point 49 (30/260) ======================= q-point: (-0.50 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.800 ( 0.000 0.830 -0.000) 0.830 2.842 ( -0.000 -3.008 0.000) 3.008 3.070 ( 0.000 -3.796 0.000) 3.796 3.246 ( 0.000 10.348 0.000) 10.348 3.654 ( 0.000 -1.449 0.000) 1.449 4.084 ( -0.000 -0.478 0.000) 0.478 4.123 ( 0.000 -4.330 -0.000) 4.330 4.629 ( -0.000 0.659 -0.000) 0.659 4.720 ( 0.000 0.721 0.000) 0.721 6.138 ( 0.000 8.193 0.000) 8.193 6.539 ( 0.000 -5.661 0.000) 5.661 6.699 ( 0.000 10.048 0.000) 10.048 7.571 ( 0.000 1.497 0.000) 1.497 7.605 ( 0.000 4.695 -0.000) 4.695 7.770 ( 0.000 4.859 0.000) 4.859 8.158 ( 0.000 -11.432 -0.000) 11.432 9.061 ( 0.000 19.565 -0.000) 19.565 9.299 ( 0.000 25.140 0.000) 25.140 10.150 ( 0.000 -37.984 0.000) 37.984 10.265 ( -0.000 1.049 -0.000) 1.049 11.150 ( 0.000 16.329 -0.000) 16.329 11.720 ( 0.000 15.903 0.000) 15.903 11.933 ( 0.000 -3.011 -0.000) 3.011 12.316 ( 0.000 -13.337 -0.000) 13.337 13.824 ( 0.000 0.128 0.000) 0.128 13.877 ( 0.000 -0.631 -0.000) 0.631 13.964 ( 0.000 -13.121 -0.000) 13.121 14.698 ( 0.000 5.235 0.000) 5.235 17.952 ( 0.000 -2.577 -0.000) 2.577 18.559 ( 0.000 7.081 0.000) 7.081 19.116 ( 0.000 -7.130 0.000) 7.130 19.170 ( -0.000 -3.282 -0.000) 3.282 20.422 ( 0.000 10.493 -0.000) 10.493 22.819 ( 0.000 1.190 -0.000) 1.190 23.354 ( 0.000 -13.108 0.000) 13.108 24.228 ( 0.000 1.257 0.000) 1.257 ======================= Grid point 99 (31/260) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.497 ( 0.230 0.000 25.581) 25.582 0.548 ( 18.879 0.000 28.171) 33.912 1.184 ( 5.040 0.000 60.242) 60.452 3.412 ( 2.381 0.000 -1.190) 2.662 3.429 ( -1.114 0.000 -5.817) 5.922 3.690 ( 2.288 0.000 0.507) 2.344 4.225 ( -5.218 0.000 1.014) 5.316 4.414 ( -0.156 0.000 -6.824) 6.826 5.198 ( -29.391 0.000 -0.609) 29.397 5.257 ( -3.148 0.000 7.387) 8.030 5.298 ( -17.778 0.000 18.104) 25.374 5.759 ( 50.765 0.000 2.590) 50.831 6.029 ( 2.888 0.000 8.652) 9.121 6.617 ( -1.352 0.000 -0.277) 1.380 6.951 ( -3.669 0.000 18.169) 18.536 7.730 ( 0.244 0.000 6.861) 6.866 8.964 ( -2.855 0.000 -7.929) 8.428 9.138 ( 23.186 0.000 -9.755) 25.154 9.566 ( 0.527 0.000 -3.205) 3.248 9.621 ( 24.051 0.000 12.925) 27.304 11.450 ( 2.238 0.000 -0.177) 2.245 11.543 ( 2.273 0.000 -4.563) 5.098 11.645 ( -2.783 0.000 -9.735) 10.125 12.817 ( 0.113 0.000 -7.138) 7.139 13.887 ( 19.149 0.000 -6.888) 20.350 14.205 ( 0.703 0.000 3.336) 3.409 14.253 ( 15.737 0.000 11.149) 19.286 16.168 ( 1.096 0.000 -12.339) 12.388 18.139 ( 5.420 0.000 0.086) 5.420 18.681 (-174.362 0.000 -2.688) 174.383 19.886 ( 1.842 0.000 1.046) 2.118 20.093 ( -0.391 0.000 -0.690) 0.794 21.176 ( -8.487 0.000 6.217) 10.521 22.545 ( 138.041 0.000 -2.166) 138.058 23.006 ( 3.158 0.000 0.995) 3.311 23.609 ( -1.654 0.000 -2.177) 2.734 ======================= Grid point 100 (32/260) ======================= q-point: ( 0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.788 ( 20.326 0.000 18.799) 27.686 1.074 ( 17.214 0.000 32.655) 36.914 1.815 ( 46.482 0.000 36.327) 58.993 3.425 ( 1.881 0.000 -5.256) 5.583 3.462 ( 2.637 0.000 0.027) 2.637 3.781 ( 6.400 0.000 1.386) 6.548 4.229 ( 6.343 0.000 4.234) 7.626 4.368 ( -3.818 0.000 -5.748) 6.901 4.718 ( -12.925 0.000 4.150) 13.575 5.215 ( -2.026 0.000 5.620) 5.974 5.366 ( 3.149 0.000 17.924) 18.199 6.045 ( -2.991 0.000 11.103) 11.499 6.649 ( 4.746 0.000 -1.167) 4.887 6.735 ( 24.451 0.000 -25.728) 35.494 6.951 ( 6.395 0.000 8.042) 10.275 7.742 ( -0.503 0.000 6.567) 6.586 8.956 ( 3.270 0.000 -10.516) 11.013 9.235 ( -4.045 0.000 -0.941) 4.153 9.517 ( -4.314 0.000 -2.913) 5.205 10.254 ( 24.441 0.000 -15.384) 28.879 11.432 ( -3.984 0.000 2.895) 4.924 11.496 ( -3.544 0.000 -4.979) 6.112 11.653 ( 5.289 0.000 -14.717) 15.639 12.889 ( 8.479 0.000 -7.160) 11.097 13.583 ( -53.600 0.000 53.590) 75.795 14.054 ( -7.016 0.000 7.651) 10.381 14.232 ( 1.278 0.000 3.748) 3.960 16.118 ( -3.927 0.000 -11.991) 12.617 16.959 ( -4.436 0.000 6.402) 7.789 18.299 ( 9.978 0.000 5.331) 11.313 19.788 ( -11.941 0.000 2.881) 12.284 20.070 ( -3.520 0.000 0.370) 3.539 20.886 ( -19.213 0.000 -0.716) 19.226 23.185 ( 12.822 0.000 3.093) 13.189 23.499 ( -8.441 0.000 -3.402) 9.101 24.350 ( 42.284 0.000 -37.743) 56.678 ======================= Grid point 101 (33/260) ======================= q-point: ( 0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.257 ( 22.635 0.000 14.716) 26.998 1.426 ( 13.473 0.000 34.131) 36.695 2.856 ( 49.131 0.000 12.852) 50.784 3.494 ( 6.401 0.000 -0.289) 6.408 3.510 ( 1.899 0.000 0.651) 2.008 3.926 ( 7.190 0.000 -2.256) 7.535 4.234 ( -8.526 0.000 -2.016) 8.761 4.423 ( 7.456 0.000 -0.309) 7.462 4.521 ( -3.922 0.000 1.529) 4.210 5.199 ( -0.586 0.000 5.052) 5.086 5.470 ( 4.094 0.000 18.873) 19.312 5.975 ( -5.116 0.000 12.324) 13.343 6.781 ( 7.951 0.000 -1.402) 8.074 6.811 ( -1.804 0.000 4.693) 5.027 7.187 ( 9.083 0.000 -13.730) 16.462 7.722 ( -2.922 0.000 6.804) 7.405 9.011 ( 1.814 0.000 -10.944) 11.093 9.104 ( -8.182 0.000 2.757) 8.635 9.444 ( 0.275 0.000 -2.556) 2.571 10.441 ( -1.893 0.000 5.273) 5.602 11.338 ( -5.534 0.000 2.094) 5.917 11.466 ( 2.195 0.000 -13.292) 13.472 11.757 ( 7.306 0.000 -16.133) 17.710 12.896 ( -23.664 0.000 53.022) 58.063 13.121 ( 15.552 0.000 -6.560) 16.879 13.960 ( -5.493 0.000 3.787) 6.672 14.268 ( 1.685 0.000 3.284) 3.691 15.970 ( -8.899 0.000 -11.190) 14.297 17.216 ( 21.748 0.000 -19.365) 29.120 18.541 ( 12.467 0.000 9.346) 15.581 19.445 ( -21.849 0.000 4.755) 22.360 19.950 ( -8.588 0.000 2.474) 8.937 20.478 ( -20.442 0.000 -5.318) 21.123 23.275 ( -12.659 0.000 -2.461) 12.896 23.464 ( 13.623 0.000 3.067) 13.964 24.772 ( 13.273 0.000 -16.464) 21.148 ======================= Grid point 102 (34/260) ======================= q-point: ( 0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( 19.693 0.000 13.581) 23.922 1.728 ( 10.690 0.000 30.709) 32.516 3.433 ( 7.250 0.000 -10.482) 12.745 3.536 ( 0.617 0.000 0.064) 0.620 3.948 ( -7.631 0.000 -6.329) 9.914 3.960 ( 38.993 0.000 13.286) 41.194 4.125 ( 1.400 0.000 -0.873) 1.650 4.325 ( -6.181 0.000 1.615) 6.388 4.725 ( 12.500 0.000 -5.512) 13.661 5.205 ( 0.026 0.000 8.329) 8.329 5.604 ( 6.216 0.000 21.978) 22.840 5.913 ( -2.933 0.000 10.798) 11.190 6.781 ( -1.881 0.000 3.254) 3.759 6.928 ( 6.359 0.000 -0.522) 6.380 7.247 ( -0.216 0.000 -6.273) 6.277 7.646 ( -6.038 0.000 9.100) 10.921 8.932 ( -6.707 0.000 -7.578) 10.120 8.957 ( -6.517 0.000 4.827) 8.110 9.588 ( 13.471 0.000 -4.195) 14.109 10.321 ( -9.809 0.000 13.850) 16.972 11.225 ( -6.088 0.000 1.454) 6.259 11.480 ( 0.293 0.000 -12.568) 12.571 11.874 ( 7.065 0.000 -16.379) 17.838 12.722 ( -3.836 0.000 31.837) 32.067 13.457 ( 18.512 0.000 -5.965) 19.449 13.844 ( -6.737 0.000 5.159) 8.485 14.304 ( 1.348 0.000 1.127) 1.757 15.735 ( -12.459 0.000 -9.689) 15.783 17.648 ( 24.687 0.000 -21.680) 32.856 18.710 ( -5.327 0.000 4.007) 6.666 19.107 ( -3.636 0.000 14.491) 14.941 19.745 ( -12.540 0.000 4.635) 13.369 20.067 ( -19.570 0.000 -8.824) 21.467 23.022 ( -11.725 0.000 -1.218) 11.788 23.708 ( 10.027 0.000 2.121) 10.249 24.938 ( 6.599 0.000 -11.254) 13.046 ======================= Grid point 103 (35/260) ======================= q-point: ( 0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( 3.727 0.000 26.642) 26.902 2.057 ( 11.951 0.000 13.419) 17.969 3.485 ( 1.804 0.000 -4.170) 4.544 3.532 ( -0.851 0.000 -1.630) 1.838 3.758 ( -7.851 0.000 -0.916) 7.904 4.157 ( 1.173 0.000 -10.041) 10.110 4.257 ( -0.914 0.000 1.542) 1.793 4.651 ( 25.325 0.000 1.878) 25.395 4.882 ( 4.114 0.000 -11.298) 12.024 5.231 ( 0.514 0.000 13.385) 13.395 5.804 ( 8.813 0.000 26.744) 28.159 5.889 ( -1.660 0.000 7.682) 7.859 6.737 ( -2.919 0.000 0.766) 3.018 7.020 ( 2.914 0.000 0.131) 2.917 7.221 ( 0.213 0.000 1.689) 1.703 7.526 ( -7.534 0.000 12.203) 14.341 8.793 ( -4.839 0.000 -4.785) 6.805 8.882 ( -1.871 0.000 7.052) 7.296 9.883 ( 15.091 0.000 -2.857) 15.359 10.139 ( -10.482 0.000 10.696) 14.976 11.107 ( -5.726 0.000 0.788) 5.780 11.420 ( -4.113 0.000 -9.981) 10.795 11.971 ( 5.368 0.000 -15.510) 16.413 12.780 ( 3.620 0.000 19.191) 19.530 13.723 ( -6.099 0.000 6.332) 8.792 13.785 ( 13.664 0.000 -5.487) 14.724 14.325 ( 1.286 0.000 -2.721) 3.010 15.471 ( -11.367 0.000 -7.802) 13.787 18.104 ( 24.692 0.000 -20.459) 32.067 18.420 ( -14.779 0.000 0.302) 14.782 19.302 ( 8.125 0.000 20.475) 22.029 19.477 ( -15.178 0.000 6.744) 16.609 19.701 ( -11.612 0.000 -10.981) 15.982 22.834 ( -6.527 0.000 0.332) 6.536 23.859 ( 4.661 0.000 0.856) 4.739 25.003 ( 1.965 0.000 -11.946) 12.106 ======================= Grid point 104 (36/260) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( -6.740 0.000 22.513) 23.501 2.182 ( -2.524 0.000 12.754) 13.002 3.502 ( -1.610 0.000 -3.463) 3.819 3.536 ( 3.918 0.000 1.249) 4.112 3.698 ( 2.550 0.000 1.759) 3.098 4.128 ( -1.786 0.000 -13.671) 13.787 4.269 ( 0.724 0.000 1.645) 1.797 4.781 ( -9.228 0.000 -7.956) 12.184 4.970 ( 4.655 0.000 -12.744) 13.567 5.266 ( 0.355 0.000 15.618) 15.622 5.856 ( -3.095 0.000 4.783) 5.697 5.946 ( -2.414 0.000 30.004) 30.101 6.739 ( 5.025 0.000 4.266) 6.592 7.048 ( 0.016 0.000 0.116) 0.117 7.318 ( 8.598 0.000 6.212) 10.607 7.413 ( -5.078 0.000 13.876) 14.776 8.755 ( 1.978 0.000 -2.694) 3.342 8.905 ( 2.526 0.000 9.531) 9.860 9.940 ( -10.972 0.000 3.006) 11.376 10.104 ( 5.217 0.000 1.942) 5.567 11.022 ( -1.835 0.000 -1.144) 2.162 11.298 ( -5.828 0.000 -11.910) 13.260 12.026 ( 2.756 0.000 -14.088) 14.355 12.882 ( 2.504 0.000 15.968) 16.164 13.646 ( -2.186 0.000 6.340) 6.707 13.896 ( -2.233 0.000 -6.842) 7.197 14.360 ( 1.961 0.000 -3.707) 4.194 15.323 ( -0.273 0.000 -7.557) 7.562 18.259 ( -0.448 0.000 0.077) 0.454 18.539 ( 21.543 0.000 -17.480) 27.742 19.138 ( -18.469 0.000 -3.953) 18.887 19.185 ( -14.504 0.000 8.713) 16.919 19.838 ( 17.172 0.000 13.121) 21.611 22.776 ( 0.605 0.000 1.576) 1.688 23.893 ( -1.297 0.000 -0.497) 1.389 24.971 ( -2.812 0.000 -15.134) 15.393 ======================= Grid point 105 (37/260) ======================= q-point: (-0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( -14.794 0.000 20.518) 25.295 2.012 ( -15.677 0.000 11.533) 19.462 3.457 ( -2.051 0.000 -4.842) 5.259 3.613 ( 1.376 0.000 1.835) 2.293 3.843 ( 9.415 0.000 -0.348) 9.422 4.056 ( -2.167 0.000 -9.665) 9.905 4.179 ( -15.986 0.000 -7.454) 17.639 4.512 ( -9.657 0.000 -1.072) 9.717 4.917 ( -5.580 0.000 -9.459) 10.982 5.303 ( 0.892 0.000 14.777) 14.803 5.783 ( -4.497 0.000 2.857) 5.327 5.843 ( -10.993 0.000 30.910) 32.806 6.900 ( 6.674 0.000 11.748) 13.511 7.022 ( -2.628 0.000 -0.331) 2.648 7.361 ( 0.148 0.000 9.757) 9.758 7.589 ( 14.171 0.000 8.822) 16.693 8.862 ( 8.767 0.000 -1.325) 8.867 9.005 ( 5.292 0.000 11.330) 12.505 9.704 ( -12.648 0.000 -8.021) 14.977 10.048 ( -11.087 0.000 5.850) 12.536 11.057 ( 5.329 0.000 -2.880) 6.058 11.166 ( -4.422 0.000 -15.435) 16.056 12.031 ( 0.048 0.000 -12.203) 12.204 12.916 ( -2.120 0.000 19.351) 19.467 13.671 ( 3.596 0.000 4.870) 6.054 13.715 ( -12.894 0.000 -9.092) 15.777 14.342 ( -3.138 0.000 -0.555) 3.186 15.448 ( 12.782 0.000 -9.792) 16.101 18.402 ( 13.483 0.000 -0.911) 13.514 18.732 ( -6.386 0.000 4.010) 7.541 18.763 ( -16.265 0.000 -8.763) 18.476 19.110 ( 12.651 0.000 -5.113) 13.646 20.225 ( 18.027 0.000 17.988) 25.466 22.855 ( 6.622 0.000 1.117) 6.716 23.807 ( -7.072 0.000 -1.753) 7.286 24.835 ( -7.839 0.000 -20.195) 21.663 ======================= Grid point 106 (38/260) ======================= q-point: (-0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( -18.420 0.000 21.666) 28.438 1.645 ( -22.418 0.000 11.095) 25.013 3.324 ( -37.350 0.000 -12.144) 39.274 3.410 ( -1.638 0.000 -5.212) 5.463 3.799 ( -9.350 0.000 4.771) 10.497 3.878 ( -3.809 0.000 -12.722) 13.281 4.148 ( 9.924 0.000 4.437) 10.871 4.450 ( -0.945 0.000 -4.738) 4.832 4.801 ( -3.836 0.000 4.021) 5.558 5.352 ( 0.986 0.000 12.785) 12.823 5.663 ( -12.052 0.000 29.573) 31.934 5.715 ( -1.733 0.000 2.545) 3.079 6.942 ( -5.217 0.000 -0.885) 5.292 6.991 ( 0.121 0.000 18.720) 18.720 7.438 ( 5.301 0.000 5.665) 7.759 7.866 ( 11.192 0.000 5.891) 12.648 9.073 ( 11.947 0.000 -0.763) 11.972 9.139 ( 5.612 0.000 8.968) 10.579 9.393 ( -16.363 0.000 -20.517) 26.243 9.747 ( -18.334 0.000 4.490) 18.876 11.095 ( 0.748 0.000 -15.847) 15.864 11.181 ( 6.673 0.000 -2.452) 7.110 11.985 ( -2.737 0.000 -10.091) 10.455 12.889 ( -3.832 0.000 26.051) 26.331 13.408 ( -15.304 0.000 -8.610) 17.560 13.785 ( 6.525 0.000 3.693) 7.498 14.267 ( -3.746 0.000 0.877) 3.848 15.720 ( 14.962 0.000 -11.384) 18.800 18.394 ( -12.349 0.000 -9.888) 15.820 18.554 ( -9.127 0.000 19.962) 21.950 18.840 ( 22.996 0.000 -1.369) 23.036 19.440 ( 18.113 0.000 -8.884) 20.174 20.601 ( 16.317 0.000 18.880) 24.954 23.020 ( 9.388 0.000 -2.496) 9.714 23.612 ( -11.848 0.000 -2.697) 12.152 24.581 ( -13.814 0.000 -27.904) 31.136 ======================= Grid point 107 (39/260) ======================= q-point: (-0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( -18.578 0.000 24.817) 31.001 1.187 ( -25.124 0.000 12.195) 27.928 2.370 ( -52.324 0.000 -2.144) 52.368 3.380 ( -0.453 0.000 -4.309) 4.333 3.661 ( -7.415 0.000 1.456) 7.556 3.768 ( -4.509 0.000 -8.024) 9.204 4.324 ( 6.562 0.000 -0.038) 6.562 4.379 ( -4.728 0.000 -8.037) 9.324 4.812 ( 2.630 0.000 14.898) 15.128 5.357 ( -2.542 0.000 9.970) 10.289 5.487 ( -10.107 0.000 26.536) 28.395 5.762 ( 5.630 0.000 5.106) 7.601 6.819 ( -6.683 0.000 -1.075) 6.769 7.000 ( -2.277 0.000 20.505) 20.631 7.543 ( 3.016 0.000 4.036) 5.039 8.008 ( 0.776 0.000 -11.385) 11.411 8.897 ( -24.213 0.000 -36.318) 43.649 9.288 ( 5.306 0.000 1.367) 5.479 9.301 ( 4.884 0.000 15.092) 15.863 9.411 ( -10.909 0.000 -2.128) 11.114 11.164 ( 8.861 0.000 -10.692) 13.886 11.295 ( 5.185 0.000 -2.202) 5.633 11.887 ( -5.298 0.000 -8.264) 9.817 12.895 ( 0.563 0.000 35.588) 35.592 13.112 ( -12.510 0.000 -7.295) 14.482 13.923 ( 6.374 0.000 3.776) 7.408 14.211 ( -1.983 0.000 1.744) 2.641 15.965 ( 11.351 0.000 -12.161) 16.635 18.177 ( -7.093 0.000 -8.491) 11.064 18.541 ( 5.705 0.000 37.261) 37.696 19.322 ( 23.703 0.000 -1.447) 23.747 19.755 ( 14.490 0.000 -6.080) 15.714 20.932 ( 13.448 0.000 17.655) 22.194 23.176 ( 5.618 0.000 -14.602) 15.645 23.343 ( -14.097 0.000 -3.029) 14.418 24.159 ( -23.782 0.000 -38.149) 44.955 ======================= Grid point 108 (40/260) ======================= q-point: (-0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( -22.366 0.000 17.275) 28.261 0.791 ( -22.666 0.000 18.476) 29.242 1.405 ( -39.492 0.000 31.366) 50.433 3.379 ( 1.088 0.000 -2.683) 2.896 3.515 ( -6.389 0.000 -3.616) 7.341 3.691 ( -1.937 0.000 -3.132) 3.682 4.281 ( -3.075 0.000 -1.405) 3.381 4.405 ( 2.316 0.000 -4.799) 5.329 4.938 ( 8.533 0.000 15.290) 17.510 5.309 ( -3.472 0.000 8.545) 9.223 5.377 ( -4.724 0.000 25.375) 25.811 5.911 ( 7.017 0.000 7.198) 10.052 6.691 ( -5.567 0.000 -0.651) 5.605 6.967 ( -9.343 0.000 9.401) 13.254 7.163 ( -63.582 0.000 -59.109) 86.813 7.738 ( -5.381 0.000 -4.706) 7.149 8.654 ( 10.495 0.000 9.629) 14.243 9.104 ( -10.116 0.000 -3.327) 10.649 9.416 ( 3.963 0.000 15.577) 16.073 9.499 ( 6.581 0.000 -3.134) 7.289 11.383 ( 4.142 0.000 -2.202) 4.691 11.384 ( 12.835 0.000 -5.575) 13.994 11.757 ( -6.039 0.000 -7.326) 9.494 12.902 ( -7.103 0.000 -6.797) 9.831 13.159 ( 24.203 0.000 43.624) 49.889 14.045 ( 5.200 0.000 6.421) 8.262 14.194 ( -0.228 0.000 2.605) 2.615 16.118 ( 6.162 0.000 -12.427) 13.871 18.091 ( -0.390 0.000 -4.855) 4.871 19.114 ( 50.332 0.000 56.647) 75.777 19.716 ( 14.947 0.000 -0.656) 14.962 19.990 ( 10.478 0.000 -0.448) 10.487 21.170 ( 6.480 0.000 13.567) 15.035 22.765 ( -62.887 0.000 -78.433) 100.531 23.084 ( -9.984 0.000 -2.018) 10.186 23.661 ( -9.293 0.000 -7.697) 12.066 ======================= Grid point 109 (41/260) ======================= q-point: ( 0.00 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.799 ( 2.344 23.377 17.180) 29.105 0.936 ( 0.970 21.245 24.934) 32.772 1.505 ( 7.368 31.357 40.415) 51.681 3.390 ( 2.095 -2.275 -0.411) 3.119 3.448 ( -2.305 1.804 -4.573) 5.429 3.584 ( 1.506 -9.681 2.135) 10.027 4.247 ( -0.359 4.772 4.006) 6.241 4.436 ( -1.349 -1.098 -4.269) 4.610 4.884 ( -10.455 -11.454 9.488) 18.180 5.353 ( 1.812 9.460 7.585) 12.260 5.413 ( -6.008 7.726 13.091) 16.345 5.660 ( 12.062 -2.390 3.013) 12.660 6.249 ( 3.689 19.368 8.663) 21.535 7.099 ( -4.329 16.424 9.991) 19.706 7.288 ( -5.626 24.537 -22.701) 33.897 7.798 ( 0.105 6.759 7.256) 9.917 8.801 ( 1.872 -11.349 -4.886) 12.497 9.046 ( 17.132 -5.475 7.028) 19.309 9.519 ( 4.260 -2.739 13.224) 14.160 9.600 ( -0.481 3.755 -1.224) 3.979 11.432 ( -2.166 -3.701 0.369) 4.304 11.532 ( 4.868 0.025 -3.981) 6.289 11.871 ( 0.014 2.762 -6.413) 6.983 12.819 ( -0.088 4.148 -11.857) 12.562 13.697 ( 13.542 -11.439 -0.887) 17.749 14.093 ( -1.176 -3.674 -0.514) 3.892 14.398 ( 5.377 8.063 5.686) 11.236 16.104 ( 2.904 -9.138 -15.228) 17.995 17.275 ( -26.589 -28.729 22.519) 45.160 19.296 ( -57.870 15.094 -26.154) 65.275 19.851 ( 5.042 -2.679 -0.695) 5.752 20.144 ( -2.569 4.213 -2.113) 5.368 21.170 ( -7.069 -0.282 7.090) 10.016 21.837 ( 52.047 -20.429 19.978) 59.375 23.634 ( -1.419 2.465 -1.906) 3.424 23.811 ( 18.552 22.100 -20.464) 35.375 ======================= Grid point 110 (42/260) ======================= q-point: ( 0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.033 ( 14.669 19.775 13.233) 27.953 1.174 ( 14.324 9.267 29.963) 34.480 2.065 ( 38.686 22.165 31.006) 54.307 3.413 ( 0.417 -1.520 -3.323) 3.678 3.448 ( 2.874 -1.254 -1.159) 3.343 3.677 ( 7.331 -8.356 2.119) 11.317 4.291 ( 4.548 4.488 4.818) 8.003 4.401 ( -1.806 2.370 -3.123) 4.316 4.691 ( -8.627 -1.871 2.528) 9.182 5.301 ( -4.325 6.213 4.804) 8.966 5.437 ( 2.090 8.430 12.416) 15.152 6.211 ( 26.011 -16.019 -2.485) 30.649 6.296 ( 0.757 20.283 11.058) 23.114 7.035 ( -3.137 15.881 5.211) 17.005 7.268 ( 4.453 16.430 -15.108) 22.760 7.809 ( -0.578 7.497 8.429) 11.295 8.823 ( 3.782 -9.740 -7.028) 12.592 9.275 ( 0.059 1.049 -1.171) 1.574 9.532 ( -4.574 1.139 -2.626) 5.395 9.820 ( 21.171 -19.338 13.982) 31.900 11.380 ( -2.749 -5.023 -2.923) 6.429 11.505 ( -6.592 2.039 -0.091) 6.901 11.943 ( 8.382 3.976 -8.909) 12.861 12.839 ( 3.178 2.635 -8.672) 9.605 13.596 ( -23.556 -0.818 18.395) 29.898 14.026 ( -5.422 -2.402 0.431) 5.946 14.345 ( -4.796 9.331 8.794) 13.690 16.040 ( -6.673 -9.972 -12.924) 17.635 16.930 ( 0.636 -2.468 1.992) 3.235 18.554 ( -9.660 17.711 -5.425) 20.891 19.786 ( -11.434 -0.154 2.304) 11.665 20.088 ( -3.776 1.605 -3.148) 5.172 20.896 ( -18.766 1.002 1.374) 18.843 22.785 ( 30.539 -27.971 7.142) 42.024 23.563 ( -5.183 3.703 -3.327) 7.186 24.274 ( 24.074 -4.416 -16.516) 29.526 ======================= Grid point 111 (43/260) ======================= q-point: ( 0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.394 ( 18.060 12.584 14.036) 26.106 1.527 ( 16.207 8.598 24.637) 30.717 2.954 ( 41.696 9.321 15.579) 45.477 3.438 ( 3.523 -3.615 -0.429) 5.065 3.511 ( 3.283 -1.360 0.048) 3.553 3.858 ( 10.046 -5.615 -0.998) 11.552 4.295 ( -6.762 3.563 -1.760) 7.843 4.462 ( 9.469 2.267 2.086) 9.958 4.535 ( -7.426 2.792 2.627) 8.357 5.251 ( -1.011 3.811 3.199) 5.077 5.499 ( 2.066 6.640 11.767) 13.668 6.268 ( -2.421 22.726 13.483) 26.535 6.623 ( 14.808 -9.039 -4.059) 17.817 6.993 ( -1.864 14.956 5.733) 16.125 7.332 ( 3.129 8.375 -11.549) 14.605 7.793 ( -2.928 8.072 9.648) 12.916 8.911 ( 4.442 -6.094 -5.750) 9.483 9.176 ( -7.834 3.772 -0.498) 8.709 9.454 ( -0.486 0.671 -1.999) 2.164 10.188 ( 11.215 -15.265 12.711) 22.811 11.295 ( -5.231 -5.683 -9.806) 12.483 11.364 ( -5.331 1.242 1.187) 5.601 12.121 ( 10.241 8.643 -11.570) 17.705 12.797 ( -11.093 3.415 17.521) 21.017 13.293 ( -0.086 9.444 8.567) 12.751 13.921 ( -5.277 -2.915 0.616) 6.060 14.328 ( 0.054 5.441 5.628) 7.828 15.850 ( -10.115 -11.477 -10.671) 18.653 17.175 ( 20.274 -3.397 -16.344) 26.263 18.583 ( 8.009 3.492 4.235) 9.709 19.440 ( -22.090 -0.203 4.582) 22.561 19.975 ( -7.228 1.676 -3.100) 8.042 20.496 ( -20.682 2.076 -1.172) 20.819 23.120 ( 1.178 -13.050 3.151) 13.477 23.520 ( 6.034 3.657 -1.856) 7.295 24.604 ( 12.429 -12.991 -10.384) 20.763 ======================= Grid point 112 (44/260) ======================= q-point: ( 0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( 13.919 8.480 17.596) 23.985 1.905 ( 17.964 10.586 16.086) 26.335 3.352 ( 1.685 -4.129 -5.566) 7.132 3.540 ( 1.276 -0.588 -0.623) 1.537 3.846 ( 21.827 -7.580 10.324) 25.307 4.079 ( 16.080 0.813 -2.932) 16.365 4.132 ( -5.656 6.606 -2.125) 8.952 4.402 ( -6.130 6.350 4.833) 10.063 4.671 ( 10.208 -4.188 -1.277) 11.108 5.278 ( 2.810 5.709 5.179) 8.204 5.570 ( 3.378 4.240 12.035) 13.200 6.259 ( -0.481 24.517 12.582) 27.561 6.805 ( 3.375 -1.933 -2.938) 4.874 7.012 ( 3.819 12.437 5.599) 14.164 7.332 ( -1.403 6.136 -5.806) 8.563 7.722 ( -6.020 8.007 11.466) 15.226 8.915 ( -2.910 -0.671 -0.572) 3.040 9.004 ( -8.424 3.603 -0.859) 9.203 9.581 ( 13.189 -0.699 -3.373) 13.631 10.293 ( -2.552 -1.739 15.030) 15.344 11.199 ( -1.959 -7.614 -5.986) 9.882 11.277 ( -3.878 -1.861 -7.633) 8.761 12.268 ( 5.762 17.577 -15.616) 24.208 12.627 ( -6.338 -2.692 28.477) 29.298 13.493 ( 15.021 2.777 -3.867) 15.757 13.820 ( -4.779 -2.074 2.074) 5.607 14.334 ( -0.519 2.930 2.720) 4.032 15.601 ( -12.912 -12.379 -9.021) 20.033 17.587 ( 23.266 -5.111 -19.568) 30.827 18.724 ( -2.473 0.923 2.436) 3.592 19.085 ( -6.061 -1.640 13.078) 14.507 19.788 ( -11.070 2.527 -2.423) 11.610 20.083 ( -20.466 2.606 -2.814) 20.822 22.987 ( -9.781 -3.200 0.531) 10.305 23.727 ( 10.935 1.315 0.271) 11.017 24.767 ( 6.178 -14.772 -9.044) 18.389 ======================= Grid point 113 (45/260) ======================= q-point: ( 0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( 6.119 8.448 16.329) 19.376 2.256 ( 13.137 13.081 13.903) 23.173 3.338 ( -0.370 -8.319 -5.417) 9.934 3.539 ( -0.959 -0.045 -1.420) 1.714 3.869 ( -7.757 4.417 7.210) 11.474 4.110 ( 2.840 -4.425 -8.042) 9.608 4.290 ( -3.469 1.881 -3.475) 5.259 4.593 ( 20.995 -1.901 3.631) 21.391 4.823 ( 4.243 -4.655 -4.125) 7.529 5.358 ( 3.395 9.337 8.497) 13.073 5.678 ( 4.660 1.728 12.116) 13.095 6.297 ( 1.900 24.841 12.772) 27.996 6.788 ( -2.736 3.132 -0.271) 4.167 7.129 ( 5.088 10.173 2.880) 11.733 7.286 ( -0.979 6.421 0.942) 6.563 7.607 ( -7.259 7.984 13.510) 17.291 8.841 ( -3.644 4.031 -3.071) 6.241 8.886 ( -2.882 0.500 6.783) 7.387 9.884 ( 15.674 0.198 -2.240) 15.834 10.187 ( -9.120 4.792 10.589) 14.774 11.151 ( -5.559 3.466 -0.554) 6.575 11.199 ( 0.305 -12.712 -12.757) 18.012 12.281 ( -0.654 19.866 -13.100) 23.805 12.658 ( 3.034 -10.316 20.440) 23.095 13.704 ( 0.015 0.327 0.446) 0.553 13.823 ( 9.685 1.205 -1.906) 9.944 14.315 ( -0.976 -0.345 -1.933) 2.193 15.333 ( -11.597 -12.740 -6.938) 18.573 17.982 ( 17.744 -8.008 -16.865) 25.757 18.522 ( -7.080 5.414 -1.339) 9.013 19.256 ( 8.779 -2.702 20.129) 22.126 19.533 ( -14.004 2.783 -1.484) 14.354 19.707 ( -13.282 2.221 -5.124) 14.409 22.821 ( -6.183 -0.976 1.011) 6.341 23.897 ( 5.684 3.133 -0.192) 6.493 24.826 ( 1.571 -16.056 -10.783) 19.404 ======================= Grid point 114 (46/260) ======================= q-point: (-0.50 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( -4.430 9.957 13.385) 17.261 2.402 ( -2.337 15.967 14.044) 21.393 3.374 ( 5.625 -10.699 -5.614) 13.327 3.504 ( -1.923 -0.310 -2.654) 3.292 3.785 ( -1.101 3.875 10.445) 11.195 4.111 ( -1.614 -2.481 -11.510) 11.884 4.238 ( -0.987 -2.615 -2.514) 3.760 4.751 ( -8.883 -3.023 -6.991) 11.701 4.882 ( 6.546 -3.839 -1.443) 7.725 5.421 ( 0.616 11.063 10.460) 15.237 5.744 ( -0.925 1.600 9.713) 9.887 6.333 ( -2.919 24.803 15.823) 29.565 6.786 ( 4.360 3.069 2.963) 6.100 7.150 ( -1.664 8.444 -0.486) 8.620 7.378 ( 7.325 6.017 7.156) 11.877 7.512 ( -3.356 9.445 14.721) 17.809 8.812 ( 1.829 5.318 -1.431) 5.803 8.899 ( 2.260 -1.038 9.585) 9.902 9.995 ( -11.180 5.479 2.479) 12.695 10.118 ( 5.862 1.605 2.509) 6.575 11.017 ( -5.642 -3.121 -9.008) 11.078 11.207 ( 1.677 -2.132 -5.911) 6.504 12.234 ( -1.573 14.419 -12.179) 18.939 12.750 ( 2.071 -11.359 16.575) 20.200 13.690 ( 0.364 4.234 3.064) 5.239 13.914 ( -3.031 1.236 -5.145) 6.098 14.319 ( 1.495 -3.435 -3.968) 5.457 15.184 ( -0.315 -12.808 -6.462) 14.349 18.169 ( 6.556 -4.656 -4.139) 9.044 18.601 ( 11.101 -1.738 -10.315) 15.253 19.139 ( -16.885 8.868 6.755) 20.233 19.258 ( -11.429 2.021 -3.888) 12.240 19.805 ( 16.804 -3.188 12.312) 21.074 22.762 ( 0.081 -0.995 1.590) 1.877 23.944 ( -0.926 4.402 -1.125) 4.637 24.793 ( -2.670 -16.421 -14.064) 21.785 ======================= Grid point 115 (47/260) ======================= q-point: (-0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -13.085 11.575 12.736) 21.620 2.228 ( -15.909 16.045 12.198) 25.678 3.435 ( -1.612 -3.241 -4.706) 5.937 3.514 ( 3.791 -7.020 -3.674) 8.784 3.855 ( 3.885 -0.906 9.945) 10.716 4.022 ( -3.648 -2.880 -9.127) 10.242 4.153 ( -12.057 -0.953 -11.331) 16.573 4.491 ( -9.312 -1.958 -2.493) 9.837 4.930 ( -1.147 1.604 1.840) 2.697 5.416 ( -2.298 9.535 11.429) 15.061 5.696 ( -4.508 3.624 9.928) 11.490 6.230 ( -8.767 24.384 14.140) 29.519 6.920 ( 4.649 -0.426 5.355) 7.104 7.115 ( -1.339 10.179 4.551) 11.230 7.450 ( 1.323 7.047 8.580) 11.182 7.636 ( 10.132 4.920 10.360) 15.303 8.910 ( 7.693 4.216 0.794) 8.808 8.996 ( 5.397 -1.183 9.957) 11.387 9.749 ( -13.307 4.701 -7.437) 15.952 10.072 ( -11.136 2.342 6.478) 13.095 10.939 ( 0.178 -6.680 -11.803) 13.563 11.252 ( 4.010 5.881 -6.279) 9.492 12.175 ( -2.453 9.737 -10.784) 14.735 12.790 ( -0.728 -10.057 16.775) 19.572 13.719 ( -9.611 0.293 -8.103) 12.574 13.752 ( 1.194 6.988 3.934) 8.108 14.303 ( -2.768 -3.531 -1.025) 4.602 15.312 ( 12.901 -12.451 -8.835) 19.988 18.371 ( 12.984 -1.024 0.334) 13.029 18.580 ( -11.633 -13.643 -4.225) 18.420 18.873 ( -10.707 10.052 3.337) 15.061 19.240 ( 12.797 10.070 -9.393) 18.799 20.195 ( 18.466 -2.920 17.953) 25.919 22.818 ( 4.711 -3.154 0.250) 5.675 23.858 ( -7.230 4.205 -2.171) 8.641 24.670 ( -6.802 -14.798 -18.183) 24.411 ======================= Grid point 116 (48/260) ======================= q-point: (-0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -17.145 12.708 15.002) 26.087 1.866 ( -21.599 16.202 10.619) 29.013 3.320 ( -29.692 -0.436 -8.693) 30.941 3.390 ( -2.395 -1.740 -5.043) 5.848 3.740 ( -7.412 -4.862 4.851) 10.105 3.874 ( -8.114 -0.804 -10.966) 13.665 4.105 ( 8.716 -2.624 1.021) 9.160 4.446 ( 0.866 -0.314 -2.428) 2.597 4.882 ( -3.588 5.792 9.895) 12.014 5.397 ( -1.700 5.095 11.292) 12.505 5.622 ( -4.614 5.349 11.709) 13.675 6.084 ( -6.947 24.169 10.605) 27.292 6.888 ( -7.370 -4.715 -0.326) 8.755 7.143 ( 0.744 13.634 16.666) 21.545 7.534 ( 5.616 7.767 4.102) 10.425 7.835 ( 7.399 -2.384 6.425) 10.085 9.092 ( 9.048 1.394 1.824) 9.335 9.118 ( 3.717 -2.554 4.356) 6.271 9.442 ( -14.377 5.657 -13.057) 20.228 9.765 ( -18.539 1.595 4.661) 19.182 10.981 ( 5.999 -3.647 -10.810) 12.890 11.334 ( 4.908 7.835 -6.318) 11.198 12.096 ( -3.825 6.430 -8.129) 11.048 12.799 ( -0.875 -5.889 17.604) 18.583 13.433 ( -13.956 1.440 -7.047) 15.700 13.870 ( 6.895 8.030 4.377) 11.453 14.234 ( -3.489 -3.084 0.070) 4.658 15.588 ( 15.212 -12.150 -10.572) 22.154 18.192 ( -18.097 -12.566 1.697) 22.097 18.700 ( -0.882 4.837 5.727) 7.549 18.833 ( 20.402 3.103 0.386) 20.641 19.555 ( 17.731 9.629 -8.498) 21.893 20.581 ( 16.759 -1.958 19.496) 25.784 22.906 ( 2.699 -9.880 -5.401) 11.579 23.671 ( -9.956 4.324 -2.469) 11.132 24.456 ( -11.248 -10.444 -22.850) 27.526 ======================= Grid point 117 (49/260) ======================= q-point: (-0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( -17.018 13.750 19.358) 29.213 1.438 ( -22.658 17.811 9.625) 30.385 2.506 ( -44.962 13.136 1.082) 46.854 3.358 ( -0.490 -2.052 -3.950) 4.479 3.646 ( -5.053 -1.457 0.914) 5.338 3.717 ( -6.596 -4.930 -4.124) 9.210 4.237 ( 4.109 -4.106 -5.628) 8.088 4.449 ( -0.383 3.241 -0.750) 3.349 4.859 ( -0.639 3.086 16.327) 16.629 5.371 ( -2.895 4.474 9.496) 10.889 5.559 ( -4.323 6.177 14.817) 16.625 6.034 ( 0.867 22.574 6.825) 23.599 6.656 ( -16.456 -12.131 -2.970) 20.659 7.165 ( -1.708 14.896 19.382) 24.504 7.652 ( 4.700 8.372 1.936) 9.794 7.921 ( -0.035 -6.565 -6.262) 9.072 8.891 ( -19.780 0.024 -24.511) 31.496 9.227 ( -3.298 -5.011 13.321) 14.609 9.338 ( 1.743 3.984 1.425) 4.576 9.489 ( -2.825 5.764 0.996) 6.496 11.140 ( 11.405 -0.355 -8.515) 14.237 11.412 ( 3.747 5.884 -4.775) 8.454 11.999 ( -4.348 4.835 -6.333) 9.077 12.842 ( 2.889 -0.280 13.021) 13.341 13.189 ( -8.372 4.295 -0.433) 9.419 14.020 ( 7.000 9.277 3.776) 12.220 14.179 ( -1.758 -2.971 1.798) 3.892 15.845 ( 12.165 -11.464 -11.573) 20.331 17.864 ( -15.070 -18.363 5.293) 24.337 18.790 ( 11.843 12.136 17.986) 24.719 19.298 ( 23.025 -0.370 -2.818) 23.200 19.870 ( 14.641 9.324 -4.271) 17.875 20.920 ( 13.736 -1.061 18.395) 22.982 22.770 ( -18.230 -25.293 -18.750) 36.382 23.543 ( -0.654 8.281 -0.977) 8.364 24.142 ( -15.734 -1.353 -26.738) 31.053 ======================= Grid point 118 (50/260) ======================= q-point: (-0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.993 ( -16.238 17.002 16.236) 28.572 1.044 ( -15.772 20.976 16.460) 30.979 1.706 ( -32.441 27.689 22.972) 48.444 3.358 ( 1.091 -2.000 -2.157) 3.137 3.536 ( -5.448 1.469 -2.098) 6.020 3.606 ( -3.722 -7.809 -0.356) 8.658 4.256 ( -0.242 0.651 -4.144) 4.202 4.444 ( 0.212 0.752 0.640) 1.010 4.903 ( 1.663 -3.391 14.762) 15.237 5.336 ( -1.671 7.148 9.085) 11.680 5.494 ( -4.871 7.180 15.129) 17.440 6.087 ( -14.003 2.070 1.134) 14.200 6.175 ( -16.432 -2.570 -2.846) 16.873 7.149 ( -3.169 15.337 17.731) 23.657 7.603 ( -14.956 13.977 -30.286) 36.555 7.796 ( -2.791 4.889 -1.338) 5.786 8.643 ( 2.705 0.295 2.576) 3.747 9.031 ( -10.195 -5.316 4.182) 12.235 9.431 ( 4.091 0.500 8.753) 9.674 9.562 ( 4.383 5.452 -0.273) 7.001 11.365 ( 11.243 -1.658 -6.563) 13.124 11.455 ( 0.899 1.649 -1.237) 2.249 11.915 ( -2.737 4.178 -6.236) 7.990 12.874 ( -2.056 2.884 -9.957) 10.568 13.267 ( 18.082 4.727 14.468) 23.635 14.106 ( 0.451 1.105 -1.447) 1.876 14.225 ( 6.613 6.971 8.635) 12.919 16.021 ( 7.679 -10.078 -12.678) 17.924 17.608 ( -13.271 -27.622 11.971) 32.900 19.320 ( 36.384 7.953 22.806) 43.671 19.674 ( 14.183 -1.908 -5.973) 15.507 20.112 ( 9.859 8.504 2.645) 13.286 21.159 ( 5.961 -0.811 13.190) 14.497 22.036 ( -49.746 -28.753 -28.382) 64.085 23.604 ( 5.165 8.538 -3.370) 10.533 23.794 ( -11.593 14.652 -23.361) 29.914 ======================= Grid point 119 (51/260) ======================= q-point: ( 0.00 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( -3.126 21.579 20.311) 29.798 1.361 ( 1.285 22.575 17.853) 28.810 2.308 ( 4.938 40.186 17.627) 44.159 3.279 ( -1.739 -10.778 3.432) 11.444 3.355 ( 3.844 -8.849 3.319) 10.203 3.498 ( -2.964 2.338 -2.233) 4.386 4.357 ( -0.104 -5.374 -0.832) 5.439 4.404 ( 1.810 8.999 4.496) 10.221 4.765 ( -5.634 -1.904 4.820) 7.655 5.502 ( -2.715 2.961 6.647) 7.767 5.630 ( 1.928 2.907 -0.011) 3.488 5.685 ( 2.022 14.472 5.689) 15.681 6.764 ( 4.475 26.889 5.376) 27.784 7.515 ( -3.414 21.211 12.740) 24.977 7.550 ( -6.459 3.949 -19.044) 20.493 8.019 ( 2.737 13.947 8.479) 16.550 8.587 ( -1.388 -8.854 0.770) 8.995 9.004 ( 10.409 1.585 12.148) 16.076 9.461 ( 0.756 -3.886 5.890) 7.097 9.740 ( -0.954 9.895 2.180) 10.177 11.275 ( -3.560 -13.146 -0.498) 13.628 11.512 ( 6.910 -3.854 -3.113) 8.502 11.760 ( -4.647 -3.659 7.908) 9.875 12.971 ( 0.586 7.472 -13.414) 15.366 13.520 ( 7.742 -6.045 -2.504) 10.137 14.006 ( -1.319 -4.765 -3.005) 5.785 14.585 ( 2.843 8.923 -0.710) 9.392 15.754 ( 1.383 -22.631 -11.745) 25.535 16.924 ( -10.207 -9.177 6.751) 15.296 19.420 ( -26.807 0.517 -18.828) 32.763 19.796 ( 8.365 -2.328 -6.284) 10.718 20.241 ( -3.995 4.513 -5.774) 8.347 21.170 ( -6.033 0.308 9.165) 10.977 21.568 ( 24.146 -8.478 13.431) 28.901 23.698 ( -1.456 3.513 -0.789) 3.884 24.037 ( 6.827 4.024 -7.244) 10.737 ======================= Grid point 120 (52/260) ======================= q-point: ( 0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 10.720 15.354 22.233) 29.069 1.500 ( 9.424 23.002 10.691) 27.059 2.643 ( 23.743 30.099 20.595) 43.518 3.299 ( 2.708 -9.987 1.313) 10.431 3.422 ( 0.652 -2.804 -0.437) 2.911 3.515 ( 7.001 -4.531 1.635) 8.498 4.333 ( -0.179 -1.058 1.276) 1.667 4.484 ( 1.844 5.126 5.571) 7.792 4.675 ( -2.731 1.420 0.713) 3.160 5.413 ( -5.750 4.341 2.455) 7.611 5.724 ( 2.774 16.961 4.681) 17.812 5.964 ( 23.002 -7.725 -0.304) 24.267 6.829 ( 0.963 26.923 9.456) 28.552 7.397 ( -4.048 10.473 -14.512) 18.349 7.504 ( -1.297 13.754 9.475) 16.753 8.080 ( 1.089 17.652 9.451) 20.052 8.621 ( 5.782 -8.781 -1.545) 10.626 9.256 ( 6.498 -1.490 5.791) 8.830 9.479 ( 0.458 -5.636 6.874) 8.901 9.750 ( 5.029 9.298 7.708) 13.083 11.210 ( -2.075 -12.910 -4.127) 13.711 11.573 ( -4.807 5.260 -1.239) 7.233 11.757 ( 6.918 -13.673 8.592) 17.568 12.991 ( 3.356 7.219 -12.356) 14.699 13.543 ( -5.019 -3.658 3.561) 7.159 13.969 ( -2.426 -2.645 -4.557) 5.801 14.559 ( -4.512 9.851 2.724) 11.172 15.686 ( -5.966 -22.186 -10.857) 25.410 16.867 ( 5.222 -3.250 -2.950) 6.822 18.849 ( -19.247 9.398 -14.334) 25.773 19.785 ( -9.520 0.080 0.002) 9.521 20.127 ( -5.711 1.848 -10.436) 12.039 20.930 ( -17.084 2.159 6.076) 18.261 22.254 ( 33.447 -21.187 11.563) 41.247 23.643 ( -3.617 3.880 -2.618) 5.915 24.200 ( 9.227 -2.872 -3.720) 10.355 ======================= Grid point 121 (53/260) ======================= q-point: ( 0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( 13.918 16.511 18.275) 28.290 1.760 ( 15.586 15.145 6.059) 22.561 3.208 ( 24.814 12.404 16.387) 32.220 3.344 ( 2.442 -6.258 -1.298) 6.842 3.449 ( 2.526 -3.829 -0.947) 4.684 3.735 ( 14.399 -4.740 3.172) 15.488 4.328 ( -2.092 0.347 0.708) 2.236 4.484 ( 0.209 0.537 1.853) 1.940 4.662 ( -1.447 7.644 6.952) 10.434 5.341 ( -0.153 5.098 -1.220) 5.244 5.778 ( 2.046 18.023 3.814) 18.536 6.379 ( 16.849 -9.464 -4.088) 19.752 6.861 ( 1.098 26.366 11.143) 28.645 7.322 ( -1.560 9.928 -8.347) 13.064 7.504 ( -0.302 12.844 6.814) 14.542 8.076 ( -3.389 18.251 11.533) 21.854 8.793 ( 9.777 -5.099 -1.071) 11.079 9.232 ( -5.654 1.331 0.962) 5.888 9.456 ( -1.642 -0.878 0.930) 2.081 10.028 ( 16.121 1.759 15.046) 22.122 11.168 ( -1.610 -9.597 -11.265) 14.886 11.416 ( -8.717 5.095 2.053) 10.303 11.966 ( 10.593 -13.766 9.714) 19.902 13.009 ( -2.245 7.351 -7.571) 10.789 13.438 ( -1.982 4.114 5.232) 6.945 13.885 ( -4.571 0.423 -5.784) 7.384 14.481 ( -3.426 8.444 5.310) 10.547 15.500 ( -10.533 -20.856 -9.645) 25.277 17.097 ( 17.737 -3.591 -12.096) 21.767 18.661 ( 0.170 3.417 -4.012) 5.273 19.449 ( -22.041 1.319 2.907) 22.271 19.984 ( -7.196 -1.390 -13.863) 15.681 20.579 ( -18.586 5.842 7.219) 20.777 22.776 ( 15.520 -18.484 7.238) 25.198 23.592 ( 1.268 2.954 -4.090) 5.202 24.352 ( 6.142 -9.564 -3.202) 11.808 ======================= Grid point 122 (54/260) ======================= q-point: ( 0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 13.416 17.157 10.100) 24.008 2.117 ( 18.374 9.569 6.739) 21.785 3.292 ( -2.997 -2.842 -1.322) 4.337 3.491 ( 1.504 -4.711 0.365) 4.959 3.664 ( 13.302 -8.627 6.562) 17.158 4.043 ( 9.269 -2.682 3.332) 10.208 4.292 ( 4.356 7.530 -2.919) 9.175 4.529 ( 0.385 2.088 6.877) 7.197 4.615 ( -0.724 2.397 5.324) 5.883 5.420 ( 7.136 7.777 0.245) 10.558 5.830 ( 2.801 18.396 3.210) 18.883 6.591 ( 6.267 -2.576 -5.400) 8.664 6.923 ( 2.595 21.220 9.709) 23.480 7.311 ( 1.423 10.347 -1.563) 10.560 7.509 ( -0.426 12.999 4.462) 13.750 7.994 ( -6.706 18.116 13.560) 23.601 8.886 ( -2.002 -3.086 6.473) 7.445 9.112 ( -5.705 6.784 -2.727) 9.274 9.559 ( 13.620 -1.251 -1.533) 13.763 10.310 ( 7.844 4.865 14.767) 17.415 11.081 ( -3.820 -3.988 -18.387) 19.199 11.289 ( -4.421 1.177 3.029) 5.487 12.178 ( 8.212 -13.193 11.896) 19.571 12.860 ( -9.776 10.468 0.488) 14.331 13.551 ( 11.091 2.446 -1.853) 11.508 13.795 ( -2.945 1.179 -5.656) 6.485 14.427 ( -3.392 5.751 4.147) 7.860 15.244 ( -13.351 -20.536 -8.091) 25.796 17.471 ( 21.011 -5.161 -15.272) 26.482 18.731 ( 1.396 -0.543 0.250) 1.519 19.064 ( -11.020 0.212 8.197) 13.736 19.773 ( -11.548 -4.299 -14.681) 19.166 20.229 ( -17.973 10.985 7.871) 22.487 22.888 ( -2.581 -6.419 3.606) 7.802 23.727 ( 11.437 -2.492 -3.499) 12.217 24.423 ( 1.627 -14.964 -4.662) 15.757 ======================= Grid point 123 (55/260) ======================= q-point: ( 0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( 7.966 16.995 5.661) 19.605 2.486 ( 16.526 8.218 6.372) 19.525 3.206 ( -4.795 -4.691 -2.820) 7.277 3.501 ( -0.728 -4.667 1.448) 4.940 3.796 ( -0.174 -9.547 6.733) 11.684 4.055 ( -0.681 -0.069 -3.487) 3.553 4.329 ( -5.660 2.365 -8.876) 10.790 4.646 ( 11.756 5.590 13.435) 18.707 4.697 ( 3.736 -6.402 0.880) 7.465 5.571 ( 6.683 10.576 3.916) 13.109 5.903 ( 3.605 17.697 3.306) 18.361 6.679 ( 4.773 2.421 -3.567) 6.431 6.957 ( -1.083 19.915 8.304) 21.604 7.353 ( 1.692 8.613 -0.602) 8.799 7.508 ( 0.085 13.534 5.816) 14.731 7.880 ( -6.594 19.076 14.969) 25.129 8.821 ( -3.812 -5.297 9.704) 11.695 9.012 ( -3.457 9.810 -0.859) 10.437 9.903 ( 18.327 1.892 -0.949) 18.449 10.354 ( -5.219 11.608 10.038) 16.209 11.000 ( -1.224 -6.010 -20.875) 21.757 11.230 ( -1.627 2.818 3.364) 4.680 12.316 ( 3.148 -13.783 10.837) 17.813 12.686 ( -7.126 9.527 2.351) 12.127 13.755 ( 1.592 3.827 -5.199) 6.649 13.800 ( 11.103 -2.789 -3.405) 11.944 14.350 ( -4.629 4.464 -0.318) 6.439 14.968 ( -12.012 -20.937 -5.370) 24.728 17.834 ( 17.228 -5.770 -13.774) 22.799 18.580 ( -9.148 0.908 3.279) 9.760 19.201 ( 14.751 -3.172 12.512) 19.601 19.501 ( -11.898 -5.254 -12.567) 18.086 19.891 ( -17.020 14.603 4.515) 22.876 22.805 ( -4.403 -0.401 1.827) 4.784 23.945 ( 9.649 -0.873 -2.957) 10.129 24.401 ( -2.482 -20.903 -7.377) 22.305 ======================= Grid point 124 (56/260) ======================= q-point: (-0.50 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.342 ( -1.759 18.082 2.664) 18.361 2.705 ( 0.310 11.269 10.174) 15.186 3.150 ( 2.874 -10.154 -7.189) 12.769 3.467 ( -2.645 -3.864 1.746) 4.998 3.765 ( -2.323 -6.336 8.810) 11.097 4.059 ( 0.168 -0.327 -9.805) 9.812 4.195 ( -4.084 -1.253 -4.977) 6.559 4.662 ( -7.295 -4.981 -6.849) 11.178 4.867 ( 7.178 2.169 14.734) 16.532 5.673 ( 2.008 12.548 7.015) 14.515 5.956 ( 0.553 16.939 2.853) 17.187 6.782 ( 5.214 0.307 1.507) 5.436 6.911 ( -5.037 23.650 5.854) 24.879 7.360 ( 0.675 10.532 -1.846) 10.714 7.545 ( 1.617 8.573 9.211) 12.687 7.811 ( -2.565 19.364 14.245) 24.175 8.808 ( 0.949 -7.043 10.825) 12.949 8.987 ( 0.996 9.502 1.488) 9.669 10.161 ( -2.974 6.730 1.449) 7.499 10.214 ( -0.855 11.728 3.632) 12.307 10.909 ( -3.778 -4.421 -17.469) 18.412 11.269 ( 4.921 4.936 0.042) 6.970 12.314 ( -4.828 -12.531 5.874) 14.658 12.621 ( 0.112 4.556 4.885) 6.681 13.786 ( 2.194 2.898 -4.600) 5.863 13.928 ( -0.270 -0.534 -2.787) 2.851 14.270 ( -2.173 1.075 -4.939) 5.502 14.823 ( 0.289 -20.257 -3.549) 20.567 18.105 ( 13.186 -2.480 -7.717) 15.478 18.466 ( -5.428 -6.554 4.378) 9.570 19.245 ( -8.633 -2.936 -6.748) 11.344 19.492 ( -1.529 19.363 4.652) 19.972 19.711 ( 10.468 -4.091 7.238) 13.368 22.750 ( -1.296 -0.003 0.589) 1.424 24.051 ( 0.038 5.215 -2.248) 5.680 24.326 ( -2.172 -26.570 -11.099) 28.877 ======================= Grid point 125 (57/260) ======================= q-point: (-0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( -11.043 19.490 3.792) 22.719 2.530 ( -16.118 10.648 7.904) 20.872 3.267 ( 5.810 -9.841 -4.943) 12.451 3.425 ( -1.012 -3.033 -0.988) 3.347 3.746 ( -2.938 -7.863 7.697) 11.389 3.952 ( -6.173 -4.810 -11.233) 13.690 4.200 ( 0.260 5.185 -3.580) 6.306 4.441 ( -9.170 -2.118 -5.485) 10.893 4.978 ( 1.142 2.544 16.318) 16.554 5.663 ( -3.876 13.303 7.520) 15.765 5.934 ( -2.846 17.382 3.313) 17.922 6.778 ( -8.263 25.546 4.248) 27.183 6.853 ( 0.005 -5.577 2.591) 6.149 7.407 ( 3.518 14.850 3.289) 15.612 7.603 ( 3.456 7.092 7.387) 10.808 7.814 ( -0.299 12.714 11.644) 17.243 8.891 ( 4.965 -7.109 10.972) 13.985 9.050 ( 4.469 6.292 1.702) 7.903 9.923 ( -13.865 11.790 -4.300) 18.701 10.148 ( -12.642 4.835 5.553) 14.630 10.879 ( 4.320 2.040 -12.856) 13.715 11.386 ( 6.205 6.154 -4.342) 9.759 12.189 ( -7.852 -11.429 6.632) 15.371 12.674 ( 3.887 1.779 2.441) 4.923 13.694 ( -10.939 -2.474 -8.578) 14.120 13.942 ( 5.030 8.479 2.191) 10.100 14.219 ( -2.697 -3.257 -3.609) 5.560 14.969 ( 13.178 -18.369 -6.437) 23.505 18.275 ( -12.628 -13.469 2.165) 18.590 18.394 ( 14.827 2.188 -2.097) 15.134 19.041 ( -9.676 5.324 4.000) 11.746 19.530 ( 10.518 17.316 -12.214) 23.657 20.098 ( 19.939 -6.330 18.267) 27.773 22.736 ( -0.882 -4.587 -3.112) 5.613 23.931 ( -9.677 0.308 -3.549) 10.312 24.293 ( -0.293 -17.383 -11.912) 21.075 ======================= Grid point 126 (58/260) ======================= q-point: (-0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( -16.189 19.804 7.999) 26.801 2.177 ( -19.498 12.033 5.637) 23.596 3.281 ( -4.946 -3.860 -0.826) 6.328 3.369 ( -8.421 0.366 -5.103) 9.853 3.630 ( -4.886 -5.020 5.055) 8.639 3.791 ( -10.873 -7.548 -8.110) 15.523 4.126 ( 0.145 5.376 -2.849) 6.086 4.443 ( 5.045 0.185 -0.875) 5.124 4.973 ( -4.285 2.557 17.780) 18.467 5.584 ( -4.367 11.700 7.711) 14.677 5.866 ( -4.512 16.980 3.867) 17.990 6.634 ( -6.065 25.138 3.450) 26.089 6.750 ( -10.887 -7.268 -0.640) 13.106 7.493 ( 3.338 15.978 11.722) 20.096 7.700 ( 4.160 5.814 1.923) 7.403 7.831 ( 1.059 6.381 7.879) 10.194 9.005 ( 2.818 -7.865 5.503) 10.004 9.126 ( 1.688 1.448 0.609) 2.306 9.640 ( -13.118 11.082 -0.443) 17.178 9.828 ( -16.454 6.104 1.875) 17.649 10.996 ( 8.427 4.776 -9.472) 13.548 11.472 ( 3.120 5.145 -5.923) 8.443 12.045 ( -7.834 -11.233 9.905) 16.902 12.779 ( 6.827 3.685 -2.081) 8.033 13.439 ( -11.752 -0.841 -7.446) 13.937 14.078 ( 6.207 6.042 6.520) 10.842 14.165 ( -0.690 0.777 -6.087) 6.175 15.246 ( 14.839 -18.915 -8.736) 25.580 17.938 ( -19.936 -10.933 4.806) 23.240 18.673 ( 10.660 -3.806 -4.126) 12.048 19.035 ( 11.071 12.776 6.712) 18.189 19.793 ( 15.984 12.094 -9.813) 22.317 20.515 ( 18.227 -4.349 21.377) 28.428 22.639 ( -9.687 -14.936 -11.559) 21.226 23.738 ( -7.427 1.020 -2.172) 7.805 24.236 ( -3.593 -8.330 -12.349) 15.323 ======================= Grid point 127 (59/260) ======================= q-point: (-0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -16.031 19.135 12.537) 27.934 1.809 ( -18.185 17.155 6.869) 25.926 2.883 ( -27.417 20.475 4.506) 34.514 3.291 ( -0.821 -4.487 -3.380) 5.678 3.558 ( -10.566 -9.238 -0.735) 14.054 3.613 ( -0.704 -2.152 2.985) 3.747 4.182 ( 4.404 -1.201 -5.256) 6.962 4.514 ( 0.940 3.203 -0.368) 3.358 4.899 ( -5.307 0.819 18.071) 18.852 5.539 ( -1.562 9.103 7.936) 12.177 5.777 ( -4.898 15.602 4.270) 16.901 6.394 ( -22.646 -10.931 -3.341) 25.368 6.594 ( -0.096 26.989 2.231) 27.081 7.551 ( -0.439 18.960 16.376) 25.057 7.745 ( 1.301 -5.132 -5.835) 7.879 7.901 ( 3.779 11.622 5.156) 13.264 8.879 ( -12.976 -2.574 -11.792) 17.721 9.129 ( -5.447 -3.277 11.811) 13.413 9.411 ( -7.098 2.164 4.690) 8.778 9.676 ( 0.566 12.936 1.783) 13.071 11.154 ( 8.559 0.626 -8.428) 12.028 11.488 ( -0.634 1.447 -3.635) 3.963 11.920 ( -6.476 -9.173 11.015) 15.729 12.940 ( 9.795 6.722 -10.108) 15.598 13.239 ( -6.284 0.598 -2.582) 6.820 14.087 ( -2.229 -5.464 -1.072) 5.998 14.283 ( 9.151 13.499 1.323) 16.362 15.501 ( 12.137 -20.124 -10.038) 25.555 17.543 ( -19.975 -11.744 6.177) 23.980 18.911 ( 16.789 0.047 3.976) 17.253 19.379 ( 18.611 7.951 -0.721) 20.251 20.081 ( 13.352 9.609 -4.392) 17.027 20.887 ( 14.991 -2.154 20.851) 25.771 22.252 ( -26.462 -22.633 -19.889) 40.100 23.669 ( 0.274 4.244 0.266) 4.261 24.114 ( -5.881 -1.166 -12.784) 14.120 ======================= Grid point 128 (60/260) ======================= q-point: (-0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.403 ( -8.757 20.642 16.647) 27.927 1.487 ( -15.629 21.509 13.245) 29.705 2.414 ( -17.802 35.842 11.690) 41.692 3.288 ( 0.991 -5.004 -0.729) 5.153 3.380 ( -7.185 -12.616 3.801) 15.008 3.572 ( -3.579 1.466 0.805) 3.950 4.271 ( 5.645 -1.772 -6.253) 8.608 4.469 ( -4.828 4.027 4.443) 7.698 4.844 ( -3.650 -1.581 12.117) 12.754 5.536 ( -0.911 7.343 7.737) 10.706 5.697 ( -3.701 15.125 5.163) 16.405 5.877 ( -24.310 -7.457 -4.410) 25.808 6.654 ( 4.913 27.368 2.965) 27.963 7.544 ( -2.657 18.877 16.451) 25.180 7.714 ( -3.768 -0.020 -18.156) 18.543 7.962 ( 1.556 11.780 7.024) 13.803 8.646 ( -6.172 -1.854 -2.183) 6.805 8.961 ( -7.769 0.404 10.220) 12.844 9.414 ( 2.581 -2.330 5.110) 6.181 9.725 ( 2.114 10.555 2.595) 11.073 11.285 ( 4.760 -8.235 -5.263) 10.871 11.450 ( -1.361 -1.730 -1.248) 2.531 11.832 ( -4.358 -5.349 9.232) 11.525 13.009 ( -0.792 7.281 -16.358) 17.923 13.299 ( 11.816 -1.015 -0.027) 11.860 14.042 ( -1.821 -5.195 -2.428) 6.016 14.463 ( 8.337 12.004 0.740) 14.633 15.681 ( 7.611 -21.334 -11.041) 25.199 17.188 ( -16.747 -12.963 7.928) 22.614 19.368 ( 24.986 -1.534 6.399) 25.838 19.671 ( 9.512 1.215 -10.985) 14.581 20.270 ( 4.763 5.938 -0.931) 7.669 21.144 ( 6.030 -0.568 14.131) 15.374 21.621 ( -26.936 -13.259 -12.161) 32.392 23.701 ( 1.414 3.622 0.407) 3.910 24.000 ( -1.865 4.835 -11.556) 12.665 ======================= Grid point 129 (61/260) ======================= q-point: ( 0.00 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( -4.545 19.260 20.573) 28.546 1.854 ( 1.450 22.271 10.148) 24.516 2.968 ( -3.131 -14.318 6.918) 16.207 3.081 ( 3.335 26.792 7.230) 27.950 3.188 ( 3.808 -6.366 4.371) 8.610 3.544 ( -2.979 2.265 0.694) 3.807 4.226 ( 3.051 -7.051 -2.827) 8.186 4.585 ( -1.919 6.960 10.987) 13.147 4.776 ( -2.442 3.088 2.466) 4.645 5.530 ( -3.135 0.349 3.744) 4.896 5.623 ( 1.778 -1.702 -0.912) 2.625 6.069 ( 0.868 18.413 0.489) 18.440 7.246 ( 4.358 16.475 -2.000) 17.159 7.539 ( -4.055 -2.660 -7.866) 9.241 7.922 ( -4.722 15.424 5.598) 17.074 8.341 ( 5.079 8.007 6.571) 11.536 8.468 ( 0.758 5.318 13.314) 14.356 9.094 ( 4.486 7.379 10.607) 13.678 9.352 ( -0.144 -5.811 5.751) 8.177 10.013 ( 0.213 14.632 4.401) 15.281 10.856 ( -4.887 -24.307 3.757) 25.076 11.367 ( 3.090 -8.477 -1.178) 9.099 11.895 ( -2.846 14.594 0.853) 14.893 13.080 ( -0.569 2.555 -10.243) 10.572 13.401 ( 5.943 -6.268 -1.101) 8.707 13.908 ( 0.391 -4.183 -2.812) 5.055 14.720 ( 2.017 1.939 -4.940) 5.677 15.267 ( 0.672 -19.837 -9.577) 22.038 16.793 ( -5.541 -4.104 -0.094) 6.896 19.396 ( -17.721 -1.911 -14.345) 22.879 19.755 ( 9.966 -1.542 -12.240) 15.859 20.322 ( -3.765 3.069 -10.485) 11.556 21.181 ( -5.465 0.717 11.574) 12.819 21.428 ( 13.776 -5.171 12.037) 19.010 23.771 ( -1.348 3.205 0.255) 3.487 24.070 ( 3.264 0.036 -2.519) 4.123 ======================= Grid point 130 (62/260) ======================= q-point: ( 0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.788 ( 7.686 17.310 16.176) 24.908 1.966 ( 7.051 20.708 9.375) 23.799 3.005 ( 5.528 -13.168 4.067) 14.849 3.200 ( 5.585 8.466 7.909) 12.862 3.319 ( 7.535 0.991 3.640) 8.427 3.526 ( 2.768 5.779 4.046) 7.578 4.281 ( 2.948 -3.358 -0.411) 4.487 4.557 ( -3.228 2.164 10.574) 11.265 4.776 ( 2.052 7.012 1.702) 7.502 5.481 ( -2.774 2.193 -1.529) 3.853 5.807 ( 15.578 -5.720 -0.816) 16.615 6.123 ( 4.169 17.577 0.960) 18.091 7.300 ( 1.041 15.337 1.550) 15.450 7.447 ( -2.701 -0.130 -10.271) 10.621 7.848 ( -3.745 13.274 10.164) 17.133 8.460 ( 8.387 -5.005 3.568) 10.398 8.561 ( 2.515 26.820 13.099) 29.954 9.237 ( 3.623 -0.947 8.593) 9.374 9.362 ( 2.049 -4.472 9.921) 11.073 10.049 ( 3.870 17.020 6.686) 18.691 10.792 ( -1.465 -25.551 -0.605) 25.600 11.494 ( 9.258 -10.324 2.354) 14.066 11.802 ( -6.501 15.469 -1.453) 16.842 13.058 ( -0.568 -1.395 -8.482) 8.615 13.464 ( 1.067 -3.324 1.767) 3.913 13.921 ( 1.082 -2.026 -3.534) 4.215 14.702 ( -3.000 1.508 -2.973) 4.485 15.216 ( -4.086 -18.472 -9.610) 21.219 16.803 ( 6.996 -2.680 -5.494) 9.291 18.969 ( -17.732 2.893 -16.489) 24.386 19.789 ( -6.174 0.226 -3.786) 7.246 20.160 ( -9.875 1.197 -16.092) 18.918 20.982 ( -14.056 2.614 9.946) 17.416 21.897 ( 26.406 -13.067 12.617) 32.051 23.720 ( -3.604 3.241 -1.537) 5.084 24.147 ( 4.119 -2.161 -0.642) 4.696 ======================= Grid point 131 (63/260) ======================= q-point: ( 0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( 13.440 14.287 8.881) 21.532 2.154 ( 10.573 18.495 7.908) 22.724 3.149 ( 6.234 -11.523 -0.095) 13.102 3.318 ( 5.889 -3.609 7.235) 10.003 3.384 ( 0.179 -2.347 -3.122) 3.909 3.743 ( 14.070 5.393 12.664) 19.683 4.353 ( 4.487 2.220 2.519) 5.604 4.510 ( -2.019 2.665 3.307) 4.703 4.808 ( -1.569 5.520 8.354) 10.135 5.464 ( 3.304 6.399 -6.310) 9.575 6.106 ( 11.139 -0.329 -3.300) 11.622 6.244 ( 9.206 8.893 0.253) 12.802 7.311 ( 0.003 13.676 4.030) 14.258 7.412 ( 0.872 2.862 -8.504) 9.015 7.804 ( -2.772 11.095 11.726) 16.379 8.573 ( -2.406 28.132 13.629) 31.352 8.691 ( 10.855 -3.540 4.035) 12.110 9.224 ( -1.033 -1.781 1.816) 2.745 9.439 ( 0.774 0.055 8.646) 8.681 10.238 ( 13.005 15.903 11.470) 23.529 10.792 ( 1.450 -25.692 -4.367) 26.101 11.639 ( -9.081 16.179 -3.225) 18.831 11.722 ( 12.139 -9.661 6.435) 16.796 12.997 ( -5.016 -7.225 -4.422) 9.845 13.498 ( 3.133 2.633 1.813) 4.476 13.917 ( -1.085 1.138 -5.238) 5.469 14.609 ( -5.480 0.129 0.189) 5.484 15.073 ( -8.534 -15.173 -9.547) 19.854 17.033 ( 16.725 -2.398 -10.054) 19.661 18.716 ( -5.075 1.854 -8.631) 10.182 19.502 ( -20.288 3.763 -1.163) 20.667 19.915 ( -11.420 -4.963 -18.701) 22.467 20.724 ( -13.251 7.192 11.035) 18.684 22.400 ( 20.740 -16.023 9.195) 27.774 23.639 ( -3.330 1.499 -3.942) 5.374 24.212 ( 2.195 -4.131 -0.936) 4.771 ======================= Grid point 132 (64/260) ======================= q-point: ( 0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( 14.320 10.244 2.610) 17.799 2.410 ( 13.326 17.173 5.870) 22.516 3.188 ( -1.821 -7.190 -0.447) 7.430 3.348 ( -1.675 -7.335 0.917) 7.579 3.502 ( 9.075 -7.519 -0.055) 11.785 3.975 ( 5.706 -3.371 9.455) 11.547 4.475 ( 4.759 9.635 1.787) 10.894 4.514 ( 3.189 -0.747 1.942) 3.808 4.727 ( -6.107 4.702 10.662) 13.156 5.598 ( 9.960 8.894 -4.903) 14.224 6.235 ( 4.706 15.981 -1.105) 16.696 6.454 ( 9.929 -5.135 -3.136) 11.610 7.319 ( 0.243 12.269 2.781) 12.582 7.445 ( 3.159 4.870 -4.449) 7.314 7.775 ( -2.326 9.023 10.888) 14.331 8.520 ( -4.696 31.521 10.211) 33.464 8.768 ( -4.960 -7.267 13.418) 16.045 9.275 ( 0.499 8.032 1.790) 8.244 9.534 ( 14.770 -1.256 0.713) 14.840 10.528 ( 12.205 15.375 11.078) 22.540 10.809 ( 0.579 -23.638 -7.641) 24.849 11.451 ( -8.442 14.895 -3.728) 17.522 11.962 ( 9.673 -7.166 9.293) 15.208 12.852 ( -8.439 -9.244 0.626) 12.533 13.606 ( 7.215 3.322 -0.718) 7.975 13.864 ( -2.533 3.366 -7.160) 8.307 14.507 ( -4.631 -3.575 2.789) 6.482 14.846 ( -12.517 -11.206 -9.686) 19.393 17.389 ( 19.867 -2.498 -11.302) 22.993 18.704 ( 1.950 -1.780 -0.794) 2.757 19.110 ( -14.847 4.355 0.841) 15.496 19.633 ( -13.561 -8.417 -16.007) 22.605 20.489 ( -12.554 12.480 9.091) 19.900 22.715 ( 9.150 -9.694 6.115) 14.666 23.608 ( 1.887 -7.361 -6.215) 9.817 24.224 ( -0.649 -4.155 -2.030) 4.670 ======================= Grid point 133 (65/260) ======================= q-point: ( 0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.580 ( 10.116 8.323 0.152) 13.100 2.684 ( 13.393 14.532 1.593) 19.827 3.100 ( -6.519 -5.971 -1.278) 8.932 3.322 ( -1.198 -10.645 4.619) 11.665 3.629 ( 3.353 -6.211 -3.861) 8.045 4.040 ( 1.548 -1.749 1.992) 3.070 4.394 ( -10.458 3.450 -2.823) 11.369 4.589 ( 2.019 -3.212 1.634) 4.130 4.776 ( 6.913 5.753 16.034) 18.384 5.792 ( 9.210 10.170 -0.652) 13.736 6.318 ( 3.528 19.225 0.498) 19.553 6.612 ( 6.471 -4.870 -1.471) 8.231 7.336 ( 1.331 12.087 -0.469) 12.170 7.497 ( 2.232 5.615 -1.959) 6.352 7.741 ( -3.051 7.652 9.809) 12.809 8.427 ( -6.278 27.604 5.421) 28.823 8.665 ( -5.478 -4.066 17.121) 18.431 9.225 ( -3.829 9.073 5.459) 11.260 9.954 ( 22.461 2.364 0.383) 22.588 10.686 ( -1.258 17.107 10.203) 19.958 10.785 ( 1.245 -16.939 -16.064) 23.378 11.334 ( -1.825 9.863 -1.588) 10.155 12.099 ( 1.635 -5.530 9.345) 10.981 12.703 ( -6.063 -7.849 5.285) 11.238 13.748 ( 6.240 -0.618 -5.575) 8.390 13.823 ( 0.401 1.296 -5.688) 5.847 14.447 ( -1.977 -10.243 3.471) 10.994 14.559 ( -13.434 -2.905 -9.970) 16.980 17.746 ( 17.273 -2.515 -8.978) 19.628 18.609 ( -10.201 2.472 4.487) 11.415 19.117 ( 12.669 -4.181 5.264) 14.342 19.351 ( -11.007 -8.419 -11.874) 18.249 20.245 ( -13.126 17.361 3.861) 22.105 22.802 ( -0.028 -0.169 2.290) 2.296 23.684 ( 5.647 -21.082 -7.106) 22.953 24.186 ( -2.374 -0.691 -2.637) 3.615 ======================= Grid point 134 (66/260) ======================= q-point: (-0.50 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.691 ( 1.052 11.784 -2.571) 12.107 2.882 ( -3.806 5.332 4.925) 8.196 2.976 ( 3.782 -2.931 -5.604) 7.369 3.325 ( 0.473 -8.902 6.936) 11.295 3.627 ( -1.831 -5.338 -4.927) 7.492 4.051 ( -3.740 -1.710 -12.090) 12.771 4.191 ( -4.451 0.708 6.534) 7.937 4.581 ( -3.210 -2.049 -4.066) 5.571 4.935 ( 5.087 3.468 19.841) 20.775 5.935 ( 4.200 12.046 3.887) 13.336 6.364 ( 0.791 19.797 0.879) 19.833 6.700 ( 2.181 -5.534 2.152) 6.325 7.339 ( -2.531 14.390 -3.066) 14.929 7.541 ( 3.749 5.898 -2.761) 7.515 7.702 ( -1.920 6.006 10.803) 12.509 8.292 ( -7.417 16.788 2.793) 18.565 8.660 ( 1.780 3.235 17.417) 17.804 9.175 ( -1.988 7.365 5.606) 9.467 10.265 ( 4.070 3.570 4.502) 7.041 10.546 ( -10.106 9.369 -4.298) 14.435 10.827 ( 5.792 0.245 -7.778) 9.701 11.375 ( 5.119 6.458 -1.425) 8.363 12.061 ( -5.916 -6.745 7.957) 11.992 12.651 ( -0.399 -4.364 7.279) 8.497 13.784 ( -1.974 -1.832 -7.597) 8.060 13.869 ( 4.715 -4.189 -5.211) 8.182 14.269 ( -10.401 -13.633 -7.336) 18.651 14.516 ( 6.416 2.443 -0.238) 6.870 18.021 ( 10.446 -4.809 -3.986) 12.171 18.440 ( -6.538 3.671 4.216) 8.602 19.162 ( -4.251 -4.001 -4.618) 7.444 19.489 ( 19.280 -9.876 12.034) 24.781 20.010 ( -8.999 21.461 -4.467) 23.696 22.757 ( -4.190 0.290 -2.574) 4.926 23.751 ( 1.443 -25.835 -6.621) 26.709 24.147 ( -0.455 3.579 -2.903) 4.630 ======================= Grid point 135 (67/260) ======================= q-point: (-0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( -9.384 15.343 -1.842) 18.079 2.650 ( -13.534 2.175 2.188) 13.881 3.121 ( 5.900 -2.206 -0.726) 6.340 3.354 ( 1.291 -3.779 3.749) 5.477 3.585 ( -1.351 -6.902 -1.561) 7.204 3.825 ( -12.445 -6.856 -9.952) 17.347 4.281 ( 8.071 1.015 2.083) 8.397 4.454 ( -8.026 4.044 -5.514) 10.544 5.026 ( -0.025 1.873 20.802) 20.886 5.950 ( -3.620 13.537 5.928) 15.215 6.352 ( -2.156 20.479 0.875) 20.611 6.696 ( -3.647 -8.648 2.994) 9.852 7.226 ( -6.530 16.231 -2.926) 17.739 7.608 ( 1.551 3.749 1.372) 4.283 7.735 ( 3.572 5.070 6.397) 8.910 8.173 ( -4.148 14.091 2.734) 14.941 8.764 ( 4.802 2.726 13.963) 15.015 9.164 ( -0.277 4.350 4.027) 5.935 10.121 ( -15.885 2.795 6.614) 17.432 10.314 ( -11.611 10.479 -7.473) 17.334 10.978 ( 7.384 4.140 -2.178) 8.741 11.483 ( 5.168 3.488 -4.175) 7.503 11.945 ( -6.199 -4.688 9.875) 12.567 12.699 ( 4.074 -2.475 3.361) 5.832 13.636 ( -9.833 -2.266 -9.271) 13.703 13.980 ( 4.788 -3.452 -0.137) 5.904 14.145 ( 0.731 -9.617 -9.538) 13.565 14.696 ( 10.988 -2.773 -3.224) 11.782 18.038 ( -9.391 -8.391 4.142) 13.257 18.441 ( 6.263 1.250 -4.979) 8.098 19.149 ( 3.159 6.553 7.510) 10.456 19.846 ( 10.124 0.797 -0.683) 10.178 19.998 ( 13.607 7.219 6.177) 16.595 22.613 ( -9.895 -7.440 -9.403) 15.547 23.729 ( -1.708 -14.854 -3.117) 15.274 24.152 ( 0.909 1.013 -4.558) 4.756 ======================= Grid point 136 (68/260) ======================= q-point: (-0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( -16.586 10.067 0.904) 19.423 2.425 ( -12.366 16.056 5.398) 20.973 3.178 ( 0.257 -5.200 0.326) 5.217 3.382 ( -1.300 0.307 -0.230) 1.355 3.523 ( -5.543 -6.407 2.884) 8.950 3.606 ( -6.280 -7.899 -5.303) 11.399 4.282 ( -7.365 7.990 -3.629) 11.456 4.454 ( 8.399 0.759 -1.495) 8.565 5.004 ( -5.374 0.775 19.877) 20.605 5.836 ( -7.889 11.670 6.112) 15.355 6.286 ( -4.416 21.199 0.158) 21.655 6.534 ( -13.501 -10.619 1.182) 17.217 7.122 ( -2.927 18.131 -2.502) 18.535 7.624 ( 0.425 -0.984 -0.136) 1.081 7.797 ( 0.691 4.383 9.776) 10.736 8.167 ( 2.921 16.097 1.842) 16.463 8.854 ( 0.993 -1.675 7.010) 7.276 9.159 ( -1.138 2.514 3.111) 4.159 9.762 ( -19.880 1.630 9.291) 22.004 10.097 ( -8.084 15.304 -4.598) 17.908 11.057 ( 0.783 -4.288 -0.468) 4.384 11.530 ( -0.098 0.266 -4.578) 4.587 11.879 ( -2.098 3.126 11.416) 12.021 12.823 ( 8.189 -1.703 -1.738) 8.543 13.421 ( -9.290 -0.175 -9.763) 13.478 13.991 ( -1.699 -7.253 -0.438) 7.462 14.280 ( 11.147 -0.543 -7.148) 13.253 14.911 ( 10.986 -8.821 -6.253) 15.414 17.753 ( -18.736 -6.471 5.940) 20.693 18.586 ( 10.057 -4.128 -6.824) 12.835 19.323 ( 11.873 14.134 8.201) 20.199 20.031 ( 12.162 9.698 -12.429) 19.911 20.399 ( 19.915 -6.426 23.442) 31.423 22.312 ( -18.191 -15.035 -15.946) 28.482 23.708 ( 0.235 -2.852 0.323) 2.880 24.144 ( -1.006 -1.148 -6.271) 6.454 ======================= Grid point 137 (69/260) ======================= q-point: (-0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.014 ( -13.037 15.942 5.326) 21.271 2.178 ( -13.615 18.332 10.429) 25.104 3.158 ( -1.891 -5.984 -0.461) 6.292 3.225 ( -10.441 -0.212 4.490) 11.368 3.379 ( -11.508 1.334 -0.486) 11.596 3.583 ( 2.199 -0.718 3.853) 4.494 4.179 ( -2.135 0.734 -4.534) 5.065 4.583 ( 4.276 3.184 -2.199) 5.767 4.911 ( -6.563 0.564 18.711) 19.837 5.700 ( -6.059 6.085 5.174) 10.025 6.170 ( -18.085 -3.499 -3.514) 18.752 6.190 ( -8.914 15.495 1.639) 17.950 7.103 ( 1.287 19.312 -2.086) 19.467 7.624 ( -0.112 -5.149 -3.304) 6.119 7.840 ( 2.663 8.340 12.510) 15.269 8.243 ( 2.800 15.100 3.110) 15.669 8.772 ( -9.577 -4.515 -2.126) 10.799 9.137 ( -2.523 4.973 7.957) 9.717 9.435 ( -12.445 0.695 8.558) 15.119 10.000 ( -1.684 15.528 0.886) 15.644 11.028 ( -3.209 -14.747 1.896) 15.211 11.470 ( -4.618 -2.933 -2.795) 6.143 11.890 ( 0.790 10.436 8.299) 13.357 13.011 ( 11.023 -1.642 -5.656) 12.498 13.250 ( -6.166 1.438 -8.491) 10.592 13.953 ( -1.683 -7.044 -2.383) 7.624 14.486 ( 9.987 3.031 -5.013) 11.578 15.097 ( 8.838 -14.458 -8.240) 18.842 17.363 ( -20.342 -5.853 5.147) 21.784 18.869 ( 19.726 -2.752 -3.180) 20.169 19.576 ( 11.151 9.653 -0.524) 14.758 20.245 ( 9.925 5.663 -8.626) 14.317 20.828 ( 17.992 -3.460 24.590) 30.665 21.855 ( -23.716 -14.664 -16.969) 32.641 23.735 ( 1.925 2.176 1.412) 3.230 24.094 ( -2.426 -0.676 -6.922) 7.366 ======================= Grid point 138 (70/260) ======================= q-point: (-0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.829 ( -7.711 19.462 14.088) 25.233 1.935 ( -11.710 20.462 11.980) 26.445 3.056 ( -5.904 -2.207 7.798) 10.027 3.122 ( -6.118 6.390 -0.178) 8.849 3.161 ( -4.574 1.106 5.118) 6.952 3.598 ( -1.830 0.983 3.124) 3.752 4.175 ( 2.282 -6.478 -5.443) 8.763 4.609 ( -1.209 7.890 3.537) 8.730 4.833 ( -4.176 0.191 12.062) 12.766 5.621 ( -3.291 1.559 4.739) 5.977 5.752 ( -17.254 -4.537 -2.061) 17.959 6.094 ( -3.310 20.097 -0.336) 20.370 7.158 ( 4.301 18.248 -2.570) 18.923 7.605 ( -1.493 -4.439 -3.658) 5.943 7.937 ( 3.489 13.046 7.618) 15.505 8.263 ( -0.319 13.390 5.918) 14.643 8.555 ( -9.663 -4.553 3.853) 11.355 9.071 ( -3.588 10.563 8.968) 14.314 9.340 ( -0.561 -4.181 6.068) 7.391 10.000 ( 0.448 13.914 3.448) 14.341 10.951 ( -4.968 -21.360 4.756) 22.440 11.376 ( -3.255 -5.544 -2.510) 6.902 11.915 ( 0.165 13.507 4.113) 14.120 13.129 ( -1.945 3.825 -13.021) 13.710 13.238 ( 9.532 -5.074 -1.082) 10.852 13.920 ( -1.026 -5.925 -2.768) 6.620 14.643 ( 6.476 3.113 -5.103) 8.813 15.224 ( 5.248 -18.387 -9.211) 21.225 17.006 ( -15.437 -5.463 3.372) 16.719 19.317 ( 22.608 -2.544 0.511) 22.756 19.701 ( 1.252 1.335 -14.757) 14.870 20.357 ( 2.306 2.473 -7.754) 8.459 21.136 ( 7.471 -0.176 17.325) 18.868 21.420 ( -13.505 -6.480 -3.782) 15.449 23.772 ( 1.098 3.017 1.234) 3.439 24.048 ( -0.470 0.572 -5.599) 5.648 ======================= Grid point 139 (71/260) ======================= q-point: ( 0.00 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -5.236 15.713 16.496) 23.376 2.236 ( 1.622 11.565 9.443) 15.018 2.634 ( -2.581 -13.956 9.656) 17.166 2.979 ( 2.659 -7.764 5.159) 9.694 3.501 ( -4.946 4.361 -1.381) 6.737 3.691 ( 3.633 14.075 4.429) 15.196 4.056 ( 5.993 -8.816 -3.958) 11.371 4.673 ( -7.051 1.844 19.045) 20.392 4.866 ( 2.284 3.581 -0.256) 4.255 5.530 ( -3.966 -0.111 1.421) 4.215 5.579 ( 2.357 -1.770 -1.151) 3.164 6.377 ( -0.473 8.794 -3.602) 9.515 7.430 ( 3.582 2.801 -9.931) 10.923 7.501 ( -2.738 -0.778 -2.662) 3.898 8.133 ( -5.830 4.765 2.951) 8.087 8.295 ( -1.102 -2.626 13.594) 13.889 8.724 ( 16.809 6.753 18.011) 25.545 9.230 ( -1.741 -2.053 4.678) 5.397 9.426 ( -1.388 20.804 7.909) 22.300 10.081 ( -0.714 -17.173 8.594) 19.217 10.529 ( -4.539 1.814 4.194) 6.441 11.181 ( 1.062 -7.494 -2.068) 7.846 12.264 ( -2.470 15.830 -2.297) 16.186 13.051 ( -3.949 -5.514 -10.037) 12.114 13.271 ( 7.837 -3.813 1.249) 8.805 13.845 ( 1.783 -1.590 -1.841) 3.016 14.622 ( 1.054 -6.788 -7.551) 10.209 15.064 ( 1.109 -1.647 -8.461) 8.690 16.737 ( -4.401 -1.318 -2.300) 5.138 19.363 ( -14.934 -0.932 -12.574) 19.545 19.732 ( 10.692 -0.572 -15.542) 18.873 20.366 ( -3.118 1.060 -13.820) 14.207 21.197 ( -5.434 0.568 12.866) 13.978 21.351 ( 9.696 -2.053 12.718) 16.124 23.823 ( -1.284 1.410 1.005) 2.156 24.062 ( 2.141 -0.443 -1.424) 2.609 ======================= Grid point 140 (72/260) ======================= q-point: ( 0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( 5.254 13.019 11.553) 18.181 2.325 ( 4.921 11.341 8.995) 15.289 2.704 ( 7.810 -12.129 7.001) 16.035 3.072 ( 4.882 -7.297 6.186) 10.740 3.419 ( -2.874 1.265 -4.564) 5.540 3.765 ( 2.594 9.898 8.634) 13.389 4.207 ( 9.199 -2.952 -0.773) 9.692 4.598 ( -3.287 1.494 16.105) 16.505 4.901 ( 0.616 3.660 2.362) 4.400 5.515 ( 2.074 1.163 -4.862) 5.412 5.701 ( 9.941 -3.600 0.059) 10.573 6.415 ( 4.555 8.148 -3.715) 10.047 7.427 ( -1.324 1.399 -4.617) 5.003 7.489 ( 1.448 1.314 -6.500) 6.788 8.023 ( -5.534 3.780 8.123) 10.531 8.372 ( 7.304 -2.230 12.697) 14.817 9.116 ( 14.226 15.217 19.381) 28.453 9.190 ( -1.858 -2.283 5.721) 6.434 9.415 ( -0.726 15.592 7.729) 17.418 10.099 ( 1.149 -24.858 8.307) 26.235 10.482 ( 0.230 7.755 0.984) 7.820 11.286 ( 9.446 -8.016 0.096) 12.389 12.175 ( -5.838 15.706 -4.820) 17.435 12.937 ( -6.016 -8.068 -6.913) 12.210 13.420 ( 6.968 -0.846 1.503) 7.178 13.880 ( 1.777 -1.554 -0.698) 2.462 14.582 ( -3.763 -7.359 -7.020) 10.844 15.048 ( -1.391 -0.718 -8.260) 8.407 16.762 ( 7.626 -1.028 -6.588) 10.129 19.000 ( -15.744 0.517 -16.786) 23.020 19.792 ( -3.265 0.109 -6.798) 7.542 20.176 ( -13.636 0.388 -18.377) 22.887 21.028 ( -11.279 1.380 11.364) 16.070 21.707 ( 21.079 -4.781 13.199) 25.325 23.770 ( -4.090 1.332 -0.742) 4.365 24.113 ( 2.780 -0.920 -0.214) 2.937 ======================= Grid point 141 (73/260) ======================= q-point: ( 0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.316 ( 11.092 11.195 5.263) 16.615 2.458 ( 7.450 7.630 7.431) 12.997 2.927 ( 11.981 -6.904 3.181) 14.189 3.162 ( 2.822 -7.561 4.550) 9.265 3.356 ( -2.727 -0.562 -5.086) 5.799 3.835 ( 2.897 2.152 12.223) 12.745 4.390 ( 8.153 0.846 1.755) 8.383 4.603 ( 1.466 4.481 10.609) 11.610 4.874 ( -4.530 0.838 5.694) 7.324 5.597 ( 7.678 5.348 -10.409) 13.997 5.947 ( 13.960 -6.915 -0.537) 15.588 6.519 ( 5.886 8.629 -3.109) 10.899 7.430 ( 2.185 2.731 -2.839) 4.505 7.489 ( -0.014 0.877 -4.100) 4.193 7.940 ( -4.746 2.580 11.206) 12.440 8.594 ( 9.047 -2.660 15.258) 17.937 9.119 ( 0.383 4.920 0.605) 4.972 9.341 ( 2.867 27.204 8.546) 28.658 9.452 ( 1.740 0.840 14.089) 14.221 10.148 ( 2.001 -31.538 4.653) 31.942 10.586 ( 10.272 11.782 5.009) 16.414 11.533 ( 14.262 -7.136 3.351) 16.296 12.017 ( -8.887 15.485 -6.994) 19.175 12.786 ( -8.306 -10.084 -3.596) 13.550 13.559 ( 6.802 2.527 1.438) 7.397 13.904 ( 0.430 -1.851 -0.355) 1.933 14.451 ( -8.076 -8.042 -5.692) 12.739 14.974 ( -4.750 0.782 -8.309) 9.603 16.999 ( 16.867 -0.830 -9.440) 19.346 18.741 ( -7.339 0.529 -9.919) 12.350 19.597 ( -14.946 4.499 -5.403) 16.517 19.798 ( -18.592 -5.100 -18.617) 26.801 20.846 ( -8.911 3.542 11.307) 14.825 22.151 ( 20.445 -6.650 10.100) 23.754 23.657 ( -6.847 0.351 -3.456) 7.678 24.161 ( 2.013 -1.018 -0.781) 2.387 ======================= Grid point 142 (74/260) ======================= q-point: ( 0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( 10.328 10.187 2.818) 14.778 2.664 ( 11.939 3.153 4.221) 13.050 3.071 ( 0.331 0.304 -0.248) 0.513 3.203 ( -1.391 -7.581 0.096) 7.708 3.354 ( 6.985 -4.837 -4.175) 9.467 3.921 ( 3.326 -1.408 12.212) 12.735 4.506 ( 3.362 -0.073 1.180) 3.563 4.666 ( -1.910 7.466 5.217) 9.306 4.766 ( -2.868 -1.317 10.016) 10.502 5.768 ( 10.731 5.967 -9.912) 15.780 6.225 ( 13.639 -5.680 -0.411) 14.780 6.621 ( 4.678 9.100 -1.738) 10.378 7.449 ( 0.179 2.513 -2.745) 3.726 7.527 ( 4.160 1.709 -2.501) 5.146 7.874 ( -3.847 1.462 11.962) 12.650 8.614 ( -8.659 -4.508 12.592) 15.933 9.247 ( 4.423 30.314 7.694) 31.586 9.436 ( -1.932 8.124 12.939) 15.400 9.499 ( 15.808 -0.733 -1.652) 15.911 10.183 ( 1.108 -32.238 0.119) 32.257 10.862 ( 14.143 12.217 10.115) 21.251 11.766 ( -3.007 4.761 -12.608) 13.808 11.865 ( 5.749 4.170 9.390) 11.773 12.601 ( -9.494 -10.987 -0.368) 14.526 13.694 ( 6.453 4.419 0.400) 7.831 13.888 ( -2.011 -1.010 -1.624) 2.775 14.258 ( -9.875 -10.723 -3.174) 14.919 14.834 ( -7.436 2.547 -8.799) 11.798 17.360 ( 20.077 -0.487 -9.131) 22.061 18.671 ( 0.451 -0.989 -0.970) 1.457 19.244 ( -15.999 8.191 -6.905) 19.255 19.438 ( -15.069 -9.712 -12.638) 21.934 20.698 ( -8.197 5.967 8.358) 13.140 22.532 ( 16.042 -5.776 7.650) 18.688 23.491 ( -8.593 -2.957 -6.802) 11.351 24.189 ( 1.052 -0.361 -1.854) 2.162 ======================= Grid point 143 (75/260) ======================= q-point: ( 0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.725 ( 6.895 7.009 2.158) 10.066 2.886 ( 6.250 -3.577 3.727) 8.109 3.035 ( -0.116 5.776 -4.032) 7.045 3.147 ( -1.259 -5.108 -0.466) 5.282 3.506 ( 6.004 -4.931 -8.666) 11.639 4.001 ( 2.881 -1.316 5.599) 6.433 4.454 ( -14.558 1.791 2.885) 14.949 4.553 ( 1.314 -0.653 -0.004) 1.467 4.864 ( 5.383 2.262 16.240) 17.258 5.971 ( 10.619 5.684 -4.767) 12.953 6.458 ( 8.858 -3.323 0.978) 9.511 6.695 ( 2.779 9.106 0.365) 9.528 7.469 ( 2.947 2.129 -5.023) 6.200 7.592 ( 2.130 2.797 -0.990) 3.653 7.831 ( -2.561 1.511 10.308) 10.728 8.404 ( -12.616 -6.382 7.679) 16.089 9.268 ( -2.177 36.660 8.734) 37.749 9.358 ( -4.642 3.787 9.266) 11.034 9.976 ( 24.927 -2.448 3.809) 25.335 10.189 ( -0.617 -30.059 -1.367) 30.096 11.115 ( 8.140 15.363 7.920) 19.105 11.570 ( -7.503 7.706 -16.266) 19.500 12.062 ( 5.488 2.222 11.827) 13.226 12.440 ( -5.682 -13.494 4.388) 15.285 13.791 ( 2.268 4.418 -4.079) 6.427 13.821 ( -3.060 -0.602 -3.566) 4.738 14.078 ( -7.473 -13.945 -0.662) 15.836 14.682 ( -5.076 4.338 -7.919) 10.359 17.721 ( 16.480 -0.248 -5.476) 17.368 18.669 ( -3.920 2.214 3.733) 5.849 19.071 ( 1.819 1.005 -0.998) 2.305 19.173 ( -8.353 -7.731 -8.164) 14.007 20.539 ( -8.850 8.473 2.504) 12.505 22.788 ( 7.026 -0.969 3.958) 8.122 23.325 ( -5.048 -9.819 -8.131) 13.712 24.199 ( 0.429 0.660 -2.610) 2.727 ======================= Grid point 144 (76/260) ======================= q-point: (-0.50 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( -2.222 -0.460 -2.531) 3.399 2.843 ( -4.670 -0.767 2.409) 5.310 3.132 ( 6.737 0.645 3.181) 7.478 3.204 ( 5.250 4.917 -1.953) 7.453 3.522 ( -2.182 -4.876 -11.491) 12.672 4.000 ( -7.696 -2.051 -11.409) 13.914 4.207 ( -5.323 0.486 11.341) 12.537 4.569 ( 0.094 0.157 -1.333) 1.345 4.990 ( 3.499 1.459 20.512) 20.859 6.151 ( 6.998 7.168 1.538) 10.135 6.555 ( 0.417 -4.074 1.735) 4.447 6.730 ( 0.457 9.468 2.561) 9.819 7.527 ( 1.878 3.918 -6.446) 7.774 7.612 ( 0.786 1.544 -1.257) 2.141 7.805 ( -1.556 3.911 8.793) 9.748 8.193 ( -8.225 -9.746 3.287) 13.170 9.199 ( -5.678 19.259 12.709) 23.763 9.329 ( 0.077 18.567 2.195) 18.697 10.140 ( -4.530 -26.788 0.757) 27.179 10.354 ( 9.049 -1.974 7.893) 12.169 11.175 ( -1.318 19.076 0.628) 19.132 11.484 ( 0.746 -1.076 -13.804) 13.866 12.097 ( -1.356 11.127 9.764) 14.866 12.430 ( 2.209 -15.685 10.511) 19.010 13.753 ( -1.911 -0.498 -7.510) 7.765 13.801 ( 0.045 -1.795 -8.362) 8.553 13.947 ( -5.587 -10.419 -0.791) 11.849 14.650 ( 3.140 4.526 -4.855) 7.343 17.950 ( 5.883 -1.635 0.009) 6.106 18.536 ( -7.232 3.442 -2.895) 8.517 19.131 ( 5.107 2.370 2.556) 6.183 19.270 ( 14.792 -9.789 9.341) 20.047 20.368 ( -7.456 10.223 -5.368) 13.745 22.747 ( -9.948 -1.062 -7.611) 12.571 23.344 ( 6.956 -10.655 -0.816) 12.751 24.198 ( -0.079 1.211 -3.180) 3.404 ======================= Grid point 145 (77/260) ======================= q-point: (-0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( -10.006 -1.334 -2.619) 10.429 2.821 ( -0.724 3.179 1.762) 3.706 3.227 ( -3.595 10.427 -2.872) 11.397 3.283 ( 6.565 -1.801 6.218) 9.220 3.445 ( -1.828 -7.822 -5.233) 9.587 3.691 ( -16.582 -4.502 -9.275) 19.526 4.280 ( 7.386 -0.282 1.034) 7.463 4.541 ( -2.934 2.676 -1.749) 4.340 5.053 ( -1.341 0.664 21.415) 21.467 6.215 ( -2.155 11.073 5.214) 12.427 6.489 ( -6.834 -9.124 1.350) 11.479 6.722 ( -1.773 10.674 3.259) 11.300 7.476 ( -4.465 7.809 -4.700) 10.149 7.613 ( -1.072 -2.111 -2.202) 3.233 7.819 ( 1.088 3.136 8.598) 9.217 8.129 ( 1.570 -8.757 -1.875) 9.092 9.110 ( -5.148 10.078 7.902) 13.803 9.345 ( 0.835 22.369 3.460) 22.650 9.992 ( -11.232 -17.564 5.249) 21.499 10.360 ( -6.399 -3.116 4.137) 8.233 11.105 ( -7.280 9.031 6.005) 13.061 11.500 ( 2.589 -3.142 -12.125) 12.791 12.120 ( 1.882 18.381 9.799) 20.914 12.521 ( 5.266 -14.624 7.572) 17.290 13.620 ( -8.197 0.750 -11.152) 13.861 13.857 ( -0.248 -10.334 -5.137) 11.544 13.914 ( 8.918 -2.857 -5.658) 10.941 14.753 ( 6.949 3.236 -4.400) 8.838 17.929 ( -8.299 -2.288 4.936) 9.923 18.440 ( -0.447 -0.655 -7.963) 8.003 19.337 ( 12.401 10.249 9.577) 18.723 19.652 ( 21.202 -11.171 16.980) 29.371 20.257 ( -1.507 8.531 -10.713) 13.778 22.454 ( -16.392 -5.634 -14.276) 22.455 23.509 ( 8.269 -5.135 2.389) 10.022 24.181 ( -1.010 0.914 -4.072) 4.294 ======================= Grid point 146 (78/260) ======================= q-point: (-0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( -9.355 2.551 -0.839) 9.732 2.762 ( -7.107 12.082 5.459) 15.043 3.097 ( -6.279 -1.510 -1.249) 6.577 3.287 ( -14.283 -9.143 4.013) 17.427 3.439 ( 4.878 0.940 0.217) 4.973 3.502 ( 2.072 -3.182 -3.773) 5.353 4.417 ( -4.986 4.349 -3.299) 7.393 4.463 ( 6.217 -0.355 -2.727) 6.798 5.014 ( -5.719 0.220 20.339) 21.129 6.065 ( -12.821 9.832 2.413) 16.336 6.308 ( -11.780 -9.814 3.661) 15.763 6.669 ( -4.132 11.633 1.678) 12.458 7.395 ( -2.123 7.869 -5.086) 9.607 7.575 ( -1.742 -2.726 -3.875) 5.048 7.859 ( 1.532 1.596 11.636) 11.845 8.206 ( 5.234 -5.855 -2.378) 8.206 9.001 ( -7.305 5.251 0.613) 9.017 9.368 ( 0.323 20.465 6.864) 21.588 9.728 ( -15.301 -6.977 9.221) 19.179 10.227 ( -6.241 -4.656 1.736) 7.978 10.929 ( -10.441 -0.979 8.677) 13.611 11.494 ( -2.530 -2.815 -5.889) 7.000 12.185 ( 2.809 19.490 7.559) 21.092 12.670 ( 8.731 -12.261 2.630) 15.280 13.439 ( -7.428 1.311 -12.287) 14.417 13.830 ( -0.768 -6.357 -3.269) 7.189 14.158 ( 14.336 -5.319 -8.061) 17.285 14.881 ( 6.386 1.594 -5.863) 8.815 17.667 ( -18.014 -1.897 6.176) 19.137 18.518 ( 10.251 -1.923 -8.121) 13.219 19.587 ( 10.264 8.920 7.047) 15.316 20.134 ( 20.193 -1.006 4.893) 20.802 20.304 ( 10.400 -0.655 6.726) 12.403 22.068 ( -19.360 -6.740 -16.440) 26.277 23.660 ( 6.240 -1.292 2.820) 6.969 24.141 ( -2.139 0.217 -5.190) 5.618 ======================= Grid point 147 (79/260) ======================= q-point: (-0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( -6.275 7.235 2.633) 9.932 2.561 ( -13.592 16.859 12.781) 25.146 2.974 ( -10.536 -14.318 5.862) 18.718 3.028 ( -6.956 -4.927 -1.090) 8.594 3.537 ( 4.621 5.020 -1.393) 6.964 3.576 ( 3.362 -0.217 4.630) 5.726 4.200 ( -12.266 0.822 -4.877) 13.225 4.637 ( 8.746 1.620 -3.607) 9.598 4.923 ( -6.688 0.405 19.742) 20.848 5.792 ( -12.718 2.468 -2.068) 13.120 6.026 ( -17.003 -4.107 5.102) 18.221 6.565 ( -6.147 11.601 -0.760) 13.151 7.370 ( 0.367 6.064 -7.124) 9.362 7.548 ( -0.264 -1.735 -1.809) 2.520 7.947 ( 5.822 2.375 11.105) 12.762 8.292 ( 2.705 -4.957 3.684) 6.742 8.806 ( -11.733 3.122 -3.722) 12.698 9.359 ( -4.166 9.089 11.865) 15.516 9.489 ( -7.702 8.892 5.706) 13.074 10.134 ( -3.564 -6.784 3.696) 8.508 10.755 ( -8.357 -4.303 9.485) 13.354 11.383 ( -7.162 -4.009 -2.485) 8.575 12.249 ( 2.385 17.935 3.951) 18.519 12.865 ( 10.305 -10.429 -0.109) 14.662 13.290 ( -5.497 1.429 -11.633) 12.946 13.817 ( 0.092 -4.541 -3.701) 5.859 14.406 ( 11.282 -5.493 -7.751) 14.750 14.979 ( 4.615 -0.126 -7.367) 8.694 17.285 ( -20.070 -1.757 4.538) 20.652 18.823 ( 21.175 -1.242 -5.863) 22.007 19.743 ( 4.230 4.986 -1.120) 6.634 20.315 ( 6.203 1.283 -14.274) 15.616 20.758 ( 22.251 -2.365 27.586) 35.520 21.650 ( -19.065 -4.751 -12.914) 23.512 23.764 ( 3.790 0.674 2.521) 4.602 24.085 ( -2.264 -0.213 -5.564) 6.011 ======================= Grid point 148 (80/260) ======================= q-point: (-0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.186 ( -3.436 12.353 8.558) 15.415 2.313 ( -12.403 14.189 15.360) 24.313 2.756 ( -10.399 -13.829 9.340) 19.663 2.962 ( -1.444 -7.131 1.865) 7.511 3.588 ( -1.624 10.431 2.184) 10.780 3.623 ( 1.932 5.467 2.902) 6.484 4.017 ( -2.722 -7.747 -6.935) 10.748 4.759 ( 0.746 5.693 5.488) 7.943 4.831 ( -3.195 -1.106 12.247) 12.705 5.606 ( -4.986 -1.759 -3.038) 6.098 5.705 ( -14.163 -0.352 4.198) 14.777 6.443 ( -5.157 10.397 -2.546) 11.881 7.382 ( 2.408 3.837 -9.734) 10.736 7.543 ( -0.833 -0.972 0.065) 1.282 8.122 ( 7.917 4.429 7.484) 11.760 8.313 ( -1.675 -3.621 11.108) 11.803 8.585 ( -6.883 3.229 2.455) 7.989 9.269 ( -4.138 -1.897 7.426) 8.710 9.438 ( -1.247 21.406 6.900) 22.525 10.092 ( -1.759 -11.216 6.596) 13.131 10.627 ( -6.291 -2.799 8.039) 10.584 11.239 ( -5.825 -5.714 -2.110) 8.428 12.284 ( 0.496 16.553 0.571) 16.570 13.058 ( 8.170 -9.813 -3.564) 13.257 13.184 ( -2.564 0.902 -7.601) 8.072 13.821 ( 0.989 -2.765 -3.090) 4.263 14.565 ( 6.061 -6.015 -7.672) 11.480 15.039 ( 2.886 -1.435 -8.256) 8.863 16.934 ( -14.756 -1.611 1.602) 14.930 19.277 ( 22.241 -1.026 -1.700) 22.329 19.722 ( -4.792 0.530 -17.091) 17.758 20.384 ( 2.858 0.463 -12.582) 12.910 21.133 ( 9.661 -0.123 20.119) 22.319 21.335 ( -9.181 -1.822 0.322) 9.365 23.819 ( 1.327 1.281 1.968) 2.697 24.047 ( -0.355 -0.235 -4.056) 4.078 ======================= Grid point 189 (81/260) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.980 ( 0.149 0.000 24.513) 24.514 1.076 ( 14.193 0.000 26.439) 30.008 2.282 ( 5.804 0.000 52.530) 52.849 3.289 ( -1.381 0.000 -8.396) 8.509 3.333 ( 3.508 0.000 -7.462) 8.246 3.709 ( 3.798 0.000 1.303) 4.016 4.258 ( 1.149 0.000 2.754) 2.984 4.318 ( -0.353 0.000 -1.737) 1.773 5.200 ( -20.068 0.000 1.911) 20.159 5.444 ( -4.005 0.000 11.500) 12.177 5.616 ( 4.324 0.000 7.747) 8.872 5.961 ( 5.855 0.000 23.026) 23.759 6.180 ( 2.072 0.000 4.559) 5.007 6.641 ( 0.830 0.000 4.069) 4.153 7.375 ( -6.232 0.000 23.002) 23.831 7.919 ( 0.362 0.000 12.991) 12.996 8.793 ( -6.380 0.000 -9.024) 11.052 9.000 ( 16.630 0.000 -3.864) 17.073 9.435 ( 1.165 0.000 -10.545) 10.610 9.887 ( 6.162 0.000 15.085) 16.295 11.235 ( 2.828 0.000 -21.398) 21.584 11.436 ( 3.913 0.000 -5.711) 6.923 11.585 ( -3.492 0.000 2.909) 4.545 12.613 ( 0.692 0.000 -13.948) 13.965 13.789 ( 8.269 0.000 -3.255) 8.886 14.274 ( 0.599 0.000 3.018) 3.077 14.467 ( 3.945 0.000 10.818) 11.515 15.844 ( 2.416 0.000 -20.191) 20.336 18.146 ( 10.075 0.000 0.789) 10.106 18.608 ( -83.192 0.000 -4.751) 83.327 19.910 ( 3.369 0.000 1.373) 3.638 20.074 ( -0.954 0.000 -1.216) 1.545 21.341 ( -16.148 0.000 10.553) 19.291 22.482 ( 71.592 0.000 -4.394) 71.727 23.035 ( 5.967 0.000 2.064) 6.314 23.548 ( -3.542 0.000 -3.994) 5.338 ======================= Grid point 190 (82/260) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.193 ( 15.355 0.000 22.122) 26.928 1.563 ( 23.901 0.000 19.842) 31.064 2.617 ( 19.155 0.000 42.388) 46.515 3.317 ( 5.729 0.000 -6.218) 8.455 3.405 ( 4.483 0.000 -6.406) 7.819 3.779 ( 2.992 0.000 -1.668) 3.425 4.307 ( -1.090 0.000 0.450) 1.179 4.321 ( 5.079 0.000 5.803) 7.712 4.835 ( -14.560 0.000 7.558) 16.405 5.388 ( -3.241 0.000 11.675) 12.117 5.763 ( 3.607 0.000 19.233) 19.568 6.215 ( 0.445 0.000 4.266) 4.290 6.357 ( 24.431 0.000 -7.626) 25.594 6.686 ( 2.903 0.000 6.521) 7.138 7.302 ( -4.661 0.000 20.457) 20.981 7.937 ( -0.766 0.000 13.100) 13.123 8.736 ( 2.065 0.000 -11.754) 11.934 9.244 ( 5.577 0.000 3.211) 6.435 9.397 ( -2.616 0.000 -9.494) 9.848 10.130 ( 16.564 0.000 1.390) 16.623 11.269 ( 4.846 0.000 -24.500) 24.975 11.407 ( -5.166 0.000 -4.390) 6.779 11.505 ( -5.377 0.000 3.941) 6.666 12.691 ( 9.576 0.000 -13.276) 16.370 13.855 ( -2.265 0.000 -0.727) 2.379 14.292 ( 0.717 0.000 1.636) 1.786 14.377 ( -15.568 0.000 14.911) 21.557 15.812 ( -2.186 0.000 -18.596) 18.724 17.274 ( -39.637 0.000 18.069) 43.561 18.397 ( 14.270 0.000 5.019) 15.127 19.846 ( -10.178 0.000 2.994) 10.610 20.057 ( -2.248 0.000 -1.662) 2.796 20.928 ( -24.748 0.000 4.667) 25.184 23.247 ( 13.202 0.000 3.320) 13.613 23.412 ( -7.099 0.000 -5.347) 8.887 23.721 ( 46.934 0.000 -26.663) 53.979 ======================= Grid point 191 (83/260) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( 20.335 0.000 19.584) 28.232 1.988 ( 15.416 0.000 21.621) 26.554 3.064 ( 15.930 0.000 9.369) 18.481 3.470 ( 2.783 0.000 -5.167) 5.869 3.562 ( 21.145 0.000 5.105) 21.752 3.811 ( 0.849 0.000 -7.794) 7.840 4.255 ( -4.804 0.000 3.464) 5.923 4.481 ( 9.154 0.000 6.388) 11.163 4.621 ( -8.532 0.000 9.081) 12.460 5.375 ( 0.115 0.000 12.243) 12.244 5.874 ( 4.739 0.000 20.255) 20.802 6.198 ( -3.285 0.000 9.159) 9.730 6.701 ( 10.817 0.000 -7.489) 13.156 6.794 ( 6.912 0.000 3.990) 7.981 7.274 ( -1.195 0.000 14.697) 14.746 7.933 ( -2.089 0.000 13.814) 13.971 8.785 ( 3.008 0.000 -12.394) 12.754 9.257 ( -3.987 0.000 14.243) 14.791 9.352 ( 1.753 0.000 -6.702) 6.928 10.446 ( 12.050 0.000 -1.570) 12.152 11.267 ( -6.109 0.000 -7.170) 9.419 11.343 ( 6.379 0.000 -25.680) 26.461 11.390 ( -5.860 0.000 2.222) 6.267 12.933 ( 16.441 0.000 -12.909) 20.903 13.648 ( -18.839 0.000 21.199) 28.360 14.107 ( -10.039 0.000 13.482) 16.810 14.302 ( -0.004 0.000 -0.733) 0.733 15.694 ( -6.525 0.000 -16.104) 17.376 17.029 ( 6.163 0.000 -1.196) 6.278 18.701 ( 13.517 0.000 7.088) 15.263 19.547 ( -18.258 0.000 5.759) 19.144 19.963 ( -6.866 0.000 -1.187) 6.967 20.439 ( -24.241 0.000 1.171) 24.270 23.210 ( -11.061 0.000 -4.198) 11.831 23.520 ( 12.805 0.000 2.605) 13.067 24.337 ( 22.062 0.000 -25.646) 33.830 ======================= Grid point 192 (84/260) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( 19.080 0.000 18.863) 26.830 2.274 ( 9.534 0.000 22.618) 24.545 3.270 ( 7.059 0.000 -5.207) 8.772 3.490 ( 0.120 0.000 -5.128) 5.130 3.777 ( -2.625 0.000 -10.686) 11.003 4.035 ( 19.646 0.000 -4.476) 20.150 4.136 ( -7.143 0.000 2.844) 7.689 4.543 ( 1.535 0.000 17.664) 17.731 4.687 ( 8.496 0.000 2.430) 8.837 5.436 ( 3.305 0.000 14.196) 14.576 6.044 ( 9.269 0.000 21.135) 23.079 6.136 ( -4.396 0.000 11.434) 12.249 6.800 ( 1.088 0.000 2.167) 2.424 6.942 ( 6.414 0.000 2.589) 6.917 7.289 ( 0.179 0.000 8.419) 8.421 7.900 ( -3.918 0.000 15.689) 16.171 8.756 ( -3.368 0.000 -10.643) 11.163 9.193 ( -4.534 0.000 20.712) 21.203 9.506 ( 14.253 0.000 -4.194) 14.857 10.516 ( -5.559 0.000 7.423) 9.273 11.196 ( 0.699 0.000 -14.216) 14.234 11.245 ( -7.101 0.000 -1.304) 7.219 11.464 ( 8.302 0.000 -23.964) 25.361 13.270 ( 18.990 0.000 -13.570) 23.340 13.345 ( -13.899 0.000 27.959) 31.223 13.982 ( -6.043 0.000 9.586) 11.332 14.281 ( -1.798 0.000 -4.328) 4.686 15.506 ( -9.531 0.000 -12.783) 15.946 17.309 ( 20.479 0.000 -12.846) 24.175 18.761 ( -12.854 0.000 1.822) 12.982 19.396 ( 7.612 0.000 12.638) 14.753 19.785 ( -10.725 0.000 -0.583) 10.740 19.972 ( -22.985 0.000 0.916) 23.003 22.991 ( -9.630 0.000 -1.972) 9.830 23.742 ( 8.880 0.000 1.303) 8.975 24.593 ( 9.327 0.000 -22.808) 24.641 ======================= Grid point 193 (85/260) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 11.799 0.000 19.500) 22.791 2.429 ( 1.416 0.000 22.019) 22.064 3.384 ( 6.314 0.000 -5.744) 8.536 3.461 ( -1.879 0.000 -5.839) 6.133 3.688 ( -3.582 0.000 -8.735) 9.441 4.008 ( -5.197 0.000 -1.645) 5.452 4.225 ( 3.853 0.000 -6.490) 7.548 4.683 ( 3.278 0.000 -2.561) 4.159 4.828 ( 6.669 0.000 10.662) 12.576 5.533 ( 3.029 0.000 16.522) 16.797 6.068 ( -4.511 0.000 10.446) 11.379 6.323 ( 13.917 0.000 24.352) 28.048 6.792 ( -1.943 0.000 7.738) 7.979 7.036 ( 2.524 0.000 1.776) 3.087 7.321 ( 2.603 0.000 7.183) 7.640 7.835 ( -5.482 0.000 18.414) 19.212 8.673 ( -2.034 0.000 -7.600) 7.868 9.173 ( -1.211 0.000 24.051) 24.081 9.842 ( 18.381 0.000 -1.529) 18.445 10.318 ( -14.184 0.000 7.841) 16.207 11.099 ( -7.193 0.000 -3.061) 7.817 11.176 ( -1.842 0.000 -13.011) 13.140 11.581 ( 7.361 0.000 -23.157) 24.299 13.211 ( -4.487 0.000 22.378) 22.824 13.589 ( 13.640 0.000 -15.387) 20.562 13.888 ( -5.030 0.000 10.837) 11.947 14.229 ( -1.249 0.000 -7.374) 7.479 15.291 ( -9.286 0.000 -9.810) 13.508 17.738 ( 24.561 0.000 -16.594) 29.641 18.434 ( -14.815 0.000 1.237) 14.867 19.467 ( -19.837 0.000 -10.822) 22.597 19.546 ( -12.953 0.000 0.279) 12.956 19.777 ( 15.958 0.000 25.882) 30.407 22.844 ( -4.683 0.000 0.443) 4.704 23.867 ( 3.450 0.000 -0.063) 3.450 24.656 ( 1.369 0.000 -22.872) 22.913 ======================= Grid point 194 (86/260) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( -8.680 0.000 20.766) 22.507 2.506 ( -4.050 0.000 19.764) 20.175 3.407 ( -2.310 0.000 -6.253) 6.667 3.518 ( 7.421 0.000 -3.693) 8.289 3.647 ( 1.272 0.000 -10.185) 10.264 3.949 ( 0.355 0.000 -0.863) 0.933 4.239 ( -2.168 0.000 -5.420) 5.838 4.577 ( -9.985 0.000 -11.572) 15.284 4.961 ( 2.975 0.000 11.671) 12.044 5.595 ( 0.172 0.000 17.429) 17.430 5.987 ( -5.322 0.000 8.713) 10.210 6.540 ( -1.874 0.000 29.886) 29.944 6.854 ( 10.874 0.000 7.408) 13.158 7.053 ( -0.822 0.000 0.452) 0.938 7.449 ( 8.886 0.000 7.134) 11.395 7.758 ( -5.359 0.000 20.613) 21.299 8.678 ( 3.878 0.000 -5.217) 6.501 9.227 ( 1.937 0.000 24.658) 24.734 10.010 ( -17.548 0.000 3.929) 17.983 10.158 ( 10.865 0.000 3.449) 11.399 10.958 ( -5.147 0.000 -6.800) 8.528 11.066 ( -6.604 0.000 -10.562) 12.457 11.668 ( 5.313 0.000 -21.340) 21.991 13.215 ( 0.510 0.000 16.753) 16.761 13.662 ( -3.747 0.000 -18.139) 18.522 13.833 ( -2.201 0.000 13.048) 13.232 14.265 ( 5.472 0.000 -5.886) 8.036 15.144 ( -2.349 0.000 -10.237) 10.503 18.202 ( 24.483 0.000 -16.346) 29.438 18.270 ( -1.138 0.000 0.995) 1.512 19.015 ( -21.786 0.000 -8.301) 23.314 19.294 ( -11.769 0.000 2.326) 11.997 20.201 ( 19.976 0.000 23.737) 31.024 22.809 ( 0.759 0.000 1.227) 1.443 23.876 ( -2.426 0.000 -1.296) 2.750 24.574 ( -5.311 0.000 -24.807) 25.369 ======================= Grid point 195 (87/260) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( -14.997 0.000 20.012) 25.008 2.313 ( -17.280 0.000 18.606) 25.392 3.352 ( -1.999 0.000 -5.754) 6.091 3.589 ( -3.800 0.000 -4.217) 5.676 3.649 ( 0.166 0.000 -15.136) 15.137 4.050 ( 8.602 0.000 5.046) 9.973 4.064 ( -13.080 0.000 -2.436) 13.305 4.356 ( -8.057 0.000 -13.829) 16.005 5.011 ( 0.739 0.000 16.240) 16.257 5.611 ( -1.183 0.000 16.061) 16.104 5.894 ( -5.074 0.000 8.655) 10.033 6.441 ( -10.557 0.000 28.856) 30.726 7.008 ( -3.644 0.000 -1.115) 3.811 7.144 ( 13.547 0.000 11.863) 18.007 7.611 ( 1.367 0.000 11.437) 11.519 7.749 ( 4.220 0.000 12.453) 13.149 8.805 ( 9.390 0.000 -4.526) 10.423 9.302 ( -0.825 0.000 19.006) 19.024 9.658 ( -16.443 0.000 4.674) 17.094 10.177 ( -10.794 0.000 7.333) 13.050 10.915 ( -5.493 0.000 -9.793) 11.229 10.942 ( 5.552 0.000 -10.454) 11.837 11.717 ( 3.149 0.000 -18.641) 18.905 13.264 ( 1.310 0.000 15.060) 15.117 13.453 ( -12.075 0.000 -18.451) 22.051 13.857 ( 2.166 0.000 14.740) 14.899 14.327 ( 0.350 0.000 -1.038) 1.095 15.200 ( 9.801 0.000 -15.161) 18.053 18.361 ( 5.560 0.000 -4.816) 7.356 18.613 ( 17.440 0.000 -11.405) 20.838 18.636 ( -10.275 0.000 -3.117) 10.737 19.144 ( -1.423 0.000 4.317) 4.545 20.627 ( 18.439 0.000 23.706) 30.033 22.858 ( 3.437 0.000 -1.899) 3.926 23.769 ( -7.951 0.000 -2.221) 8.256 24.359 ( -11.613 0.000 -27.049) 29.436 ======================= Grid point 196 (88/260) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( -18.077 0.000 18.855) 26.121 1.936 ( -22.945 0.000 17.954) 29.135 3.210 ( -30.340 0.000 1.189) 30.363 3.314 ( -0.856 0.000 -4.394) 4.477 3.614 ( -0.491 0.000 -13.913) 13.922 3.860 ( -9.684 0.000 1.623) 9.819 4.231 ( 7.281 0.000 4.232) 8.422 4.232 ( -1.291 0.000 -13.055) 13.119 5.067 ( 1.682 0.000 18.958) 19.033 5.603 ( -2.593 0.000 12.065) 12.340 5.856 ( 0.515 0.000 12.072) 12.083 6.257 ( -12.694 0.000 28.975) 31.634 6.906 ( -6.131 0.000 -2.870) 6.770 7.379 ( 5.848 0.000 15.776) 16.825 7.609 ( -0.456 0.000 12.102) 12.111 7.826 ( -1.921 0.000 -4.273) 4.685 9.011 ( 11.632 0.000 -5.664) 12.938 9.073 ( -20.139 0.000 0.107) 20.139 9.569 ( 2.318 0.000 22.877) 22.994 9.838 ( -21.828 0.000 4.652) 22.318 10.863 ( 2.845 0.000 -8.269) 8.745 11.071 ( 7.469 0.000 -10.268) 12.697 11.726 ( 0.729 0.000 -14.899) 14.917 13.165 ( -13.017 0.000 -16.814) 21.264 13.320 ( 1.879 0.000 16.312) 16.420 13.963 ( 5.490 0.000 15.738) 16.668 14.299 ( -2.293 0.000 2.212) 3.186 15.420 ( 13.816 0.000 -18.918) 23.426 18.201 ( -11.270 0.000 -10.531) 15.424 18.813 ( 6.741 0.000 5.696) 8.826 18.849 ( 21.758 0.000 2.457) 21.896 19.325 ( 16.799 0.000 -1.695) 16.884 21.007 ( 15.435 0.000 23.109) 27.790 22.890 ( -0.972 0.000 -13.254) 13.290 23.560 ( -12.302 0.000 -2.675) 12.589 24.027 ( -16.410 0.000 -25.197) 30.070 ======================= Grid point 197 (89/260) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( -23.474 0.000 18.861) 30.113 1.531 ( -21.356 0.000 15.725) 26.521 2.592 ( -30.001 0.000 23.069) 37.845 3.299 ( 0.024 0.000 -4.542) 4.542 3.598 ( 1.222 0.000 -8.599) 8.685 3.631 ( -12.052 0.000 -4.148) 12.746 4.228 ( 1.251 0.000 -6.189) 6.314 4.327 ( 1.996 0.000 1.051) 2.255 5.134 ( 1.698 0.000 17.748) 17.829 5.554 ( -3.780 0.000 10.107) 10.791 5.957 ( 6.210 0.000 13.847) 15.176 6.054 ( -12.223 0.000 27.612) 30.196 6.768 ( -6.613 0.000 -4.238) 7.855 7.260 ( -26.281 0.000 -16.660) 31.117 7.567 ( -10.054 0.000 17.780) 20.425 7.753 ( 4.454 0.000 5.841) 7.345 8.751 ( -9.477 0.000 5.169) 10.795 9.223 ( 10.330 0.000 -7.764) 12.922 9.399 ( -21.517 0.000 0.485) 21.522 9.677 ( 3.537 0.000 22.820) 23.093 11.008 ( 12.271 0.000 -5.817) 13.579 11.172 ( 4.666 0.000 -12.330) 13.184 11.696 ( -1.487 0.000 -9.454) 9.570 12.898 ( -10.676 0.000 -15.007) 18.417 13.413 ( 5.014 0.000 16.030) 16.796 14.119 ( 7.035 0.000 17.138) 18.526 14.267 ( -1.283 0.000 3.617) 3.838 15.641 ( 11.356 0.000 -20.655) 23.571 18.024 ( -4.284 0.000 -7.566) 8.694 19.065 ( 18.620 0.000 14.563) 23.639 19.317 ( 23.177 0.000 0.981) 23.198 19.688 ( 19.116 0.000 0.959) 19.140 21.311 ( 10.752 0.000 21.416) 23.964 22.623 ( -25.863 0.000 -38.101) 46.050 23.289 ( -13.783 0.000 -2.513) 14.011 23.705 ( -9.994 0.000 -9.607) 13.863 ======================= Grid point 198 (90/260) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.118 ( -16.881 0.000 22.003) 27.732 1.121 ( -19.613 0.000 20.134) 28.108 2.230 ( -11.022 0.000 45.134) 46.460 3.300 ( 1.234 0.000 -6.611) 6.725 3.407 ( -8.779 0.000 -6.883) 11.155 3.635 ( 3.280 0.000 -1.776) 3.730 4.240 ( 0.717 0.000 -1.319) 1.501 4.333 ( -0.690 0.000 -1.347) 1.513 5.213 ( 4.403 0.000 13.079) 13.800 5.499 ( -3.598 0.000 10.798) 11.381 5.886 ( -9.549 0.000 18.070) 20.438 6.101 ( 5.036 0.000 10.675) 11.804 6.349 ( -50.930 0.000 -9.357) 51.783 6.657 ( -3.158 0.000 -2.393) 3.962 7.459 ( -6.450 0.000 24.748) 25.575 7.865 ( 3.301 0.000 11.956) 12.403 8.740 ( 7.269 0.000 1.686) 7.462 9.023 ( -15.317 0.000 -4.316) 15.913 9.377 ( 6.431 0.000 -9.841) 11.756 9.778 ( 2.903 0.000 20.403) 20.608 11.218 ( 2.734 0.000 -16.702) 16.925 11.269 ( 13.009 0.000 -5.672) 14.192 11.643 ( -2.557 0.000 -2.498) 3.575 12.700 ( -6.380 0.000 -14.195) 15.563 13.586 ( 10.028 0.000 7.881) 12.754 14.261 ( -0.035 0.000 3.761) 3.761 14.300 ( 8.065 0.000 17.440) 19.215 15.787 ( 6.990 0.000 -20.962) 22.097 18.009 ( 3.643 0.000 -3.658) 5.162 19.460 ( 7.688 0.000 -7.367) 10.648 19.715 ( 15.676 0.000 0.587) 15.687 20.097 ( 15.204 0.000 5.720) 16.245 21.472 ( 0.509 0.000 17.455) 17.462 21.833 ( -27.709 0.000 -22.360) 35.606 23.054 ( -7.795 0.000 -1.051) 7.866 23.599 ( -1.945 0.000 -2.198) 2.935 ======================= Grid point 199 (91/260) ======================= q-point: ( 0.00 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.191 ( -0.464 17.550 22.133) 28.250 1.372 ( 7.381 22.538 21.582) 32.066 2.396 ( 6.369 11.816 46.485) 48.384 3.331 ( -2.131 2.087 -6.718) 7.351 3.342 ( 2.573 2.243 -5.688) 6.634 3.626 ( 1.989 -7.391 2.387) 8.017 4.290 ( 6.261 3.901 2.229) 7.707 4.387 ( -2.718 4.165 -0.225) 4.979 5.064 ( -15.419 -9.011 9.141) 20.063 5.518 ( -3.051 6.369 9.742) 12.033 5.624 ( 3.126 0.487 3.494) 4.713 5.863 ( 1.737 -4.760 20.653) 21.266 6.413 ( 4.044 18.928 5.654) 20.164 6.906 ( -1.686 17.218 -7.067) 18.688 7.528 ( -5.627 13.198 20.493) 25.016 8.003 ( 0.522 8.143 14.323) 16.484 8.715 ( -3.263 -4.560 -2.933) 6.328 9.054 ( 12.370 3.616 -1.300) 12.953 9.476 ( 0.188 3.346 -9.303) 9.888 9.830 ( 2.985 -2.867 15.381) 15.928 11.365 ( 0.634 -4.469 -7.329) 8.608 11.444 ( 7.409 7.521 -10.937) 15.201 11.662 ( -3.017 10.155 -7.179) 12.797 12.580 ( 0.497 -1.973 -13.497) 13.649 13.702 ( 7.897 -7.974 0.378) 11.229 14.146 ( -0.550 -9.065 5.146) 10.438 14.503 ( 2.370 2.821 5.151) 6.334 15.757 ( 2.617 -9.013 -20.551) 22.593 17.597 ( -15.232 -31.140 12.231) 36.760 18.893 ( -41.312 10.750 -16.723) 45.847 19.850 ( 5.337 -4.942 0.351) 7.282 20.090 ( -2.537 1.008 -3.198) 4.205 21.351 ( -14.156 1.008 11.029) 17.974 22.082 ( 43.972 -19.497 6.614) 48.553 23.520 ( 14.975 24.124 -9.385) 29.905 23.590 ( -2.372 4.340 -3.491) 6.054 ======================= Grid point 200 (92/260) ======================= q-point: ( 0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( 11.477 13.669 18.215) 25.502 1.693 ( 16.579 10.527 22.866) 30.142 2.753 ( 21.076 12.751 37.233) 44.644 3.311 ( 2.369 -0.050 -6.532) 6.949 3.419 ( 4.636 0.911 -3.684) 5.991 3.686 ( 3.992 -7.589 -0.618) 8.597 4.341 ( -1.754 2.866 0.994) 3.504 4.429 ( 6.377 8.294 6.293) 12.209 4.801 ( -10.926 -2.745 8.499) 14.112 5.436 ( -5.564 3.701 9.086) 11.279 5.725 ( 1.768 0.102 14.121) 14.232 6.150 ( 20.558 -11.589 -0.525) 23.605 6.482 ( 2.173 20.287 3.930) 20.778 6.922 ( 3.288 14.327 -0.772) 14.719 7.460 ( -4.475 13.616 18.169) 23.141 8.030 ( -0.310 9.233 14.281) 17.009 8.694 ( 2.915 -2.989 -6.054) 7.355 9.285 ( 5.960 3.266 3.594) 7.688 9.426 ( -2.712 2.854 -8.171) 9.070 9.987 ( 12.058 -8.089 6.654) 15.972 11.291 ( -6.044 -5.432 -7.323) 10.939 11.526 ( -3.286 1.812 1.218) 3.945 11.624 ( 6.212 19.408 -19.919) 28.496 12.647 ( 8.471 -2.851 -11.961) 14.932 13.767 ( -2.436 -7.869 1.909) 8.456 14.112 ( -5.059 -10.686 7.057) 13.768 14.475 ( -5.028 5.103 4.372) 8.392 15.720 ( -2.841 -9.456 -18.887) 21.312 17.132 ( -22.520 -10.838 14.419) 28.854 18.500 ( 1.463 6.991 -1.217) 7.245 19.829 ( -8.483 -1.620 2.145) 8.899 20.005 ( -5.454 -4.095 -5.043) 8.482 20.978 ( -22.376 4.286 6.348) 23.651 22.861 ( 29.081 -23.926 1.153) 37.676 23.482 ( -6.012 4.126 -5.034) 8.861 23.934 ( 23.851 11.076 -15.911) 30.736 ======================= Grid point 201 (93/260) ======================= q-point: ( 0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( 17.524 7.485 15.713) 24.699 2.027 ( 12.734 3.775 23.026) 26.582 3.198 ( 11.579 10.910 8.220) 17.907 3.440 ( 9.569 -2.807 -1.143) 10.037 3.537 ( 13.213 -1.591 2.835) 13.607 3.772 ( 4.993 -3.232 -6.555) 8.851 4.303 ( -3.295 3.427 3.855) 6.120 4.557 ( 5.536 4.982 6.911) 10.160 4.654 ( -5.640 4.620 9.584) 12.042 5.381 ( -0.600 -0.005 9.889) 9.907 5.779 ( 1.548 -1.690 15.710) 15.876 6.421 ( 2.974 3.381 -2.239) 5.029 6.593 ( 11.493 7.196 3.832) 14.091 7.008 ( 4.557 12.708 2.597) 13.748 7.418 ( -2.752 12.472 13.941) 18.907 8.035 ( -1.979 9.958 14.763) 17.917 8.784 ( 5.462 0.345 -7.727) 9.469 9.278 ( -4.330 2.205 10.579) 11.642 9.393 ( 0.603 3.138 -2.215) 3.888 10.285 ( 14.936 -10.001 -0.547) 17.983 11.113 ( -10.047 -5.214 -8.139) 13.942 11.406 ( -6.881 1.364 2.168) 7.342 11.763 ( 9.556 23.030 -22.499) 33.584 12.857 ( 13.493 -5.864 -8.200) 16.843 13.603 ( -13.715 -3.653 15.308) 20.875 13.990 ( -6.464 -8.119 7.221) 12.643 14.400 ( -2.770 6.438 1.270) 7.122 15.585 ( -7.307 -10.486 -15.551) 20.129 17.007 ( 6.882 -2.030 -1.470) 7.324 18.673 ( 11.358 -2.471 4.597) 12.500 19.533 ( -18.722 -1.250 4.926) 19.400 19.873 ( -7.425 -6.851 -6.451) 11.987 20.541 ( -22.125 8.197 4.728) 24.064 23.153 ( -2.993 -7.534 0.552) 8.126 23.469 ( 10.920 -2.122 -3.763) 11.743 24.300 ( 15.275 -3.063 -18.497) 24.183 ======================= Grid point 202 (94/260) ======================= q-point: ( 0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( 17.380 3.320 15.462) 23.498 2.289 ( 10.279 1.747 19.304) 21.939 3.290 ( 0.846 1.211 -1.120) 1.854 3.507 ( 0.720 0.983 -3.038) 3.273 3.820 ( 4.749 -1.385 -10.164) 11.304 3.950 ( 13.868 -0.675 -8.285) 16.168 4.223 ( -5.097 4.769 7.824) 10.485 4.597 ( 1.519 4.483 11.890) 12.798 4.706 ( 5.983 2.399 7.486) 9.879 5.455 ( 5.350 1.441 12.155) 13.358 5.856 ( 3.396 -3.980 16.668) 17.470 6.427 ( 0.566 11.509 2.449) 11.780 6.803 ( 6.793 3.830 4.236) 8.875 7.099 ( 3.976 12.039 5.168) 13.691 7.395 ( -1.647 10.352 10.273) 14.677 8.000 ( -4.317 9.511 16.226) 19.297 8.806 ( -1.714 5.130 -8.287) 9.896 9.216 ( -4.776 1.864 21.272) 21.882 9.519 ( 13.611 1.051 -3.013) 13.981 10.489 ( 2.685 -2.991 4.611) 6.117 10.908 ( -6.296 -11.049 -15.257) 19.862 11.284 ( -5.605 2.400 1.745) 6.342 11.893 ( 6.871 24.572 -22.398) 33.951 13.075 ( 4.802 -11.832 8.398) 15.284 13.441 ( 0.362 3.749 4.708) 6.030 13.900 ( -3.934 -6.814 6.172) 10.000 14.337 ( -4.096 4.361 -2.986) 6.686 15.388 ( -9.795 -11.055 -11.877) 18.953 17.280 ( 19.515 -2.323 -11.440) 22.740 18.756 ( -8.980 -0.647 1.051) 9.064 19.351 ( 5.602 -3.911 12.319) 14.087 19.673 ( -11.510 -7.745 -6.515) 15.326 20.115 ( -21.821 10.536 4.553) 24.656 22.991 ( -9.186 -0.413 -0.217) 9.197 23.717 ( 11.284 -2.635 -1.564) 11.693 24.481 ( 6.654 -9.585 -19.031) 22.323 ======================= Grid point 203 (95/260) ======================= q-point: ( 0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( 4.885 0.460 18.775) 19.405 2.542 ( 12.622 4.640 12.982) 18.692 3.271 ( -1.831 -5.085 -1.784) 5.691 3.483 ( -2.183 1.378 -4.195) 4.925 3.856 ( 1.441 6.583 -13.006) 14.648 4.024 ( -2.593 3.086 0.820) 4.114 4.157 ( -1.142 -5.634 -4.596) 7.360 4.701 ( 1.134 1.524 -3.563) 4.038 4.839 ( 7.647 2.334 15.837) 17.741 5.593 ( 5.211 5.003 14.277) 16.001 5.944 ( 1.369 -3.911 14.834) 15.402 6.516 ( 8.175 10.369 7.789) 15.330 6.864 ( -1.149 6.931 8.724) 11.201 7.163 ( 0.858 9.272 1.991) 9.522 7.416 ( 3.039 10.429 10.850) 15.353 7.928 ( -5.656 8.805 18.446) 21.208 8.751 ( -1.136 7.682 -5.313) 9.409 9.182 ( -2.197 0.253 23.685) 23.788 9.857 ( 18.604 1.621 -0.406) 18.679 10.363 ( -13.815 4.348 7.371) 16.250 10.843 ( -0.086 -16.093 -19.342) 25.162 11.193 ( -3.680 3.825 1.601) 5.544 11.942 ( 2.007 22.909 -20.977) 31.127 13.084 ( -2.584 -10.736 20.433) 23.226 13.599 ( 9.855 1.043 -11.674) 15.313 13.865 ( -0.172 -3.168 6.683) 7.398 14.231 ( -4.633 0.707 -6.741) 8.210 15.174 ( -9.223 -10.892 -8.603) 16.665 17.681 ( 21.913 -4.149 -13.462) 26.050 18.505 ( -10.542 5.329 -0.384) 11.819 19.375 ( -14.262 -5.647 -10.804) 18.762 19.673 ( -2.363 4.120 0.598) 4.787 19.713 ( 0.231 -0.769 23.740) 23.753 22.844 ( -5.172 -0.057 1.025) 5.273 23.880 ( 5.196 0.814 -1.671) 5.519 24.511 ( 0.202 -12.959 -20.640) 24.372 ======================= Grid point 204 (96/260) ======================= q-point: (-0.50 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( -6.210 0.903 17.248) 18.354 2.705 ( -2.627 11.354 15.243) 19.188 3.272 ( 4.442 -12.050 -5.217) 13.862 3.423 ( -2.495 0.494 -5.401) 5.970 3.834 ( -1.064 4.152 -15.009) 15.609 3.994 ( 0.679 7.749 7.982) 11.146 4.138 ( -1.501 -10.173 -5.791) 11.802 4.578 ( -10.219 -0.074 -9.644) 14.052 5.012 ( 5.435 5.749 14.797) 16.779 5.680 ( 0.549 7.084 14.949) 16.552 5.947 ( -2.923 -0.724 11.476) 11.864 6.683 ( -0.231 11.353 17.326) 20.716 6.876 ( 6.003 1.944 6.482) 9.046 7.154 ( -0.659 7.646 0.604) 7.698 7.550 ( 7.362 9.477 10.319) 15.827 7.855 ( -4.702 8.951 19.867) 22.292 8.771 ( 4.043 8.983 -2.431) 10.147 9.215 ( 0.996 -1.789 23.376) 23.466 10.045 ( -16.560 3.512 2.422) 17.100 10.190 ( 10.633 3.379 4.809) 12.149 10.758 ( -4.932 -11.953 -15.359) 20.077 11.141 ( -1.588 4.801 -1.999) 5.437 11.920 ( 0.091 18.598 -19.580) 27.005 13.089 ( -0.557 -11.092 16.569) 19.947 13.654 ( -2.191 -0.090 -13.392) 13.571 13.873 ( -1.734 2.429 7.281) 7.869 14.216 ( 4.801 -4.099 -6.358) 8.959 15.031 ( -2.376 -10.471 -8.768) 13.862 18.059 ( 17.136 -5.773 -7.021) 19.397 18.429 ( 3.368 6.128 -6.770) 9.733 19.058 ( -14.479 4.038 -8.811) 17.424 19.314 ( -15.891 3.033 3.024) 16.458 20.145 ( 21.170 -5.200 22.665) 31.447 22.791 ( -0.650 -1.637 0.658) 1.880 23.911 ( -1.754 3.080 -2.259) 4.203 24.425 ( -4.775 -13.603 -22.740) 26.925 ======================= Grid point 205 (97/260) ======================= q-point: (-0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( -12.536 3.384 17.025) 21.411 2.497 ( -18.308 11.114 13.559) 25.349 3.332 ( -0.826 -2.888 -5.694) 6.438 3.418 ( 2.728 -7.504 -5.448) 9.666 3.776 ( -3.116 2.705 -14.020) 14.614 3.975 ( -10.628 -2.596 -3.418) 11.462 4.086 ( 1.828 -0.156 8.564) 8.758 4.374 ( -5.181 1.504 -8.642) 10.188 5.108 ( 1.957 8.652 16.087) 18.371 5.675 ( -3.080 5.619 13.986) 15.384 5.895 ( -3.590 2.053 11.528) 12.247 6.581 ( -9.790 12.092 18.995) 24.554 6.983 ( -1.707 -2.397 1.093) 3.139 7.239 ( 10.012 7.837 6.902) 14.467 7.681 ( 2.229 6.245 11.069) 12.903 7.838 ( 0.467 7.967 14.305) 16.381 8.898 ( 8.662 8.668 -1.266) 12.320 9.271 ( -1.037 -3.318 17.296) 17.642 9.703 ( -15.874 4.592 3.989) 16.999 10.215 ( -11.540 3.253 7.934) 14.377 10.692 ( 2.843 -8.432 -12.538) 15.374 11.136 ( 2.277 7.807 -6.062) 10.143 11.890 ( 0.195 14.322 -17.823) 22.865 13.098 ( -1.641 -12.968 11.685) 17.533 13.493 ( -9.439 1.380 -13.453) 16.492 13.897 ( 3.049 3.778 11.180) 12.189 14.280 ( 0.720 -4.336 -1.417) 4.619 15.087 ( 9.669 -10.429 -13.802) 19.818 18.344 ( 7.211 -0.877 -3.986) 8.286 18.449 ( 1.094 -8.519 -6.683) 10.882 18.862 ( -2.810 13.443 -5.935) 14.961 19.174 ( 4.770 2.989 2.527) 6.170 20.595 ( 19.667 -3.085 23.512) 30.808 22.794 ( 0.141 -5.897 -4.008) 7.132 23.805 ( -8.045 2.898 -3.283) 9.160 24.251 ( -8.519 -9.502 -23.215) 26.491 ======================= Grid point 206 (98/260) ======================= q-point: (-0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( -15.138 6.512 18.022) 24.420 2.095 ( -23.297 10.010 11.585) 27.877 3.258 ( -19.326 3.133 0.623) 19.588 3.306 ( -3.482 -0.181 -1.546) 3.814 3.612 ( -4.536 0.482 -12.126) 12.955 3.820 ( -5.673 -4.008 1.206) 7.050 4.112 ( 0.543 -3.396 -3.554) 4.946 4.374 ( 3.888 5.658 -1.053) 6.945 5.160 ( 0.353 7.876 17.703) 19.379 5.628 ( -3.640 2.630 11.618) 12.455 5.872 ( -0.675 2.636 14.735) 14.985 6.410 ( -10.247 13.405 19.558) 25.831 6.857 ( -9.888 -4.631 -2.778) 11.267 7.446 ( 6.314 5.295 7.850) 11.381 7.700 ( -0.522 7.929 11.977) 14.374 7.853 ( -2.500 3.577 3.132) 5.372 9.040 ( -6.296 1.090 0.999) 6.467 9.143 ( -0.410 7.330 -2.492) 7.753 9.574 ( 0.026 1.023 19.522) 19.549 9.866 ( -21.611 2.360 5.115) 22.334 10.789 ( 8.273 -2.234 -7.890) 11.648 11.204 ( 5.053 7.816 -7.759) 12.117 11.857 ( -0.809 11.543 -15.356) 19.227 13.027 ( -7.231 -11.003 -2.889) 13.479 13.334 ( -3.601 -0.339 3.140) 4.790 14.009 ( 5.518 4.202 10.768) 12.809 14.262 ( -1.440 -3.358 2.632) 4.503 15.308 ( 13.869 -10.469 -17.803) 24.878 18.124 ( -14.281 -6.464 -6.909) 17.131 18.743 ( 15.866 -7.416 0.426) 17.519 18.902 ( 10.235 7.442 1.975) 12.808 19.456 ( 19.272 10.058 -0.500) 21.744 20.995 ( 16.185 -1.133 23.292) 28.385 22.714 ( -8.869 -14.911 -15.955) 23.571 23.618 ( -8.693 4.067 -2.946) 10.039 24.013 ( -11.294 -1.098 -19.919) 22.924 ======================= Grid point 207 (99/260) ======================= q-point: (-0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -20.141 9.087 13.562) 25.926 1.674 ( -17.548 14.040 17.729) 28.625 2.744 ( -27.516 13.750 21.062) 37.280 3.287 ( 0.132 -1.068 -3.708) 3.861 3.568 ( -0.092 -1.569 -6.302) 6.495 3.666 ( -8.935 1.051 -3.052) 9.500 4.134 ( 2.272 -4.156 -4.034) 6.222 4.437 ( 1.524 5.728 -0.127) 5.929 5.184 ( -0.990 3.935 16.994) 17.471 5.578 ( -3.211 2.706 10.863) 11.647 5.904 ( -0.576 -1.104 19.296) 19.336 6.280 ( -4.641 17.182 15.930) 23.886 6.564 ( -20.288 -13.702 -5.510) 25.094 7.377 ( -13.421 7.100 -16.089) 22.122 7.684 ( -5.517 9.675 17.520) 20.761 7.845 ( 4.185 8.507 9.743) 13.594 8.765 ( -10.881 1.581 4.068) 11.724 9.303 ( 8.901 6.830 -5.272) 12.396 9.414 ( -20.747 0.450 3.902) 21.115 9.674 ( 2.549 1.013 18.719) 18.918 10.992 ( 12.904 -0.477 -6.171) 14.311 11.290 ( 4.872 7.195 -9.020) 12.524 11.801 ( -2.304 10.087 -12.204) 16.000 12.837 ( -9.029 -5.460 -11.783) 15.817 13.359 ( 3.726 -4.660 13.050) 14.349 14.116 ( 2.494 -1.006 7.114) 7.605 14.278 ( 3.105 1.747 7.685) 8.471 15.535 ( 11.767 -10.130 -19.835) 25.189 17.870 ( -9.731 -12.237 -2.736) 15.872 19.067 ( 20.381 -3.995 8.624) 22.488 19.236 ( 18.001 -0.446 -4.307) 18.514 19.854 ( 19.674 11.042 2.967) 22.755 21.303 ( 10.091 -0.658 20.531) 22.886 22.303 ( -28.738 -21.918 -27.422) 45.368 23.491 ( -4.016 11.108 -4.863) 12.774 23.760 ( -9.934 5.220 -10.984) 15.703 ======================= Grid point 208 (100/260) ======================= q-point: (-0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( -13.582 15.747 18.797) 28.032 1.415 ( -12.303 21.331 19.136) 31.186 2.374 ( -12.813 14.085 39.343) 43.709 3.296 ( 1.692 -0.272 -5.327) 5.595 3.464 ( -8.205 4.572 -5.027) 10.653 3.592 ( 1.195 -4.384 -0.353) 4.558 4.188 ( 3.882 -1.370 -1.268) 4.308 4.432 ( -1.492 5.287 -0.831) 5.556 5.186 ( -1.428 -2.655 13.685) 14.013 5.545 ( -2.138 4.720 11.333) 12.461 5.865 ( -8.127 -0.471 15.751) 17.730 5.997 ( -29.572 -15.264 0.674) 33.285 6.313 ( 3.541 17.669 11.445) 21.348 7.050 ( -11.471 18.731 -17.242) 27.924 7.606 ( -5.792 12.292 21.487) 25.423 7.950 ( 2.788 8.064 13.787) 16.214 8.701 ( 2.828 -1.621 3.114) 4.508 9.060 ( -12.898 2.374 -0.355) 13.119 9.437 ( 5.218 4.643 -7.838) 10.499 9.757 ( 2.141 -0.513 17.815) 17.950 11.237 ( 11.590 -2.751 -6.316) 13.483 11.363 ( 4.207 7.213 -10.722) 13.590 11.730 ( -2.700 9.793 -8.948) 13.537 12.662 ( -5.825 -2.904 -13.271) 14.781 13.509 ( 8.972 -6.671 9.050) 14.384 14.142 ( -0.037 -6.439 4.989) 8.146 14.396 ( 5.972 4.763 8.959) 11.774 15.692 ( 7.494 -9.429 -20.675) 23.927 17.732 ( -4.840 -21.368 3.044) 22.120 19.446 ( 0.678 -2.377 -13.162) 13.392 19.570 ( 22.828 -8.763 2.895) 24.623 20.166 ( 4.822 3.438 -0.025) 5.922 21.402 ( -2.292 -4.678 9.543) 10.872 21.709 ( -13.621 -6.359 -2.353) 15.215 23.407 ( -1.246 22.304 -10.139) 24.532 23.635 ( -2.344 3.462 -1.910) 4.596 ======================= Grid point 209 (101/260) ======================= q-point: ( 0.00 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -1.118 22.492 17.741) 28.668 1.817 ( 0.219 18.326 22.409) 28.949 2.788 ( 6.192 23.647 28.787) 37.765 3.315 ( 0.514 -2.626 -0.699) 2.766 3.406 ( 2.022 -6.102 0.570) 6.453 3.478 ( -4.182 2.131 2.803) 5.467 4.345 ( 6.864 -1.046 1.966) 7.216 4.497 ( 0.759 7.740 2.578) 8.193 4.930 ( -12.243 -2.816 12.813) 17.944 5.621 ( 4.329 -0.976 -0.600) 4.478 5.640 ( -5.665 2.557 6.850) 9.250 5.868 ( 0.176 6.949 12.596) 14.387 6.851 ( 4.853 20.242 1.114) 20.845 7.188 ( -2.932 8.618 -14.458) 17.085 7.861 ( -4.197 17.280 18.944) 25.982 8.254 ( 2.159 15.247 16.266) 22.399 8.659 ( -4.104 -0.530 6.611) 7.799 9.151 ( 10.339 5.960 5.444) 13.117 9.533 ( -0.013 0.778 -0.703) 1.048 9.858 ( -0.048 7.299 10.375) 12.685 11.208 ( -1.529 -10.131 -6.152) 11.951 11.465 ( 6.511 -3.285 -2.471) 7.700 11.850 ( -3.969 2.851 -0.702) 4.937 12.631 ( 2.507 7.935 -19.349) 21.062 13.513 ( 6.698 -8.306 1.680) 10.802 13.971 ( -1.933 -7.352 0.188) 7.604 14.574 ( 2.212 3.500 -0.797) 4.217 15.448 ( 2.189 -19.853 -19.090) 27.629 17.079 ( -11.559 -17.916 9.062) 23.167 18.988 ( -24.253 -0.093 -23.293) 33.627 19.734 ( 8.563 -5.590 -1.488) 10.334 20.104 ( -4.547 0.264 -7.470) 8.749 21.382 ( -11.271 1.796 11.714) 16.355 21.785 ( 26.641 -9.780 8.221) 29.547 23.677 ( -3.069 4.906 -1.328) 5.937 23.886 ( 9.778 10.183 -7.647) 16.055 ======================= Grid point 210 (102/260) ======================= q-point: ( 0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( 6.257 19.843 13.641) 24.879 1.940 ( 7.182 12.426 24.584) 28.467 3.087 ( 17.123 14.122 19.784) 29.733 3.316 ( 0.786 0.641 2.320) 2.532 3.436 ( -0.068 0.041 2.866) 2.868 3.525 ( 8.634 -4.147 -0.127) 9.579 4.383 ( -1.126 0.692 3.223) 3.484 4.628 ( 6.787 10.154 7.994) 14.597 4.747 ( -5.559 -1.723 8.630) 10.409 5.487 ( -9.322 0.507 4.726) 10.464 5.811 ( 7.123 4.627 2.028) 8.733 5.985 ( 12.755 -1.452 4.973) 13.767 6.917 ( 2.118 18.747 -5.091) 19.540 7.167 ( 2.211 8.154 -3.375) 9.098 7.811 ( -4.027 18.560 18.589) 26.575 8.321 ( 1.380 17.732 15.497) 23.590 8.653 ( 3.564 -0.140 4.146) 5.469 9.365 ( 5.483 4.258 7.592) 10.288 9.503 ( -2.548 3.146 -1.602) 4.354 9.928 ( 7.527 4.262 7.765) 11.624 11.129 ( -4.408 -10.122 -4.692) 11.996 11.550 ( -1.381 0.776 -0.905) 1.824 11.837 ( 5.819 -1.758 -2.861) 6.719 12.691 ( 6.691 8.126 -17.169) 20.139 13.586 ( -0.214 -7.850 1.597) 8.013 13.921 ( -3.544 -7.171 0.184) 8.001 14.577 ( -1.493 4.351 -1.078) 4.725 15.403 ( -3.496 -20.167 -17.442) 26.892 16.907 ( -5.273 -9.579 6.522) 12.732 18.606 ( -7.959 2.540 -11.286) 14.041 19.779 ( -4.106 -2.996 -0.928) 5.167 19.924 ( -11.744 -3.024 -9.372) 15.327 21.082 ( -18.115 5.063 8.578) 20.673 22.403 ( 29.737 -18.772 4.407) 35.442 23.583 ( -5.669 5.199 -3.497) 8.450 24.083 ( 10.083 3.535 -7.317) 12.950 ======================= Grid point 211 (103/260) ======================= q-point: ( 0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.912 ( 11.601 14.665 10.520) 21.455 2.151 ( 9.229 8.127 21.813) 25.041 3.295 ( 1.269 -4.372 -3.084) 5.499 3.442 ( 5.274 0.139 3.734) 6.464 3.492 ( 8.411 -2.604 3.906) 9.633 3.782 ( 17.191 8.486 4.574) 19.710 4.357 ( -2.539 1.915 3.846) 4.991 4.615 ( -1.945 1.487 10.325) 10.611 4.831 ( 2.642 9.661 9.990) 14.146 5.364 ( -0.893 -1.101 3.870) 4.121 5.885 ( 1.791 10.451 6.869) 12.634 6.288 ( 13.808 -7.656 -4.235) 16.347 6.949 ( 2.993 17.258 -4.195) 18.011 7.233 ( 3.782 7.508 1.845) 8.607 7.767 ( -3.634 19.340 17.629) 26.420 8.343 ( -2.304 18.745 15.802) 24.625 8.817 ( 11.110 2.774 1.844) 11.599 9.352 ( -5.802 4.373 11.711) 13.782 9.452 ( -1.819 2.252 1.043) 3.077 10.174 ( 14.085 0.969 -0.576) 14.130 11.023 ( -6.202 -4.146 -3.234) 8.131 11.439 ( -6.930 2.083 0.614) 7.263 12.031 ( 11.900 -1.071 -5.440) 13.128 12.819 ( 7.843 4.419 -11.068) 14.267 13.526 ( -4.867 -3.138 4.162) 7.132 13.829 ( -5.251 -6.077 0.281) 8.036 14.527 ( -3.172 5.225 -1.168) 6.223 15.258 ( -7.851 -20.024 -14.235) 25.792 16.951 ( 9.386 -3.062 -2.462) 10.175 18.607 ( 6.886 -3.488 -2.051) 7.987 19.503 ( -19.269 -1.423 2.305) 19.459 19.729 ( -7.992 -6.365 -11.634) 15.483 20.732 ( -18.474 9.319 7.868) 22.137 22.875 ( 14.671 -16.765 3.508) 22.552 23.487 ( -0.495 2.762 -6.887) 7.437 24.228 ( 5.579 -3.466 -8.484) 10.729 ======================= Grid point 212 (104/260) ======================= q-point: ( 0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 14.155 9.454 8.691) 19.112 2.368 ( 9.273 6.189 15.445) 19.049 3.277 ( -2.556 -2.957 -0.889) 4.009 3.489 ( 1.092 -3.554 -0.662) 3.776 3.663 ( 7.492 -9.750 -5.274) 13.379 4.080 ( 8.135 8.581 -7.015) 13.748 4.288 ( -5.436 2.261 9.400) 11.091 4.662 ( 4.299 1.726 7.161) 8.529 4.828 ( -0.744 7.859 14.560) 16.562 5.494 ( 10.306 2.490 7.458) 12.963 5.943 ( 3.021 11.385 8.602) 14.585 6.480 ( 7.411 -3.476 -5.089) 9.639 7.031 ( 4.542 14.422 0.567) 15.131 7.302 ( 2.540 6.168 1.190) 6.776 7.732 ( -2.665 19.117 16.326) 25.280 8.291 ( -5.437 17.915 16.824) 25.171 8.984 ( 3.301 11.475 -0.799) 11.967 9.241 ( -7.727 -0.329 20.386) 21.804 9.546 ( 13.682 1.734 0.266) 13.794 10.417 ( 10.368 -1.693 -7.254) 12.766 10.836 ( -12.291 2.716 -3.071) 12.957 11.339 ( -3.261 2.422 2.736) 4.897 12.232 ( 8.517 3.137 -8.387) 12.358 12.906 ( 0.274 -1.507 3.422) 3.749 13.496 ( 3.743 2.098 -2.329) 4.883 13.741 ( -3.023 -6.726 0.215) 7.377 14.435 ( -6.029 4.674 -3.914) 8.574 15.057 ( -9.776 -19.767 -9.972) 24.202 17.233 ( 18.581 -1.806 -8.541) 20.530 18.727 ( -0.120 -2.247 -0.765) 2.377 19.253 ( -0.727 -4.815 10.576) 11.644 19.507 ( -11.949 -7.614 -12.465) 18.871 20.367 ( -19.908 12.917 6.424) 24.586 22.951 ( -4.531 -3.920 3.140) 6.764 23.615 ( 12.453 -7.309 -8.482) 16.747 24.269 ( 0.154 -8.577 -10.138) 13.280 ======================= Grid point 213 (105/260) ======================= q-point: ( 0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( 5.339 7.978 10.166) 13.982 2.613 ( 14.477 3.401 6.330) 16.163 3.191 ( -6.071 -3.832 -0.091) 7.180 3.486 ( -1.216 -1.984 -2.533) 3.440 3.777 ( 5.118 -11.957 -6.523) 14.550 4.034 ( -8.318 -0.764 -12.898) 15.366 4.205 ( -2.970 7.768 8.766) 12.083 4.700 ( -2.917 -1.254 -0.145) 3.178 4.970 ( 10.048 8.777 19.091) 23.291 5.713 ( 9.044 5.974 10.392) 15.016 6.023 ( 2.669 11.528 9.091) 14.922 6.631 ( 9.313 0.732 -1.044) 9.400 7.079 ( -0.711 12.122 3.501) 12.637 7.328 ( -0.055 6.419 -1.214) 6.533 7.735 ( 0.477 16.508 14.957) 22.281 8.201 ( -6.293 16.968 18.027) 25.544 9.000 ( 0.292 15.113 1.426) 15.183 9.143 ( -5.117 -4.270 20.719) 21.765 9.922 ( 20.711 4.612 3.367) 21.484 10.504 ( -9.482 8.913 4.279) 13.699 10.592 ( -1.396 -6.427 -19.416) 20.499 11.292 ( -2.612 4.774 3.904) 6.697 12.311 ( 1.057 7.381 -11.277) 13.519 12.870 ( -3.742 -5.556 14.552) 16.020 13.635 ( 7.186 2.346 -9.960) 12.504 13.735 ( 4.128 -8.451 -0.345) 9.412 14.274 ( -8.409 3.395 -7.048) 11.486 14.857 ( -8.367 -18.479 -5.547) 21.030 17.613 ( 20.326 -1.785 -8.704) 22.183 18.606 ( -7.288 3.806 -0.195) 8.225 19.244 ( -10.921 -6.877 -11.578) 17.338 19.517 ( 19.782 -9.585 16.012) 27.195 19.957 ( -22.241 15.013 3.693) 27.087 22.839 ( -5.642 -0.392 1.344) 5.813 23.842 ( 10.708 -7.951 -8.337) 15.729 24.201 ( -4.930 -12.028 -11.812) 17.564 ======================= Grid point 214 (106/260) ======================= q-point: (-0.50 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.453 ( -3.324 9.290 8.452) 12.992 2.882 ( 4.560 5.092 7.006) 9.788 3.056 ( -2.282 -8.537 -2.826) 9.278 3.428 ( -3.793 -0.535 -4.609) 5.993 3.836 ( -3.296 -1.837 -12.655) 13.206 3.847 ( -1.263 -15.621 -4.875) 16.413 4.203 ( 0.842 9.478 9.131) 13.188 4.561 ( -9.812 -1.009 -3.060) 10.328 5.187 ( 7.356 9.209 18.233) 21.710 5.850 ( 2.096 8.563 10.886) 14.008 6.061 ( -0.401 12.208 8.332) 14.785 6.825 ( 8.281 -1.000 2.915) 8.836 7.021 ( -5.502 13.204 4.587) 15.022 7.322 ( 1.403 7.745 -1.986) 8.118 7.790 ( 1.751 11.323 13.168) 17.455 8.119 ( -4.938 15.853 18.222) 24.652 9.035 ( 2.884 13.525 4.526) 14.550 9.121 ( -0.919 -6.051 19.180) 20.133 10.171 ( -12.863 8.648 -0.409) 15.505 10.317 ( 8.791 8.338 6.829) 13.908 10.582 ( -0.181 -3.113 -14.714) 15.041 11.254 ( -0.834 5.513 -0.328) 5.585 12.262 ( -2.992 9.526 -10.643) 14.594 12.834 ( -2.605 -9.410 14.316) 17.329 13.651 ( -3.241 -0.802 -11.873) 12.334 13.868 ( 5.797 -4.742 -0.466) 7.504 14.153 ( -0.537 0.152 -6.503) 6.527 14.736 ( -1.804 -16.263 -5.139) 17.151 17.986 ( 18.229 -1.584 -4.394) 18.818 18.475 ( -6.957 -0.650 -3.272) 7.715 19.115 ( 1.639 0.410 -6.343) 6.564 19.508 ( -21.699 15.425 -2.233) 26.716 19.994 ( 23.494 -8.594 21.126) 32.743 22.743 ( -4.454 -3.017 -2.309) 5.854 23.984 ( 2.970 1.613 -5.466) 6.426 24.048 ( -5.917 -19.035 -15.451) 25.220 ======================= Grid point 215 (107/260) ======================= q-point: (-0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( -9.025 11.563 8.825) 17.118 2.664 ( -18.400 3.936 5.149) 19.508 3.205 ( 8.013 -6.452 -1.876) 10.457 3.346 ( -2.379 -1.504 -5.713) 6.368 3.730 ( -2.626 -5.442 -12.071) 13.499 3.838 ( -3.338 -9.253 0.628) 9.856 4.210 ( -5.013 9.881 4.456) 11.942 4.396 ( -1.763 0.531 1.638) 2.464 5.310 ( 1.724 8.675 18.015) 20.069 5.834 ( -4.705 9.735 9.740) 14.552 6.046 ( -2.464 12.415 8.952) 15.503 6.880 ( -6.003 8.247 3.692) 10.848 6.905 ( -4.575 1.652 3.754) 6.144 7.418 ( 7.615 7.776 -1.121) 10.941 7.833 ( 0.643 7.161 10.630) 12.833 8.071 ( -3.334 14.072 17.814) 22.945 9.123 ( 2.678 9.753 6.736) 12.152 9.150 ( 1.642 -6.823 13.558) 15.267 9.870 ( -13.827 11.618 0.266) 18.061 10.272 ( -14.281 1.219 4.975) 15.172 10.676 ( 9.655 8.547 -5.641) 14.075 11.275 ( 3.140 5.544 -5.636) 8.506 12.181 ( -3.207 9.266 -8.278) 12.833 12.812 ( -1.799 -11.089 9.841) 14.935 13.479 ( -9.764 -2.594 -13.131) 16.568 13.989 ( 6.750 2.904 4.114) 8.421 14.163 ( 0.002 -5.880 -2.857) 6.538 14.799 ( 9.118 -15.309 -10.691) 20.780 18.262 ( -6.158 -8.664 -2.009) 10.817 18.337 ( 9.383 -0.238 -4.418) 10.373 19.131 ( -10.650 9.834 1.147) 14.541 19.313 ( 14.923 12.111 -6.864) 20.408 20.499 ( 22.726 -5.994 23.347) 33.128 22.619 ( -8.120 -10.632 -10.262) 16.861 23.831 ( -8.968 -3.347 -6.648) 11.654 24.045 ( 0.715 -6.134 -12.138) 13.619 ======================= Grid point 216 (108/260) ======================= q-point: (-0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( -12.904 12.583 10.979) 21.104 2.291 ( -18.475 8.843 6.474) 21.481 3.242 ( -1.644 -3.294 -4.641) 5.924 3.344 ( -1.708 1.596 2.854) 3.689 3.641 ( -6.804 -0.539 -6.230) 9.241 3.708 ( -6.235 -4.571 3.207) 8.370 4.108 ( -2.408 3.454 -0.934) 4.313 4.463 ( 4.441 2.901 3.437) 6.321 5.321 ( -3.556 5.570 17.744) 18.935 5.745 ( -4.829 9.039 8.644) 13.407 6.001 ( -3.738 10.027 10.970) 15.325 6.714 ( -13.651 -5.426 -0.936) 14.719 6.766 ( -6.782 15.770 6.202) 18.252 7.527 ( 1.827 1.166 -7.026) 7.353 7.878 ( 2.584 8.274 9.081) 12.554 8.051 ( -1.504 15.180 20.352) 25.435 9.036 ( -10.695 -1.913 4.326) 11.694 9.276 ( 6.323 2.370 7.170) 9.849 9.682 ( -6.130 10.988 6.251) 14.049 9.933 ( -17.908 4.391 7.119) 19.765 10.848 ( 8.589 7.986 -4.791) 12.669 11.336 ( 3.707 4.884 -6.809) 9.163 12.103 ( -3.549 7.903 -5.685) 10.361 12.790 ( -1.743 -8.450 0.858) 8.670 13.290 ( -6.183 -3.495 -5.781) 9.158 14.087 ( -0.374 -0.700 -1.086) 1.345 14.193 ( 6.307 -0.415 5.221) 8.198 15.008 ( 13.014 -16.652 -15.389) 26.144 17.971 ( -17.733 -7.258 -0.973) 19.185 18.581 ( 12.816 -7.567 -4.791) 15.635 19.111 ( 8.391 12.119 -0.989) 14.774 19.676 ( 20.105 9.962 -1.053) 22.463 20.957 ( 18.668 -2.585 24.168) 30.647 22.339 ( -17.955 -19.307 -19.551) 32.824 23.687 ( -4.139 2.133 -2.865) 5.467 23.994 ( -3.552 -0.532 -11.699) 12.238 ======================= Grid point 217 (109/260) ======================= q-point: (-0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -13.791 13.734 12.295) 23.021 2.011 ( -11.707 17.387 13.789) 25.090 3.087 ( -17.224 15.343 12.727) 26.345 3.256 ( -1.349 -0.922 1.713) 2.368 3.534 ( -3.474 -2.670 -2.485) 5.037 3.642 ( -2.295 -2.139 0.820) 3.242 4.100 ( 1.728 0.558 -2.759) 3.303 4.529 ( 1.380 3.238 1.399) 3.788 5.248 ( -6.485 1.635 17.277) 18.526 5.693 ( -1.905 7.302 7.783) 10.841 5.939 ( -4.504 5.248 12.673) 14.438 6.312 ( -24.840 -9.189 -4.112) 26.803 6.708 ( -0.823 21.386 7.516) 22.683 7.460 ( -4.967 0.574 -17.785) 18.475 7.924 ( -0.963 11.434 14.745) 18.683 8.110 ( 3.176 16.855 19.885) 26.260 8.803 ( -10.349 1.165 3.133) 10.875 9.358 ( -5.775 -3.454 8.698) 10.997 9.488 ( -7.737 7.662 2.414) 11.153 9.786 ( 0.419 10.383 10.937) 15.086 11.008 ( 8.555 2.039 -6.252) 10.790 11.387 ( 2.325 2.375 -5.894) 6.767 12.019 ( -4.111 6.421 -2.962) 8.179 12.732 ( -2.964 -1.627 -11.630) 12.112 13.246 ( 1.909 -5.545 4.048) 7.126 14.047 ( -2.220 -5.441 -0.784) 5.928 14.355 ( 7.641 4.700 4.539) 10.054 15.227 ( 11.449 -18.218 -17.833) 27.946 17.613 ( -17.294 -10.805 1.605) 20.455 18.903 ( 21.111 -8.856 -4.285) 23.291 19.332 ( 11.242 6.961 -4.458) 13.954 20.047 ( 15.616 6.361 0.156) 16.863 21.291 ( 9.510 -0.243 19.160) 21.392 21.871 ( -22.771 -17.940 -16.943) 33.577 23.655 ( 0.910 5.436 -2.196) 5.933 23.881 ( -5.135 4.809 -10.083) 12.295 ======================= Grid point 218 (110/260) ======================= q-point: (-0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( -7.736 20.592 16.806) 27.682 1.853 ( -6.983 19.549 18.866) 28.051 2.796 ( -11.790 24.014 25.217) 36.763 3.273 ( 2.398 -2.495 -1.716) 3.862 3.449 ( -4.654 -8.240 2.409) 9.765 3.576 ( -4.895 5.041 0.670) 7.059 4.184 ( 7.167 -0.323 -1.473) 7.324 4.523 ( -1.757 4.099 1.142) 4.603 5.126 ( -9.115 -1.864 15.951) 18.466 5.684 ( -0.912 5.088 6.267) 8.124 5.790 ( -18.986 -4.422 -0.913) 19.516 5.896 ( -5.879 4.533 12.883) 14.868 6.751 ( 3.716 21.534 5.465) 22.525 7.313 ( -5.762 6.631 -20.229) 22.054 7.906 ( -3.438 15.210 18.096) 23.888 8.190 ( 1.443 14.276 17.570) 22.685 8.707 ( -1.418 1.459 7.340) 7.616 9.116 ( -9.488 3.600 5.484) 11.535 9.509 ( 2.232 1.028 1.761) 3.023 9.833 ( 1.205 9.060 10.226) 13.716 11.158 ( 7.109 -4.935 -7.181) 11.245 11.405 ( 0.768 -1.717 -3.771) 4.214 11.934 ( -4.100 4.906 -1.031) 6.477 12.656 ( -1.444 4.429 -18.059) 18.650 13.355 ( 7.367 -6.937 5.127) 11.344 14.007 ( -1.807 -6.632 -0.123) 6.875 14.494 ( 5.553 4.391 1.782) 7.301 15.385 ( 7.446 -19.207 -19.019) 28.037 17.312 ( -13.578 -16.319 5.393) 21.904 19.304 ( 9.713 -8.976 -18.179) 22.481 19.479 ( 8.770 -1.543 -1.300) 9.000 20.195 ( -1.619 -0.474 -6.842) 7.047 21.347 ( 1.369 -0.384 5.566) 5.745 21.610 ( -3.597 -3.581 10.677) 11.822 23.693 ( 2.294 5.416 -1.915) 6.186 23.793 ( -0.587 10.196 -8.450) 13.255 ======================= Grid point 219 (111/260) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( -1.056 20.435 13.804) 24.683 2.161 ( -3.256 15.347 22.443) 27.383 3.102 ( -4.123 -7.861 5.319) 10.348 3.239 ( 3.528 -5.754 2.754) 7.290 3.321 ( 2.578 12.624 13.978) 19.010 3.617 ( -1.349 9.182 9.101) 12.998 4.261 ( 6.415 -6.021 6.190) 10.757 4.685 ( 4.150 9.040 -0.416) 9.956 4.949 ( -11.063 4.201 15.013) 19.116 5.585 ( 3.554 -2.296 -1.133) 4.381 5.625 ( -7.112 -2.811 3.699) 8.495 6.093 ( 0.994 11.807 2.244) 12.060 7.166 ( 4.472 7.876 -6.631) 11.225 7.293 ( -3.391 3.330 -14.972) 15.708 8.199 ( -3.295 13.480 20.095) 24.421 8.555 ( -0.871 6.897 15.576) 17.057 8.754 ( 4.505 14.631 14.651) 21.189 9.292 ( 6.633 7.118 10.507) 14.321 9.503 ( 0.056 -2.308 8.617) 8.921 10.136 ( 0.508 16.978 8.101) 18.818 10.904 ( -5.774 -18.976 0.175) 19.836 11.334 ( 5.019 -8.792 -2.290) 10.380 11.929 ( -5.380 8.854 2.436) 10.643 12.807 ( 2.570 5.968 -17.405) 18.578 13.372 ( 6.451 -5.753 -1.583) 8.787 13.839 ( -0.448 -4.901 -3.797) 6.216 14.610 ( 2.497 -2.273 -5.936) 6.829 15.006 ( 1.264 -18.137 -16.943) 24.851 16.812 ( -8.637 -8.400 2.571) 12.319 18.946 ( -17.192 -2.891 -28.362) 33.291 19.630 ( 10.863 -4.056 -2.790) 11.927 20.102 ( -5.159 -0.312 -11.278) 12.406 21.418 ( -9.894 1.436 11.840) 15.496 21.638 ( 16.868 -4.634 8.838) 19.598 23.777 ( -2.738 4.321 0.316) 5.125 24.007 ( 5.932 2.432 -3.841) 7.474 ======================= Grid point 220 (112/260) ======================= q-point: ( 0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( 2.405 17.887 13.268) 22.400 2.215 ( 4.108 13.866 18.889) 23.789 3.085 ( 1.652 -9.540 3.068) 10.157 3.321 ( 3.556 -6.014 1.453) 7.136 3.374 ( 0.468 0.775 5.755) 5.826 3.740 ( 11.075 16.863 17.616) 26.784 4.373 ( 3.668 -1.235 8.038) 8.921 4.752 ( -7.208 3.066 7.659) 10.955 4.839 ( 7.281 9.007 7.421) 13.756 5.463 ( -8.832 -2.549 -0.308) 9.198 5.772 ( 13.502 -4.537 -2.372) 14.441 6.149 ( 3.989 11.274 1.885) 12.107 7.208 ( 0.732 8.635 -12.596) 15.289 7.269 ( 3.665 2.377 -5.790) 7.253 8.163 ( -3.841 13.027 20.855) 24.888 8.599 ( 5.387 2.763 10.448) 12.076 8.852 ( 0.946 24.354 15.386) 28.823 9.438 ( 0.652 0.438 14.794) 14.815 9.533 ( 3.038 2.656 6.285) 7.469 10.185 ( 4.314 18.020 5.578) 19.351 10.819 ( -1.628 -20.328 3.096) 20.627 11.493 ( 9.612 -8.622 -2.654) 13.183 11.816 ( -5.387 7.150 2.533) 9.304 12.842 ( 3.428 2.845 -13.956) 14.649 13.459 ( 2.592 -4.321 -1.622) 5.293 13.824 ( -0.513 -1.879 -5.899) 6.212 14.620 ( -0.408 -2.838 -5.028) 5.788 14.958 ( -3.169 -17.677 -16.489) 24.380 16.744 ( 1.835 -5.930 0.119) 6.209 18.619 ( -9.239 -0.687 -19.204) 21.322 19.717 ( -1.579 -2.545 -3.846) 4.874 19.880 ( -14.934 -1.378 -11.952) 19.178 21.176 ( -14.155 3.718 9.450) 17.421 22.083 ( 23.632 -11.697 6.773) 27.225 23.687 ( -6.049 4.369 -1.878) 7.694 24.111 ( 4.541 -0.201 -2.853) 5.366 ======================= Grid point 221 (113/260) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 6.725 14.440 10.022) 18.819 2.368 ( 7.783 12.246 14.478) 20.497 3.152 ( 3.682 -8.605 -0.050) 9.360 3.358 ( 0.270 -5.138 -0.204) 5.150 3.402 ( 1.954 -5.925 2.281) 6.642 4.026 ( 11.720 8.960 15.879) 21.674 4.445 ( 2.183 8.426 3.390) 9.341 4.641 ( -3.192 1.358 12.748) 13.212 4.989 ( 0.940 4.223 9.783) 10.696 5.356 ( 2.906 0.733 -4.051) 5.039 6.036 ( 12.061 -2.442 -3.302) 12.741 6.254 ( 6.419 8.953 1.020) 11.064 7.234 ( 3.896 9.665 -9.573) 14.151 7.328 ( 2.741 2.172 -2.681) 4.407 8.118 ( -4.384 11.869 19.389) 23.152 8.771 ( 2.147 15.526 11.120) 19.218 8.909 ( 9.941 10.806 11.537) 18.673 9.371 ( -7.733 -1.916 14.473) 16.521 9.570 ( -1.078 9.207 5.755) 10.911 10.317 ( 7.218 9.481 -3.401) 12.392 10.876 ( 5.091 -10.270 11.912) 16.531 11.528 ( -6.298 6.158 -6.475) 10.932 11.877 ( 11.334 -7.270 6.949) 15.153 12.875 ( 1.271 -3.311 -8.423) 9.139 13.491 ( 1.913 0.395 -1.969) 2.773 13.782 ( -2.685 1.621 -7.900) 8.500 14.582 ( -2.514 -3.648 -2.975) 5.336 14.823 ( -7.532 -16.128 -15.547) 23.634 16.889 ( 12.832 -2.622 -3.892) 13.663 18.539 ( 3.350 -2.757 -9.670) 10.598 19.480 ( -19.005 -0.595 -2.055) 19.125 19.614 ( -9.754 -4.504 -11.467) 15.714 20.914 ( -14.033 7.588 8.554) 18.102 22.530 ( 19.224 -14.720 4.666) 24.657 23.545 ( -6.844 2.323 -5.776) 9.252 24.165 ( 1.422 -2.382 -3.578) 4.528 ======================= Grid point 222 (114/260) ======================= q-point: ( 0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( 10.184 11.074 6.745) 16.488 2.552 ( 8.217 10.838 8.808) 16.204 3.178 ( -1.795 -5.865 -0.263) 6.140 3.368 ( 0.865 -6.943 -0.170) 6.999 3.449 ( 3.079 -10.564 -3.838) 11.653 4.153 ( -1.801 -1.101 5.298) 5.703 4.434 ( -2.851 10.672 -1.200) 11.111 4.699 ( 2.390 1.814 13.394) 13.726 4.963 ( 1.308 4.347 13.375) 14.125 5.560 ( 13.837 3.615 1.810) 14.416 6.227 ( 7.838 10.070 0.620) 12.776 6.407 ( 8.889 0.735 -1.337) 9.019 7.289 ( 1.737 8.444 -5.197) 10.066 7.388 ( 4.137 3.396 -2.222) 5.796 8.059 ( -4.448 10.430 16.559) 20.069 8.703 ( -7.285 17.518 11.898) 22.395 9.147 ( -3.759 2.361 20.026) 20.512 9.310 ( 6.799 10.392 3.118) 12.804 9.608 ( 9.271 4.441 6.612) 12.223 10.432 ( 5.661 -0.278 -10.352) 11.802 10.950 ( -3.133 7.329 10.388) 13.093 11.392 ( -3.838 3.848 -0.093) 5.435 12.127 ( 10.317 -6.962 6.205) 13.908 12.857 ( -1.813 -8.183 -0.424) 8.392 13.547 ( 3.869 3.152 -4.779) 6.909 13.703 ( -2.756 3.363 -8.978) 9.975 14.515 ( -3.859 -0.640 -3.323) 5.133 14.611 ( -10.715 -17.911 -12.461) 24.309 17.212 ( 19.658 -0.182 -6.118) 20.589 18.664 ( 7.419 -3.435 -3.301) 8.817 19.176 ( -8.781 -2.065 5.530) 10.581 19.360 ( -12.565 -6.324 -12.332) 18.707 20.633 ( -16.001 11.731 5.953) 20.714 22.817 ( 7.449 -8.436 4.942) 12.291 23.440 ( -0.726 -7.838 -11.401) 13.855 24.158 ( -1.220 -2.410 -4.514) 5.261 ======================= Grid point 223 (115/260) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.615 ( 6.756 8.794 3.392) 11.597 2.731 ( 9.611 8.452 3.623) 13.302 3.091 ( -6.415 -5.271 0.001) 8.303 3.381 ( 0.448 -8.157 0.627) 8.193 3.500 ( 2.615 -12.206 -7.562) 14.595 4.009 ( -10.458 -1.961 -9.622) 14.346 4.377 ( -2.401 8.290 5.593) 10.284 4.678 ( -4.726 -0.928 6.630) 8.195 5.142 ( 9.941 6.806 20.506) 23.783 5.837 ( 12.478 5.655 5.521) 14.770 6.351 ( 4.171 16.744 3.021) 17.518 6.598 ( 9.858 -2.422 0.212) 10.154 7.290 ( -0.110 6.424 -4.135) 7.641 7.449 ( 1.398 5.675 -2.479) 6.348 8.010 ( -3.138 9.022 14.848) 17.655 8.561 ( -8.651 11.037 10.907) 17.766 9.035 ( -6.216 2.191 16.366) 17.644 9.362 ( -1.628 15.673 9.214) 18.253 10.018 ( 24.384 3.377 5.816) 25.295 10.500 ( 2.319 -4.041 -10.123) 11.143 10.785 ( -10.858 16.331 -2.009) 19.713 11.374 ( -0.646 3.434 7.244) 8.042 12.256 ( 1.409 -5.670 5.456) 7.994 12.827 ( -1.675 -5.216 6.832) 8.758 13.584 ( 1.929 -3.398 -9.201) 9.996 13.692 ( 2.007 2.382 -9.289) 9.797 14.336 ( -11.127 -3.642 -12.137) 16.863 14.471 ( -2.341 -11.313 -0.696) 11.573 17.609 ( 20.375 1.144 -4.817) 20.968 18.668 ( -7.311 2.389 1.100) 7.770 19.094 ( -4.797 -6.890 -9.550) 12.715 19.322 ( 15.465 -8.512 10.434) 20.505 20.290 ( -19.038 15.588 1.367) 24.643 22.829 ( -5.334 -0.522 0.127) 5.361 23.494 ( 6.712 -20.406 -11.863) 24.539 24.112 ( -2.225 0.283 -4.811) 5.308 ======================= Grid point 224 (116/260) ======================= q-point: (-0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.673 ( -0.676 9.834 0.721) 9.883 2.903 ( -3.630 -4.929 -1.433) 6.287 2.962 ( 3.111 3.307 2.715) 5.290 3.382 ( -1.080 -4.260 -1.922) 4.797 3.526 ( 1.818 -13.408 -4.308) 14.200 3.783 ( -8.335 -3.483 -15.631) 18.053 4.369 ( 0.133 6.317 11.003) 12.689 4.562 ( -7.418 1.192 2.912) 8.058 5.347 ( 5.995 5.595 21.884) 23.370 6.038 ( 5.725 9.052 6.727) 12.647 6.401 ( 0.291 17.774 3.234) 18.069 6.753 ( 4.267 -4.587 3.125) 7.001 7.276 ( -1.721 9.393 -3.823) 10.286 7.452 ( 1.570 4.471 -4.822) 6.760 7.980 ( -2.693 6.792 13.720) 15.545 8.418 ( -7.240 5.679 12.481) 15.506 8.998 ( -0.247 4.046 13.262) 13.868 9.335 ( -2.684 11.110 11.547) 16.247 10.363 ( 2.526 2.701 4.055) 5.488 10.407 ( -9.322 4.061 -6.637) 12.143 10.739 ( 11.024 15.737 -1.925) 19.311 11.359 ( -1.294 4.655 1.939) 5.206 12.237 ( -3.332 -5.736 7.765) 10.213 12.793 ( -3.107 0.485 6.493) 7.215 13.608 ( -4.613 -3.126 -11.104) 12.424 13.696 ( 6.603 -9.119 -10.700) 15.533 14.143 ( -6.244 -6.872 -5.350) 10.716 14.474 ( 3.418 -3.435 -3.755) 6.130 17.969 ( 15.297 -0.471 -1.203) 15.352 18.455 ( -11.532 -0.753 -3.189) 11.989 19.121 ( 7.896 1.426 0.102) 8.024 19.718 ( 11.928 -6.902 6.102) 15.071 19.952 ( -5.609 14.197 4.770) 15.993 22.654 ( -11.067 -5.682 -9.062) 15.391 23.602 ( 5.138 -18.381 -7.563) 20.530 24.066 ( -1.382 2.868 -5.474) 6.332 ======================= Grid point 225 (117/260) ======================= q-point: (-0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( -8.154 8.887 0.410) 12.068 2.691 ( -11.030 2.314 2.354) 11.513 3.111 ( 6.338 -2.341 -0.590) 6.783 3.322 ( -2.484 -0.784 -5.839) 6.394 3.570 ( 1.341 -8.640 -4.086) 9.651 3.657 ( -1.975 -8.084 -4.316) 9.374 4.403 ( -6.871 3.021 3.735) 8.383 4.420 ( 1.138 6.424 7.860) 10.215 5.435 ( -1.114 3.541 21.020) 21.346 6.070 ( -3.415 11.818 6.487) 13.907 6.376 ( -3.218 17.027 2.612) 17.524 6.756 ( -4.824 -6.648 2.821) 8.685 7.186 ( -5.396 11.776 -1.801) 13.078 7.512 ( 3.251 0.804 -7.541) 8.251 7.967 ( 0.216 5.533 11.181) 12.477 8.337 ( -3.198 5.490 16.404) 17.591 9.042 ( 0.928 3.583 11.699) 12.270 9.298 ( -2.657 5.417 9.597) 11.336 10.158 ( -11.222 13.399 -4.027) 17.936 10.274 ( -10.645 -0.838 5.126) 11.844 10.987 ( 8.496 17.157 3.681) 19.496 11.361 ( 2.469 2.267 -5.343) 6.307 12.180 ( -3.803 -3.988 10.826) 12.148 12.748 ( -1.376 1.620 1.363) 2.525 13.407 ( -10.153 -3.453 -14.238) 17.825 13.901 ( 13.301 -10.392 -6.181) 17.976 14.040 ( -4.198 -8.760 -1.990) 9.916 14.582 ( 7.770 -2.179 -8.071) 11.413 18.106 ( -5.923 -5.692 3.285) 8.847 18.317 ( 2.249 -1.867 -7.567) 8.112 19.311 ( 6.126 8.924 7.716) 13.293 19.622 ( 2.042 14.353 -14.187) 20.284 20.353 ( 25.165 -7.331 23.273) 35.052 22.359 ( -16.306 -13.331 -17.233) 27.214 23.668 ( 2.665 -8.284 -2.543) 9.066 24.034 ( -0.962 1.784 -7.643) 7.907 ======================= Grid point 226 (118/260) ======================= q-point: (-0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.363 ( -12.694 7.351 4.505) 15.345 2.528 ( -7.592 14.398 5.444) 17.164 3.152 ( -1.149 -4.810 -3.087) 5.830 3.360 ( 6.462 -0.453 -1.470) 6.642 3.505 ( -5.509 -7.678 -1.596) 9.584 3.667 ( -0.435 -2.908 6.674) 7.293 4.246 ( -7.358 8.313 0.195) 11.103 4.502 ( 4.009 0.877 5.845) 7.142 5.387 ( -6.595 1.542 18.925) 20.100 5.950 ( -8.974 8.736 5.812) 13.807 6.287 ( -6.009 14.949 1.328) 16.166 6.562 ( -14.756 -4.941 1.568) 15.641 7.106 ( -2.134 13.140 -0.480) 13.321 7.499 ( -2.242 -3.144 -10.579) 11.262 8.040 ( 3.910 6.633 12.274) 14.489 8.357 ( 2.295 8.285 18.470) 20.373 8.992 ( -8.533 1.759 8.085) 11.885 9.298 ( 1.312 2.203 7.969) 8.372 9.911 ( -15.157 6.551 3.853) 16.956 10.094 ( -5.653 11.172 6.609) 14.158 11.056 ( -0.355 8.191 1.520) 8.338 11.416 ( 2.518 2.760 -5.757) 6.863 12.125 ( -3.715 -0.302 11.302) 11.901 12.758 ( 2.596 2.368 -5.299) 6.358 13.210 ( -6.641 -3.435 -11.195) 13.462 13.961 ( -3.381 -8.873 -1.861) 9.676 14.165 ( 13.460 -7.291 -4.718) 16.018 14.730 ( 8.511 -6.147 -11.973) 15.924 17.843 ( -18.770 -4.619 3.544) 19.652 18.433 ( 10.626 -6.299 -8.676) 15.095 19.394 ( 5.412 14.188 -2.811) 15.443 19.849 ( 16.044 5.989 -4.744) 17.770 20.881 ( 22.639 -4.706 26.150) 34.907 21.959 ( -19.820 -15.590 -20.172) 32.292 23.709 ( 1.965 0.268 -0.140) 1.988 23.992 ( -1.766 0.212 -9.198) 9.369 ======================= Grid point 227 (119/260) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( -7.485 13.302 10.824) 18.712 2.390 ( -7.749 18.388 10.643) 22.615 3.127 ( -0.211 -5.317 -1.623) 5.563 3.377 ( -7.436 -7.538 6.834) 12.602 3.439 ( -3.022 7.227 7.382) 10.764 3.658 ( 0.977 2.814 4.971) 5.795 4.127 ( -4.032 1.653 -0.735) 4.419 4.583 ( 3.192 2.061 1.866) 4.233 5.273 ( -7.699 1.275 17.886) 19.514 5.769 ( -9.035 -0.489 2.010) 9.269 6.121 ( -13.678 4.008 -0.074) 14.253 6.243 ( -12.960 9.194 3.969) 16.378 7.091 ( 0.330 13.258 -0.528) 13.272 7.435 ( -1.340 -1.931 -14.286) 14.478 8.128 ( 2.532 7.934 15.460) 17.560 8.468 ( 3.594 12.018 19.961) 23.576 8.795 ( -9.733 -0.077 5.230) 11.049 9.328 ( -1.481 3.338 8.941) 9.658 9.613 ( -13.356 4.113 8.835) 16.533 10.067 ( 0.604 13.725 6.851) 15.351 11.031 ( -1.602 -1.856 -0.424) 2.488 11.406 ( -2.680 -0.871 -4.279) 5.123 12.071 ( -3.543 4.255 9.121) 10.670 12.803 ( 2.681 5.378 -15.119) 16.269 13.136 ( 1.123 -4.839 -3.336) 5.983 13.901 ( -2.302 -8.192 -2.312) 8.818 14.393 ( 9.938 -3.964 -4.578) 11.638 14.869 ( 7.620 -11.784 -15.002) 20.543 17.438 ( -21.066 -5.898 3.015) 22.083 18.735 ( 21.023 -6.684 -10.454) 24.411 19.494 ( 3.481 8.207 -7.113) 11.405 20.104 ( 8.906 -0.859 -6.805) 11.242 21.291 ( 11.929 -0.004 20.814) 23.990 21.574 ( -12.528 -10.027 -9.149) 18.471 23.750 ( 2.207 3.769 -0.420) 4.387 23.940 ( -1.459 0.996 -8.237) 8.424 ======================= Grid point 228 (120/260) ======================= q-point: (-0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( -2.791 17.240 14.799) 22.892 2.256 ( -8.211 19.153 17.510) 27.218 3.143 ( 1.294 -5.715 1.271) 5.996 3.255 ( -6.330 -9.907 7.770) 14.092 3.312 ( -6.272 19.167 13.762) 24.415 3.673 ( -2.810 3.999 5.670) 7.485 4.128 ( 4.636 -5.219 1.088) 7.066 4.634 ( 1.951 6.265 0.195) 6.565 5.134 ( -9.835 2.466 17.270) 20.026 5.623 ( -5.370 -5.389 -3.545) 8.394 5.801 ( -13.736 0.350 6.120) 15.041 6.112 ( -3.429 14.007 2.621) 14.657 7.109 ( 1.969 10.302 -3.461) 11.044 7.383 ( -2.041 1.953 -16.027) 16.274 8.199 ( 0.846 11.911 17.304) 21.025 8.510 ( -0.454 13.737 18.720) 23.223 8.715 ( -1.245 -0.711 11.965) 12.050 9.249 ( -4.474 10.051 8.470) 13.885 9.495 ( -1.582 -1.276 8.831) 9.062 10.106 ( 1.328 14.329 7.841) 16.388 10.993 ( -2.647 -11.380 -0.614) 11.700 11.326 ( -3.137 -5.572 -3.054) 7.087 12.013 ( -3.855 7.563 5.479) 10.103 12.804 ( 1.212 6.760 -19.168) 20.362 13.229 ( 7.221 -5.547 -0.396) 9.114 13.861 ( -1.258 -6.951 -2.772) 7.589 14.539 ( 5.775 -2.339 -5.356) 8.216 14.970 ( 5.160 -16.236 -16.601) 23.787 17.062 ( -16.554 -7.981 2.941) 18.611 19.134 ( 14.726 -6.767 -22.662) 27.860 19.456 ( -2.636 -0.801 -5.115) 5.809 20.164 ( 0.109 -2.029 -11.266) 11.448 21.366 ( 3.302 1.642 5.583) 6.691 21.550 ( -0.009 -2.202 15.496) 15.652 23.790 ( 1.296 4.102 0.321) 4.314 23.927 ( 2.096 3.004 -6.255) 7.248 ======================= Grid point 229 (121/260) ======================= q-point: ( 0.00 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( 1.585 10.479 10.426) 14.867 2.484 ( -7.786 13.500 19.639) 25.071 2.852 ( -4.296 -11.952 11.472) 17.115 3.092 ( 3.658 -6.180 5.654) 9.140 3.503 ( -8.083 3.282 2.927) 9.201 3.857 ( 6.143 10.911 13.400) 18.340 4.115 ( 9.040 -7.326 9.811) 15.220 4.837 ( 3.888 4.376 -2.522) 6.374 5.062 ( -8.787 4.623 20.102) 22.420 5.538 ( 2.997 -1.525 -2.010) 3.917 5.555 ( -7.588 -2.915 -0.343) 8.136 6.288 ( -0.520 5.430 -4.879) 7.318 7.215 ( 4.393 -0.081 -11.805) 12.597 7.357 ( -3.198 1.591 -11.555) 12.095 8.390 ( -4.632 4.526 22.389) 23.307 8.593 ( -3.344 0.059 16.100) 16.444 9.079 ( 21.464 9.031 17.133) 28.910 9.373 ( -1.113 -0.700 10.444) 10.527 9.610 ( -0.730 14.413 10.298) 17.729 10.308 ( 0.480 -11.944 14.218) 18.575 10.628 ( -8.826 4.613 5.339) 11.299 11.125 ( 2.207 -9.408 -3.672) 10.337 12.210 ( -4.771 13.542 -2.920) 14.652 12.827 ( -0.834 -3.566 -12.804) 13.317 13.260 ( 7.885 -3.841 -2.157) 9.032 13.776 ( 2.587 -1.234 -5.841) 6.506 14.432 ( 1.609 -8.704 -11.127) 14.218 14.839 ( 1.356 -1.080 -14.294) 14.398 16.701 ( -7.777 -2.520 -0.720) 8.207 18.896 ( -14.462 -1.412 -31.618) 34.797 19.571 ( 11.902 -1.469 -3.335) 12.447 20.096 ( -5.110 -0.210 -13.367) 14.312 21.439 ( -9.775 0.515 11.439) 15.056 21.577 ( 12.679 -1.368 9.765) 16.062 23.847 ( -2.684 1.961 1.376) 3.597 24.024 ( 4.550 -0.044 -2.337) 5.115 ======================= Grid point 230 (122/260) ======================= q-point: ( 0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( -0.801 11.318 16.213) 19.789 2.485 ( 2.989 8.680 9.087) 12.917 2.860 ( 3.412 -9.398 7.909) 12.749 3.179 ( 3.479 -5.620 4.380) 7.930 3.387 ( -4.285 0.294 2.442) 4.941 3.999 ( 5.181 6.277 15.898) 17.861 4.348 ( 11.910 -0.799 14.689) 18.927 4.873 ( -4.183 7.090 4.105) 9.199 4.964 ( -0.268 1.465 11.155) 11.254 5.401 ( -5.404 -2.366 -6.875) 9.059 5.690 ( 10.657 -2.598 -0.754) 10.995 6.332 ( 5.151 4.855 -4.326) 8.296 7.292 ( 3.802 1.214 -9.488) 10.293 7.313 ( 2.123 1.227 -10.991) 11.261 8.328 ( -5.475 3.184 22.281) 23.164 8.621 ( 5.423 0.432 11.662) 12.869 9.310 ( -5.040 5.201 10.180) 12.493 9.519 ( 8.813 18.281 18.192) 27.254 9.625 ( 4.080 4.776 12.967) 14.409 10.303 ( -3.839 -25.037 10.580) 27.450 10.561 ( 4.284 13.509 8.205) 16.376 11.271 ( 12.114 -9.500 -1.826) 15.503 12.083 ( -7.225 12.978 -4.158) 15.425 12.780 ( -2.061 -6.436 -9.148) 11.373 13.406 ( 7.160 -0.889 -2.755) 7.723 13.816 ( 2.316 0.192 -6.771) 7.159 14.405 ( -2.342 -9.928 -10.127) 14.374 14.819 ( -0.945 -0.343 -14.850) 14.884 16.660 ( 4.144 -2.011 -3.006) 5.500 18.601 ( -8.642 -0.644 -23.549) 25.093 19.680 ( -0.853 -0.938 -4.682) 4.851 19.862 ( -15.602 -0.416 -13.887) 20.891 21.232 ( -11.461 1.407 9.378) 14.876 21.916 ( 18.563 -4.078 8.290) 20.735 23.755 ( -6.688 1.811 -0.950) 6.993 24.098 ( 2.854 -0.600 -1.270) 3.181 ======================= Grid point 231 (123/260) ======================= q-point: ( 0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( 4.668 10.457 10.515) 15.546 2.588 ( 6.058 4.807 7.770) 10.962 2.986 ( 7.152 -4.702 2.356) 8.877 3.222 ( 0.276 -6.536 1.663) 6.750 3.318 ( -3.643 -1.614 2.028) 4.471 4.109 ( 2.554 0.900 15.554) 15.788 4.606 ( 9.122 2.089 19.595) 21.715 4.756 ( -5.143 11.569 3.116) 13.038 4.969 ( -3.410 -6.178 5.080) 8.694 5.393 ( 7.842 1.876 -9.724) 12.633 5.942 ( 14.178 -3.399 0.530) 14.589 6.450 ( 6.909 5.936 -3.594) 9.792 7.352 ( 2.742 0.765 -6.962) 7.521 7.364 ( 5.011 2.666 -7.475) 9.386 8.252 ( -5.844 2.109 20.158) 21.094 8.856 ( 13.048 0.458 10.561) 16.792 9.179 ( -5.635 2.286 6.021) 8.558 9.519 ( -4.744 17.619 11.469) 21.552 9.760 ( 0.854 8.802 14.752) 17.200 10.242 ( -2.319 -18.367 5.900) 19.431 10.826 ( 16.720 6.703 18.208) 25.612 11.520 ( 9.706 -5.731 -6.225) 12.876 11.944 ( -3.656 9.868 0.987) 10.569 12.706 ( -4.215 -8.888 -4.575) 10.848 13.536 ( 6.549 2.690 -3.461) 7.880 13.832 ( 0.192 1.506 -8.152) 8.292 14.309 ( -5.444 -11.635 -7.722) 14.988 14.742 ( -4.308 0.713 -15.167) 15.783 16.850 ( 15.193 -1.007 -4.909) 15.998 18.499 ( 1.807 -1.014 -14.555) 14.702 19.479 ( -18.118 0.390 -8.365) 19.960 19.542 ( -11.880 -2.173 -6.591) 13.759 21.032 ( -10.485 3.189 8.057) 13.602 22.303 ( 18.527 -5.968 5.975) 20.362 23.577 ( -10.584 0.730 -4.905) 11.688 24.132 ( 0.992 -0.783 -2.103) 2.454 ======================= Grid point 232 (124/260) ======================= q-point: ( 0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.637 ( 7.542 9.165 6.080) 13.336 2.747 ( 8.504 4.049 4.768) 10.557 3.080 ( -0.275 -0.278 1.053) 1.124 3.222 ( -0.756 -10.193 -0.428) 10.230 3.253 ( -0.536 -3.467 -2.719) 4.439 4.123 ( -3.837 -0.954 6.118) 7.284 4.620 ( -4.881 5.467 5.102) 8.930 4.729 ( -4.690 0.783 6.224) 7.833 5.011 ( 8.697 0.686 15.774) 18.025 5.626 ( 15.059 2.050 -3.998) 15.715 6.235 ( 14.631 -2.224 1.664) 14.892 6.579 ( 6.437 7.296 -2.323) 10.003 7.358 ( 0.001 0.440 -6.559) 6.574 7.480 ( 6.009 3.226 -3.117) 7.499 8.174 ( -5.044 1.709 17.749) 18.531 8.816 ( -13.563 -1.781 8.864) 16.300 9.418 ( -1.597 15.814 8.304) 17.933 9.462 ( 21.787 3.733 0.780) 22.118 9.740 ( -3.533 7.845 14.431) 16.801 10.245 ( 1.034 -15.427 8.841) 17.811 11.159 ( 10.825 10.565 17.135) 22.856 11.478 ( -8.151 1.096 -14.223) 16.430 12.070 ( 11.715 2.077 10.412) 15.810 12.605 ( -4.999 -11.427 0.621) 12.488 13.642 ( 4.152 5.025 -5.636) 8.617 13.785 ( -3.228 2.525 -9.757) 10.583 14.176 ( -6.452 -13.681 -4.366) 15.743 14.605 ( -6.142 1.870 -14.218) 15.600 17.216 ( 21.545 0.257 -4.954) 22.108 18.604 ( 9.564 -1.710 -5.666) 11.247 19.172 ( -11.426 1.519 -0.755) 11.551 19.245 ( -14.364 -4.384 -7.710) 16.882 20.822 ( -12.336 5.239 4.688) 14.198 22.654 ( 15.162 -5.174 5.446) 16.921 23.327 ( -12.641 -2.676 -10.344) 16.552 24.136 ( 0.104 -0.249 -3.439) 3.449 ======================= Grid point 233 (125/260) ======================= q-point: ( 0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.770 ( 3.501 5.587 2.277) 6.976 2.933 ( 9.456 7.568 0.213) 12.114 3.002 ( -6.056 -1.328 2.259) 6.599 3.183 ( -0.246 -8.422 2.985) 8.939 3.297 ( 2.720 -6.994 -10.976) 13.296 3.972 ( -10.425 -1.127 -9.933) 14.443 4.535 ( -4.561 6.314 7.034) 10.495 4.641 ( -4.200 -2.946 7.687) 9.242 5.240 ( 9.259 2.381 21.885) 23.882 5.934 ( 15.344 2.917 1.105) 15.658 6.497 ( 10.245 -1.361 3.076) 10.783 6.692 ( 5.039 8.313 -0.601) 9.739 7.347 ( 0.730 0.345 -7.298) 7.343 7.555 ( 1.483 3.222 -2.446) 4.309 8.125 ( -2.942 2.522 17.669) 18.089 8.536 ( -14.957 -5.258 6.542) 17.151 9.335 ( -3.344 15.368 0.349) 15.732 9.626 ( -6.137 9.916 15.021) 19.016 10.033 ( 22.689 -2.633 1.232) 22.875 10.319 ( 6.019 -10.323 16.432) 20.318 11.126 ( -10.516 12.463 -15.760) 22.677 11.444 ( 2.947 1.751 11.535) 12.033 12.262 ( 3.289 7.923 8.800) 12.290 12.568 ( 2.117 -16.714 8.328) 18.794 13.618 ( -4.598 5.039 -12.371) 14.127 13.712 ( -2.773 -1.039 -9.538) 9.988 14.046 ( -6.002 -11.505 -1.958) 13.124 14.496 ( -1.405 2.755 -10.703) 11.141 17.639 ( 20.378 1.092 -2.725) 20.589 18.710 ( -7.535 1.388 0.124) 7.663 18.983 ( 3.024 -3.022 -6.632) 7.890 19.183 ( 7.902 -3.957 7.557) 11.628 20.549 ( -15.322 7.402 -0.914) 17.041 22.820 ( -5.356 -0.245 -1.628) 5.603 23.149 ( 3.163 -9.804 -8.672) 13.465 24.127 ( -0.247 0.577 -4.690) 4.732 ======================= Grid point 234 (126/260) ======================= q-point: (-0.50 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.752 ( -5.114 -1.155 -0.789) 5.302 2.892 ( -4.111 2.434 1.710) 5.075 3.094 ( 5.408 9.091 -3.369) 11.102 3.258 ( 6.500 -5.621 3.668) 9.344 3.306 ( 0.991 -8.512 -9.066) 12.475 3.717 ( -11.636 -1.990 -17.088) 20.769 4.463 ( -4.443 2.414 13.928) 14.817 4.591 ( -2.134 0.991 3.617) 4.315 5.422 ( 4.385 1.703 23.366) 23.835 6.202 ( 10.117 5.329 3.822) 12.057 6.606 ( -0.459 -1.766 3.589) 4.026 6.772 ( 2.646 8.331 1.485) 8.866 7.372 ( 2.588 0.396 -8.913) 9.290 7.533 ( -2.202 3.034 -4.994) 6.245 8.101 ( -3.656 5.591 16.627) 17.919 8.294 ( -8.892 -10.253 9.490) 16.561 9.304 ( 0.580 14.317 -3.790) 14.822 9.508 ( -8.338 6.432 16.433) 19.517 10.230 ( 0.745 -9.368 8.751) 12.841 10.518 ( 0.047 2.263 6.413) 6.801 11.021 ( 8.950 8.235 -11.654) 16.844 11.450 ( -4.521 2.689 7.947) 9.530 12.282 ( -0.318 11.587 9.779) 15.165 12.653 ( 1.860 -13.995 11.475) 18.193 13.542 ( 1.318 -1.606 -13.926) 14.080 13.571 ( -8.618 -3.003 -14.601) 17.218 13.943 ( -4.155 -6.805 0.150) 7.975 14.520 ( 4.738 2.838 -8.437) 10.084 17.962 ( 10.983 -0.189 1.334) 11.065 18.444 ( -12.582 -0.331 -6.315) 14.082 19.199 ( 14.391 5.191 3.864) 15.780 19.510 ( 20.173 -8.900 14.260) 26.258 20.243 ( -12.981 8.857 -6.135) 16.870 22.524 ( -17.771 -4.894 -15.471) 24.064 23.338 ( 11.513 -6.170 0.497) 13.072 24.107 ( -0.953 1.019 -6.163) 6.319 ======================= Grid point 235 (127/260) ======================= q-point: (-0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( -8.023 -1.242 0.976) 8.177 2.852 ( -0.776 5.669 1.093) 5.826 3.110 ( -1.780 1.999 -6.433) 6.967 3.318 ( 0.730 0.338 -5.621) 5.679 3.421 ( 6.993 -4.788 2.602) 8.866 3.498 ( -5.787 -5.781 -8.366) 11.701 4.424 ( -1.321 0.571 12.052) 12.138 4.546 ( -3.555 3.342 2.283) 5.387 5.478 ( -2.820 0.878 21.982) 22.179 6.304 ( -2.162 10.056 4.371) 11.176 6.511 ( -7.820 -6.375 1.395) 10.185 6.787 ( -1.869 9.093 2.778) 9.690 7.356 ( -3.007 3.600 -7.244) 8.630 7.486 ( -1.583 -1.521 -8.729) 9.001 8.066 ( 0.571 4.188 9.565) 10.458 8.241 ( -0.692 -8.562 18.346) 20.257 9.319 ( -4.109 13.612 4.378) 14.878 9.371 ( -2.836 2.614 6.292) 7.380 10.191 ( -7.464 -5.088 14.712) 17.264 10.367 ( -8.722 4.400 -3.666) 10.434 11.245 ( 1.522 7.264 7.352) 10.447 11.354 ( 1.091 -3.063 -1.302) 3.502 12.308 ( 0.569 16.656 10.007) 19.439 12.668 ( -0.520 -11.800 6.750) 13.605 13.354 ( -9.216 -1.525 -15.952) 18.486 13.649 ( 9.804 -8.894 -12.763) 18.388 13.884 ( -0.933 -4.013 -0.208) 4.125 14.618 ( 6.117 2.258 -9.304) 11.362 18.031 ( -5.584 -1.606 5.817) 8.222 18.274 ( -2.216 -1.594 -9.192) 9.589 19.495 ( 12.622 6.802 6.785) 15.862 19.821 ( 4.625 3.393 -8.325) 10.109 20.237 ( 18.498 -2.478 17.333) 25.471 22.123 ( -18.887 -7.062 -19.891) 28.324 23.550 ( 9.304 -2.759 2.115) 9.932 24.064 ( -2.178 0.802 -8.120) 8.445 ======================= Grid point 236 (128/260) ======================= q-point: (-0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( -6.089 2.791 5.143) 8.444 2.832 ( -2.138 12.771 2.264) 13.145 3.057 ( -2.289 -4.253 -2.155) 5.289 3.242 ( -5.569 -8.008 -6.553) 11.751 3.461 ( 3.315 1.945 4.555) 5.960 3.586 ( 6.263 -3.753 6.193) 9.574 4.401 ( -7.941 5.527 1.486) 9.789 4.495 ( 2.765 -1.571 5.895) 6.698 5.406 ( -7.128 0.471 19.490) 20.758 6.087 ( -17.604 3.939 1.097) 18.073 6.366 ( -8.635 -2.888 2.284) 9.388 6.700 ( -7.143 10.742 1.209) 12.957 7.280 ( -2.722 3.000 -6.660) 7.795 7.430 ( -1.457 -2.120 -10.201) 10.520 8.158 ( 4.454 5.319 14.841) 16.383 8.302 ( 4.506 -8.278 15.516) 18.155 9.123 ( -13.013 4.422 10.457) 17.270 9.436 ( 4.673 9.591 0.001) 10.669 9.969 ( -15.623 0.011 12.142) 19.787 10.259 ( -3.125 2.621 4.433) 6.024 11.109 ( -9.537 -0.694 9.789) 13.684 11.433 ( 0.351 -0.759 -0.858) 1.198 12.322 ( -0.649 16.827 6.937) 18.212 12.710 ( 4.343 -8.856 1.156) 9.931 13.170 ( -6.294 -0.507 -15.115) 16.381 13.744 ( 0.613 -8.858 -6.057) 10.749 13.995 ( 12.254 -4.730 -7.562) 15.157 14.714 ( 5.142 1.184 -11.111) 12.300 17.781 ( -19.211 -1.377 5.894) 20.142 18.334 ( 10.295 -2.681 -10.813) 15.169 19.663 ( 3.911 9.517 -0.541) 10.303 19.909 ( 8.195 -0.236 -13.338) 15.657 20.780 ( 26.451 -3.642 28.728) 39.220 21.729 ( -16.515 -5.665 -18.168) 25.197 23.709 ( 6.342 -0.073 2.458) 6.803 23.996 ( -2.711 0.145 -9.812) 10.181 ======================= Grid point 237 (129/260) ======================= q-point: (-0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( -2.693 6.696 9.461) 11.899 2.769 ( -5.300 17.300 8.595) 20.031 3.013 ( -1.853 -4.314 0.171) 4.698 3.115 ( -6.934 -14.362 6.818) 17.345 3.583 ( 6.770 4.265 6.518) 10.320 3.694 ( 3.246 0.029 7.626) 8.288 4.160 ( -14.283 1.073 0.507) 14.332 4.617 ( 7.134 0.965 1.364) 7.327 5.301 ( -6.456 0.997 18.469) 19.591 5.733 ( -15.545 -1.545 -2.450) 15.813 6.122 ( -16.333 -0.306 4.389) 16.915 6.531 ( -8.803 10.537 -2.433) 13.944 7.221 ( -2.003 0.271 -8.182) 8.428 7.423 ( 2.255 0.789 -10.470) 10.739 8.260 ( 3.719 4.600 20.004) 20.861 8.470 ( 8.089 -5.571 14.377) 17.412 8.879 ( -12.176 3.651 10.077) 16.221 9.526 ( 3.667 11.499 3.941) 12.697 9.667 ( -15.787 1.107 11.906) 19.804 10.235 ( -0.471 0.836 7.804) 7.863 10.948 ( -8.448 -2.891 10.206) 13.561 11.352 ( -7.305 -2.783 -1.194) 7.907 12.313 ( -1.075 14.743 3.027) 15.089 12.818 ( 5.627 -5.319 -5.776) 9.660 13.064 ( -1.360 -1.186 -10.179) 10.338 13.734 ( 0.177 -5.880 -4.986) 7.711 14.224 ( 11.010 -6.688 -10.230) 16.450 14.782 ( 3.805 -0.041 -12.691) 13.250 17.358 ( -22.425 -1.807 3.491) 22.766 18.636 ( 21.289 -2.519 -13.584) 25.379 19.651 ( -5.484 5.480 -7.668) 10.905 20.042 ( 7.068 -3.435 -13.771) 15.855 21.281 ( 17.072 -0.739 25.800) 30.945 21.452 ( -7.775 -2.165 -7.112) 10.758 23.811 ( 3.525 1.800 2.089) 4.475 23.940 ( -0.724 -0.468 -9.125) 9.166 ======================= Grid point 238 (130/260) ======================= q-point: (-0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.388 ( -0.100 9.164 11.469) 14.681 2.640 ( -9.746 16.442 16.501) 25.250 2.954 ( -6.188 -10.188 8.964) 14.915 3.039 ( -0.295 -9.041 6.478) 11.126 3.660 ( -4.422 10.681 6.042) 13.044 3.743 ( 1.889 3.715 9.995) 10.830 3.980 ( 0.516 -7.964 3.520) 8.723 4.749 ( 5.703 3.578 -1.368) 6.870 5.198 ( -7.973 2.418 19.913) 21.585 5.530 ( -3.723 -2.769 -4.264) 6.302 5.791 ( -15.726 -0.690 4.067) 16.258 6.369 ( -6.317 8.020 -4.539) 11.173 7.185 ( 0.496 -0.269 -10.372) 10.388 7.429 ( -0.864 1.539 -11.214) 11.352 8.387 ( 3.139 5.540 20.539) 21.503 8.605 ( 1.077 -2.125 18.541) 18.693 8.766 ( 2.844 3.541 13.276) 14.031 9.433 ( -8.220 0.926 9.017) 12.236 9.588 ( 1.411 13.444 7.955) 15.685 10.262 ( 1.304 -2.872 10.969) 11.413 10.798 ( -8.800 -2.344 9.012) 12.812 11.191 ( -7.056 -5.834 -3.076) 9.658 12.283 ( -2.401 13.901 -0.319) 14.111 12.858 ( 0.451 -2.282 -14.043) 14.234 13.112 ( 6.580 -4.268 -2.278) 8.167 13.743 ( 1.615 -3.406 -5.302) 6.506 14.376 ( 6.121 -7.668 -11.077) 14.797 14.822 ( 2.692 -0.976 -13.685) 13.981 16.957 ( -17.448 -2.363 1.307) 17.656 19.034 ( 16.066 -2.504 -26.194) 30.830 19.445 ( -8.512 -0.261 -6.419) 10.665 20.128 ( 3.343 -1.008 -13.127) 13.584 21.396 ( 3.179 0.890 5.337) 6.275 21.518 ( 1.489 -0.790 17.833) 17.913 23.860 ( 0.950 2.162 1.962) 3.071 23.949 ( 2.985 -0.156 -5.694) 6.430 ======================= Grid point 279 (131/260) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 0.244 0.000 22.457) 22.459 1.553 ( 7.893 0.000 22.817) 24.143 3.012 ( 8.720 0.000 2.945) 9.204 3.138 ( 3.870 0.000 -12.019) 12.627 3.235 ( -4.040 0.000 21.192) 21.574 3.732 ( 2.554 0.000 0.969) 2.732 4.350 ( 4.949 0.000 7.383) 8.888 4.356 ( -0.159 0.000 5.079) 5.081 5.288 ( -15.717 0.000 7.496) 17.413 5.670 ( -2.914 0.000 11.033) 11.411 5.679 ( 5.923 0.000 1.963) 6.239 6.162 ( -0.868 0.000 -5.646) 5.713 6.478 ( -5.906 0.000 25.638) 26.309 6.783 ( 5.956 0.000 9.392) 11.121 7.739 ( -5.397 0.000 14.475) 15.448 8.246 ( -2.388 0.000 20.286) 20.426 8.629 ( -10.234 0.000 -8.399) 13.239 9.002 ( 16.628 0.000 3.943) 17.089 9.183 ( 1.980 0.000 -14.393) 14.528 10.224 ( -0.165 0.000 20.527) 20.527 10.742 ( 0.718 0.000 -28.859) 28.868 11.360 ( 3.709 0.000 -1.286) 3.925 11.635 ( -1.745 0.000 0.887) 1.958 12.287 ( 2.276 0.000 -19.642) 19.773 13.764 ( 4.816 0.000 0.731) 4.871 14.290 ( -1.061 0.000 -2.193) 2.436 14.661 ( -1.165 0.000 9.234) 9.307 15.444 ( 4.304 0.000 -19.856) 20.317 18.172 ( 14.227 0.000 1.890) 14.352 18.505 ( -51.402 0.000 -5.749) 51.723 19.937 ( 4.199 0.000 1.345) 4.410 20.048 ( -1.762 0.000 -1.492) 2.309 21.566 ( -22.706 0.000 12.411) 25.876 22.375 ( 50.515 0.000 -6.696) 50.956 23.086 ( 8.071 0.000 3.210) 8.686 23.459 ( -5.664 0.000 -5.162) 7.663 ======================= Grid point 280 (132/260) ======================= q-point: ( 0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( 13.154 0.000 21.506) 25.210 1.882 ( 18.685 0.000 13.666) 23.150 3.148 ( 3.611 0.000 -5.470) 6.555 3.220 ( 5.891 0.000 -12.279) 13.619 3.325 ( 10.065 0.000 22.699) 24.830 3.740 ( -1.428 0.000 -1.859) 2.344 4.368 ( -0.199 0.000 4.862) 4.867 4.477 ( 6.076 0.000 10.007) 11.708 5.023 ( -11.209 0.000 12.917) 17.103 5.628 ( -2.762 0.000 12.098) 12.409 5.908 ( 12.406 0.000 -0.682) 12.425 6.199 ( 4.800 0.000 -4.387) 6.503 6.526 ( 6.822 0.000 18.668) 19.875 6.887 ( 2.629 0.000 12.496) 12.769 7.651 ( -6.043 0.000 16.064) 17.163 8.235 ( -1.981 0.000 17.221) 17.334 8.512 ( -0.081 0.000 -11.681) 11.681 9.178 ( 0.574 0.000 -11.994) 12.008 9.377 ( 17.575 0.000 9.665) 20.057 10.282 ( 3.689 0.000 14.680) 15.137 10.728 ( 3.448 0.000 -31.155) 31.346 11.344 ( -4.839 0.000 -1.490) 5.063 11.553 ( -6.153 0.000 -0.057) 6.154 12.387 ( 10.731 0.000 -18.027) 20.979 13.847 ( 2.827 0.000 1.088) 3.030 14.261 ( -1.313 0.000 -5.549) 5.702 14.587 ( -8.123 0.000 8.141) 11.500 15.459 ( 0.458 0.000 -16.671) 16.677 17.555 ( -38.486 0.000 11.212) 40.086 18.496 ( 17.042 0.000 5.374) 17.869 19.901 ( -8.084 0.000 2.763) 8.543 20.009 ( -2.878 0.000 -3.212) 4.313 21.050 ( -28.879 0.000 7.623) 29.869 23.277 ( 37.907 0.000 -17.677) 41.826 23.308 ( -6.740 0.000 -8.157) 10.582 23.312 ( 12.689 0.000 3.401) 13.137 ======================= Grid point 281 (133/260) ======================= q-point: ( 0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( 18.981 0.000 20.048) 27.608 2.255 ( 16.085 0.000 7.761) 17.860 3.202 ( 2.437 0.000 3.754) 4.476 3.301 ( 3.877 0.000 -12.283) 12.880 3.613 ( 15.102 0.000 -0.094) 15.102 3.682 ( -3.517 0.000 -5.162) 6.246 4.338 ( -4.090 0.000 4.690) 6.223 4.602 ( 4.131 0.000 4.520) 6.123 4.922 ( -1.279 0.000 21.747) 21.785 5.628 ( 0.954 0.000 12.954) 12.989 6.110 ( 8.682 0.000 4.602) 9.826 6.291 ( 3.514 0.000 0.921) 3.633 6.761 ( 11.756 0.000 11.146) 16.200 6.957 ( 2.973 0.000 12.114) 12.473 7.565 ( -5.216 0.000 16.578) 17.379 8.226 ( -1.916 0.000 16.126) 16.239 8.534 ( 2.699 0.000 -13.711) 13.974 9.212 ( 6.158 0.000 -7.048) 9.359 9.652 ( 6.324 0.000 24.806) 25.599 10.449 ( 10.976 0.000 3.663) 11.571 10.771 ( 6.279 0.000 -32.929) 33.522 11.181 ( -10.489 0.000 -1.842) 10.649 11.414 ( -7.188 0.000 -1.110) 7.274 12.626 ( 15.988 0.000 -18.910) 24.763 13.856 ( -3.196 0.000 6.263) 7.031 14.211 ( -2.527 0.000 -8.824) 9.178 14.387 ( -12.319 0.000 12.066) 17.244 15.404 ( -3.330 0.000 -13.007) 13.426 17.111 ( -8.537 0.000 8.212) 11.846 18.813 ( 11.211 0.000 4.713) 12.162 19.658 ( -14.566 0.000 5.509) 15.573 19.905 ( -6.930 0.000 -4.810) 8.436 20.520 ( -24.303 0.000 7.204) 25.349 23.115 ( -9.324 0.000 -5.827) 10.995 23.563 ( 11.454 0.000 1.880) 11.607 23.851 ( 22.486 0.000 -23.976) 32.871 ======================= Grid point 282 (134/260) ======================= q-point: ( 0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( 19.136 0.000 19.444) 27.281 2.542 ( 11.573 0.000 6.193) 13.125 3.251 ( 1.792 0.000 2.326) 2.936 3.323 ( 0.689 0.000 -12.305) 12.324 3.589 ( -4.514 0.000 -7.836) 9.044 3.877 ( 11.792 0.000 -11.093) 16.190 4.223 ( -7.989 0.000 5.531) 9.717 4.644 ( 0.217 0.000 -1.021) 1.044 5.023 ( 5.409 0.000 23.803) 24.409 5.712 ( 4.705 0.000 13.797) 14.577 6.317 ( -1.509 0.000 6.675) 6.843 6.321 ( 12.204 0.000 8.714) 14.996 6.966 ( 6.251 0.000 9.873) 11.685 7.047 ( 3.483 0.000 8.523) 9.208 7.516 ( -2.344 0.000 18.390) 18.539 8.213 ( -2.383 0.000 16.354) 16.526 8.530 ( -0.420 0.000 -12.446) 12.453 9.433 ( 16.615 0.000 -3.262) 16.932 9.750 ( -0.460 0.000 35.656) 35.659 10.625 ( 1.290 0.000 4.026) 4.228 10.839 ( 5.504 0.000 -33.110) 33.564 10.983 ( -5.457 0.000 -7.139) 8.986 11.287 ( -4.565 0.000 -2.443) 5.177 12.928 ( 17.179 0.000 -22.201) 28.071 13.739 ( -9.501 0.000 14.501) 17.336 14.129 ( -3.759 0.000 -10.843) 11.476 14.204 ( -7.569 0.000 11.918) 14.119 15.284 ( -6.622 0.000 -9.871) 11.886 17.169 ( 11.639 0.000 -1.542) 11.741 18.789 ( -14.228 0.000 1.089) 14.269 19.493 ( -4.381 0.000 -1.448) 4.614 19.721 ( -10.361 0.000 -5.993) 11.969 20.184 ( -8.407 0.000 19.877) 21.582 22.938 ( -7.111 0.000 -3.994) 8.156 23.756 ( 7.510 0.000 0.111) 7.511 24.121 ( 9.874 0.000 -24.754) 26.650 ======================= Grid point 283 (135/260) ======================= q-point: ( 0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( 3.556 0.000 7.795) 8.568 2.772 ( 12.927 0.000 20.211) 23.991 3.295 ( -1.034 0.000 -11.761) 11.806 3.296 ( 3.699 0.000 -3.002) 4.764 3.483 ( -4.206 0.000 -9.544) 10.429 4.041 ( 6.940 0.000 -11.446) 13.386 4.073 ( -7.039 0.000 6.009) 9.255 4.588 ( -6.016 0.000 -5.840) 8.384 5.174 ( 5.419 0.000 21.427) 22.102 5.834 ( 4.222 0.000 14.265) 14.876 6.267 ( -4.607 0.000 9.570) 10.621 6.629 ( 16.569 0.000 9.338) 19.019 7.032 ( -1.085 0.000 8.450) 8.519 7.096 ( -0.030 0.000 4.641) 4.641 7.556 ( 2.905 0.000 22.618) 22.804 8.189 ( -3.063 0.000 17.699) 17.962 8.511 ( 1.216 0.000 -8.856) 8.939 9.795 ( -1.173 0.000 39.089) 39.106 9.817 ( 21.155 0.000 -1.522) 21.210 10.442 ( -16.416 0.000 5.545) 17.327 10.831 ( -1.560 0.000 -27.184) 27.229 10.974 ( 1.443 0.000 -7.303) 7.444 11.249 ( 1.776 0.000 -8.732) 8.911 13.177 ( 10.462 0.000 -27.459) 29.385 13.583 ( -7.958 0.000 16.276) 18.118 14.059 ( 0.147 0.000 -9.401) 9.402 14.121 ( -3.230 0.000 12.262) 12.681 15.115 ( -8.352 0.000 -8.524) 11.934 17.500 ( 21.218 0.000 -7.426) 22.480 18.465 ( -14.631 0.000 1.633) 14.722 19.251 ( -17.871 0.000 -10.748) 20.854 19.489 ( -11.418 0.000 -6.086) 12.939 20.326 ( 14.369 0.000 30.530) 33.742 22.829 ( -3.339 0.000 -3.074) 4.539 23.854 ( 2.303 0.000 -1.378) 2.684 24.181 ( 0.974 0.000 -24.651) 24.670 ======================= Grid point 284 (136/260) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.683 ( -7.887 0.000 9.494) 12.343 2.901 ( -5.182 0.000 20.222) 20.875 3.256 ( -0.563 0.000 -9.785) 9.801 3.406 ( 7.373 0.000 -7.147) 10.268 3.415 ( -0.776 0.000 -10.003) 10.033 4.022 ( 2.063 0.000 5.777) 6.134 4.106 ( 0.960 0.000 -7.672) 7.732 4.384 ( -12.597 0.000 -7.986) 14.915 5.301 ( 3.450 0.000 20.883) 21.166 5.900 ( -0.369 0.000 13.169) 13.174 6.183 ( -5.225 0.000 11.620) 12.741 6.952 ( 1.091 0.000 8.769) 8.836 7.004 ( 10.031 0.000 7.051) 12.261 7.068 ( -3.067 0.000 1.177) 3.285 7.693 ( 5.782 0.000 22.198) 22.939 8.155 ( -3.473 0.000 19.806) 20.109 8.563 ( 5.397 0.000 -6.351) 8.334 9.828 ( -4.088 0.000 33.737) 33.984 10.104 ( -16.172 0.000 9.059) 18.536 10.217 ( 17.528 0.000 1.328) 17.578 10.686 ( -7.924 0.000 -22.124) 23.500 10.930 ( -4.817 0.000 -3.148) 5.755 11.302 ( 5.014 0.000 -14.727) 15.557 13.192 ( -3.380 0.000 -30.388) 30.575 13.497 ( -3.280 0.000 12.769) 13.183 14.118 ( 0.567 0.000 15.253) 15.264 14.144 ( 8.885 0.000 -6.437) 10.971 14.948 ( -5.877 0.000 -10.059) 11.650 17.949 ( 24.653 0.000 -9.120) 26.286 18.278 ( -4.415 0.000 -1.306) 4.604 18.859 ( -17.533 0.000 -6.200) 18.597 19.275 ( -8.249 0.000 -4.067) 9.197 20.721 ( 18.376 0.000 29.729) 34.950 22.780 ( -1.436 0.000 -6.038) 6.207 23.841 ( -3.211 0.000 -2.355) 3.982 24.090 ( -5.470 0.000 -22.969) 23.611 ======================= Grid point 285 (137/260) ======================= q-point: (-0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( -14.446 0.000 10.123) 17.640 2.678 ( -18.478 0.000 17.865) 25.702 3.249 ( 0.993 0.000 -4.739) 4.842 3.381 ( -1.040 0.000 -11.013) 11.062 3.485 ( -0.813 0.000 -5.877) 5.933 4.029 ( -8.729 0.000 -9.973) 13.253 4.137 ( -7.378 0.000 -0.303) 7.384 4.157 ( 8.602 0.000 5.611) 10.271 5.389 ( 1.832 0.000 21.123) 21.202 5.869 ( -4.296 0.000 9.507) 10.432 6.124 ( -2.490 0.000 15.259) 15.460 6.828 ( -9.137 0.000 7.860) 12.053 6.982 ( -5.629 0.000 -1.468) 5.818 7.321 ( 14.350 0.000 6.395) 15.710 7.795 ( -0.663 0.000 14.874) 14.889 8.131 ( -2.468 0.000 22.262) 22.398 8.694 ( 8.569 0.000 -6.733) 10.898 9.584 ( -20.710 0.000 8.890) 22.537 10.012 ( 0.018 0.000 31.771) 31.771 10.303 ( -14.807 0.000 2.798) 15.069 10.621 ( 10.312 0.000 -20.599) 23.036 10.815 ( -4.779 0.000 0.234) 4.785 11.382 ( 5.532 0.000 -15.361) 16.327 12.999 ( -9.384 0.000 -28.801) 30.291 13.488 ( 0.129 0.000 9.087) 9.088 14.197 ( 4.170 0.000 18.677) 19.137 14.301 ( 5.612 0.000 -1.733) 5.874 14.894 ( 3.731 0.000 -16.068) 16.495 18.182 ( -7.580 0.000 -12.911) 14.971 18.416 ( 23.066 0.000 -7.722) 24.325 18.677 ( 2.940 0.000 6.577) 7.204 19.188 ( 1.042 0.000 -0.094) 1.046 21.127 ( 16.914 0.000 27.880) 32.609 22.709 ( -5.154 0.000 -15.787) 16.607 23.721 ( -8.262 0.000 -2.659) 8.679 23.906 ( -8.648 0.000 -16.993) 19.067 ======================= Grid point 286 (138/260) ======================= q-point: (-0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( -17.674 0.000 11.975) 21.349 2.290 ( -22.807 0.000 17.660) 28.845 3.242 ( -2.013 0.000 -3.669) 4.185 3.306 ( -15.137 0.000 5.451) 16.089 3.380 ( 4.060 0.000 -8.743) 9.639 3.790 ( -11.719 0.000 -11.113) 16.151 4.109 ( 2.138 0.000 3.321) 3.950 4.314 ( 5.346 0.000 4.473) 6.970 5.449 ( 0.419 0.000 19.855) 19.860 5.789 ( -4.590 0.000 6.990) 8.363 6.151 ( 2.186 0.000 17.363) 17.500 6.626 ( -12.572 0.000 5.598) 13.762 6.838 ( -8.249 0.000 -4.013) 9.174 7.494 ( -4.932 0.000 1.478) 5.149 7.738 ( -0.859 0.000 10.286) 10.322 8.126 ( -2.426 0.000 25.199) 25.316 8.862 ( 9.318 0.000 -9.579) 13.363 9.185 ( -19.546 0.000 8.497) 21.313 9.893 ( -23.987 0.000 -0.918) 24.004 10.085 ( 1.065 0.000 29.570) 29.589 10.774 ( 6.652 0.000 -18.510) 19.669 10.802 ( 3.984 0.000 3.473) 5.285 11.467 ( 5.487 0.000 -11.787) 13.002 12.755 ( -9.792 0.000 -25.952) 27.738 13.525 ( 2.030 0.000 6.893) 7.185 14.337 ( 6.097 0.000 20.457) 21.346 14.346 ( -0.202 0.000 2.502) 2.510 15.024 ( 11.191 0.000 -21.454) 24.198 17.979 ( -7.877 0.000 -12.620) 14.876 18.812 ( 17.877 0.000 -2.971) 18.122 18.941 ( 18.998 0.000 7.166) 20.304 19.356 ( 15.677 0.000 2.865) 15.937 21.479 ( 13.579 0.000 25.684) 29.053 22.459 ( -17.165 0.000 -30.020) 34.580 23.511 ( -12.151 0.000 -2.310) 12.369 23.725 ( -6.713 0.000 -6.794) 9.551 ======================= Grid point 287 (139/260) ======================= q-point: (-0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -17.946 0.000 17.343) 24.957 1.871 ( -21.703 0.000 18.930) 28.799 3.021 ( -13.031 0.000 14.509) 19.502 3.176 ( -2.827 0.000 -8.123) 8.601 3.492 ( 7.284 0.000 -1.790) 7.500 3.542 ( -11.472 0.000 -2.760) 11.800 4.178 ( 3.696 0.000 1.781) 4.103 4.376 ( 0.432 0.000 3.957) 3.980 5.469 ( -1.690 0.000 16.816) 16.900 5.727 ( -2.840 0.000 7.039) 7.590 6.245 ( 2.836 0.000 14.914) 15.181 6.330 ( -18.385 0.000 -1.716) 18.465 6.668 ( -6.416 0.000 -5.485) 8.441 7.116 ( -26.581 0.000 8.891) 28.028 7.817 ( 1.743 0.000 8.077) 8.263 8.153 ( 1.162 0.000 28.280) 28.304 8.877 ( -11.935 0.000 6.771) 13.722 9.014 ( 7.617 0.000 -13.411) 15.423 9.401 ( -24.090 0.000 -1.136) 24.116 10.149 ( 0.461 0.000 25.664) 25.668 10.818 ( 1.830 0.000 -22.611) 22.685 10.974 ( 11.397 0.000 3.773) 12.006 11.554 ( 4.616 0.000 -6.178) 7.712 12.531 ( -8.205 0.000 -23.244) 24.650 13.588 ( 3.179 0.000 5.219) 6.111 14.333 ( -1.178 0.000 2.782) 3.021 14.494 ( 5.738 0.000 19.159) 20.000 15.211 ( 10.829 0.000 -22.844) 25.281 17.876 ( -0.149 0.000 -8.041) 8.043 19.135 ( 14.294 0.000 -3.294) 14.669 19.365 ( 21.054 0.000 4.155) 21.460 19.778 ( 24.256 0.000 5.517) 24.875 21.743 ( 8.001 0.000 23.219) 24.558 21.930 ( -27.901 0.000 -32.018) 42.468 23.249 ( -13.094 0.000 -1.566) 13.187 23.620 ( -3.543 0.000 -1.527) 3.858 ======================= Grid point 288 (140/260) ======================= q-point: (-0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -14.038 0.000 21.147) 25.382 1.559 ( -11.472 0.000 24.149) 26.736 2.902 ( -0.952 0.000 15.334) 15.364 3.123 ( -0.335 0.000 -10.697) 10.702 3.342 ( -8.701 0.000 7.123) 11.245 3.636 ( 6.519 0.000 1.395) 6.667 4.255 ( 3.784 0.000 3.450) 5.121 4.367 ( -1.446 0.000 4.484) 4.711 5.447 ( -2.965 0.000 11.800) 12.167 5.697 ( -1.838 0.000 8.751) 8.942 5.887 ( -22.998 0.000 -4.940) 23.523 6.239 ( -4.659 0.000 1.509) 4.897 6.649 ( 4.748 0.000 3.288) 5.775 6.671 ( -18.528 0.000 25.017) 31.131 7.807 ( -3.502 0.000 11.396) 11.922 8.235 ( 0.422 0.000 25.570) 25.573 8.784 ( 2.988 0.000 3.294) 4.447 8.933 ( -17.896 0.000 -6.562) 19.062 9.143 ( 3.804 0.000 -12.542) 13.106 10.193 ( -0.295 0.000 22.998) 23.000 10.788 ( -0.024 0.000 -26.130) 26.130 11.211 ( 10.686 0.000 0.900) 10.724 11.622 ( 2.628 0.000 -1.277) 2.922 12.357 ( -4.916 0.000 -21.356) 21.915 13.669 ( 4.228 0.000 2.970) 5.167 14.313 ( -1.170 0.000 0.837) 1.438 14.616 ( 3.252 0.000 14.593) 14.951 15.359 ( 7.905 0.000 -22.068) 23.441 17.947 ( 8.034 0.000 -2.953) 8.560 19.222 ( -10.946 0.000 -14.118) 17.864 19.739 ( 14.966 0.000 1.901) 15.086 20.116 ( 1.118 0.000 -1.967) 2.262 21.609 ( 14.100 0.000 -6.258) 15.427 21.827 ( -5.251 0.000 19.090) 19.799 23.045 ( -5.195 0.000 0.235) 5.201 23.553 ( -3.404 0.000 -2.571) 4.266 ======================= Grid point 289 (141/260) ======================= q-point: ( 0.00 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( -3.704 14.734 21.325) 26.183 1.771 ( 8.466 18.726 19.569) 28.378 3.036 ( 5.924 2.467 5.061) 8.173 3.178 ( 4.804 3.488 -10.583) 12.135 3.315 ( -3.937 7.775 17.303) 19.374 3.676 ( 1.396 -4.696 2.721) 5.604 4.381 ( 7.799 3.630 7.134) 11.175 4.433 ( -0.494 4.893 5.497) 7.376 5.249 ( -14.496 -2.799 10.600) 18.175 5.646 ( 3.078 -1.635 1.484) 3.788 5.723 ( -2.883 3.371 9.674) 10.642 6.212 ( -3.409 -3.006 6.816) 8.192 6.448 ( -1.129 7.733 5.575) 9.600 6.920 ( 5.219 7.809 4.912) 10.599 7.868 ( -4.583 12.363 15.432) 20.298 8.341 ( -1.664 8.553 18.427) 20.383 8.686 ( -9.589 5.130 -0.519) 10.887 9.079 ( 15.090 6.880 4.319) 17.138 9.254 ( 0.973 7.250 -12.088) 14.129 10.125 ( -1.015 -5.388 14.584) 15.581 11.019 ( 1.235 19.123 -23.072) 29.993 11.291 ( 4.197 -5.096 -3.171) 7.324 11.640 ( -1.188 0.699 0.180) 1.390 12.278 ( 1.828 -0.663 -17.995) 18.100 13.716 ( 4.386 -4.754 1.634) 6.671 14.225 ( -1.185 -6.747 1.026) 6.926 14.601 ( -1.306 -4.160 5.424) 6.959 15.354 ( 4.218 -8.832 -19.853) 22.135 17.794 ( -5.798 -25.840 9.072) 27.993 18.611 ( -26.315 2.426 -13.250) 29.562 19.862 ( 4.880 -6.089 0.966) 7.863 20.028 ( -2.622 -1.990 -3.107) 4.527 21.572 ( -20.090 0.701 11.595) 23.207 22.134 ( 37.546 -14.706 -0.435) 40.326 23.400 ( 12.321 20.387 -3.599) 24.091 23.519 ( -5.007 5.267 -3.869) 8.233 ======================= Grid point 290 (142/260) ======================= q-point: ( 0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( 8.526 9.482 18.633) 22.578 2.067 ( 15.711 14.065 16.428) 26.731 3.161 ( 5.787 0.064 -8.819) 10.549 3.276 ( 5.831 5.358 -8.494) 11.613 3.361 ( 5.838 4.823 20.463) 21.819 3.687 ( -0.281 -4.114 0.978) 4.238 4.413 ( -0.629 3.659 5.989) 7.046 4.581 ( 8.050 8.526 9.325) 14.981 5.008 ( -10.181 -1.184 13.542) 16.984 5.624 ( -4.537 -0.775 9.264) 10.345 5.860 ( 10.713 -2.293 2.170) 11.168 6.238 ( 4.805 -3.960 3.506) 7.146 6.487 ( 4.729 6.381 3.462) 8.664 7.041 ( 5.174 8.628 7.632) 12.628 7.799 ( -5.128 14.169 17.783) 23.309 8.341 ( -1.520 9.994 16.638) 19.468 8.581 ( -0.224 6.074 -5.811) 8.409 9.226 ( 0.195 4.739 -10.467) 11.491 9.447 ( 16.799 6.862 11.126) 21.286 10.132 ( 0.318 -8.004 8.251) 11.500 11.007 ( 1.220 14.541 -21.234) 25.765 11.327 ( 1.210 3.106 -6.410) 7.225 11.568 ( -6.028 0.819 0.115) 6.084 12.370 ( 10.223 -1.313 -16.762) 19.678 13.785 ( 1.859 -5.773 1.586) 6.269 14.196 ( -2.062 -7.254 -0.595) 7.565 14.534 ( -6.113 -3.021 3.004) 7.451 15.366 ( 0.219 -9.114 -16.572) 18.914 17.398 ( -26.643 -13.135 12.583) 32.260 18.490 ( 10.231 -1.583 0.129) 10.354 19.865 ( -4.245 -4.553 1.099) 6.321 19.910 ( -9.684 -6.440 -4.124) 12.340 21.117 ( -25.066 5.375 7.595) 26.738 22.834 ( 30.362 -21.011 -3.957) 37.135 23.372 ( -7.898 5.572 -6.119) 11.440 23.700 ( 16.423 15.871 -8.382) 24.328 ======================= Grid point 291 (143/260) ======================= q-point: ( 0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 15.231 2.877 15.636) 22.017 2.383 ( 12.458 8.293 14.721) 20.993 3.232 ( 2.851 1.146 -5.046) 5.908 3.376 ( 5.149 7.389 -5.548) 10.578 3.550 ( 8.627 -4.732 -1.230) 9.916 3.682 ( 0.956 1.046 -2.344) 2.739 4.402 ( -2.230 4.594 3.921) 6.439 4.694 ( 1.321 7.729 6.651) 10.282 4.942 ( 0.959 2.335 20.504) 20.658 5.597 ( 0.935 -3.336 11.478) 11.990 6.035 ( 6.401 -3.259 9.832) 12.177 6.349 ( 4.497 -0.632 -2.326) 5.102 6.661 ( 11.477 0.630 3.739) 12.087 7.147 ( 4.102 9.280 7.434) 12.578 7.733 ( -4.655 15.799 19.707) 25.683 8.334 ( -2.138 10.271 15.163) 18.439 8.618 ( 3.502 7.930 -8.759) 12.324 9.257 ( 5.901 4.075 -5.382) 8.966 9.708 ( 4.836 5.038 26.115) 27.032 10.206 ( 7.656 -12.987 -7.424) 16.805 10.960 ( -4.399 5.219 -8.688) 11.048 11.355 ( 3.747 18.276 -15.677) 24.368 11.428 ( -6.394 1.531 -1.414) 6.725 12.602 ( 15.562 -1.924 -17.262) 23.321 13.779 ( -3.401 -6.866 5.580) 9.479 14.122 ( -5.598 -8.812 1.573) 10.557 14.393 ( -7.499 1.213 0.462) 7.610 15.305 ( -3.637 -9.486 -12.535) 16.135 17.079 ( -5.816 -2.941 7.740) 10.118 18.751 ( 11.470 -5.975 3.496) 13.397 19.609 ( -15.795 -4.997 1.364) 16.623 19.764 ( -6.995 -9.301 -3.283) 12.092 20.655 ( -22.280 10.061 6.877) 25.395 23.146 ( -7.250 0.330 -1.466) 7.404 23.356 ( 17.463 -12.146 -8.380) 22.863 23.970 ( 11.873 6.443 -14.310) 19.679 ======================= Grid point 292 (144/260) ======================= q-point: ( 0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.336 ( 17.702 -2.032 12.733) 21.900 2.600 ( 6.761 2.706 14.013) 15.792 3.253 ( 0.064 -0.209 -5.385) 5.389 3.440 ( 1.196 7.562 -2.591) 8.083 3.605 ( 0.548 1.051 -10.110) 10.179 3.780 ( 7.668 -4.930 -9.617) 13.251 4.317 ( -6.474 6.170 1.828) 9.128 4.700 ( -1.287 5.191 3.017) 6.141 5.060 ( 5.748 3.507 22.910) 23.879 5.704 ( 6.848 -0.930 13.020) 14.740 6.175 ( 4.697 -5.200 15.565) 17.069 6.423 ( 5.321 2.472 -0.361) 5.878 6.890 ( 9.431 0.054 3.393) 10.023 7.214 ( 1.074 7.288 4.221) 8.491 7.695 ( -2.452 16.006 21.451) 26.876 8.308 ( -3.093 9.422 14.512) 17.577 8.647 ( 1.016 11.196 -6.712) 13.093 9.466 ( 14.644 2.664 -2.342) 15.067 9.776 ( -0.874 1.565 34.724) 34.770 10.369 ( 9.233 -15.485 -16.209) 24.244 10.776 ( -13.189 2.053 1.199) 13.402 11.295 ( -4.416 5.470 -1.800) 7.257 11.457 ( 6.551 23.625 -20.733) 32.108 12.898 ( 16.525 -2.629 -19.485) 25.684 13.671 ( -8.345 -6.027 12.326) 16.059 14.011 ( -4.671 -9.041 1.540) 10.292 14.253 ( -6.567 2.635 -1.993) 7.351 15.183 ( -6.635 -9.547 -9.142) 14.790 17.163 ( 11.985 -0.490 -0.758) 12.019 18.770 ( -10.916 -1.933 0.466) 11.095 19.397 ( -7.808 -7.082 -6.853) 12.573 19.670 ( 1.053 -6.055 4.318) 7.511 20.271 ( -16.553 8.187 12.974) 22.568 22.969 ( -8.105 2.385 -2.648) 8.854 23.653 ( 12.353 -9.421 -5.689) 16.544 24.106 ( 4.620 -1.307 -17.810) 18.446 ======================= Grid point 293 (145/260) ======================= q-point: ( 0.40 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.685 ( 2.646 -3.502 17.313) 17.861 2.713 ( 14.056 -1.721 5.783) 15.296 3.219 ( -2.389 -2.587 -5.656) 6.662 3.400 ( -4.113 3.428 -3.479) 6.385 3.594 ( -0.201 7.801 -11.975) 14.293 3.898 ( 5.681 -9.345 -9.688) 14.610 4.199 ( -4.298 8.028 3.772) 9.856 4.625 ( -6.792 3.439 -2.972) 8.172 5.226 ( 6.446 4.841 21.924) 23.359 5.867 ( 6.015 2.775 13.546) 15.079 6.224 ( -1.941 -2.590 13.380) 13.766 6.629 ( 14.104 0.628 5.592) 15.185 7.012 ( 1.895 1.578 4.183) 4.856 7.200 ( -2.518 5.347 0.870) 5.974 7.723 ( 1.486 13.467 21.240) 25.193 8.267 ( -3.533 8.499 15.316) 17.869 8.666 ( 2.387 14.194 -1.904) 14.519 9.681 ( 2.784 -7.341 15.232) 17.137 9.940 ( 14.676 7.143 18.804) 24.900 10.469 ( -17.367 2.089 3.778) 17.896 10.484 ( 4.838 -14.733 -16.463) 22.616 11.214 ( -4.228 7.800 0.111) 8.873 11.521 ( 3.269 23.194 -21.280) 31.646 13.137 ( 9.350 -3.845 -21.899) 24.120 13.536 ( -6.447 -3.970 12.151) 14.316 13.971 ( 1.325 -7.645 -1.668) 7.936 14.134 ( -4.780 0.635 2.418) 5.394 15.019 ( -7.999 -8.946 -7.574) 14.191 17.494 ( 20.749 -0.202 -5.421) 21.446 18.505 ( -12.231 3.379 0.094) 12.689 19.161 ( -12.817 -6.205 -10.643) 17.778 19.604 ( -13.010 8.076 -5.947) 16.427 20.248 ( 12.257 -6.408 29.683) 32.747 22.834 ( -5.061 0.188 -3.282) 6.035 23.823 ( 5.741 -3.848 -4.845) 8.441 24.098 ( -1.680 -6.452 -19.704) 20.801 ======================= Grid point 294 (146/260) ======================= q-point: (-0.50 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( -7.153 -2.167 12.284) 14.379 2.959 ( -0.256 2.822 12.003) 12.333 3.161 ( 1.747 -7.783 -6.607) 10.357 3.312 ( -2.179 -0.300 -5.698) 6.108 3.551 ( -1.251 3.317 -12.908) 13.386 3.960 ( 1.938 -7.516 -7.211) 10.594 4.192 ( 1.711 9.050 6.674) 11.374 4.428 ( -11.161 4.113 -5.256) 13.004 5.375 ( 4.435 6.803 20.989) 22.505 5.952 ( -0.281 4.502 12.242) 13.046 6.187 ( -3.385 1.021 13.376) 13.836 6.904 ( 6.730 -1.410 6.431) 9.415 7.008 ( -0.050 0.573 4.012) 4.053 7.160 ( 0.951 5.897 0.061) 5.974 7.811 ( 2.973 8.941 17.568) 19.936 8.226 ( -3.351 7.891 16.845) 18.901 8.744 ( 5.466 15.938 0.923) 16.875 9.707 ( -3.203 -10.869 20.286) 23.236 10.127 ( -15.575 2.204 8.547) 17.902 10.295 ( 15.214 6.706 7.844) 18.384 10.488 ( -2.674 -8.858 -10.955) 14.339 11.108 ( -5.926 8.561 -1.462) 10.514 11.529 ( 1.785 19.582 -19.626) 27.782 13.144 ( -3.979 -4.702 -23.004) 23.815 13.466 ( -2.756 -2.881 7.410) 8.415 14.078 ( 8.731 -6.074 -0.698) 10.659 14.097 ( 0.589 -1.621 6.729) 6.947 14.861 ( -5.580 -8.000 -8.702) 13.071 17.929 ( 23.231 -0.917 -5.297) 23.845 18.326 ( -6.074 3.062 -5.347) 8.652 18.908 ( -10.114 4.529 -5.265) 12.269 19.304 ( -12.239 3.110 -3.761) 13.176 20.651 ( 19.962 -6.365 29.266) 35.994 22.739 ( -4.235 -3.989 -7.882) 9.796 23.857 ( -2.070 1.329 -3.397) 4.194 23.993 ( -4.451 -8.697 -19.674) 21.966 ======================= Grid point 295 (147/260) ======================= q-point: (-0.40 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -11.888 0.659 11.846) 16.796 2.724 ( -19.133 2.487 10.817) 22.119 3.226 ( 1.901 -2.229 -4.945) 5.748 3.321 ( 1.759 -3.539 -4.307) 5.846 3.530 ( 0.630 1.550 -10.365) 10.499 3.940 ( -3.221 -6.135 -4.842) 8.453 4.117 ( -10.159 4.089 -1.851) 11.106 4.343 ( 3.922 9.290 5.950) 11.708 5.473 ( 1.849 7.581 20.344) 21.789 5.908 ( -5.235 3.508 9.212) 11.161 6.159 ( -1.669 3.454 15.676) 16.139 6.842 ( -7.739 2.293 5.755) 9.914 6.974 ( -5.951 -1.425 -1.729) 6.359 7.342 ( 11.827 1.620 3.275) 12.378 7.859 ( -1.653 5.300 12.324) 13.516 8.201 ( -2.044 7.649 18.446) 20.073 8.876 ( 7.402 15.651 -0.323) 17.316 9.542 ( -16.336 -4.601 9.502) 19.450 9.959 ( -3.101 -3.786 17.881) 18.538 10.305 ( -14.443 -0.574 -1.455) 14.527 10.561 ( 9.801 2.731 5.279) 11.463 11.025 ( -0.940 10.815 -4.535) 11.764 11.536 ( 2.335 14.994 -17.773) 23.370 12.956 ( -9.410 -4.072 -24.820) 26.854 13.449 ( -0.258 -4.084 7.314) 8.381 14.159 ( 3.656 -2.689 13.295) 14.049 14.251 ( 6.749 -4.806 -0.054) 8.286 14.809 ( 3.299 -7.896 -14.419) 16.767 18.170 ( -8.481 -1.166 -12.452) 15.111 18.378 ( 21.187 -2.836 -2.433) 21.514 18.779 ( -1.481 8.629 -0.472) 8.768 19.226 ( 6.055 3.620 1.619) 7.238 21.090 ( 18.527 -3.405 27.644) 33.451 22.597 ( -8.973 -10.240 -17.930) 22.513 23.732 ( -8.298 0.522 -4.158) 9.296 23.880 ( -4.500 -1.991 -13.062) 13.959 ======================= Grid point 296 (148/260) ======================= q-point: (-0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( -15.653 4.359 11.640) 19.988 2.343 ( -19.721 4.379 15.157) 25.255 3.214 ( -2.884 -1.802 -3.026) 4.552 3.358 ( 3.268 -0.096 -2.237) 3.961 3.428 ( -9.769 7.528 -2.214) 12.530 3.805 ( -8.761 0.160 -6.337) 10.814 4.024 ( 1.684 -2.651 0.710) 3.220 4.436 ( 3.124 7.420 6.035) 10.062 5.517 ( -0.976 5.888 18.581) 19.516 5.815 ( -4.845 2.266 7.248) 9.008 6.185 ( 1.484 3.323 17.120) 17.503 6.669 ( -10.971 4.321 2.761) 12.110 6.797 ( -10.700 -3.663 -1.967) 11.480 7.439 ( -6.482 -4.463 -2.837) 8.365 7.842 ( 1.405 8.982 11.132) 14.372 8.210 ( -0.589 8.495 21.867) 23.466 9.024 ( 7.621 13.857 -4.661) 16.487 9.191 ( -18.677 0.340 7.905) 20.284 9.886 ( -17.060 -3.726 -0.630) 17.474 10.031 ( -3.825 0.176 21.039) 21.384 10.742 ( 8.706 1.879 5.598) 10.520 11.037 ( 2.109 13.282 -8.377) 15.844 11.559 ( 2.801 9.908 -14.645) 17.902 12.720 ( -9.443 -3.208 -23.829) 25.832 13.478 ( 1.744 -4.965 7.109) 8.845 14.245 ( 1.621 -5.901 9.297) 11.130 14.353 ( 4.446 -1.299 9.711) 10.759 14.933 ( 10.892 -8.636 -20.362) 24.655 17.951 ( -9.806 -2.373 -10.940) 14.882 18.760 ( 17.168 -10.262 0.727) 20.015 18.885 ( 12.427 3.514 -0.853) 12.942 19.509 ( 19.616 10.724 4.208) 22.749 21.461 ( 13.369 -1.655 24.381) 27.855 22.286 ( -18.304 -14.648 -26.751) 35.569 23.558 ( -8.451 3.273 -3.456) 9.699 23.759 ( -5.429 2.920 -6.592) 9.025 ======================= Grid point 297 (149/260) ======================= q-point: (-0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -16.263 8.029 16.064) 24.229 2.034 ( -15.204 11.734 18.381) 26.584 3.097 ( -9.436 5.006 6.434) 12.470 3.209 ( -6.356 5.083 -1.494) 8.274 3.483 ( 6.977 -0.575 -1.399) 7.139 3.606 ( -10.019 4.967 -1.201) 11.247 4.105 ( 5.002 -3.771 1.649) 6.478 4.473 ( -0.233 6.097 4.483) 7.571 5.499 ( -3.803 2.353 15.467) 16.101 5.753 ( -2.665 2.185 6.529) 7.382 6.252 ( -1.048 0.795 15.525) 15.580 6.363 ( -17.551 -0.497 -5.232) 18.321 6.608 ( -7.770 -0.177 4.715) 9.090 7.139 ( -18.005 1.196 -2.358) 18.198 7.917 ( 1.506 9.474 10.119) 13.943 8.267 ( 2.111 10.278 25.367) 27.451 8.882 ( -12.173 1.067 6.427) 13.807 9.152 ( 6.226 11.788 -9.384) 16.303 9.453 ( -22.635 3.862 0.267) 22.964 10.068 ( 0.790 -4.345 19.828) 20.314 10.947 ( 10.885 -0.449 3.135) 11.336 11.051 ( 1.203 15.256 -14.165) 20.853 11.594 ( 2.740 5.148 -8.948) 10.681 12.508 ( -7.692 -2.071 -21.617) 23.038 13.539 ( 3.172 -5.039 6.079) 8.509 14.258 ( -0.907 -6.685 5.822) 8.911 14.475 ( 4.982 -1.481 12.567) 13.599 15.119 ( 10.864 -8.841 -22.205) 26.253 17.789 ( -4.312 -7.429 -5.500) 10.200 19.102 ( 14.464 -11.706 -6.024) 19.558 19.191 ( 18.904 -2.306 3.082) 19.292 19.929 ( 19.338 8.581 3.070) 21.378 21.589 ( -9.630 -11.184 -2.903) 15.042 21.916 ( -6.705 -1.748 0.653) 6.960 23.379 ( -8.226 9.527 -5.700) 13.817 23.664 ( -3.396 4.059 -1.403) 5.476 ======================= Grid point 298 (150/260) ======================= q-point: (-0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( -6.894 13.673 21.889) 26.713 1.782 ( -12.767 18.052 18.993) 29.148 2.973 ( -2.711 6.720 14.189) 15.932 3.146 ( 0.145 2.219 -9.215) 9.479 3.422 ( -8.406 7.096 6.415) 12.734 3.610 ( 4.948 -2.346 2.010) 5.833 4.221 ( 6.440 -0.878 4.423) 7.862 4.456 ( -1.783 5.496 4.208) 7.148 5.429 ( -5.692 -1.341 11.897) 13.256 5.716 ( -3.399 1.087 4.261) 5.558 5.881 ( -20.044 -0.225 1.744) 20.121 6.296 ( -3.876 -2.363 10.491) 11.431 6.497 ( -4.737 4.523 7.747) 10.144 6.885 ( -4.868 8.319 1.022) 9.693 7.919 ( -2.738 10.646 12.449) 16.608 8.336 ( -0.682 8.740 22.935) 24.553 8.789 ( 1.394 2.844 6.298) 7.050 9.046 ( -15.885 7.277 -1.262) 17.518 9.233 ( 3.490 8.962 -11.855) 15.266 10.109 ( -0.083 -4.704 17.273) 17.902 11.038 ( 0.738 18.300 -19.597) 26.823 11.158 ( 9.280 -4.661 -0.636) 10.404 11.631 ( 1.839 1.881 -3.157) 4.109 12.346 ( -4.630 -0.970 -19.569) 20.133 13.622 ( 4.243 -4.711 3.947) 7.468 14.244 ( -1.202 -6.653 3.652) 7.684 14.573 ( 2.591 -3.104 9.562) 10.382 15.269 ( 7.949 -8.759 -21.826) 24.825 17.767 ( 2.011 -15.343 0.996) 15.506 19.136 ( -11.945 -8.425 -16.755) 22.235 19.619 ( 19.189 -8.190 2.147) 20.974 20.112 ( -2.953 -1.435 -4.251) 5.371 21.479 ( 13.817 -6.183 0.495) 15.146 21.881 ( -6.230 1.357 15.038) 16.334 23.272 ( 0.250 16.974 -4.609) 17.591 23.603 ( -3.059 4.472 -1.585) 5.645 ======================= Grid point 299 (151/260) ======================= q-point: ( 0.00 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( -4.402 18.866 18.409) 26.725 2.196 ( 4.125 19.196 17.282) 26.156 3.115 ( 0.030 4.219 0.606) 4.263 3.247 ( 5.107 1.877 -6.861) 8.757 3.563 ( -0.519 15.274 17.826) 23.480 3.580 ( -1.120 -2.798 7.177) 7.784 4.447 ( 7.796 1.393 8.110) 11.335 4.540 ( 3.441 5.388 4.007) 7.545 5.209 ( -13.471 -0.376 14.503) 19.797 5.606 ( 2.912 -2.257 -0.232) 3.691 5.774 ( -6.446 0.093 6.681) 9.284 6.121 ( -2.224 -1.573 12.468) 12.762 6.728 ( -0.853 14.269 -11.695) 18.469 7.024 ( 5.162 1.999 -5.156) 7.565 8.224 ( -2.517 19.530 19.059) 27.404 8.600 ( 1.696 16.466 16.772) 23.565 8.802 ( -9.143 4.976 7.535) 12.850 9.256 ( 10.989 9.237 3.208) 14.710 9.506 ( 1.813 15.315 2.267) 15.587 10.074 ( -2.477 1.677 10.448) 10.868 11.080 ( -0.697 -8.741 -5.645) 10.428 11.364 ( 7.263 2.640 -9.140) 11.969 11.746 ( -3.163 11.208 -7.330) 13.761 12.288 ( 2.383 3.034 -16.513) 16.958 13.563 ( 4.039 -9.393 3.289) 10.740 14.016 ( -2.495 -11.708 3.372) 12.436 14.541 ( -0.064 -1.521 -2.653) 3.058 15.066 ( 3.791 -18.241 -19.021) 26.625 17.272 ( -8.537 -21.882 11.177) 26.012 18.558 ( -15.159 -6.436 -21.362) 26.973 19.721 ( 6.240 -6.648 0.118) 9.118 19.971 ( -3.998 -3.191 -6.261) 8.085 21.594 ( -15.878 1.190 9.933) 18.766 21.887 ( 25.061 -8.612 2.773) 26.644 23.651 ( -4.754 6.815 -1.332) 8.416 23.758 ( 10.274 12.498 -5.497) 17.087 ======================= Grid point 300 (152/260) ======================= q-point: ( 0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 2.959 16.649 15.240) 22.764 2.359 ( 7.829 12.602 18.808) 23.955 3.152 ( 3.541 -0.826 -4.546) 5.821 3.345 ( 5.520 0.447 -6.922) 8.864 3.529 ( -2.015 2.722 6.436) 7.273 3.689 ( 6.650 12.564 13.391) 19.529 4.483 ( -0.512 2.310 7.788) 8.139 4.773 ( 12.590 8.545 7.941) 17.163 4.990 ( -9.299 -0.123 14.686) 17.383 5.579 ( -8.260 -3.654 4.015) 9.885 5.822 ( 11.036 -2.340 1.935) 11.447 6.148 ( 2.901 -0.715 9.920) 10.361 6.722 ( 2.829 12.256 -11.405) 16.979 7.144 ( 6.632 1.191 -2.873) 7.325 8.194 ( -3.934 20.684 20.622) 29.472 8.651 ( 0.286 18.569 17.343) 25.410 8.725 ( 0.779 7.430 2.426) 7.855 9.379 ( 0.774 9.500 -4.863) 10.700 9.670 ( 11.518 13.198 17.156) 24.519 10.026 ( -2.963 -1.072 3.088) 4.412 11.038 ( -1.294 -5.399 -3.983) 6.833 11.505 ( 4.616 0.095 -6.297) 7.808 11.665 ( -0.607 12.384 -10.691) 16.372 12.376 ( 9.256 3.815 -15.725) 18.642 13.619 ( 0.725 -9.413 2.302) 9.717 13.965 ( -3.465 -12.898 2.927) 13.672 14.509 ( -2.365 0.117 -5.732) 6.202 15.071 ( -0.204 -18.627 -15.416) 24.180 17.089 ( -10.357 -14.733 11.708) 21.481 18.403 ( 3.108 -6.522 -9.899) 12.255 19.714 ( -6.526 -6.706 -5.773) 10.994 19.819 ( -10.082 -4.004 -1.426) 10.941 21.237 ( -19.307 5.458 7.214) 21.321 22.441 ( 27.484 -16.039 -0.104) 31.822 23.512 ( -8.376 7.089 -3.693) 11.578 23.947 ( 8.736 7.820 -6.426) 13.371 ======================= Grid point 301 (153/260) ======================= q-point: ( 0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( 9.060 11.746 12.769) 19.573 2.535 ( 6.054 6.324 17.758) 19.798 3.218 ( 3.172 -2.418 -5.156) 6.519 3.426 ( 3.674 -4.632 -7.318) 9.408 3.513 ( -0.331 0.660 3.114) 3.201 3.841 ( 6.153 15.305 -0.778) 16.514 4.480 ( -1.818 2.371 5.103) 5.913 4.849 ( -1.804 5.834 13.654) 14.958 5.044 ( 5.407 7.017 13.158) 15.862 5.487 ( 1.710 -6.396 8.332) 10.642 6.023 ( 7.347 1.214 7.213) 10.367 6.267 ( 7.278 -3.309 2.916) 8.510 6.813 ( 8.113 10.419 -8.118) 15.501 7.253 ( 4.413 1.273 -1.404) 4.803 8.139 ( -5.286 19.434 19.431) 27.986 8.665 ( -2.184 21.108 16.742) 27.030 8.831 ( 8.580 10.522 0.439) 13.584 9.387 ( 2.909 8.888 -1.838) 9.531 9.787 ( -5.562 -2.012 22.774) 23.530 10.066 ( 8.533 3.902 -5.729) 10.994 11.016 ( -2.607 2.474 1.354) 3.840 11.438 ( -5.193 0.091 -1.141) 5.318 11.778 ( 10.341 15.538 -18.113) 26.009 12.584 ( 13.771 1.791 -14.076) 19.773 13.599 ( -3.013 -9.197 3.527) 10.301 13.881 ( -5.556 -12.700 3.703) 14.348 14.428 ( -4.611 1.588 -8.199) 9.540 15.008 ( -3.706 -18.462 -10.826) 21.720 16.997 ( 0.982 -4.541 6.625) 8.092 18.569 ( 11.595 -10.660 -2.022) 15.880 19.467 ( -13.327 -6.623 -7.283) 16.569 19.619 ( -10.645 -5.036 1.576) 11.881 20.871 ( -19.033 9.811 6.471) 22.369 22.917 ( 18.610 -16.717 0.565) 25.022 23.331 ( -6.983 4.692 -8.747) 12.137 24.062 ( 4.002 2.422 -8.105) 9.358 ======================= Grid point 302 (154/260) ======================= q-point: ( 0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.382 ( 12.712 6.214 10.501) 17.621 2.654 ( 3.097 3.043 13.986) 14.644 3.230 ( -1.371 -2.047 -4.598) 5.216 3.453 ( -0.096 -6.322 -4.249) 7.618 3.550 ( 4.359 -4.238 -4.392) 7.500 3.882 ( -1.743 10.581 -11.004) 15.365 4.419 ( -3.814 3.816 1.447) 5.586 4.834 ( -4.057 6.433 9.320) 12.029 5.157 ( 6.668 5.110 19.684) 21.401 5.680 ( 12.543 -0.694 11.100) 16.763 6.158 ( 4.669 3.851 13.464) 14.761 6.423 ( 8.818 -1.685 -0.574) 8.996 6.986 ( 8.792 7.753 -4.450) 12.538 7.307 ( 1.167 2.009 -1.120) 2.579 8.058 ( -5.433 15.837 15.375) 22.731 8.629 ( -4.371 20.229 17.557) 27.140 8.980 ( 5.096 19.386 2.280) 20.174 9.505 ( 3.413 -0.918 0.402) 3.557 9.730 ( 4.777 -5.536 15.062) 16.743 10.230 ( 7.367 4.270 0.218) 8.518 10.855 ( -13.609 4.875 1.487) 14.532 11.401 ( 0.283 5.605 3.169) 6.445 11.931 ( 7.581 17.629 -20.090) 27.782 12.844 ( 13.660 -1.566 -11.840) 18.145 13.525 ( -4.770 -6.594 5.181) 9.648 13.779 ( -4.329 -12.397 2.334) 13.337 14.296 ( -7.001 1.322 -8.384) 11.003 14.894 ( -5.903 -17.336 -7.004) 19.607 17.158 ( 13.796 0.186 0.756) 13.818 18.701 ( -0.893 -4.744 -1.860) 5.173 19.254 ( -9.717 -5.946 -10.398) 15.423 19.491 ( 3.527 -9.625 10.170) 14.440 20.491 ( -20.440 11.693 7.053) 24.582 23.004 ( -7.882 -0.066 1.539) 8.032 23.397 ( 13.838 -13.485 -13.271) 23.441 24.077 ( -0.853 -1.144 -8.981) 9.093 ======================= Grid point 303 (155/260) ======================= q-point: ( 0.40 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( 6.657 0.391 11.442) 13.244 2.732 ( 6.970 2.971 6.245) 9.819 3.158 ( -4.725 -3.463 -3.965) 7.073 3.416 ( -2.987 -2.078 -4.474) 5.767 3.643 ( 5.194 -9.272 -7.034) 12.745 3.739 ( -8.668 0.041 -14.462) 16.860 4.380 ( -0.407 8.522 5.850) 10.345 4.719 ( -8.080 4.778 2.552) 9.727 5.368 ( 9.297 8.212 21.616) 24.922 5.935 ( 9.754 3.405 11.808) 15.690 6.241 ( 1.286 5.385 12.819) 13.963 6.645 ( 13.039 0.215 2.567) 13.291 7.088 ( 1.480 4.978 -2.494) 5.761 7.301 ( -1.222 4.432 -1.627) 4.877 8.000 ( -2.435 11.844 11.442) 16.647 8.564 ( -5.041 18.227 18.446) 26.417 9.058 ( 2.703 20.607 4.950) 21.365 9.460 ( -3.457 -12.317 6.351) 14.283 10.073 ( 21.004 3.565 8.638) 22.988 10.353 ( 4.593 4.475 3.992) 7.553 10.537 ( -17.126 4.028 -0.770) 17.610 11.387 ( -3.561 8.843 5.359) 10.936 11.991 ( 2.217 18.770 -20.081) 27.577 13.027 ( 4.714 -5.774 -5.980) 9.556 13.455 ( -2.169 -2.625 -1.999) 3.949 13.751 ( 2.126 -13.015 -0.435) 13.195 14.146 ( -5.950 0.521 -3.680) 7.015 14.757 ( -6.538 -15.238 -5.065) 17.338 17.509 ( 20.644 1.797 -2.009) 20.819 18.584 ( -8.829 3.669 -2.073) 9.783 19.032 ( -7.085 -5.745 -9.633) 13.266 19.706 ( 4.183 -1.781 1.004) 4.655 20.164 ( -6.329 2.212 20.058) 21.149 22.820 ( -9.332 -1.785 -5.026) 10.749 23.628 ( 10.395 -14.572 -11.984) 21.541 24.007 ( -4.340 -1.377 -7.923) 9.138 ======================= Grid point 304 (156/260) ======================= q-point: (-0.50 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( -4.706 2.224 9.579) 10.902 2.979 ( 11.306 -0.705 3.865) 11.969 3.021 ( -8.780 -5.117 -1.186) 10.231 3.311 ( -5.512 -0.571 -7.332) 9.191 3.555 ( -4.599 -2.602 -13.021) 14.052 3.741 ( 4.534 -12.208 -6.772) 14.679 4.407 ( 0.327 9.764 9.482) 13.614 4.540 ( -8.968 5.983 0.636) 10.800 5.563 ( 6.089 10.231 20.414) 23.632 6.065 ( 0.647 5.767 10.589) 12.075 6.269 ( -0.335 7.581 12.707) 14.800 6.889 ( 8.348 -1.754 3.746) 9.316 7.054 ( -3.748 4.844 -1.963) 6.432 7.281 ( 1.234 5.114 -2.301) 5.743 7.990 ( -0.941 7.963 8.481) 11.671 8.501 ( -4.404 16.919 18.619) 25.541 9.123 ( 3.427 13.679 3.998) 14.657 9.437 ( -1.093 -9.345 10.576) 14.155 10.190 ( -15.990 3.895 1.072) 16.492 10.403 ( 2.715 -0.241 -0.505) 2.772 10.501 ( 14.125 13.360 13.837) 23.864 11.278 ( -6.901 8.214 2.806) 11.089 11.973 ( 0.032 19.829 -17.700) 26.580 13.001 ( -5.253 -8.034 -4.872) 10.764 13.392 ( -3.984 -3.677 -7.112) 8.943 13.881 ( 10.397 -12.517 -2.533) 16.468 14.083 ( -0.207 0.311 2.450) 2.478 14.632 ( -4.550 -12.937 -5.575) 14.804 17.934 ( 21.536 1.306 -1.164) 21.607 18.361 ( -11.604 0.074 -7.991) 14.089 19.025 ( 6.795 5.802 -2.379) 9.247 19.430 ( -20.396 9.033 -5.709) 23.026 20.475 ( 22.710 -9.641 28.024) 37.337 22.607 ( -11.163 -8.748 -13.342) 19.472 23.749 ( 3.290 -12.455 -11.076) 16.989 23.902 ( -4.024 1.884 -5.483) 7.058 ======================= Grid point 305 (157/260) ======================= q-point: (-0.40 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -8.200 4.714 9.059) 13.097 2.744 ( -16.531 -0.355 4.302) 17.085 3.161 ( 3.949 -3.619 -3.386) 6.337 3.259 ( 2.343 -2.507 -2.160) 4.055 3.511 ( 1.831 -2.974 -10.106) 10.692 3.799 ( 2.126 -7.644 -4.995) 9.376 4.277 ( -11.496 9.923 3.510) 15.587 4.511 ( 2.358 6.648 8.107) 10.746 5.666 ( 0.446 9.299 18.590) 20.791 6.014 ( -6.166 6.823 8.203) 12.323 6.278 ( -1.148 7.938 14.402) 16.484 6.907 ( -6.299 -4.580 0.031) 7.788 6.950 ( -5.906 7.633 -0.702) 9.677 7.370 ( 5.267 0.616 -4.037) 6.665 7.988 ( -0.033 6.724 8.737) 11.025 8.464 ( -2.286 16.326 18.076) 24.464 9.215 ( 5.181 8.691 2.262) 10.368 9.394 ( -7.098 -4.044 11.803) 14.354 9.931 ( -9.428 2.485 1.337) 9.841 10.336 ( -8.824 4.244 7.301) 12.214 10.747 ( 7.021 13.988 11.937) 19.684 11.199 ( -0.067 6.649 -1.980) 6.938 11.939 ( -0.654 20.230 -14.757) 25.050 12.837 ( -8.872 -6.554 -13.272) 17.257 13.311 ( -2.486 -8.468 0.449) 8.837 14.088 ( 7.513 -8.706 -4.929) 12.511 14.123 ( 4.552 -3.197 9.230) 10.776 14.586 ( 2.048 -11.960 -10.680) 16.165 18.135 ( -9.582 -2.044 -10.468) 14.338 18.314 ( 14.915 -3.258 1.538) 15.344 19.005 ( -9.225 12.433 -8.588) 17.704 19.340 ( 15.491 7.060 4.535) 17.617 20.989 ( 22.656 -6.142 27.193) 35.923 22.309 ( -15.883 -16.307 -21.920) 31.602 23.712 ( -4.031 -2.685 -4.618) 6.692 23.855 ( -0.609 0.015 -7.904) 7.927 ======================= Grid point 306 (158/260) ======================= q-point: (-0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( -12.019 6.988 9.711) 16.959 2.460 ( -11.909 6.904 11.113) 17.691 3.165 ( -1.116 -3.021 -3.148) 4.503 3.355 ( 6.623 0.556 -2.357) 7.051 3.533 ( -0.823 -1.067 -4.318) 4.523 3.790 ( -3.328 0.312 2.155) 3.977 4.091 ( -5.559 8.059 1.460) 9.898 4.565 ( 1.190 4.704 6.924) 8.455 5.641 ( -5.515 4.398 14.885) 16.472 5.902 ( -5.650 6.831 7.349) 11.515 6.277 ( -1.870 4.871 16.450) 17.258 6.673 ( -16.676 -5.538 -2.471) 17.744 6.842 ( -4.352 9.782 -0.384) 10.713 7.349 ( -6.535 -3.683 -9.367) 12.001 8.062 ( 5.163 10.797 12.270) 17.140 8.482 ( 0.907 16.565 19.183) 25.361 9.171 ( -14.759 -2.684 7.307) 16.686 9.334 ( 5.287 11.310 2.009) 12.645 9.785 ( -8.526 -0.970 0.139) 8.582 10.148 ( -9.428 9.024 16.615) 21.128 10.858 ( 3.653 9.557 6.619) 12.185 11.237 ( 3.038 5.957 -3.256) 7.437 11.895 ( -1.220 19.603 -13.244) 23.689 12.632 ( -8.385 -4.511 -17.733) 20.127 13.305 ( 1.136 -11.045 5.767) 12.511 14.113 ( -1.004 -6.585 3.046) 7.325 14.299 ( 7.927 -4.346 6.272) 11.003 14.679 ( 9.110 -14.126 -18.104) 24.704 17.898 ( -13.395 -2.220 -6.940) 15.248 18.516 ( 9.185 -11.739 -1.454) 14.976 19.024 ( 10.551 8.915 -5.901) 15.020 19.718 ( 19.355 8.181 3.516) 21.305 21.416 ( 13.309 -2.472 21.072) 25.045 21.928 ( -15.837 -17.867 -20.063) 31.186 23.621 ( -3.946 2.735 -4.770) 6.768 23.818 ( -1.864 1.958 -5.717) 6.324 ======================= Grid point 307 (159/260) ======================= q-point: (-0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( -8.488 13.868 15.354) 22.363 2.291 ( -8.259 12.402 14.656) 20.900 3.140 ( -0.367 -0.284 -3.553) 3.583 3.406 ( -10.562 8.803 0.845) 13.775 3.484 ( 5.166 1.836 2.439) 6.000 3.705 ( -4.656 4.400 7.161) 9.608 4.087 ( 3.819 2.280 1.527) 4.703 4.576 ( -1.019 3.545 4.555) 5.861 5.533 ( -6.972 0.422 11.369) 13.343 5.817 ( -4.466 3.535 5.145) 7.676 6.225 ( -12.467 -6.234 11.366) 17.985 6.291 ( -14.108 0.998 6.736) 15.665 6.787 ( -1.173 13.055 -1.880) 13.242 7.151 ( -9.326 -0.062 -12.193) 15.351 8.173 ( 2.738 13.313 13.920) 19.455 8.557 ( 1.682 16.901 20.835) 26.880 8.916 ( -8.973 1.527 6.966) 11.462 9.426 ( 2.598 8.885 0.354) 9.263 9.525 ( -15.890 5.703 1.895) 16.988 10.077 ( -1.844 6.389 17.104) 18.351 10.942 ( 4.572 1.461 0.351) 4.812 11.282 ( 1.953 4.726 -4.639) 6.904 11.847 ( -1.261 17.896 -12.172) 21.680 12.455 ( -6.195 -2.365 -17.722) 18.922 13.366 ( 3.644 -11.087 6.816) 13.515 14.088 ( -1.963 -8.773 4.768) 10.177 14.439 ( 5.190 -2.132 4.293) 7.065 14.845 ( 10.193 -16.555 -20.998) 28.616 17.616 ( -12.834 -7.885 -1.266) 15.116 18.773 ( 15.773 -15.682 -8.401) 23.776 19.243 ( 10.680 4.239 -3.745) 12.086 20.030 ( 9.315 0.304 -2.928) 9.769 21.391 ( -8.973 -6.218 -9.259) 14.315 21.862 ( 4.496 -3.114 16.838) 17.704 23.552 ( -1.088 6.388 -8.142) 10.405 23.772 ( -1.949 5.292 -1.471) 5.828 ======================= Grid point 308 (160/260) ======================= q-point: (-0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -4.968 18.584 19.938) 27.705 2.176 ( -5.106 18.052 15.065) 24.061 3.141 ( -0.334 5.426 1.381) 5.609 3.219 ( -4.867 6.028 -1.950) 7.990 3.538 ( -0.253 -0.132 10.090) 10.094 3.638 ( -3.733 9.795 6.977) 12.592 4.229 ( 9.563 0.919 5.420) 11.031 4.550 ( -1.943 3.479 3.428) 5.256 5.408 ( -8.322 -0.372 11.862) 14.494 5.694 ( -9.392 -3.764 -0.502) 10.130 5.902 ( -10.567 2.197 8.366) 13.656 6.185 ( -5.881 -3.387 15.720) 17.122 6.767 ( -0.720 15.007 -6.928) 16.545 7.002 ( -2.481 3.125 -10.057) 10.820 8.221 ( -0.243 16.374 16.069) 22.943 8.567 ( -2.073 13.203 17.002) 21.626 8.907 ( 1.916 6.903 12.826) 14.691 9.198 ( -11.513 7.613 3.462) 14.230 9.485 ( 1.424 12.610 -1.685) 12.802 10.084 ( -0.869 3.901 13.605) 14.179 11.040 ( 5.000 -5.844 -3.879) 8.614 11.300 ( 1.450 3.247 -7.149) 7.985 11.802 ( -1.377 15.015 -10.054) 18.123 12.329 ( -3.141 0.241 -16.743) 17.037 13.464 ( 4.808 -10.111 5.415) 12.436 14.056 ( -2.177 -10.289 4.540) 11.455 14.519 ( 2.458 -1.970 0.830) 3.257 14.988 ( 7.611 -17.637 -20.905) 28.390 17.411 ( -8.284 -16.275 5.075) 18.954 18.887 ( -6.749 -13.931 -22.661) 27.444 19.483 ( 14.984 -4.521 0.641) 15.664 20.048 ( -3.295 -4.185 -7.469) 9.174 21.421 ( 13.495 0.100 2.714) 13.766 21.873 ( -7.533 -1.395 14.257) 16.185 23.585 ( 6.111 10.911 -7.062) 14.361 23.730 ( -2.434 7.244 -0.225) 7.645 ======================= Grid point 309 (161/260) ======================= q-point: ( 0.00 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -3.312 15.941 14.217) 21.615 2.547 ( -0.760 14.727 17.220) 22.671 3.140 ( -3.139 -3.260 -1.024) 4.640 3.242 ( 2.715 -1.508 -1.676) 3.530 3.582 ( -3.824 2.759 12.096) 12.983 3.925 ( 4.479 16.906 19.090) 25.890 4.433 ( 7.980 -2.213 10.802) 13.611 4.656 ( 5.385 5.476 -0.772) 7.719 5.246 ( -12.545 3.986 13.008) 18.506 5.549 ( 3.348 -3.124 -1.343) 4.772 5.716 ( -8.681 -4.851 6.176) 11.706 6.160 ( -0.173 3.741 4.911) 6.176 6.972 ( -1.491 7.975 -14.502) 16.617 7.023 ( 3.638 -0.991 -11.658) 12.253 8.612 ( -1.635 16.248 20.861) 26.493 8.875 ( -9.723 3.320 14.569) 17.827 9.017 ( 9.556 19.711 14.436) 26.235 9.473 ( 6.810 12.080 6.069) 15.138 9.705 ( 3.314 1.366 14.359) 14.799 10.291 ( -3.214 18.548 6.407) 19.885 10.869 ( -2.314 -11.381 -2.088) 11.800 11.274 ( 5.057 -8.535 -4.084) 10.728 11.956 ( -6.627 8.261 -0.779) 10.619 12.448 ( 4.809 10.154 -18.868) 21.960 13.358 ( 5.232 -9.223 0.612) 10.621 13.779 ( -2.646 -10.418 -2.403) 11.014 14.499 ( 2.012 -5.718 -5.748) 8.353 14.652 ( 2.147 -16.359 -18.359) 24.683 16.909 ( -8.651 -12.630 7.791) 17.177 18.395 ( -9.764 -7.843 -28.070) 30.737 19.601 ( 7.630 -4.520 -0.438) 8.879 19.907 ( -5.116 -2.659 -8.922) 10.623 21.615 ( -13.626 0.697 8.457) 16.052 21.762 ( 17.120 -3.703 4.174) 18.006 23.784 ( -3.991 5.534 0.400) 6.834 23.931 ( 7.393 4.567 -3.783) 9.478 ======================= Grid point 310 (162/260) ======================= q-point: ( 0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( 0.400 15.844 11.852) 19.790 2.590 ( 1.726 9.773 18.017) 20.569 3.105 ( 0.231 -4.246 -0.735) 4.315 3.308 ( 2.991 -3.045 -2.230) 4.816 3.527 ( -3.354 -0.266 9.693) 10.261 4.089 ( 7.711 19.787 13.413) 25.117 4.514 ( 0.526 1.664 7.590) 7.788 4.890 ( 14.909 1.749 7.827) 16.929 5.033 ( -9.109 4.761 10.230) 14.502 5.474 ( -10.679 -6.261 1.013) 12.421 5.762 ( 11.234 -2.671 3.727) 12.134 6.203 ( 3.315 4.216 3.964) 6.669 6.947 ( 2.476 8.634 -14.368) 16.944 7.121 ( 6.935 -2.395 -9.375) 11.904 8.578 ( -4.817 14.788 19.923) 25.275 8.796 ( 0.728 2.415 9.076) 9.420 9.161 ( 1.140 24.785 17.431) 30.322 9.611 ( 4.003 12.134 2.524) 13.024 9.790 ( -0.197 -1.607 18.544) 18.614 10.232 ( -0.837 18.234 0.585) 18.263 10.896 ( 6.137 -8.212 4.596) 11.235 11.410 ( 6.631 -7.872 -5.637) 11.735 11.843 ( -2.680 6.443 -1.136) 7.070 12.542 ( 7.549 8.583 -16.283) 19.894 13.432 ( 2.102 -7.369 -0.334) 7.670 13.720 ( -2.644 -9.312 -4.640) 10.734 14.505 ( -0.303 -2.144 -8.186) 8.467 14.633 ( -1.111 -20.067 -14.751) 24.930 16.822 ( -1.216 -10.097 8.142) 13.028 18.249 ( 0.529 -7.153 -18.854) 20.172 19.618 ( -7.195 -2.466 -6.311) 9.883 19.731 ( -9.250 -4.214 -3.706) 10.819 21.333 ( -14.764 3.542 6.688) 16.590 22.169 ( 21.604 -9.801 2.578) 23.863 23.648 ( -9.151 5.481 -2.064) 10.865 24.047 ( 4.284 2.298 -3.572) 6.033 ======================= Grid point 311 (163/260) ======================= q-point: ( 0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( 4.890 13.492 10.040) 17.514 2.665 ( 2.566 6.332 15.191) 16.657 3.137 ( 2.725 -5.188 -1.707) 6.104 3.328 ( -0.754 -4.187 -2.871) 5.133 3.483 ( -2.570 -2.776 6.389) 7.425 4.193 ( -0.619 14.582 -1.688) 14.693 4.524 ( -0.626 3.761 5.917) 7.039 4.962 ( 0.978 5.572 18.078) 18.942 5.147 ( 0.696 0.451 5.740) 5.800 5.362 ( 8.213 -4.865 6.128) 11.343 6.021 ( 13.313 -1.474 3.142) 13.758 6.293 ( 4.910 5.154 3.400) 7.889 7.026 ( 7.401 8.971 -12.033) 16.735 7.236 ( 5.639 -2.058 -6.698) 8.994 8.480 ( -8.204 12.651 16.631) 22.449 8.963 ( 13.216 3.566 5.859) 14.890 9.155 ( -3.149 19.667 17.528) 26.532 9.608 ( -6.508 4.592 5.384) 9.614 9.715 ( -4.868 6.868 7.131) 11.033 10.299 ( 5.210 12.944 7.700) 15.937 11.081 ( 6.200 3.218 6.478) 9.527 11.421 ( -1.321 -1.911 -3.772) 4.430 11.930 ( 10.405 2.070 -2.501) 10.900 12.678 ( 8.330 3.468 -11.466) 14.590 13.448 ( 0.268 -3.865 -1.860) 4.297 13.650 ( -3.829 -7.722 -5.135) 10.033 14.444 ( -4.299 -0.226 -13.255) 13.936 14.570 ( -2.791 -21.659 -7.493) 23.087 16.904 ( 8.449 -3.977 5.443) 10.808 18.348 ( 10.980 -9.363 -10.003) 17.558 19.370 ( -12.060 -2.729 -7.094) 14.255 19.527 ( -12.671 -3.717 0.026) 13.205 21.051 ( -15.199 7.110 5.774) 17.745 22.591 ( 19.793 -13.270 1.750) 23.894 23.423 ( -12.409 3.488 -6.589) 14.476 24.086 ( 0.528 0.223 -4.371) 4.408 ======================= Grid point 312 (164/260) ======================= q-point: ( 0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( 7.417 9.947 7.960) 14.742 2.740 ( 2.677 5.100 10.409) 11.896 3.172 ( -0.742 -3.379 -0.906) 3.576 3.289 ( -0.609 -7.596 -6.197) 9.822 3.446 ( -1.888 -6.057 2.408) 6.786 4.036 ( -12.461 3.109 -12.983) 18.262 4.527 ( 0.139 7.304 5.873) 9.373 4.928 ( -7.213 1.551 8.320) 11.120 5.261 ( 11.906 5.320 18.444) 22.588 5.676 ( 16.509 -0.589 9.562) 19.087 6.284 ( 11.461 4.566 6.007) 13.722 6.411 ( 7.174 3.250 1.823) 8.084 7.151 ( 5.337 6.332 -8.813) 12.093 7.327 ( 4.953 0.986 -4.557) 6.803 8.336 ( -7.990 10.599 11.273) 17.415 9.004 ( -8.226 9.454 17.872) 21.828 9.360 ( 5.310 11.011 3.960) 12.850 9.402 ( -1.032 0.218 2.719) 2.917 9.756 ( 8.137 8.905 6.469) 13.687 10.427 ( 5.642 10.734 13.735) 18.323 10.969 ( -13.926 5.834 -5.800) 16.175 11.515 ( 6.097 4.725 9.793) 12.466 12.135 ( 9.166 3.743 -6.324) 11.748 12.823 ( 7.538 -3.310 -3.739) 9.042 13.453 ( 0.590 0.474 -4.554) 4.616 13.548 ( -4.891 -7.284 -5.990) 10.623 14.295 ( -7.577 -2.410 -13.184) 15.396 14.501 ( -3.187 -17.816 -3.685) 18.470 17.172 ( 17.300 1.017 1.942) 17.439 18.579 ( 11.218 -6.320 -5.356) 13.946 19.161 ( -13.176 -2.870 -8.353) 15.863 19.311 ( -0.864 -6.948 8.227) 10.803 20.728 ( -18.631 10.183 4.233) 21.650 22.920 ( 8.743 -8.275 6.033) 13.465 23.171 ( -6.909 -6.328 -16.290) 18.792 24.063 ( -1.742 -0.254 -5.153) 5.446 ======================= Grid point 313 (165/260) ======================= q-point: ( 0.40 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 3.630 4.979 5.289) 8.120 2.824 ( 5.228 5.312 5.787) 9.436 3.084 ( -6.173 -2.878 -1.116) 6.902 3.308 ( 1.978 -8.075 -6.607) 10.620 3.424 ( 0.003 -9.485 -1.160) 9.555 3.723 ( -14.671 -2.076 -16.753) 22.365 4.548 ( 0.601 7.424 8.776) 11.510 4.795 ( -7.248 1.926 4.851) 8.931 5.546 ( 11.591 8.100 21.206) 25.488 5.994 ( 12.982 1.898 10.035) 16.518 6.440 ( 3.961 12.030 6.222) 14.111 6.626 ( 12.374 -1.699 2.962) 12.837 7.183 ( 0.108 2.942 -6.843) 7.449 7.395 ( 1.314 4.735 -3.731) 6.170 8.226 ( -4.701 9.669 7.629) 13.183 8.868 ( -7.470 1.650 18.901) 20.391 9.154 ( -9.121 0.643 -3.840) 9.917 9.588 ( 3.277 19.241 13.401) 23.676 10.098 ( 21.585 -0.068 1.360) 21.628 10.572 ( 4.137 11.628 18.513) 22.250 10.644 ( -13.622 6.374 -10.020) 18.072 11.571 ( -2.885 8.385 10.867) 14.026 12.244 ( 3.401 6.139 -7.475) 10.253 12.937 ( 2.258 -3.572 3.069) 5.222 13.435 ( 0.208 -3.707 -8.176) 8.980 13.474 ( -1.938 -7.328 -9.655) 12.275 14.138 ( -5.333 -2.505 -7.326) 9.401 14.432 ( -2.915 -13.375 -3.061) 14.027 17.565 ( 21.146 3.172 0.107) 21.383 18.646 ( -9.574 2.071 -3.281) 10.331 18.931 ( 1.591 -3.522 -6.335) 7.421 19.548 ( 17.482 -9.986 10.956) 22.921 20.337 ( -19.777 11.029 5.039) 23.198 22.753 ( -15.959 -4.648 -10.320) 19.565 23.298 ( 12.335 -14.539 -5.690) 19.897 24.008 ( -2.606 0.782 -5.817) 6.422 ======================= Grid point 314 (166/260) ======================= q-point: (-0.50 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( -2.213 4.451 3.453) 6.053 2.901 ( -4.235 -3.936 0.788) 5.835 3.001 ( 2.475 1.219 1.529) 3.154 3.279 ( -4.331 -2.449 -7.612) 9.094 3.447 ( -0.425 -7.891 -6.233) 10.065 3.504 ( 0.905 -8.442 -10.027) 13.139 4.576 ( -0.005 6.305 9.535) 11.431 4.656 ( -7.198 4.604 5.489) 10.155 5.759 ( 5.480 7.534 20.738) 22.734 6.188 ( 4.233 5.962 8.445) 11.170 6.497 ( 0.653 13.021 6.815) 14.712 6.818 ( 4.439 -4.414 3.699) 7.271 7.175 ( 0.532 4.731 -6.856) 8.347 7.366 ( -1.833 3.312 -4.609) 5.964 8.152 ( -4.176 7.294 5.922) 10.282 8.800 ( -3.593 2.050 24.418) 24.766 9.037 ( -0.925 -1.298 -8.398) 8.548 9.622 ( -2.319 13.937 16.400) 21.647 10.299 ( -14.371 6.120 -8.798) 17.927 10.420 ( 7.714 1.033 5.211) 9.366 10.830 ( 14.673 15.617 12.987) 25.057 11.464 ( -8.192 9.544 7.987) 14.899 12.272 ( 1.004 8.262 -4.974) 9.696 12.889 ( -6.346 -1.167 2.443) 6.899 13.323 ( -8.204 -2.888 -15.856) 18.085 13.565 ( 10.783 -16.833 -3.859) 20.359 14.069 ( -1.719 -3.643 -1.908) 4.457 14.389 ( -0.293 -7.531 -4.730) 8.898 17.971 ( 18.486 1.844 1.153) 18.613 18.341 ( -14.782 -1.575 -7.642) 16.715 19.146 ( 15.941 6.009 2.160) 17.172 19.636 ( -15.801 8.132 -8.651) 19.764 20.292 ( 19.285 -6.210 24.552) 31.832 22.380 ( -18.607 -12.125 -19.552) 29.589 23.508 ( 9.020 -9.482 -1.624) 13.188 23.941 ( -3.009 1.617 -7.309) 8.068 ======================= Grid point 315 (167/260) ======================= q-point: (-0.40 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( -7.021 3.982 3.389) 8.755 2.748 ( -7.779 2.533 3.698) 8.978 3.086 ( 2.885 -3.331 -2.454) 5.043 3.208 ( 1.722 -2.444 -3.994) 4.989 3.432 ( 1.263 -3.854 -7.680) 8.685 3.625 ( 8.357 -8.388 -1.860) 11.985 4.479 ( -9.047 8.449 5.352) 13.486 4.622 ( 0.186 3.896 9.779) 10.528 5.814 ( -3.697 4.497 17.778) 18.707 6.196 ( -4.061 9.856 6.498) 12.484 6.482 ( -3.620 10.524 8.544) 14.031 6.798 ( -6.449 -4.862 1.594) 8.232 7.124 ( -4.227 7.464 -5.389) 10.130 7.356 ( 0.048 -2.033 -8.576) 8.814 8.127 ( 2.125 5.863 7.816) 10.000 8.783 ( -2.548 8.192 25.789) 27.178 9.081 ( 4.919 -4.399 -6.091) 8.980 9.546 ( -7.818 7.366 14.846) 18.325 10.050 ( -8.983 7.055 -8.157) 14.036 10.460 ( -3.874 6.577 14.459) 16.351 11.106 ( 8.313 17.530 7.460) 20.786 11.333 ( -4.372 6.725 3.036) 8.577 12.271 ( -0.496 10.194 -1.659) 10.340 12.747 ( -7.324 -0.169 -3.657) 8.188 13.137 ( -6.575 -7.151 -10.559) 14.348 13.810 ( 13.776 -17.381 -4.054) 22.545 14.023 ( -3.091 -7.517 0.699) 8.158 14.412 ( 3.576 -2.791 -8.787) 9.889 18.095 ( -8.576 -1.480 -7.749) 11.653 18.239 ( 5.863 -3.797 2.948) 7.582 19.282 ( -11.040 13.341 -12.608) 21.421 19.502 ( 18.088 7.620 4.260) 20.085 20.843 ( 27.154 -7.375 27.096) 39.063 21.957 ( -19.487 -15.907 -23.975) 34.750 23.645 ( 4.715 -3.051 0.175) 5.619 23.866 ( -2.760 0.597 -9.487) 9.898 ======================= Grid point 316 (168/260) ======================= q-point: (-0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( -6.701 6.927 8.641) 12.944 2.640 ( -4.617 10.205 6.142) 12.774 3.089 ( -0.227 -3.978 -2.969) 4.969 3.356 ( 10.465 -4.604 1.372) 11.515 3.447 ( 1.456 -0.995 -4.845) 5.156 3.777 ( 5.676 -2.792 3.542) 7.250 4.297 ( -9.626 9.998 4.894) 14.716 4.636 ( -0.460 2.048 7.294) 7.590 5.695 ( -9.613 1.433 11.969) 15.418 6.071 ( -9.728 7.218 7.326) 14.156 6.381 ( -8.323 4.272 8.535) 12.664 6.594 ( -13.040 0.155 2.018) 13.196 7.047 ( -1.696 8.179 -6.657) 10.681 7.277 ( -5.624 -3.559 -11.592) 13.367 8.265 ( 8.248 8.082 12.329) 16.893 8.807 ( 0.967 8.200 24.413) 25.771 9.097 ( -5.529 1.214 0.467) 5.680 9.441 ( -1.955 1.701 9.435) 9.785 9.889 ( -7.166 6.965 -4.581) 10.993 10.370 ( -6.914 11.111 19.429) 23.426 11.128 ( -4.553 13.929 5.632) 15.699 11.332 ( 1.532 3.914 -2.969) 5.146 12.243 ( -2.368 11.268 0.765) 11.539 12.594 ( -6.149 3.053 -12.943) 14.651 13.062 ( 0.200 -10.746 -2.141) 10.959 13.955 ( -3.684 -10.146 1.754) 10.936 14.077 ( 13.364 -15.892 -5.340) 21.440 14.481 ( 4.870 -2.893 -12.684) 13.892 17.871 ( -16.206 -0.120 -1.881) 16.315 18.284 ( 4.999 -10.020 -5.348) 12.409 19.246 ( 6.518 11.890 -9.941) 16.814 19.822 ( 12.241 1.188 -0.308) 12.302 21.365 ( 15.197 -2.256 18.466) 24.021 21.589 ( -7.905 -13.367 -12.187) 19.741 23.677 ( -0.868 2.706 -5.408) 6.110 23.829 ( 0.914 -0.783 -5.124) 5.263 ======================= Grid point 317 (169/260) ======================= q-point: (-0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( -2.725 11.202 14.702) 18.683 2.578 ( -2.869 15.495 8.950) 18.122 3.096 ( 1.481 -3.606 -2.011) 4.386 3.408 ( -2.677 -5.659 -1.727) 6.494 3.600 ( 7.984 6.305 6.266) 11.948 3.827 ( -1.114 5.728 11.620) 13.003 4.159 ( -3.446 3.512 4.064) 6.382 4.633 ( -0.622 2.202 3.406) 4.104 5.530 ( -7.537 -0.269 6.290) 9.820 5.842 ( -13.995 -1.334 8.479) 16.418 6.176 ( -13.215 1.118 4.818) 14.110 6.351 ( -10.991 5.173 7.501) 14.277 7.027 ( 0.035 7.730 -7.540) 10.798 7.140 ( -4.574 -0.470 -14.987) 15.677 8.430 ( 5.042 10.807 16.365) 20.249 8.910 ( 0.875 -2.453 12.910) 13.170 8.937 ( -3.680 16.722 16.978) 24.113 9.462 ( -0.664 1.700 6.890) 7.127 9.721 ( -8.674 7.297 2.242) 11.555 10.298 ( -2.868 12.026 16.421) 20.555 11.033 ( -4.986 6.399 0.550) 8.131 11.318 ( -2.168 0.008 -4.205) 4.731 12.179 ( -4.231 10.863 1.273) 11.727 12.475 ( -2.844 6.196 -18.279) 19.509 13.118 ( 4.821 -11.230 1.610) 12.326 13.889 ( -3.139 -10.821 1.512) 11.368 14.302 ( 9.854 -13.887 -5.625) 17.932 14.553 ( 4.899 -6.133 -16.222) 18.021 17.486 ( -20.100 -4.343 1.933) 20.655 18.481 ( 14.018 -11.622 -15.310) 23.790 19.354 ( 3.538 6.178 -6.548) 9.673 19.951 ( 2.392 -6.872 -9.122) 11.669 21.333 ( -0.386 -0.088 -5.756) 5.770 21.798 ( 8.757 -2.750 21.210) 23.111 23.657 ( 1.874 3.844 -9.358) 10.289 23.853 ( 1.184 2.247 -0.172) 2.546 ======================= Grid point 318 (170/260) ======================= q-point: (-0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.398 ( -2.916 13.202 16.006) 20.953 2.553 ( -2.027 18.275 13.367) 22.732 3.138 ( 2.753 -3.682 -1.958) 4.997 3.304 ( -6.843 -1.357 -1.081) 7.059 3.626 ( -3.389 9.029 13.978) 16.982 3.862 ( 0.388 9.970 14.443) 17.555 4.220 ( 8.531 -2.452 7.846) 11.847 4.627 ( -0.178 4.288 -0.083) 4.292 5.421 ( -5.992 1.240 6.810) 9.155 5.598 ( -9.876 -3.626 6.382) 12.305 5.915 ( -12.547 -1.879 5.144) 13.690 6.203 ( -5.280 4.484 6.898) 9.776 6.997 ( -0.812 2.597 -8.447) 8.875 7.058 ( -1.783 5.912 -17.180) 18.256 8.545 ( 4.099 14.026 17.709) 22.960 8.862 ( 1.062 12.124 13.137) 17.908 9.025 ( -3.388 4.003 21.334) 21.970 9.394 ( -2.534 11.905 6.481) 13.789 9.647 ( 0.095 2.466 7.759) 8.142 10.303 ( -0.165 14.378 11.834) 18.623 10.941 ( -3.880 -3.076 -3.857) 6.276 11.258 ( -2.014 -5.165 -3.642) 6.633 12.081 ( -5.752 9.505 0.463) 11.120 12.423 ( 1.060 8.963 -19.740) 21.705 13.236 ( 6.351 -10.375 1.613) 12.271 13.834 ( -2.705 -10.917 0.094) 11.248 14.441 ( 5.108 -9.789 -5.034) 12.135 14.617 ( 4.451 -11.572 -18.841) 22.554 17.135 ( -15.219 -9.620 4.971) 18.677 18.608 ( -1.523 -11.599 -29.010) 31.280 19.416 ( 7.243 -2.110 -0.673) 7.574 19.958 ( 0.550 -3.899 -9.533) 10.314 21.450 ( 11.067 1.962 3.285) 11.710 21.840 ( -7.063 -1.498 13.427) 15.245 23.742 ( 7.123 5.126 -5.338) 10.272 23.863 ( -0.108 4.505 0.074) 4.507 ======================= Grid point 319 (171/260) ======================= q-point: ( 0.00 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.610 ( -1.003 7.276 10.071) 12.465 2.825 ( -5.559 10.938 14.563) 19.042 3.022 ( -4.074 -6.454 5.300) 9.292 3.182 ( 2.644 -3.617 3.739) 5.836 3.644 ( -8.629 2.092 11.686) 14.676 4.189 ( 7.508 6.900 19.541) 22.041 4.383 ( 12.617 -1.775 16.136) 20.559 4.755 ( 3.390 3.182 -5.716) 7.368 5.365 ( -9.257 6.211 4.357) 11.968 5.488 ( -2.739 -2.222 -3.602) 5.041 5.597 ( -5.257 -5.543 11.986) 14.213 6.223 ( -0.516 1.622 -1.073) 2.012 6.981 ( 3.602 -1.136 -12.525) 13.082 7.094 ( -1.809 2.617 -15.199) 15.529 8.846 ( -6.938 4.713 15.300) 17.448 8.938 ( -7.282 3.090 26.618) 27.768 9.340 ( 22.133 9.355 9.874) 25.979 9.623 ( 3.199 -3.208 14.426) 15.120 9.794 ( 2.204 11.893 8.221) 14.625 10.593 ( -0.493 -8.333 14.060) 16.352 10.706 ( -8.677 14.081 2.290) 16.697 11.049 ( 2.845 -12.313 -3.788) 13.193 12.167 ( -6.415 10.253 -1.312) 12.166 12.580 ( 1.660 1.111 -12.289) 12.450 13.200 ( 7.289 -5.032 -3.620) 9.569 13.605 ( 0.886 -5.001 -11.771) 12.820 14.240 ( 2.127 -9.324 -7.922) 12.419 14.547 ( 0.883 -0.667 -15.056) 15.097 16.736 ( -8.929 -4.024 4.897) 10.950 18.270 ( -7.292 -3.318 -32.052) 33.038 19.537 ( 8.401 -1.577 -0.631) 8.571 19.867 ( -5.758 -1.012 -10.310) 11.852 21.623 ( -12.818 0.107 7.595) 14.899 21.717 ( 13.374 -0.887 4.891) 14.268 23.871 ( -4.178 2.486 1.140) 4.993 23.978 ( 6.609 0.522 -2.379) 7.043 ======================= Grid point 320 (172/260) ======================= q-point: ( 0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( -0.245 7.632 8.628) 11.522 2.778 ( -1.767 7.732 14.690) 16.695 2.981 ( -0.287 -6.533 4.408) 7.886 3.243 ( 2.090 -2.495 2.663) 4.205 3.524 ( -5.924 0.007 11.382) 12.831 4.349 ( 4.103 3.657 18.567) 19.364 4.644 ( 9.428 10.293 9.037) 16.628 4.865 ( 8.588 -3.718 2.467) 9.678 5.154 ( -7.961 6.102 -0.157) 10.031 5.320 ( -11.396 -7.783 2.918) 14.106 5.725 ( 11.221 -0.790 7.200) 13.356 6.272 ( 5.134 1.773 -1.268) 5.578 7.062 ( 5.399 0.940 -13.686) 14.742 7.088 ( 4.929 0.960 -12.696) 13.653 8.779 ( -0.927 3.948 11.920) 12.591 8.833 ( -6.318 1.589 21.260) 22.236 9.543 ( -6.340 6.272 13.001) 15.765 9.800 ( 2.912 8.820 10.059) 13.692 9.864 ( 8.647 7.313 10.773) 15.630 10.465 ( -6.147 -2.576 7.595) 10.105 10.787 ( 12.272 3.780 12.841) 18.159 11.205 ( 10.931 -9.556 -5.061) 15.376 12.039 ( -5.340 10.187 -0.079) 11.502 12.599 ( 1.901 -2.881 -9.223) 9.847 13.331 ( 6.558 -2.177 -4.396) 8.190 13.601 ( 0.975 -2.203 -15.009) 15.201 14.239 ( -0.823 -10.622 -6.528) 12.494 14.515 ( -1.545 -0.576 -15.700) 15.786 16.678 ( 2.313 -3.495 5.417) 6.849 18.137 ( 0.081 -2.953 -23.791) 23.974 19.602 ( -4.820 0.597 -4.573) 6.671 19.653 ( -10.804 -2.887 -6.877) 13.129 21.383 ( -12.040 1.208 6.324) 13.653 22.031 ( 17.095 -3.293 4.072) 17.879 23.731 ( -9.945 2.123 -1.534) 10.284 24.068 ( 2.672 0.190 -1.763) 3.206 ======================= Grid point 321 (173/260) ======================= q-point: ( 0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.651 ( 3.160 6.899 7.551) 10.705 2.797 ( 1.100 5.453 11.280) 12.577 3.016 ( 2.741 -5.327 0.798) 6.044 3.255 ( -1.552 -2.510 2.138) 3.644 3.428 ( -6.061 -1.715 8.941) 10.937 4.340 ( -8.783 1.339 3.866) 9.689 4.721 ( -0.532 11.996 -1.663) 12.123 5.044 ( -6.799 -7.982 1.433) 10.582 5.081 ( 7.986 4.604 24.190) 25.887 5.282 ( 13.938 -3.184 1.157) 14.344 5.997 ( 14.402 -0.513 6.048) 15.629 6.399 ( 7.359 3.288 -1.208) 8.150 7.154 ( 5.669 2.182 -11.955) 13.409 7.206 ( 8.372 0.251 -10.379) 13.338 8.656 ( -10.459 4.077 20.071) 22.997 8.990 ( 14.786 0.105 4.093) 15.342 9.340 ( -12.828 0.068 9.535) 15.984 9.730 ( -8.662 9.144 8.414) 15.147 9.980 ( 0.740 9.243 9.354) 13.171 10.456 ( 2.137 1.107 16.482) 16.656 11.159 ( 15.984 5.262 10.833) 20.013 11.334 ( 3.419 -6.445 -8.425) 11.144 12.033 ( 5.910 7.467 6.508) 11.534 12.614 ( 0.718 -7.212 -4.785) 8.685 13.443 ( 5.432 1.672 -5.722) 8.065 13.581 ( -0.527 -0.084 -16.635) 16.643 14.187 ( -3.235 -11.616 -4.963) 13.040 14.431 ( -3.832 -0.698 -15.825) 16.297 16.843 ( 13.110 -1.549 4.695) 14.011 18.207 ( 10.340 -3.559 -15.078) 18.626 19.339 ( -12.337 -0.501 -5.180) 13.389 19.469 ( -12.750 -1.584 -2.361) 13.063 21.158 ( -12.279 2.729 5.057) 13.558 22.392 ( 18.130 -5.090 3.423) 19.140 23.471 ( -15.480 1.108 -5.912) 16.608 24.085 ( -0.212 -0.117 -2.655) 2.666 ======================= Grid point 322 (174/260) ======================= q-point: ( 0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.747 ( 4.653 5.907 5.334) 9.219 2.856 ( 3.208 5.193 5.990) 8.553 3.074 ( 2.966 -5.411 -2.697) 6.734 3.189 ( -5.319 -1.409 1.803) 5.790 3.316 ( -5.843 -4.958 5.537) 9.454 4.053 ( -17.102 -0.239 -12.167) 20.990 4.708 ( -1.280 8.942 5.258) 10.452 4.878 ( -6.616 -5.815 5.244) 10.251 5.386 ( 14.220 5.262 22.252) 26.926 5.635 ( 18.914 -2.719 5.517) 19.889 6.301 ( 14.754 -0.374 5.435) 15.728 6.546 ( 7.346 5.241 -0.728) 9.053 7.207 ( 1.586 0.081 -8.832) 8.973 7.376 ( 9.130 2.444 -8.171) 12.494 8.492 ( -8.237 3.990 13.864) 16.612 8.969 ( -15.737 -4.738 6.747) 17.765 9.497 ( 19.981 3.118 2.476) 20.374 9.542 ( -5.780 6.569 4.665) 9.916 9.985 ( -1.715 8.033 13.019) 15.394 10.568 ( 5.358 2.161 22.373) 23.107 11.079 ( -13.209 3.611 -17.300) 22.064 11.585 ( 11.644 1.735 15.503) 19.466 12.242 ( 10.855 8.126 6.710) 15.129 12.625 ( 1.761 -12.803 1.699) 13.035 13.492 ( -2.886 2.789 -10.700) 11.428 13.525 ( 0.457 1.412 -14.627) 14.702 14.100 ( -4.497 -10.084 -3.748) 11.660 14.330 ( -2.977 -1.492 -13.265) 13.677 17.192 ( 20.415 0.639 2.589) 20.588 18.472 ( 17.285 -3.037 -7.548) 19.105 19.128 ( -17.959 -0.487 -4.446) 18.507 19.208 ( -1.273 -2.645 4.071) 5.019 20.888 ( -16.022 4.302 2.443) 16.769 22.751 ( 17.076 -5.231 4.211) 18.349 23.102 ( -19.736 -1.352 -12.109) 23.194 24.062 ( -1.270 0.064 -4.142) 4.332 ======================= Grid point 323 (175/260) ======================= q-point: ( 0.40 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.811 ( 0.082 3.867 1.913) 4.315 2.928 ( 1.988 4.413 0.452) 4.861 3.077 ( -4.682 1.595 0.840) 5.017 3.125 ( 3.260 -6.705 -2.977) 8.029 3.248 ( -1.023 -7.139 3.017) 7.818 3.683 ( -16.310 -1.189 -17.642) 24.056 4.687 ( -1.597 5.453 7.333) 9.277 4.790 ( -4.114 -2.156 6.524) 8.009 5.680 ( 10.619 3.866 23.212) 25.817 6.013 ( 17.116 0.128 6.852) 18.437 6.577 ( 11.014 -0.831 5.209) 12.212 6.680 ( 6.142 6.924 -0.269) 9.260 7.198 ( -0.348 -0.678 -7.999) 8.035 7.483 ( 1.792 2.758 -5.648) 6.536 8.404 ( -3.194 7.201 9.660) 12.465 8.672 ( -13.152 -10.478 6.711) 18.105 9.342 ( -8.712 7.613 2.406) 11.817 9.909 ( 0.117 10.262 14.329) 17.625 10.070 ( 19.890 -2.911 3.343) 20.378 10.720 ( -6.990 3.109 6.968) 10.348 10.777 ( 0.664 3.750 -1.913) 4.262 11.719 ( -0.721 4.494 12.978) 13.753 12.398 ( 3.833 11.722 5.097) 13.345 12.735 ( 7.649 -15.886 8.487) 19.567 13.349 ( -6.810 1.582 -14.823) 16.389 13.465 ( -5.675 -1.099 -14.500) 15.610 14.012 ( -3.575 -6.063 -1.656) 7.230 14.293 ( 1.454 -1.413 -9.958) 10.162 17.621 ( 21.358 1.637 0.750) 21.434 18.668 ( -14.779 0.250 -4.071) 15.332 18.892 ( 14.280 -0.472 -2.617) 14.525 19.377 ( 15.305 -4.920 11.574) 19.809 20.530 ( -19.462 5.644 -0.205) 20.265 22.648 ( -22.537 -3.846 -16.170) 28.003 23.087 ( 15.413 -4.997 2.597) 16.409 24.023 ( -1.786 0.450 -6.001) 6.277 ======================= Grid point 324 (176/260) ======================= q-point: (-0.50 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -4.920 -0.633 1.078) 5.076 2.901 ( -2.841 3.340 -0.094) 4.386 3.030 ( -0.851 0.773 -3.589) 3.769 3.207 ( 3.285 -3.469 -2.008) 5.182 3.301 ( 6.172 -3.955 0.837) 7.378 3.389 ( -8.420 -2.899 -15.360) 17.755 4.672 ( -1.575 2.650 6.744) 7.415 4.719 ( -4.403 1.310 9.271) 10.347 5.864 ( 3.208 2.407 21.972) 22.335 6.300 ( 9.707 3.697 6.200) 12.097 6.692 ( -1.452 -0.148 5.357) 5.552 6.788 ( 4.199 5.775 0.460) 7.155 7.201 ( 2.415 -1.460 -8.700) 9.146 7.430 ( -5.026 2.178 -6.218) 8.286 8.283 ( -9.348 4.590 5.665) 11.855 8.607 ( 3.565 -8.832 15.563) 18.246 9.215 ( -3.634 7.175 -1.451) 8.173 9.827 ( -8.471 5.250 16.519) 19.292 10.396 ( -6.331 1.511 -6.587) 9.260 10.443 ( 4.351 1.641 0.196) 4.654 11.051 ( 15.514 4.710 14.244) 21.582 11.637 ( -8.226 4.921 9.838) 13.735 12.462 ( 2.021 12.761 7.965) 15.178 12.841 ( -1.405 -8.362 7.267) 11.167 13.262 ( -2.091 -4.366 -15.911) 16.631 13.270 ( -4.584 -5.405 -13.265) 15.039 13.947 ( -3.161 -4.666 0.261) 5.642 14.338 ( 4.325 0.228 -10.003) 10.900 17.999 ( 15.283 0.695 2.375) 15.482 18.312 ( -15.445 -0.866 -6.960) 16.963 19.270 ( 19.367 4.660 3.541) 20.233 19.691 ( 4.518 -1.628 0.531) 4.832 20.260 ( 1.823 1.649 12.029) 12.278 22.161 ( -22.615 -6.700 -21.999) 32.254 23.373 ( 12.709 -3.216 3.309) 13.521 23.965 ( -2.961 0.594 -8.456) 8.979 ======================= Grid point 325 (177/260) ======================= q-point: (-0.40 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.659 ( -4.535 0.043 4.117) 6.125 2.865 ( -0.595 6.189 0.688) 6.255 3.021 ( 0.596 -3.000 -2.952) 4.250 3.153 ( -3.244 -2.383 -8.889) 9.758 3.380 ( 5.527 -0.654 -3.084) 6.363 3.477 ( 10.172 -4.792 0.743) 11.268 4.611 ( -5.776 3.789 5.419) 8.780 4.671 ( -2.366 0.756 10.767) 11.050 5.869 ( -6.043 1.171 17.786) 18.821 6.393 ( -2.415 8.222 4.935) 9.889 6.565 ( -10.188 -4.324 4.845) 12.082 6.819 ( -1.680 6.587 0.762) 6.841 7.207 ( -1.688 -0.491 -8.247) 8.432 7.312 ( -4.702 -0.661 -9.375) 10.509 8.208 ( 2.447 1.671 7.519) 8.081 8.719 ( 2.025 -4.876 25.744) 26.280 9.211 ( 3.984 6.959 -6.730) 10.468 9.645 ( -12.150 2.438 15.009) 19.464 10.159 ( -9.057 2.717 -12.598) 15.752 10.571 ( 0.984 3.147 18.459) 18.751 11.337 ( 9.609 4.446 4.340) 11.443 11.470 ( -9.599 3.811 9.615) 14.110 12.498 ( -0.699 14.697 9.068) 17.284 12.751 ( -4.924 -4.318 1.402) 6.698 13.037 ( -8.978 -2.313 -15.921) 18.424 13.428 ( 11.773 -14.237 -9.004) 20.552 13.887 ( -2.457 -3.837 0.523) 4.586 14.411 ( 4.565 0.758 -11.772) 12.649 18.080 ( -5.940 0.035 -8.384) 10.275 18.168 ( -1.252 -2.354 6.096) 6.653 19.522 ( -7.098 7.949 -14.931) 18.344 19.618 ( 12.673 2.414 2.385) 13.119 20.709 ( 29.328 -4.205 27.593) 40.487 21.702 ( -18.503 -6.964 -23.455) 30.676 23.599 ( 9.410 -1.167 3.121) 9.983 23.874 ( -4.256 0.198 -11.327) 12.102 ======================= Grid point 326 (178/260) ======================= q-point: (-0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.604 ( -2.105 3.384 8.492) 9.380 2.873 ( 1.084 11.160 2.389) 11.464 3.017 ( -0.504 -2.270 -2.157) 3.172 3.161 ( 3.920 -10.672 -1.342) 11.449 3.520 ( 8.911 4.820 1.389) 10.226 3.683 ( 9.817 -5.094 3.397) 11.570 4.462 ( -10.540 4.799 4.734) 12.511 4.652 ( -1.019 -0.212 8.724) 8.786 5.716 ( -10.778 0.576 11.188) 15.546 6.164 ( -18.657 1.984 8.561) 20.623 6.407 ( -7.930 -0.516 2.273) 8.265 6.713 ( -9.072 7.250 0.406) 11.620 7.136 ( -3.004 -0.643 -8.544) 9.079 7.211 ( -3.037 -0.982 -12.222) 12.632 8.386 ( 11.959 3.161 11.470) 16.869 8.759 ( -1.992 -4.500 26.318) 26.774 9.285 ( -1.090 8.039 1.190) 8.200 9.469 ( -2.656 1.021 9.183) 9.614 9.987 ( -7.361 2.188 -6.739) 10.217 10.556 ( -5.419 5.230 21.890) 23.149 11.300 ( -9.229 2.378 9.758) 13.640 11.418 ( -1.434 2.814 -1.814) 3.642 12.452 ( -4.421 10.401 5.987) 12.790 12.699 ( -1.848 2.677 -2.922) 4.372 12.895 ( -1.489 -4.450 -11.585) 12.499 13.604 ( 5.274 -15.139 -7.463) 17.683 13.898 ( 5.155 -3.288 -2.661) 6.668 14.471 ( 3.735 0.338 -13.509) 14.020 17.891 ( -20.078 1.494 4.652) 20.664 18.115 ( 5.790 -5.268 -10.972) 13.478 19.498 ( 5.482 10.772 -13.779) 18.329 19.762 ( 1.424 -6.053 -4.246) 7.529 21.325 ( 23.524 -1.357 25.017) 34.366 21.400 ( -5.254 -4.240 -12.860) 14.524 23.736 ( 1.143 2.845 -5.394) 6.204 23.793 ( 1.752 -2.437 -5.267) 6.062 ======================= Grid point 327 (179/260) ======================= q-point: (-0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.596 ( -0.747 5.067 10.845) 11.994 2.913 ( 1.531 15.014 6.652) 16.493 3.017 ( 0.737 -2.489 0.157) 2.601 3.217 ( 0.404 -11.921 3.721) 12.495 3.739 ( 11.184 6.294 8.037) 15.142 3.864 ( 7.070 -2.196 9.230) 11.832 4.217 ( -13.620 1.725 5.555) 14.810 4.669 ( 1.565 1.022 3.336) 3.824 5.525 ( -8.673 -0.223 2.382) 8.997 5.821 ( -15.902 -0.137 14.339) 21.413 6.185 ( -15.313 -0.323 1.928) 15.437 6.493 ( -11.420 5.814 -0.741) 12.837 7.052 ( -3.600 -2.089 -9.556) 10.424 7.179 ( 1.485 2.067 -14.481) 14.703 8.631 ( 7.217 8.589 17.376) 20.683 8.798 ( 5.250 -7.143 16.198) 18.465 9.170 ( -7.543 4.545 20.424) 22.242 9.575 ( 7.170 6.393 2.415) 9.905 9.806 ( -10.836 1.491 2.045) 11.127 10.485 ( -3.587 4.702 17.745) 18.704 11.133 ( -9.353 2.171 8.453) 12.792 11.304 ( -8.459 -0.881 -4.405) 9.578 12.372 ( -4.312 8.340 2.781) 9.792 12.635 ( -2.409 5.421 -11.434) 12.881 12.936 ( 5.457 -5.422 -3.896) 8.623 13.625 ( -0.144 -11.312 -6.134) 12.869 14.048 ( 8.753 -6.352 -7.272) 13.032 14.513 ( 3.001 -0.266 -14.491) 14.801 17.430 ( -24.230 -1.176 4.157) 24.612 18.307 ( 13.518 -4.443 -20.193) 24.703 19.489 ( -7.096 5.678 -8.237) 12.265 19.792 ( 6.659 -6.559 -11.927) 15.153 21.348 ( 3.701 0.760 -3.178) 4.937 21.755 ( 10.656 -1.115 22.223) 24.671 23.715 ( 2.538 1.533 -11.514) 11.890 23.875 ( 3.419 0.218 2.311) 4.133 ======================= Grid point 328 (180/260) ======================= q-point: (-0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( -0.464 6.053 11.099) 12.651 2.912 ( -4.031 14.746 11.622) 19.203 3.045 ( 1.600 -3.298 1.721) 4.049 3.186 ( -3.619 -9.230 6.212) 11.700 3.818 ( -8.626 7.169 10.379) 15.282 4.012 ( 6.534 3.534 16.484) 18.080 4.134 ( 7.987 -4.339 11.178) 14.408 4.712 ( 2.337 2.771 -2.655) 4.493 5.416 ( -1.695 -1.273 -3.466) 4.063 5.605 ( -9.642 3.165 17.964) 20.632 5.844 ( -17.195 -3.647 1.332) 17.628 6.303 ( -7.074 3.380 -1.239) 7.937 6.981 ( -1.245 -1.309 -11.070) 11.217 7.164 ( -1.170 2.489 -15.623) 15.863 8.799 ( 8.831 9.431 17.814) 22.007 8.963 ( 4.623 -1.812 14.621) 15.441 9.097 ( -3.993 2.519 25.627) 26.058 9.601 ( -5.587 1.636 8.366) 10.192 9.716 ( 4.290 8.091 4.918) 10.395 10.509 ( 2.816 2.958 14.077) 14.657 10.941 ( -11.767 3.903 4.307) 13.124 11.119 ( -7.801 -7.308 -3.706) 11.313 12.283 ( -5.126 9.196 0.368) 10.535 12.586 ( -0.126 4.087 -13.481) 14.088 13.060 ( 7.207 -5.718 -3.025) 9.684 13.611 ( 0.217 -8.148 -8.266) 11.609 14.179 ( 5.547 -8.080 -8.463) 12.949 14.540 ( 2.314 -0.624 -14.791) 14.984 17.004 ( -18.477 -3.003 4.104) 19.164 18.433 ( 0.666 -4.448 -33.105) 33.409 19.388 ( 2.464 -0.623 -1.202) 2.812 19.899 ( 3.892 -1.537 -10.446) 11.253 21.483 ( 9.176 0.955 3.471) 9.857 21.817 ( -6.403 -0.612 12.812) 14.336 23.816 ( 8.102 1.884 -5.788) 10.133 23.917 ( 0.305 0.973 2.017) 2.260 ======================= Grid point 369 (181/260) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.829 ( 1.053 0.000 17.990) 18.020 1.931 ( 1.019 0.000 15.391) 15.424 2.845 ( 4.824 0.000 -10.259) 11.337 2.902 ( 1.891 0.000 -11.687) 11.839 3.625 ( -0.436 0.000 11.528) 11.536 3.745 ( 0.937 0.000 0.335) 0.995 4.477 ( -1.134 0.000 6.521) 6.619 4.518 ( 6.639 0.000 7.538) 10.045 5.494 ( -12.180 0.000 13.390) 18.101 5.743 ( 3.693 0.000 5.162) 6.347 5.827 ( 0.523 0.000 3.972) 4.006 6.006 ( -1.602 0.000 -9.578) 9.711 6.850 ( -7.447 0.000 12.423) 14.484 6.943 ( 8.426 0.000 6.010) 10.350 7.988 ( -1.286 0.000 12.254) 12.321 8.441 ( -10.717 0.000 -11.501) 15.720 8.613 ( -5.413 0.000 15.599) 16.511 8.946 ( 1.592 0.000 -9.002) 9.141 9.162 ( 16.368 0.000 13.893) 21.469 10.154 ( -1.991 0.000 -31.521) 31.584 10.682 ( -1.500 0.000 26.581) 26.623 11.410 ( 0.458 0.000 6.516) 6.532 11.569 ( -2.751 0.000 -9.685) 10.068 11.886 ( 5.915 0.000 -20.223) 21.070 13.821 ( 4.122 0.000 5.345) 6.750 14.173 ( -3.622 0.000 -9.553) 10.216 14.821 ( -4.303 0.000 7.392) 8.553 15.131 ( 6.245 0.000 -12.114) 13.629 18.220 ( 18.822 0.000 3.200) 19.092 18.394 ( -34.965 0.000 -5.589) 35.409 19.962 ( 4.242 0.000 1.357) 4.453 20.018 ( -2.738 0.000 -1.540) 3.141 21.806 ( -28.430 0.000 12.309) 30.980 22.224 ( 40.394 0.000 -8.971) 41.378 23.159 ( 9.138 0.000 4.323) 10.109 23.355 ( -7.662 0.000 -5.541) 9.456 ======================= Grid point 370 (182/260) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( 12.629 0.000 18.384) 22.304 2.088 ( 11.227 0.000 7.322) 13.404 2.953 ( 4.911 0.000 -14.852) 15.643 2.980 ( 10.070 0.000 -9.080) 13.559 3.619 ( -1.891 0.000 7.594) 7.825 3.714 ( -3.631 0.000 -0.820) 3.722 4.460 ( -1.707 0.000 3.847) 4.209 4.626 ( 2.552 0.000 3.530) 4.356 5.342 ( -5.024 0.000 18.629) 19.294 5.809 ( -1.075 0.000 5.775) 5.874 5.929 ( 12.528 0.000 4.377) 13.271 6.089 ( 8.827 0.000 -6.625) 11.037 6.802 ( 0.810 0.000 7.929) 7.971 7.101 ( 5.721 0.000 8.323) 10.099 7.978 ( -2.274 0.000 18.596) 18.734 8.287 ( -2.445 0.000 -11.087) 11.353 8.562 ( -2.890 0.000 16.096) 16.354 8.983 ( 3.825 0.000 -7.623) 8.528 9.573 ( 22.155 0.000 10.681) 24.595 10.089 ( 1.598 0.000 -34.682) 34.718 10.697 ( -1.766 0.000 27.492) 27.549 11.366 ( -5.856 0.000 3.865) 7.016 11.457 ( -5.920 0.000 -10.936) 12.436 12.017 ( 10.143 0.000 -19.809) 22.255 13.917 ( 4.145 0.000 6.298) 7.539 14.085 ( -3.385 0.000 -11.513) 12.000 14.715 ( -7.474 0.000 5.502) 9.281 15.202 ( 2.743 0.000 -10.246) 10.607 17.722 ( -29.860 0.000 6.553) 30.570 18.611 ( 18.281 0.000 6.729) 19.480 19.938 ( -5.353 0.000 -4.061) 6.719 19.953 ( -5.586 0.000 2.706) 6.207 21.207 ( -31.288 0.000 8.413) 32.400 22.917 ( 27.738 0.000 -18.388) 33.280 23.198 ( -4.446 0.000 -5.032) 6.714 23.377 ( 11.222 0.000 3.358) 11.714 ======================= Grid point 371 (183/260) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( 13.006 0.000 2.551) 13.254 2.355 ( 18.303 0.000 18.142) 25.771 3.017 ( 3.828 0.000 -16.543) 16.980 3.183 ( 10.378 0.000 -5.290) 11.648 3.587 ( -1.080 0.000 -1.900) 2.185 3.613 ( -5.963 0.000 -2.115) 6.327 4.415 ( -3.601 0.000 2.636) 4.463 4.638 ( -0.951 0.000 -0.859) 1.281 5.353 ( 1.697 0.000 20.519) 20.589 5.841 ( 3.005 0.000 8.639) 9.146 6.200 ( 13.173 0.000 6.808) 14.828 6.263 ( 8.414 0.000 -3.557) 9.135 6.887 ( 5.918 0.000 -0.184) 5.921 7.199 ( 2.690 0.000 11.415) 11.728 7.977 ( -1.287 0.000 24.998) 25.031 8.277 ( 2.182 0.000 -12.009) 12.205 8.545 ( -1.928 0.000 17.638) 17.743 9.101 ( 10.015 0.000 -4.402) 10.939 10.040 ( 21.729 0.000 11.690) 24.674 10.097 ( 5.315 0.000 -36.559) 36.943 10.712 ( -1.325 0.000 26.061) 26.095 11.197 ( -11.471 0.000 3.508) 11.995 11.313 ( -6.339 0.000 -9.885) 11.743 12.206 ( 12.574 0.000 -24.660) 27.681 13.991 ( 1.517 0.000 8.669) 8.801 13.996 ( -3.525 0.000 -12.051) 12.555 14.549 ( -9.794 0.000 5.422) 11.194 15.200 ( -1.343 0.000 -8.819) 8.921 17.303 ( -13.107 0.000 10.938) 17.071 18.890 ( 6.123 0.000 3.534) 7.070 19.754 ( -14.575 0.000 4.351) 15.210 19.784 ( -9.033 0.000 -7.529) 11.759 20.712 ( -17.076 0.000 12.611) 21.228 22.957 ( -7.173 0.000 -12.044) 14.018 23.455 ( 18.754 0.000 -15.648) 24.425 23.591 ( 9.484 0.000 1.039) 9.541 ======================= Grid point 372 (184/260) ======================= q-point: ( 0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( 11.596 0.000 1.401) 11.680 2.764 ( 19.091 0.000 17.560) 25.939 3.043 ( 1.783 0.000 -15.800) 15.900 3.297 ( 0.194 0.000 1.233) 1.248 3.482 ( -6.468 0.000 -3.417) 7.315 3.630 ( 8.004 0.000 -13.840) 15.988 4.321 ( -6.395 0.000 3.902) 7.492 4.595 ( -3.323 0.000 -3.885) 5.112 5.449 ( 4.055 0.000 19.384) 19.803 5.947 ( 5.407 0.000 10.062) 11.423 6.381 ( 3.580 0.000 0.193) 3.586 6.477 ( 13.566 0.000 8.446) 15.980 6.987 ( 3.827 0.000 -6.433) 7.485 7.247 ( -0.304 0.000 11.078) 11.082 8.026 ( 1.352 0.000 28.919) 28.951 8.303 ( 2.560 0.000 -10.251) 10.566 8.543 ( -1.746 0.000 19.990) 20.066 9.373 ( 17.462 0.000 -3.635) 17.836 10.159 ( 7.046 0.000 -36.328) 37.005 10.423 ( 11.892 0.000 23.284) 26.145 10.741 ( 0.173 0.000 17.352) 17.353 10.947 ( -12.785 0.000 3.790) 13.335 11.184 ( -4.726 0.000 -8.919) 10.093 12.411 ( 12.277 0.000 -31.386) 33.702 13.911 ( -2.466 0.000 -10.541) 10.825 13.986 ( -4.481 0.000 12.691) 13.459 14.378 ( -7.172 0.000 5.572) 9.083 15.115 ( -5.672 0.000 -8.320) 10.069 17.239 ( 4.360 0.000 8.124) 9.220 18.797 ( -14.043 0.000 -0.380) 14.049 19.436 ( -16.763 0.000 -2.957) 17.022 19.562 ( -11.306 0.000 -10.234) 15.250 20.648 ( 6.038 0.000 27.141) 27.805 22.800 ( -6.150 0.000 -11.796) 13.303 23.704 ( 9.445 0.000 -16.833) 19.301 23.746 ( 5.868 0.000 -1.175) 5.985 ======================= Grid point 373 (185/260) ======================= q-point: ( 0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( 6.133 0.000 1.763) 6.382 3.038 ( 1.301 0.000 -13.410) 13.473 3.145 ( 13.883 0.000 18.039) 22.762 3.254 ( -2.067 0.000 -2.027) 2.895 3.353 ( -5.360 0.000 -4.166) 6.789 3.805 ( 10.196 0.000 -12.929) 16.466 4.189 ( -6.868 0.000 5.248) 8.643 4.473 ( -8.191 0.000 -5.932) 10.114 5.574 ( 4.795 0.000 18.781) 19.383 6.054 ( 2.720 0.000 7.205) 7.701 6.419 ( 0.330 0.000 6.710) 6.718 6.771 ( 14.559 0.000 5.537) 15.576 7.007 ( -0.252 0.000 -7.390) 7.394 7.211 ( -4.817 0.000 6.922) 8.433 8.118 ( 2.286 0.000 27.061) 27.157 8.356 ( 4.424 0.000 -6.616) 7.958 8.547 ( -1.607 0.000 23.402) 23.457 9.733 ( 18.293 0.000 -10.522) 21.103 10.239 ( 6.999 0.000 -28.791) 29.629 10.474 ( -12.746 0.000 13.919) 18.873 10.688 ( -5.385 0.000 34.882) 35.295 10.900 ( 5.318 0.000 0.811) 5.380 11.103 ( -1.784 0.000 -8.576) 8.760 12.545 ( 6.289 0.000 -37.665) 38.186 13.863 ( -9.149 0.000 13.475) 16.287 13.893 ( 3.092 0.000 -7.666) 8.266 14.317 ( -0.200 0.000 7.618) 7.620 14.953 ( -8.755 0.000 -8.656) 12.312 17.468 ( 16.597 0.000 3.990) 17.070 18.471 ( -16.102 0.000 -1.765) 16.198 19.091 ( -16.343 0.000 -4.752) 17.020 19.323 ( -10.196 0.000 -10.766) 14.828 20.941 ( 15.657 0.000 33.212) 36.717 22.666 ( -5.401 0.000 -15.399) 16.318 23.792 ( 2.679 0.000 -13.809) 14.067 23.814 ( 1.302 0.000 -2.639) 2.943 ======================= Grid point 374 (186/260) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.796 ( -5.636 0.000 3.777) 6.785 3.035 ( -0.217 0.000 -9.816) 9.818 3.201 ( -5.618 0.000 3.043) 6.389 3.276 ( 4.935 0.000 -5.572) 7.444 3.379 ( 1.654 0.000 11.364) 11.484 3.929 ( 2.062 0.000 -11.260) 11.448 4.131 ( 1.866 0.000 5.176) 5.502 4.276 ( -8.602 0.000 -3.647) 9.344 5.693 ( 3.643 0.000 18.617) 18.970 6.056 ( -3.151 0.000 2.197) 3.841 6.434 ( -0.723 0.000 14.022) 14.040 6.921 ( -3.666 0.000 -8.641) 9.386 7.099 ( -6.775 0.000 1.936) 7.046 7.103 ( 14.427 0.000 3.355) 14.812 8.180 ( -1.032 0.000 19.426) 19.454 8.451 ( 5.833 0.000 -4.948) 7.649 8.566 ( -0.864 0.000 27.951) 27.964 9.968 ( 7.191 0.000 -32.106) 32.901 10.139 ( -19.971 0.000 8.097) 21.550 10.370 ( 9.648 0.000 -4.291) 10.559 10.665 ( -4.463 0.000 31.691) 32.004 10.984 ( 1.261 0.000 15.254) 15.306 11.079 ( 0.911 0.000 -9.747) 9.790 12.512 ( -2.288 0.000 -39.786) 39.852 13.716 ( -6.899 0.000 10.160) 12.281 14.021 ( 10.655 0.000 -6.372) 12.415 14.381 ( 4.614 0.000 11.763) 12.636 14.759 ( -8.527 0.000 -9.557) 12.808 17.873 ( 22.765 0.000 1.319) 22.803 18.176 ( -13.268 0.000 -9.156) 16.121 18.837 ( -7.225 0.000 4.132) 8.323 19.152 ( -4.481 0.000 -8.334) 9.463 21.325 ( 16.339 0.000 32.635) 36.496 22.505 ( -8.088 0.000 -22.994) 24.374 23.784 ( -0.978 0.000 -7.880) 7.941 23.788 ( -3.415 0.000 -3.015) 4.555 ======================= Grid point 375 (187/260) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.628 ( -11.105 0.000 7.698) 13.513 2.894 ( -13.558 0.000 1.412) 13.631 3.187 ( 4.213 0.000 -0.270) 4.222 3.320 ( -7.047 0.000 6.371) 9.499 3.377 ( 4.778 0.000 -4.846) 6.805 3.765 ( -13.685 0.000 -14.596) 20.008 4.216 ( 0.848 0.000 4.176) 4.261 4.262 ( 8.079 0.000 5.295) 9.659 5.777 ( 1.418 0.000 18.257) 18.312 5.962 ( -5.760 0.000 -0.036) 5.761 6.444 ( -0.567 0.000 16.803) 16.813 6.777 ( -8.712 0.000 -9.202) 12.672 6.953 ( -8.192 0.000 -1.581) 8.343 7.385 ( 12.082 0.000 0.190) 12.084 8.125 ( -7.147 0.000 12.947) 14.789 8.560 ( 6.032 0.000 -6.876) 9.147 8.606 ( -0.589 0.000 30.065) 30.071 9.743 ( -21.106 0.000 8.397) 22.715 9.920 ( -4.923 0.000 -35.347) 35.688 10.533 ( 4.098 0.000 5.002) 6.466 10.621 ( -4.181 0.000 22.660) 23.043 11.024 ( -0.285 0.000 27.448) 27.449 11.115 ( 5.412 0.000 -12.684) 13.790 12.351 ( -5.936 0.000 -38.174) 38.633 13.638 ( -2.471 0.000 6.862) 7.293 14.252 ( 12.042 0.000 -4.120) 12.727 14.525 ( 6.984 0.000 14.923) 16.476 14.607 ( -3.977 0.000 -12.797) 13.401 17.905 ( -11.152 0.000 -15.099) 18.771 18.341 ( 23.446 0.000 0.019) 23.446 18.856 ( 7.194 0.000 11.361) 13.448 19.148 ( 5.903 0.000 -3.589) 6.908 21.685 ( 14.063 0.000 29.654) 32.819 22.239 ( -14.268 0.000 -31.058) 34.178 23.672 ( -7.706 0.000 -2.227) 8.022 23.740 ( -2.407 0.000 -1.909) 3.072 ======================= Grid point 376 (188/260) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( -12.164 0.000 14.179) 18.681 2.562 ( -19.547 0.000 8.978) 21.510 3.179 ( -7.161 0.000 0.080) 7.161 3.319 ( 8.390 0.000 0.924) 8.441 3.327 ( -13.143 0.000 -4.987) 14.058 3.546 ( -0.545 0.000 -10.418) 10.432 4.249 ( 1.084 0.000 7.934) 8.008 4.406 ( 4.888 0.000 5.068) 7.041 5.809 ( -1.476 0.000 16.826) 16.891 5.853 ( -4.610 0.000 -0.943) 4.706 6.485 ( 1.698 0.000 16.566) 16.653 6.541 ( -13.600 0.000 -9.508) 16.594 6.756 ( -11.061 0.000 -4.484) 11.935 7.509 ( -1.842 0.000 -1.282) 2.244 7.998 ( -5.193 0.000 11.987) 13.064 8.645 ( -0.603 0.000 29.787) 29.793 8.659 ( 5.439 0.000 -11.025) 12.293 9.341 ( -20.268 0.000 7.487) 21.606 9.671 ( -14.457 0.000 -24.059) 28.069 10.523 ( -4.046 0.000 -4.747) 6.238 10.603 ( -1.380 0.000 21.502) 21.547 11.088 ( 2.088 0.000 27.717) 27.795 11.253 ( 9.687 0.000 -10.882) 14.569 12.168 ( -5.720 0.000 -34.838) 35.304 13.635 ( 0.776 0.000 5.197) 5.255 14.390 ( 0.195 0.000 1.683) 1.694 14.623 ( 9.587 0.000 -19.510) 21.738 14.689 ( 6.293 0.000 15.638) 16.857 17.719 ( -4.121 0.000 -14.106) 14.695 18.769 ( 18.805 0.000 -0.852) 18.825 19.118 ( 15.912 0.000 10.880) 19.276 19.392 ( 18.863 0.000 0.823) 18.881 21.832 ( -20.340 0.000 -33.424) 39.126 21.982 ( 10.815 0.000 26.184) 28.330 23.479 ( -11.308 0.000 -0.773) 11.334 23.683 ( -3.285 0.000 0.737) 3.366 ======================= Grid point 377 (189/260) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( -18.702 0.000 13.403) 23.009 2.202 ( -12.121 0.000 20.413) 23.741 3.024 ( -12.744 0.000 -10.311) 16.393 3.041 ( -6.167 0.000 -4.133) 7.424 3.503 ( 9.294 0.000 1.993) 9.506 3.568 ( 1.453 0.000 2.523) 2.911 4.294 ( 2.243 0.000 8.372) 8.667 4.472 ( 1.106 0.000 5.698) 5.804 5.775 ( -4.692 0.000 14.366) 15.112 5.788 ( -1.558 0.000 -1.433) 2.117 6.205 ( -18.277 0.000 -6.650) 19.449 6.447 ( -12.585 0.000 1.664) 12.695 6.626 ( 3.782 0.000 5.191) 6.423 7.318 ( -14.711 0.000 6.695) 16.163 7.983 ( -0.064 0.000 8.129) 8.129 8.706 ( 1.883 0.000 29.567) 29.627 8.729 ( 3.528 0.000 -15.669) 16.062 8.994 ( -14.972 0.000 5.913) 16.098 9.296 ( -18.711 0.000 -11.753) 22.096 10.403 ( -5.226 0.000 -17.719) 18.473 10.630 ( -0.354 0.000 23.403) 23.406 11.204 ( 4.998 0.000 20.377) 20.981 11.427 ( 8.858 0.000 -7.278) 11.464 12.007 ( -4.580 0.000 -30.963) 31.300 13.677 ( 2.312 0.000 4.777) 5.307 14.344 ( -3.346 0.000 -3.009) 4.500 14.812 ( 3.134 0.000 13.779) 14.131 14.818 ( 11.511 0.000 -16.095) 19.788 17.709 ( 5.298 0.000 -9.441) 10.826 19.044 ( 7.850 0.000 -4.985) 9.299 19.475 ( 17.256 0.000 7.080) 18.652 19.841 ( 22.269 0.000 0.862) 22.286 21.398 ( -13.430 0.000 -23.685) 27.228 22.194 ( 5.292 0.000 23.411) 24.001 23.234 ( -12.402 0.000 0.210) 12.404 23.608 ( -4.508 0.000 -0.195) 4.512 ======================= Grid point 378 (190/260) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.908 ( -11.510 0.000 16.438) 20.067 2.006 ( -10.425 0.000 21.025) 23.468 2.842 ( -3.235 0.000 -10.754) 11.230 2.933 ( -3.183 0.000 -7.953) 8.566 3.601 ( 0.696 0.000 10.100) 10.124 3.669 ( 6.421 0.000 1.635) 6.626 4.379 ( 5.120 0.000 8.131) 9.608 4.484 ( -0.694 0.000 7.022) 7.057 5.683 ( -6.906 0.000 12.540) 14.316 5.787 ( 1.580 0.000 -0.743) 1.746 5.844 ( -15.167 0.000 0.503) 15.175 6.176 ( -12.155 0.000 -5.676) 13.415 6.766 ( 7.870 0.000 6.710) 10.343 7.042 ( -13.591 0.000 12.409) 18.404 7.989 ( -0.680 0.000 8.009) 8.038 8.686 ( -7.525 0.000 -17.490) 19.040 8.727 ( -8.437 0.000 20.066) 21.768 8.892 ( 7.436 0.000 12.928) 14.914 8.986 ( -7.364 0.000 -5.497) 9.189 10.269 ( -4.183 0.000 -26.359) 26.688 10.661 ( -0.926 0.000 25.175) 25.192 11.337 ( 4.736 0.000 12.205) 13.092 11.560 ( 5.005 0.000 -5.710) 7.594 11.887 ( -1.651 0.000 -26.857) 26.908 13.740 ( 3.182 0.000 4.919) 5.859 14.262 ( -3.840 0.000 -6.642) 7.672 14.857 ( -0.804 0.000 10.538) 10.569 15.000 ( 9.238 0.000 -13.989) 16.764 17.890 ( 13.692 0.000 -3.096) 14.038 18.966 ( -16.567 0.000 -12.090) 20.510 19.788 ( 12.560 0.000 3.184) 12.957 20.064 ( 0.158 0.000 -3.024) 3.028 21.497 ( 27.811 0.000 -6.125) 28.477 22.197 ( -11.391 0.000 19.224) 22.346 23.065 ( -2.237 0.000 1.796) 2.869 23.500 ( -6.102 0.000 -2.951) 6.778 ======================= Grid point 379 (191/260) ======================= q-point: ( 0.00 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( -4.778 13.448 17.297) 22.424 2.102 ( 5.887 15.246 13.727) 21.343 2.912 ( 2.401 5.604 -8.996) 10.867 2.960 ( 3.185 5.047 -11.101) 12.604 3.636 ( -1.386 1.915 9.188) 9.488 3.725 ( 0.974 -0.847 1.986) 2.369 4.533 ( 4.113 4.510 7.595) 9.744 4.582 ( 3.223 5.062 7.553) 9.647 5.490 ( -11.793 -0.604 14.422) 18.640 5.695 ( 3.431 -3.230 4.036) 6.205 5.864 ( -2.590 1.973 3.783) 4.991 6.098 ( -0.350 8.108 -11.125) 13.770 6.689 ( -4.748 -9.632 12.873) 16.764 6.970 ( 6.158 -1.316 -0.871) 6.357 8.158 ( -0.602 15.722 14.283) 21.249 8.527 ( -5.288 8.083 -2.285) 9.926 8.752 ( -9.725 10.775 8.481) 16.811 9.006 ( 3.428 6.120 -8.486) 11.010 9.300 ( 13.570 13.330 15.378) 24.461 10.171 ( -2.523 1.123 -17.138) 17.360 10.828 ( -1.186 13.029 10.996) 17.090 11.287 ( 0.701 -8.919 1.655) 9.099 11.605 ( -0.941 1.184 -3.917) 4.199 11.904 ( 4.303 1.879 -19.722) 20.273 13.783 ( 3.661 -3.818 5.669) 7.753 14.142 ( -3.230 -3.244 -9.103) 10.189 14.721 ( -4.266 -8.766 6.890) 11.938 15.041 ( 6.085 -8.651 -12.206) 16.151 17.967 ( 1.250 -19.496 9.251) 21.615 18.371 ( -15.748 -5.316 -11.802) 20.385 19.887 ( 4.143 -6.306 1.611) 7.715 19.972 ( -2.883 -4.179 -2.730) 5.764 21.785 ( -25.095 -1.571 10.262) 27.158 22.082 ( 33.225 -9.887 -4.688) 34.980 23.367 ( 10.358 15.517 -0.113) 18.657 23.446 ( -7.023 7.744 -3.555) 11.042 ======================= Grid point 380 (192/260) ======================= q-point: ( 0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 5.886 7.163 14.790) 17.456 2.334 ( 13.689 16.493 11.206) 24.186 2.973 ( 4.940 2.738 -10.555) 11.971 3.053 ( 7.877 5.171 -12.010) 15.265 3.609 ( -2.713 0.095 6.373) 6.927 3.710 ( -2.500 0.647 0.765) 2.694 4.507 ( -3.459 4.233 2.431) 5.982 4.733 ( 5.315 8.394 4.459) 10.890 5.334 ( -5.087 -0.790 18.839) 19.530 5.760 ( -0.282 -4.374 5.317) 6.891 5.930 ( 10.709 0.059 5.351) 11.971 6.169 ( 7.406 6.581 -7.329) 12.323 6.653 ( 0.225 -9.435 9.213) 13.189 7.116 ( 7.257 -1.149 0.188) 7.350 8.166 ( -1.752 16.544 19.129) 25.351 8.428 ( -2.397 12.323 -6.576) 14.172 8.660 ( -2.696 8.853 12.698) 15.713 9.060 ( 3.919 7.541 -5.783) 10.280 9.660 ( 18.510 8.398 9.902) 22.610 10.102 ( -0.405 0.779 -17.711) 17.733 10.842 ( 0.541 12.265 12.231) 17.330 11.274 ( -1.939 -4.878 -1.338) 5.417 11.513 ( -6.809 2.286 -5.351) 8.957 12.017 ( 9.882 0.458 -19.185) 21.585 13.854 ( 1.954 -5.657 5.327) 8.012 14.075 ( -1.647 -1.853 -9.726) 10.037 14.616 ( -7.276 -8.589 5.095) 12.355 15.110 ( 2.691 -8.801 -10.305) 13.816 17.605 ( -24.345 -10.378 8.746) 27.873 18.515 ( 17.276 -9.232 2.958) 19.810 19.807 ( -9.601 -10.134 -4.460) 14.655 19.916 ( -4.900 -3.471 2.198) 6.395 21.259 ( -26.884 4.188 6.965) 28.086 22.704 ( 28.417 -14.912 -9.550) 33.482 23.267 ( -9.007 7.344 -4.354) 12.410 23.596 ( 11.114 13.646 -2.984) 17.850 ======================= Grid point 381 (193/260) ======================= q-point: ( 0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( 12.148 1.402 11.262) 16.625 2.631 ( 13.168 13.222 11.712) 22.032 3.038 ( 3.234 2.159 -13.593) 14.138 3.222 ( 10.564 2.611 -9.545) 14.475 3.552 ( -3.654 -1.137 0.905) 3.933 3.641 ( -3.850 2.758 -1.987) 5.136 4.419 ( -5.234 1.624 -1.856) 5.786 4.783 ( -0.224 11.043 1.869) 11.202 5.357 ( 2.687 0.281 19.807) 19.990 5.798 ( 3.823 -4.080 9.319) 10.867 6.191 ( 12.944 -0.652 7.853) 15.154 6.310 ( 6.617 3.721 -2.949) 8.144 6.741 ( 7.087 -8.786 2.975) 11.673 7.234 ( 4.054 0.321 2.491) 4.769 8.144 ( -3.668 13.167 18.301) 22.842 8.427 ( 2.117 14.969 -2.601) 15.340 8.663 ( 0.451 10.704 13.960) 17.597 9.175 ( 9.263 6.586 -2.739) 11.692 9.909 ( 4.545 -6.980 -18.589) 20.370 10.207 ( 13.089 6.577 13.333) 19.808 10.890 ( 1.904 13.060 9.662) 16.357 11.205 ( -5.079 3.260 -1.665) 6.261 11.347 ( -7.338 2.285 -7.120) 10.477 12.208 ( 12.688 0.600 -23.399) 26.625 13.861 ( -1.573 -8.024 0.379) 8.186 14.041 ( -1.290 -0.650 -2.771) 3.125 14.459 ( -8.880 -7.601 4.412) 12.494 15.107 ( -1.387 -8.849 -8.725) 12.504 17.266 ( -10.345 -3.310 10.899) 15.387 18.812 ( 8.539 -8.087 3.081) 12.158 19.537 ( -15.310 -13.108 -6.828) 21.280 19.795 ( -6.237 -2.968 4.521) 8.255 20.807 ( -18.696 7.691 9.061) 22.154 23.015 ( -4.369 3.248 -14.950) 15.911 23.221 ( 14.835 -12.186 -2.181) 19.322 23.776 ( 7.464 9.229 -6.299) 13.438 ======================= Grid point 382 (194/260) ======================= q-point: ( 0.30 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 14.065 -1.478 7.445) 15.983 2.864 ( 7.368 3.703 12.931) 15.337 3.054 ( 1.109 1.353 -13.033) 13.149 3.402 ( 6.637 7.460 -4.034) 10.769 3.468 ( -4.402 -2.127 -3.528) 6.029 3.590 ( 1.747 -0.700 -9.001) 9.196 4.309 ( -5.066 0.674 -2.234) 5.577 4.737 ( -4.826 10.600 0.379) 11.653 5.475 ( 5.425 2.225 18.852) 19.742 5.937 ( 7.510 -1.081 10.605) 13.040 6.397 ( 2.231 1.231 2.564) 3.615 6.464 ( 13.236 -0.929 8.745) 15.891 6.902 ( 7.687 -4.751 -3.229) 9.596 7.277 ( -0.445 1.198 4.012) 4.211 8.107 ( -2.390 6.078 15.218) 16.560 8.456 ( 0.310 15.516 3.402) 15.887 8.717 ( 2.067 15.198 16.004) 22.167 9.420 ( 14.603 3.789 -3.037) 15.390 9.941 ( 5.368 -14.475 -22.855) 27.581 10.482 ( 8.024 4.646 27.080) 28.624 10.868 ( -9.118 4.012 12.154) 15.715 11.114 ( 0.556 17.821 -9.368) 20.141 11.248 ( -1.896 6.239 -6.669) 9.327 12.418 ( 12.369 1.038 -29.721) 32.209 13.815 ( -2.262 -7.724 -2.432) 8.408 13.977 ( -5.938 -2.904 5.274) 8.457 14.311 ( -5.748 -5.435 4.211) 8.962 15.024 ( -5.431 -8.586 -7.987) 12.923 17.240 ( 5.579 0.204 8.246) 9.959 18.771 ( -11.440 -2.900 -0.471) 11.811 19.236 ( -13.163 -10.885 -8.728) 19.182 19.695 ( -6.748 4.282 -1.556) 8.142 20.621 ( -0.617 -1.047 22.550) 22.583 22.839 ( -8.183 3.045 -12.485) 15.235 23.506 ( 12.279 -11.921 -7.281) 18.598 23.863 ( 2.577 4.641 -7.571) 9.246 ======================= Grid point 383 (195/260) ======================= q-point: ( 0.40 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.785 ( 8.264 0.510 3.349) 8.932 2.967 ( 3.288 -6.453 5.295) 8.971 3.058 ( 1.601 -1.478 -4.571) 5.064 3.350 ( -6.213 0.873 -2.402) 6.718 3.446 ( -0.431 7.938 -2.455) 8.320 3.703 ( 8.098 -8.375 -10.529) 15.703 4.238 ( -0.786 5.625 0.247) 5.685 4.590 ( -9.774 9.002 -1.151) 13.338 5.626 ( 6.052 4.792 18.568) 20.108 6.086 ( 4.473 2.725 7.930) 9.504 6.425 ( 0.395 0.651 7.607) 7.645 6.751 ( 13.966 -1.430 6.362) 15.413 6.991 ( 1.809 -0.832 -5.852) 6.182 7.231 ( -4.424 1.658 3.320) 5.775 8.116 ( 0.484 0.234 15.005) 15.015 8.451 ( -1.422 11.770 4.399) 12.645 8.798 ( 3.043 18.949 17.554) 26.009 9.653 ( 8.756 -8.109 -11.289) 16.427 10.110 ( 14.737 -5.858 -11.834) 19.787 10.492 ( -13.105 0.854 6.496) 14.651 10.742 ( -2.057 3.624 37.274) 37.506 11.143 ( 1.704 19.317 -11.393) 22.492 11.219 ( -0.294 10.610 -4.797) 11.648 12.556 ( 6.328 1.416 -35.819) 36.401 13.771 ( -4.443 -7.600 7.676) 11.680 13.861 ( -2.130 -4.314 -2.566) 5.452 14.267 ( 0.186 -4.180 7.259) 8.378 14.872 ( -8.022 -7.504 -7.970) 13.571 17.485 ( 16.962 1.640 4.400) 17.600 18.486 ( -15.136 1.325 -2.684) 15.429 18.996 ( -8.658 -5.902 -5.834) 11.993 19.459 ( -14.600 9.461 -8.653) 19.431 20.845 ( 15.323 -8.409 32.170) 36.612 22.654 ( -8.310 -1.561 -16.734) 18.749 23.677 ( 6.432 -7.805 -7.539) 12.615 23.859 ( -1.554 1.486 -6.191) 6.554 ======================= Grid point 384 (196/260) ======================= q-point: (-0.50 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.790 ( -5.997 -0.309 4.965) 7.791 3.016 ( 0.521 -1.771 -7.747) 7.964 3.172 ( 2.234 -3.929 6.689) 8.073 3.222 ( 0.466 -2.089 -3.177) 3.831 3.403 ( -4.045 0.555 0.598) 4.126 3.794 ( 2.523 -9.156 -10.176) 13.919 4.297 ( 3.242 11.530 4.079) 12.653 4.373 ( -8.590 8.243 -1.226) 11.968 5.764 ( 4.154 6.394 18.296) 19.821 6.106 ( -3.153 4.480 2.752) 6.131 6.453 ( 0.050 1.872 13.930) 14.056 6.918 ( -2.486 0.066 -7.478) 7.881 7.039 ( 3.986 -2.916 4.039) 6.380 7.165 ( 2.587 3.134 -0.375) 4.082 8.162 ( 0.676 -2.135 15.918) 16.075 8.421 ( -1.811 6.723 2.739) 7.482 8.890 ( 2.868 20.267 15.936) 25.941 9.749 ( 3.686 -14.135 -14.297) 20.440 10.166 ( -17.623 0.382 1.593) 17.699 10.390 ( 11.190 1.841 -2.190) 11.550 10.790 ( -0.514 7.052 32.615) 33.372 11.108 ( -3.442 11.372 3.113) 12.283 11.229 ( 2.102 14.782 -7.669) 16.785 12.523 ( -2.708 1.288 -37.855) 37.974 13.655 ( -6.225 -6.000 9.476) 12.828 13.950 ( 9.675 -6.483 -6.782) 13.477 14.333 ( 4.471 -4.280 11.428) 12.996 14.696 ( -7.745 -5.889 -8.544) 12.949 17.892 ( 22.557 1.797 1.834) 22.703 18.182 ( -14.132 0.476 -9.537) 17.056 18.895 ( -2.552 5.215 3.849) 6.966 19.187 ( -7.791 3.423 -7.893) 11.606 21.248 ( 18.140 -7.091 32.273) 37.695 22.429 ( -11.144 -7.129 -24.183) 27.565 23.743 ( 1.456 -3.675 -5.432) 6.719 23.790 ( -4.097 0.119 -3.921) 5.672 ======================= Grid point 385 (197/260) ======================= q-point: (-0.40 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.637 ( -9.769 0.977 7.717) 12.487 2.885 ( -13.275 -1.091 3.316) 13.727 3.156 ( 4.323 -2.504 -1.827) 5.319 3.294 ( -6.215 -1.838 2.486) 6.941 3.394 ( 7.759 0.358 -3.120) 8.370 3.748 ( -5.912 -3.028 -12.168) 13.863 4.160 ( -6.023 4.196 3.720) 8.229 4.469 ( 6.672 10.640 6.038) 13.935 5.845 ( 0.587 5.986 17.147) 18.172 6.006 ( -6.275 4.006 0.631) 7.472 6.467 ( -0.815 2.488 15.369) 15.591 6.787 ( -8.140 1.012 -8.680) 11.942 6.954 ( -7.972 0.014 -0.611) 7.996 7.358 ( 9.374 -2.865 -1.339) 9.893 8.156 ( -4.364 2.080 14.286) 15.082 8.427 ( 2.570 1.045 4.685) 5.445 8.958 ( 1.597 19.996 11.276) 23.012 9.687 ( -12.579 -6.101 1.528) 14.063 9.870 ( -8.027 -1.950 -15.624) 17.673 10.455 ( -4.167 0.933 10.234) 11.089 10.885 ( 5.778 11.000 14.452) 19.059 11.061 ( -2.922 5.462 15.597) 16.783 11.260 ( 2.333 15.164 -6.081) 16.503 12.354 ( -6.543 0.424 -36.260) 36.848 13.587 ( -2.054 -5.139 6.497) 8.535 14.166 ( 11.889 -7.643 -4.890) 14.955 14.467 ( 6.072 -5.021 13.092) 15.280 14.558 ( -3.587 -4.990 -10.572) 12.228 17.906 ( -11.050 0.123 -14.326) 18.093 18.352 ( 22.629 0.753 0.584) 22.649 18.839 ( -1.787 -0.228 5.246) 5.547 19.242 ( 12.435 7.651 0.904) 14.628 21.639 ( 14.617 -4.247 28.281) 32.117 22.119 ( -14.672 -10.841 -29.301) 34.516 23.662 ( -7.143 -0.844 -3.037) 7.808 23.750 ( -0.918 0.620 -1.745) 2.067 ======================= Grid point 386 (198/260) ======================= q-point: (-0.30 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( -11.622 3.059 13.044) 17.736 2.602 ( -14.753 3.194 9.551) 17.863 3.162 ( -6.887 -1.446 -0.633) 7.066 3.277 ( 5.478 -1.594 -3.362) 6.622 3.430 ( -5.470 5.915 -1.251) 8.154 3.615 ( -0.338 5.731 -9.590) 11.177 4.131 ( 1.141 -3.961 6.874) 8.015 4.576 ( 2.668 9.430 7.772) 12.508 5.827 ( -4.731 0.802 8.575) 9.827 5.904 ( -3.926 5.058 5.724) 8.589 6.483 ( -1.399 1.321 8.888) 9.093 6.578 ( -10.497 2.440 -3.249) 11.256 6.758 ( -10.843 0.252 -3.532) 11.406 7.412 ( -4.849 -8.587 -1.205) 9.935 8.101 ( -1.697 9.175 11.579) 14.871 8.526 ( 5.389 0.740 9.231) 10.715 8.999 ( 1.155 19.505 6.162) 20.488 9.333 ( -20.230 -0.742 5.417) 20.956 9.688 ( -10.288 1.112 -18.053) 20.808 10.382 ( -4.191 -1.503 13.772) 14.474 10.954 ( -2.311 18.413 2.215) 18.690 11.075 ( 1.981 -0.512 23.467) 23.556 11.323 ( 5.612 8.586 -6.803) 12.308 12.169 ( -5.579 0.175 -32.803) 33.275 13.589 ( 0.981 -4.617 5.107) 6.954 14.331 ( 2.369 -5.740 2.344) 6.637 14.529 ( 6.476 -7.302 -14.637) 17.592 14.635 ( 6.693 -6.055 9.364) 13.006 17.712 ( -5.496 -0.508 -13.473) 14.559 18.751 ( 16.504 -4.383 -0.679) 17.089 18.940 ( 11.615 -7.609 5.870) 15.075 19.583 ( 19.640 11.325 3.327) 22.914 21.637 ( -17.417 -13.517 -23.509) 32.230 22.036 ( 10.106 1.153 19.151) 21.685 23.487 ( -9.735 0.482 -3.535) 10.368 23.717 ( -2.239 2.906 0.935) 3.786 ======================= Grid point 387 (199/260) ======================= q-point: (-0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( -12.344 6.196 15.318) 20.625 2.367 ( -11.716 10.520 16.318) 22.676 3.022 ( -6.476 0.777 -5.129) 8.297 3.147 ( -10.201 7.784 -8.553) 15.421 3.503 ( 8.378 0.552 2.305) 8.707 3.632 ( 0.842 5.943 1.147) 6.111 4.206 ( 4.937 -3.967 7.692) 9.964 4.607 ( -0.712 8.040 8.556) 11.763 5.736 ( -5.063 -3.432 4.387) 7.527 5.837 ( -4.225 3.869 6.158) 8.410 6.241 ( -16.769 2.948 -4.979) 17.740 6.466 ( -10.038 2.242 0.433) 10.295 6.625 ( 1.352 0.137 4.455) 4.658 7.209 ( -13.409 -9.116 4.715) 16.886 8.120 ( 0.615 12.299 9.040) 15.277 8.649 ( 4.179 2.923 9.391) 10.687 8.977 ( -12.131 2.202 3.328) 12.770 9.041 ( 0.450 17.270 3.895) 17.710 9.391 ( -16.551 7.495 -7.593) 19.692 10.325 ( -3.621 -2.151 4.173) 5.929 10.890 ( -3.157 17.232 2.075) 17.641 11.163 ( 2.735 -2.791 17.859) 18.282 11.445 ( 7.118 2.559 -6.151) 9.749 12.022 ( -3.789 1.410 -28.127) 28.416 13.635 ( 2.512 -4.219 4.814) 6.877 14.304 ( -3.114 -3.832 -1.934) 5.303 14.680 ( 7.197 -9.616 -2.337) 12.236 14.774 ( 6.962 -6.642 -1.652) 9.763 17.658 ( 2.220 -4.437 -8.210) 9.593 18.976 ( 4.924 -9.445 -6.051) 12.250 19.276 ( 19.609 -10.092 5.487) 22.726 19.944 ( 13.370 4.252 -1.471) 14.107 21.294 ( -7.519 -6.849 -16.984) 19.796 22.236 ( 3.997 2.001 21.547) 22.006 23.287 ( -8.425 4.488 -3.901) 10.312 23.663 ( -3.514 4.832 0.942) 6.049 ======================= Grid point 388 (200/260) ======================= q-point: (-0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( -5.593 12.890 14.442) 20.150 2.160 ( -12.113 13.296 19.837) 26.777 2.917 ( -1.839 5.907 -9.539) 11.370 2.987 ( -4.176 5.155 -7.705) 10.167 3.632 ( 1.156 2.622 6.218) 6.847 3.662 ( 3.972 0.881 4.017) 5.717 4.351 ( 8.216 -0.144 8.420) 11.765 4.593 ( -1.912 6.681 8.799) 11.213 5.643 ( -5.320 -4.238 8.325) 10.750 5.747 ( -6.743 -0.327 2.820) 7.316 5.948 ( -9.353 5.697 2.055) 11.142 6.238 ( -10.211 6.090 -9.370) 15.138 6.701 ( 2.768 -5.297 9.264) 11.025 6.979 ( -8.639 -5.300 5.300) 11.437 8.141 ( 0.017 14.090 10.111) 17.342 8.632 ( -5.693 1.890 3.238) 6.817 8.913 ( 3.555 6.545 -2.975) 8.020 9.030 ( -14.043 13.034 7.876) 20.715 9.112 ( 2.164 14.269 4.941) 15.254 10.251 ( -3.213 -0.570 -8.674) 9.268 10.846 ( -2.126 15.255 6.828) 16.848 11.242 ( 2.677 -7.722 8.532) 11.815 11.562 ( 5.100 0.275 -3.938) 6.450 11.922 ( -1.506 2.865 -23.583) 23.804 13.702 ( 3.340 -3.781 5.091) 7.167 14.227 ( -3.772 -3.535 -5.957) 7.888 14.754 ( -0.095 -8.999 8.335) 12.266 14.918 ( 8.335 -8.066 -12.814) 17.284 17.772 ( 9.713 -10.511 -0.644) 14.326 18.837 ( -17.719 -12.364 -13.784) 25.629 19.665 ( 16.697 -9.003 2.768) 19.170 20.031 ( -1.670 -3.520 -3.894) 5.508 21.456 ( 24.375 -2.121 -2.732) 24.620 22.187 ( -13.487 -1.772 15.944) 20.958 23.215 ( 2.969 12.226 -1.485) 12.669 23.576 ( -5.315 6.592 -1.054) 8.533 ======================= Grid point 389 (201/260) ======================= q-point: ( 0.00 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( -7.125 16.439 16.311) 24.229 2.478 ( 6.431 18.312 11.356) 22.487 3.034 ( -0.945 5.032 -6.142) 7.996 3.078 ( 3.878 5.221 -9.504) 11.516 3.694 ( -1.595 3.284 5.890) 6.930 3.815 ( 0.110 11.072 4.392) 11.912 4.621 ( 7.085 3.016 8.942) 11.801 4.684 ( 3.783 3.942 8.509) 10.112 5.450 ( -8.334 -3.329 10.482) 13.799 5.633 ( -1.447 -3.018 2.570) 4.220 5.890 ( -4.449 0.947 5.975) 7.510 6.265 ( -1.669 4.824 -2.381) 5.633 6.562 ( -2.579 0.055 0.128) 2.582 6.897 ( 6.000 -4.751 -8.468) 11.414 8.568 ( -0.063 20.236 15.200) 25.309 8.791 ( 0.581 16.677 3.075) 16.968 8.968 ( -9.417 10.464 9.017) 16.718 9.214 ( 4.926 12.922 -4.946) 14.687 9.701 ( 8.814 22.839 15.033) 28.728 10.188 ( -5.149 0.765 -1.019) 5.304 11.046 ( -3.432 -4.581 2.419) 6.214 11.168 ( 6.365 5.794 -7.652) 11.517 11.642 ( -1.750 5.693 -2.823) 6.591 11.969 ( 2.987 4.441 -16.618) 17.458 13.652 ( 3.111 -8.858 6.451) 11.391 14.010 ( -3.484 -10.133 -6.211) 12.385 14.510 ( -3.189 -9.558 1.419) 10.176 14.772 ( 5.665 -16.481 -11.240) 20.738 17.514 ( -4.102 -21.651 14.083) 26.152 18.166 ( -7.419 -13.045 -19.396) 24.524 19.738 ( 4.565 -7.054 1.698) 8.572 19.864 ( -3.515 -5.486 -4.788) 8.086 21.757 ( -19.380 -0.995 6.895) 20.594 21.904 ( 23.414 -6.514 -0.827) 24.317 23.631 ( -6.228 8.942 -0.528) 10.910 23.675 ( 9.341 12.352 -3.143) 15.803 ======================= Grid point 390 (202/260) ======================= q-point: ( 0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.278 ( 0.597 14.481 13.759) 19.984 2.665 ( 9.028 13.629 12.897) 20.823 3.044 ( 2.694 2.959 -6.071) 7.271 3.154 ( 5.179 3.884 -11.978) 13.615 3.650 ( -3.411 3.458 6.164) 7.848 3.816 ( -0.810 11.022 0.848) 11.084 4.606 ( -4.332 4.374 2.360) 6.593 4.903 ( 9.496 6.473 3.657) 12.060 5.306 ( -4.432 -2.093 16.798) 17.499 5.638 ( -1.256 -6.839 4.097) 8.071 5.936 ( 8.459 0.779 9.219) 12.536 6.292 ( 3.456 3.073 1.143) 4.764 6.548 ( 2.323 1.394 -3.094) 4.112 7.039 ( 8.717 -5.485 -7.638) 12.823 8.553 ( -4.324 17.661 14.780) 23.432 8.744 ( -0.897 12.947 -0.155) 12.979 8.936 ( 0.719 21.180 11.583) 24.151 9.304 ( 3.900 14.960 -2.069) 15.598 9.907 ( 3.529 12.830 2.139) 13.478 10.116 ( 3.487 1.891 8.151) 9.065 11.018 ( 1.179 0.291 2.839) 3.088 11.304 ( 7.657 7.435 -9.484) 14.277 11.543 ( -7.106 3.271 -3.830) 8.710 12.068 ( 9.477 5.261 -16.133) 19.436 13.691 ( -0.558 -9.651 4.968) 10.869 13.953 ( -1.201 -10.930 -4.912) 12.043 14.423 ( -5.419 -7.869 -0.861) 9.593 14.837 ( 2.539 -16.738 -9.484) 19.405 17.332 ( -12.886 -14.402 12.590) 23.065 18.238 ( 13.784 -15.928 -6.324) 21.993 19.611 ( -12.849 -7.286 -4.512) 15.444 19.818 ( -4.126 -5.559 0.844) 6.974 21.354 ( -20.137 4.423 4.923) 21.196 22.406 ( 25.159 -12.572 -3.500) 28.342 23.450 ( -10.830 8.946 -2.488) 14.265 23.842 ( 6.952 9.212 -4.430) 12.361 ======================= Grid point 391 (203/260) ======================= q-point: ( 0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 6.912 10.123 11.358) 16.711 2.836 ( 5.010 6.388 13.693) 15.919 3.093 ( 2.506 2.158 -7.771) 8.445 3.231 ( 4.833 -1.431 -12.114) 13.121 3.590 ( -3.546 3.155 4.439) 6.499 3.784 ( -2.193 11.913 -3.834) 12.706 4.480 ( -6.831 3.551 -4.128) 8.735 5.011 ( 0.770 9.198 1.643) 9.375 5.353 ( 4.574 -1.198 15.294) 16.008 5.686 ( 6.560 -5.432 13.364) 15.847 6.179 ( 12.704 -0.447 9.246) 15.719 6.369 ( 3.161 1.283 5.014) 6.064 6.664 ( 9.927 2.456 -5.995) 11.854 7.185 ( 6.545 -4.475 -5.382) 9.583 8.433 ( -8.956 14.118 9.524) 19.241 8.857 ( 10.139 17.118 4.155) 20.324 8.959 ( -0.557 21.286 10.725) 23.842 9.376 ( 4.681 13.111 1.547) 14.007 9.777 ( -8.980 -5.765 -10.665) 15.087 10.379 ( 12.803 9.822 22.110) 27.373 11.070 ( -0.327 4.459 5.496) 7.085 11.369 ( -1.488 1.374 -6.675) 6.975 11.454 ( 4.609 16.178 -11.945) 20.632 12.265 ( 12.850 5.788 -18.709) 23.423 13.659 ( -2.572 -11.070 1.263) 11.435 13.917 ( -3.101 -11.775 1.181) 12.233 14.304 ( -5.767 -5.596 -2.601) 8.446 14.835 ( -1.168 -16.545 -7.879) 18.363 17.177 ( -3.410 -4.732 11.231) 12.656 18.534 ( 13.188 -17.361 -1.375) 21.846 19.326 ( -13.094 -5.950 -6.321) 15.710 19.690 ( -7.169 -6.280 4.983) 10.754 20.983 ( -18.216 8.405 5.397) 20.775 22.852 ( 19.737 -13.804 -8.879) 25.670 23.210 ( -11.964 5.871 -1.900) 13.462 23.928 ( 2.644 5.250 -5.820) 8.272 ======================= Grid point 392 (204/260) ======================= q-point: ( 0.30 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.575 ( 10.553 5.253 8.935) 14.792 2.902 ( -0.424 1.247 11.549) 11.624 3.088 ( -1.268 1.757 -9.769) 10.007 3.311 ( 4.691 -8.298 -8.943) 13.071 3.526 ( -3.027 1.114 0.686) 3.298 3.698 ( -5.998 7.538 -7.446) 12.175 4.386 ( -0.919 6.917 -3.657) 7.878 4.940 ( -7.084 6.962 1.100) 9.993 5.531 ( 9.809 3.058 16.995) 19.859 5.910 ( 11.901 -0.864 12.728) 17.446 6.426 ( 1.697 1.911 8.949) 9.307 6.453 ( 13.090 -0.223 7.146) 14.916 6.873 ( 10.446 2.253 -6.732) 12.630 7.266 ( 2.237 -2.186 -2.982) 4.321 8.275 ( -7.611 10.040 7.488) 14.656 8.893 ( -4.743 23.445 6.608) 24.816 9.100 ( 7.303 18.193 9.516) 21.792 9.471 ( 0.904 -1.487 -2.818) 3.312 9.709 ( 10.373 -3.154 -5.373) 12.100 10.607 ( 5.117 6.935 21.077) 22.771 10.917 ( -12.678 1.746 10.981) 16.863 11.429 ( 5.294 10.572 -1.095) 11.874 11.542 ( 5.599 19.854 -17.853) 27.281 12.486 ( 12.300 6.233 -23.739) 27.453 13.611 ( -2.177 -11.322 0.282) 11.533 13.814 ( -7.493 -12.433 4.294) 15.138 14.204 ( -3.637 -4.271 -0.792) 5.665 14.766 ( -4.264 -15.380 -6.821) 17.357 17.251 ( 8.887 0.943 8.515) 12.344 18.655 ( -0.403 -8.096 -2.896) 8.608 19.070 ( -12.573 -4.295 -8.074) 15.547 19.666 ( 3.784 -6.521 7.224) 10.442 20.666 ( -13.484 5.479 11.820) 18.750 22.885 ( -12.168 0.217 -16.701) 20.665 23.246 ( 13.759 -11.812 0.939) 18.158 23.933 ( -0.881 2.231 -6.156) 6.607 ======================= Grid point 393 (205/260) ======================= q-point: ( 0.40 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.815 ( 11.692 0.711 5.908) 13.119 2.874 ( -3.776 -0.550 7.938) 8.807 3.036 ( -1.542 -0.836 -7.685) 7.883 3.325 ( -3.919 -3.785 -4.645) 7.160 3.501 ( -0.423 -6.137 -7.276) 9.528 3.543 ( -4.810 -2.335 -5.512) 7.679 4.428 ( 4.649 11.349 0.145) 12.265 4.770 ( -9.793 6.881 1.600) 12.075 5.760 ( 9.270 7.539 17.874) 21.500 6.147 ( 8.414 2.676 9.483) 12.957 6.463 ( 1.178 3.459 8.682) 9.419 6.735 ( 13.546 -0.060 6.863) 15.185 6.993 ( 2.019 1.150 -6.663) 7.056 7.265 ( -1.569 1.321 -2.237) 3.035 8.181 ( -3.145 6.198 8.283) 10.813 8.781 ( -6.692 16.841 -0.717) 18.136 9.175 ( 0.951 8.870 8.311) 12.193 9.497 ( 3.320 2.250 3.065) 5.048 10.069 ( 21.323 0.910 -3.394) 21.611 10.502 ( -15.351 -0.046 0.616) 15.363 10.856 ( 1.560 7.685 33.505) 34.411 11.472 ( -2.200 13.275 2.471) 13.681 11.601 ( 4.043 21.520 -17.480) 28.018 12.628 ( 5.587 6.063 -29.383) 30.518 13.565 ( -4.310 -11.361 6.638) 13.846 13.690 ( -2.209 -11.962 -2.976) 12.523 14.171 ( 0.181 -4.540 4.806) 6.614 14.652 ( -5.880 -13.002 -6.149) 15.538 17.536 ( 17.854 3.198 4.827) 18.770 18.521 ( -13.639 1.822 -4.486) 14.473 18.896 ( 0.499 -3.284 -4.224) 5.374 19.641 ( -11.114 6.509 -5.779) 14.117 20.644 ( 10.112 -8.924 27.976) 31.057 22.579 ( -15.006 -5.844 -20.187) 25.823 23.488 ( 10.206 -9.500 -1.428) 14.016 23.880 ( -3.177 0.752 -5.633) 6.511 ======================= Grid point 394 (206/260) ======================= q-point: (-0.50 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.790 ( -5.786 0.238 6.091) 8.404 2.969 ( 0.781 -2.451 -3.290) 4.176 3.080 ( 4.783 -3.982 4.891) 7.915 3.176 ( -4.111 -2.701 -5.075) 7.068 3.387 ( -5.183 -1.958 -3.818) 6.728 3.589 ( 4.703 -9.966 -8.761) 14.078 4.539 ( 3.782 10.642 4.314) 12.090 4.570 ( -8.766 9.373 1.814) 12.961 5.938 ( 4.968 9.427 17.390) 20.396 6.220 ( -2.287 5.722 4.336) 7.534 6.518 ( 1.896 4.596 12.478) 13.432 6.943 ( -2.639 2.224 -8.688) 9.348 6.979 ( 5.482 -2.510 5.816) 8.377 7.223 ( -0.340 2.099 -4.250) 4.752 8.168 ( -0.183 3.297 10.871) 11.361 8.651 ( -4.994 11.957 -5.782) 14.189 9.235 ( 3.442 5.462 10.595) 12.407 9.572 ( 2.715 4.583 2.699) 5.972 10.167 ( -16.277 0.110 1.923) 16.391 10.439 ( 13.007 2.615 -0.757) 13.289 10.948 ( 1.834 9.168 26.761) 28.347 11.361 ( -8.035 12.357 5.240) 15.644 11.662 ( 4.419 23.247 -10.087) 25.723 12.580 ( -4.618 4.537 -31.285) 31.948 13.464 ( -5.378 -11.697 7.969) 15.141 13.762 ( 8.861 -11.294 -7.649) 16.266 14.222 ( 3.390 -5.824 9.211) 11.412 14.521 ( -5.913 -10.306 -6.110) 13.360 17.944 ( 21.657 3.020 2.451) 22.003 18.190 ( -15.732 0.249 -9.138) 18.195 19.037 ( 9.307 7.812 3.593) 12.672 19.298 ( -16.143 7.036 -7.721) 19.228 21.048 ( 21.724 -11.221 31.060) 39.530 22.216 ( -17.452 -12.774 -26.240) 34.004 23.643 ( 5.467 -5.379 -0.484) 7.684 23.792 ( -4.449 0.052 -5.754) 7.274 ======================= Grid point 395 (207/260) ======================= q-point: (-0.40 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.672 ( -7.034 2.295 7.080) 10.240 2.849 ( -10.792 -1.899 5.639) 12.324 3.094 ( 4.360 -3.271 -2.976) 6.210 3.254 ( -2.329 -1.781 0.653) 3.004 3.360 ( 7.894 -3.681 -4.579) 9.840 3.661 ( 4.098 -4.250 -8.240) 10.137 4.354 ( -10.542 11.698 3.806) 16.201 4.657 ( 4.230 7.135 6.717) 10.673 5.987 ( -4.196 6.229 12.567) 14.640 6.128 ( -5.318 7.826 4.074) 10.302 6.554 ( -0.415 5.469 12.780) 13.907 6.819 ( -7.395 1.526 -8.435) 11.321 6.953 ( -7.342 0.227 1.216) 7.446 7.273 ( 2.509 -4.481 -5.216) 7.320 8.213 ( 2.866 3.926 13.823) 14.653 8.594 ( 0.795 12.097 -4.361) 12.883 9.324 ( 3.027 9.214 9.928) 13.880 9.572 ( -5.062 1.105 2.493) 5.750 9.870 ( -12.292 1.174 -1.152) 12.402 10.552 ( -1.751 7.099 8.667) 11.339 11.041 ( 3.964 7.420 12.568) 15.124 11.234 ( -5.268 9.977 8.817) 14.319 11.723 ( 2.059 25.218 -2.935) 25.472 12.381 ( -8.535 2.628 -30.225) 31.516 13.408 ( -1.470 -11.979 6.396) 13.659 13.963 ( 11.725 -11.100 -7.863) 17.958 14.323 ( 4.456 -9.218 10.459) 14.636 14.408 ( -3.736 -7.981 -7.477) 11.557 17.909 ( -10.526 0.085 -12.337) 16.217 18.358 ( 17.211 -0.419 2.869) 17.454 18.888 ( -10.524 5.151 -3.457) 12.216 19.425 ( 17.603 9.052 4.480) 20.295 21.516 ( 15.848 -7.139 24.243) 29.830 21.823 ( -13.570 -16.284 -24.438) 32.350 23.641 ( -5.972 -1.021 -4.556) 7.581 23.752 ( 2.002 -0.589 -1.481) 2.559 ======================= Grid point 396 (208/260) ======================= q-point: (-0.30 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.541 ( -7.575 6.134 11.269) 14.899 2.675 ( -7.466 3.550 10.102) 13.053 3.116 ( -3.403 -3.077 -1.551) 4.843 3.270 ( 5.828 1.557 -6.094) 8.575 3.489 ( 3.807 -1.382 -0.040) 4.051 3.735 ( 4.771 4.727 -5.820) 8.887 4.187 ( -6.082 8.862 6.447) 12.534 4.725 ( 1.003 4.461 9.210) 10.283 5.826 ( -10.711 -0.577 2.616) 11.041 6.052 ( -5.004 8.417 8.612) 13.040 6.548 ( -4.072 3.468 4.564) 7.032 6.621 ( -10.065 1.486 1.498) 10.284 6.778 ( -8.379 2.185 -4.056) 9.562 7.213 ( -7.484 -8.774 -4.335) 12.320 8.326 ( 5.399 10.618 12.287) 17.113 8.672 ( 6.669 12.292 2.747) 14.251 9.300 ( -15.419 -1.565 6.353) 16.749 9.414 ( 0.220 17.361 3.738) 17.760 9.713 ( -5.389 1.689 -4.875) 7.460 10.480 ( -6.232 9.798 15.502) 19.369 11.086 ( -3.134 3.167 14.075) 14.763 11.204 ( 1.839 6.493 -0.394) 6.760 11.711 ( -2.711 25.296 -2.082) 25.526 12.184 ( -5.493 1.614 -26.977) 27.578 13.423 ( 1.575 -11.646 5.782) 13.097 14.158 ( 6.719 -9.863 -0.166) 11.935 14.343 ( 1.785 -12.009 -14.900) 19.220 14.449 ( 4.941 -9.397 8.685) 13.717 17.708 ( -8.049 0.414 -12.133) 14.566 18.529 ( 3.149 -13.112 2.488) 13.713 18.941 ( 13.163 4.642 -2.008) 14.101 19.768 ( 14.377 5.370 1.263) 15.399 21.357 ( -13.886 -11.807 -21.250) 27.996 22.008 ( 15.170 -3.300 23.083) 27.818 23.491 ( -6.912 -0.032 -7.978) 10.556 23.782 ( 0.694 2.717 1.165) 3.036 ======================= Grid point 397 (209/260) ======================= q-point: (-0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -5.172 12.884 12.450) 18.648 2.575 ( -5.741 8.416 15.368) 18.439 3.047 ( -2.072 1.233 -4.720) 5.300 3.283 ( -4.953 3.685 -9.058) 10.961 3.570 ( 5.194 6.215 4.107) 9.081 3.802 ( 1.877 9.362 -0.111) 9.549 4.185 ( 4.887 2.151 8.551) 10.081 4.731 ( -1.999 3.247 10.897) 11.545 5.634 ( -7.979 -5.511 -0.726) 9.725 5.940 ( -7.590 5.580 7.254) 11.889 6.283 ( -16.043 0.390 0.954) 16.076 6.539 ( -5.343 2.556 4.090) 7.198 6.652 ( -3.114 3.806 -3.917) 6.287 7.013 ( -10.098 -7.846 -3.074) 13.152 8.441 ( 3.744 16.409 11.225) 20.231 8.798 ( 1.110 9.874 5.868) 11.539 9.035 ( -5.338 5.280 4.404) 8.705 9.460 ( 1.653 18.799 2.190) 18.998 9.555 ( -10.346 7.496 1.943) 12.923 10.377 ( -6.446 7.467 13.212) 16.489 11.032 ( -2.568 -1.710 7.531) 8.139 11.231 ( -0.479 4.985 -0.129) 5.010 11.647 ( -1.650 18.793 -6.664) 20.008 12.067 ( -2.588 3.059 -20.847) 21.228 13.482 ( 3.255 -10.732 5.549) 12.512 14.176 ( -2.980 -8.494 1.644) 9.150 14.444 ( 8.293 -12.788 -14.214) 20.841 14.554 ( 4.513 -12.674 3.648) 13.939 17.553 ( -5.201 -4.646 -5.650) 8.976 18.617 ( 2.978 -20.899 -6.825) 22.186 19.204 ( 13.132 0.909 -0.231) 13.166 19.934 ( 2.720 -5.060 -6.532) 8.698 21.211 ( 3.841 -0.407 -7.876) 8.772 22.235 ( 1.883 -1.939 19.704) 19.889 23.389 ( -0.392 4.513 -8.173) 9.344 23.782 ( -1.082 5.716 1.879) 6.113 ======================= Grid point 398 (210/260) ======================= q-point: (-0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -0.272 17.971 11.893) 21.552 2.464 ( -8.667 13.599 17.198) 23.576 3.031 ( 1.461 4.343 -7.319) 8.635 3.129 ( -6.607 6.757 -7.297) 11.940 3.668 ( 3.211 3.994 4.508) 6.825 3.814 ( -0.650 11.512 4.658) 12.436 4.375 ( 11.373 1.590 9.709) 15.038 4.698 ( -2.807 2.785 10.884) 11.581 5.522 ( -3.303 -6.605 0.694) 7.417 5.775 ( -10.184 2.192 7.557) 12.870 6.024 ( -9.850 1.421 4.070) 10.752 6.383 ( -8.609 3.984 -3.889) 10.252 6.612 ( -2.032 0.134 2.063) 2.899 6.869 ( -2.513 -4.408 -6.436) 8.195 8.516 ( 2.041 18.786 13.043) 22.961 8.759 ( -0.692 10.230 3.761) 10.922 9.096 ( 4.039 11.301 3.928) 12.628 9.264 ( -14.906 11.011 3.348) 18.832 9.550 ( 4.306 21.875 9.713) 24.319 10.281 ( -4.878 4.371 5.168) 8.343 11.038 ( 2.230 -7.218 2.300) 7.897 11.175 ( -4.100 7.626 -2.662) 9.058 11.640 ( 1.466 10.664 -5.429) 12.056 11.993 ( -1.424 3.883 -17.503) 17.985 13.566 ( 4.027 -9.592 5.784) 11.903 14.099 ( -4.250 -9.136 -3.025) 10.520 14.533 ( 1.221 -10.609 0.333) 10.684 14.661 ( 6.952 -15.769 -9.898) 19.873 17.503 ( 0.158 -13.585 3.934) 14.144 18.478 ( -14.195 -20.063 -18.848) 30.972 19.502 ( 15.856 -5.806 1.443) 16.947 19.926 ( -1.225 -5.912 -5.130) 7.923 21.448 ( 18.675 1.247 0.096) 18.717 22.124 ( -14.713 -3.704 11.376) 18.964 23.474 ( 9.059 10.765 -4.203) 14.684 23.740 ( -3.603 8.087 1.147) 8.927 ======================= Grid point 399 (211/260) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( -5.001 12.487 14.153) 19.526 2.818 ( 2.048 13.734 10.635) 17.490 3.083 ( -0.829 -0.404 -4.360) 4.456 3.178 ( 1.508 4.248 -5.065) 6.780 3.804 ( -3.799 6.491 11.237) 13.522 4.131 ( 1.816 17.096 -0.135) 17.193 4.651 ( 7.282 0.179 10.909) 13.118 4.736 ( 6.775 0.941 8.403) 10.834 5.366 ( -3.942 -4.097 1.858) 5.982 5.533 ( -8.378 -6.640 -2.204) 10.915 5.926 ( -3.196 2.363 15.557) 16.057 6.282 ( -1.935 -0.951 7.102) 7.423 6.670 ( -1.283 6.810 -15.401) 16.888 6.798 ( 4.537 -4.124 -12.168) 13.626 8.933 ( -4.417 12.895 11.725) 17.979 9.056 ( -1.090 10.476 5.236) 11.762 9.323 ( 4.841 18.454 14.422) 23.917 9.529 ( 3.374 18.206 0.698) 18.529 10.017 ( 6.603 0.101 15.763) 17.090 10.333 ( -8.538 17.155 -1.589) 19.228 10.903 ( 1.454 -5.328 5.706) 7.941 11.171 ( 3.370 -6.027 -6.599) 9.551 11.897 ( -6.903 14.514 -3.671) 16.486 12.120 ( 6.009 10.918 -14.544) 19.153 13.411 ( 4.420 -13.545 5.163) 15.155 13.715 ( -5.035 -17.097 -5.694) 18.711 14.356 ( -0.037 -6.331 -8.154) 10.323 14.405 ( 3.696 -15.496 -6.188) 17.091 17.119 ( -6.171 -15.065 14.117) 21.548 17.884 ( -3.426 -12.394 -24.805) 27.940 19.612 ( 5.859 -4.766 1.552) 7.711 19.760 ( -4.838 -4.106 -6.302) 8.943 21.741 ( -15.917 -0.556 4.732) 16.615 21.809 ( 17.011 -2.771 0.938) 17.261 23.795 ( -5.035 6.349 0.892) 8.153 23.866 ( 7.278 5.925 -2.909) 9.826 ======================= Grid point 400 (212/260) ======================= q-point: ( 0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.583 ( -1.713 13.407 12.245) 18.238 2.885 ( 2.073 7.469 12.484) 14.695 3.066 ( 0.264 -0.966 -3.202) 3.355 3.229 ( 3.138 3.528 -6.295) 7.869 3.733 ( -5.196 3.910 11.429) 13.149 4.150 ( 0.001 18.797 -4.246) 19.271 4.666 ( -4.437 1.127 3.752) 5.919 4.984 ( 11.779 1.430 1.347) 11.941 5.237 ( -3.169 -4.825 8.585) 10.345 5.500 ( 0.378 -5.394 5.564) 7.759 5.970 ( 5.472 2.241 16.100) 17.152 6.307 ( 2.730 -0.233 6.478) 7.034 6.663 ( 3.907 6.829 -14.445) 16.449 6.916 ( 8.734 -5.499 -11.767) 15.652 8.829 ( -1.810 6.212 6.018) 8.836 8.984 ( -8.273 14.403 10.154) 19.468 9.484 ( 4.178 23.908 12.499) 27.300 9.643 ( 6.041 18.154 1.045) 19.161 9.967 ( -13.078 -4.264 0.553) 13.767 10.351 ( 10.288 15.765 11.433) 22.025 10.990 ( 7.946 -1.126 4.541) 9.221 11.281 ( 5.673 -7.345 -7.276) 11.793 11.770 ( -3.419 14.371 -4.597) 15.471 12.256 ( 9.758 11.654 -12.731) 19.827 13.461 ( -0.771 -11.703 2.632) 12.020 13.635 ( -1.561 -17.433 -3.959) 17.945 14.305 ( -3.069 -4.118 -8.563) 9.985 14.453 ( 1.817 -17.960 -6.396) 19.152 17.049 ( -2.944 -11.541 14.812) 19.007 17.913 ( 9.836 -13.568 -15.259) 22.665 19.511 ( -12.219 -2.540 -4.522) 13.274 19.698 ( -3.513 -5.483 -0.189) 6.514 21.434 ( -15.112 3.019 3.868) 15.888 22.192 ( 20.302 -7.752 -0.144) 21.732 23.612 ( -12.220 6.129 -1.475) 13.750 23.980 ( 3.670 4.198 -3.225) 6.442 ======================= Grid point 401 (213/260) ======================= q-point: ( 0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( 2.685 11.086 9.614) 14.918 2.929 ( 0.186 3.044 12.029) 12.409 3.084 ( 2.054 -2.938 -3.664) 5.126 3.240 ( -1.372 2.688 -6.747) 7.391 3.635 ( -6.531 1.098 9.017) 11.187 4.069 ( -8.743 12.392 -8.424) 17.348 4.556 ( -3.008 4.152 -2.966) 5.923 5.115 ( -2.236 -0.888 -4.222) 4.860 5.307 ( 10.614 -1.365 10.813) 15.214 5.623 ( 10.489 -0.481 20.044) 22.628 6.177 ( 11.743 0.357 12.107) 16.870 6.393 ( 4.290 1.476 6.857) 8.222 6.780 ( 9.884 6.708 -13.019) 17.669 7.073 ( 8.352 -5.554 -10.190) 14.297 8.731 ( -12.103 13.553 9.706) 20.601 9.019 ( 13.816 2.998 0.554) 14.148 9.489 ( -5.027 20.412 11.203) 23.821 9.602 ( -14.495 -1.391 -4.972) 15.387 9.797 ( 2.178 18.267 7.885) 20.015 10.595 ( 9.748 9.388 15.041) 20.233 11.134 ( -3.618 0.912 2.862) 4.702 11.365 ( 11.814 -0.136 -4.303) 12.574 11.803 ( 6.737 15.988 -8.009) 19.109 12.452 ( 11.904 10.150 -11.768) 19.576 13.412 ( -2.867 -11.850 -3.358) 12.646 13.609 ( -2.279 -14.932 2.262) 15.274 14.212 ( -4.455 -3.986 -8.459) 10.358 14.453 ( -0.666 -18.363 -5.902) 19.300 17.085 ( 4.605 -3.698 12.647) 13.958 18.170 ( 16.283 -15.404 -7.903) 23.767 19.266 ( -10.130 -0.550 -3.577) 10.757 19.554 ( -9.704 -6.274 2.657) 11.857 21.140 ( -15.658 6.202 3.646) 17.232 22.588 ( 19.067 -10.573 -2.776) 21.978 23.317 ( -16.572 3.866 -3.436) 17.360 24.004 ( -0.322 2.252 -4.020) 4.619 ======================= Grid point 402 (214/260) ======================= q-point: ( 0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.709 ( 4.939 6.703 6.651) 10.656 2.938 ( -1.113 1.958 9.692) 9.951 3.127 ( 1.859 -1.813 -3.276) 4.180 3.157 ( -4.017 -1.898 -8.167) 9.297 3.512 ( -6.781 -2.308 3.907) 8.159 3.786 ( -15.977 1.105 -10.959) 19.406 4.573 ( 3.695 9.695 -0.750) 10.402 4.991 ( -7.089 -1.791 -1.219) 7.412 5.615 ( 15.599 5.027 14.962) 22.191 5.911 ( 13.943 0.437 15.342) 20.736 6.448 ( 13.000 -0.246 7.977) 15.254 6.491 ( 4.285 4.067 8.531) 10.376 6.962 ( 8.634 4.882 -10.526) 14.463 7.203 ( 6.524 -3.205 -8.359) 11.077 8.504 ( -11.013 10.801 6.925) 16.909 9.203 ( -11.221 -7.106 -7.867) 15.437 9.344 ( -5.128 16.846 7.203) 19.025 9.497 ( 15.060 5.321 5.153) 16.783 9.899 ( 5.566 18.400 8.887) 21.178 10.724 ( -2.751 2.258 2.231) 4.201 10.974 ( -5.459 4.494 18.012) 19.350 11.632 ( 10.443 7.950 -0.611) 13.139 11.932 ( 6.935 17.805 -10.736) 21.918 12.668 ( 11.305 8.931 -12.753) 19.241 13.355 ( -2.087 -12.781 -6.016) 14.280 13.528 ( -6.413 -12.061 4.380) 14.345 14.116 ( -3.446 -4.352 -4.936) 7.428 14.413 ( -2.091 -17.036 -5.379) 17.987 17.280 ( 12.862 1.657 8.947) 15.755 18.467 ( 13.926 -8.686 -5.980) 17.468 19.039 ( -14.876 0.605 -4.224) 15.476 19.484 ( 5.645 -9.288 9.496) 14.433 20.812 ( -17.846 7.269 5.058) 19.922 22.810 ( -6.771 -6.981 -20.215) 22.432 23.067 ( 3.167 -4.606 8.564) 10.227 23.966 ( -2.490 1.066 -4.803) 5.514 ======================= Grid point 403 (215/260) ======================= q-point: ( 0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.806 ( 2.479 0.387 5.055) 5.643 2.931 ( -0.243 2.856 4.453) 5.295 3.032 ( -4.185 0.647 -4.662) 6.298 3.197 ( 2.643 -6.666 -4.311) 8.367 3.378 ( -6.752 -4.656 -6.703) 10.592 3.476 ( -11.054 -4.403 -4.297) 12.650 4.656 ( 3.907 9.289 2.290) 10.335 4.857 ( -6.509 1.610 1.545) 6.880 5.928 ( 12.232 8.164 16.915) 22.414 6.191 ( 10.874 1.292 10.279) 15.019 6.571 ( 3.362 6.360 6.250) 9.530 6.727 ( 12.438 -0.977 8.000) 14.821 7.033 ( 0.470 1.987 -8.422) 8.666 7.289 ( 2.372 1.243 -7.356) 7.828 8.349 ( -5.640 8.807 6.099) 12.106 8.917 ( -11.203 -7.349 -13.416) 18.961 9.263 ( -4.038 11.089 16.398) 20.203 9.812 ( 7.367 17.155 6.202) 19.673 10.117 ( 17.976 3.643 0.051) 18.341 10.484 ( -15.710 -1.821 -2.310) 15.983 11.055 ( 4.664 10.221 26.776) 29.037 11.716 ( -1.741 9.411 0.996) 9.622 12.036 ( 5.551 19.970 -8.953) 22.578 12.806 ( 3.433 9.620 -17.623) 20.369 13.317 ( -1.341 -13.410 -2.034) 13.630 13.398 ( -4.814 -12.792 0.565) 13.680 14.076 ( -0.230 -4.654 0.597) 4.698 14.357 ( -2.610 -14.045 -4.764) 15.059 17.609 ( 18.584 3.409 4.435) 19.407 18.556 ( -13.837 1.370 -5.527) 14.963 18.863 ( 10.285 0.031 -0.881) 10.323 19.681 ( 4.377 -2.916 2.351) 5.761 20.542 ( -5.278 -0.161 16.767) 17.579 22.417 ( -21.823 -8.804 -22.876) 32.819 23.306 ( 12.628 -7.247 5.163) 15.448 23.894 ( -3.807 0.542 -5.933) 7.070 ======================= Grid point 404 (216/260) ======================= q-point: (-0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.797 ( -3.286 0.302 4.721) 5.760 2.920 ( -2.346 -1.961 0.860) 3.176 3.013 ( 0.171 -2.511 -0.773) 2.633 3.118 ( -2.877 -2.552 -7.448) 8.382 3.326 ( -2.015 -3.588 -2.994) 5.089 3.400 ( 5.684 -7.292 -4.141) 10.130 4.715 ( -2.456 5.624 4.844) 7.818 4.741 ( -1.952 6.955 2.988) 7.817 6.126 ( 3.670 7.775 16.550) 18.650 6.330 ( 1.413 4.718 5.269) 7.212 6.647 ( 2.674 7.347 7.987) 11.177 6.902 ( 0.306 -3.690 4.430) 5.773 7.023 ( 2.825 3.135 -7.531) 8.633 7.254 ( -3.520 1.078 -7.301) 8.177 8.278 ( -2.997 6.292 8.168) 10.737 8.775 ( -0.024 -2.105 -16.028) 16.166 9.261 ( 0.450 4.943 21.924) 22.479 9.845 ( -2.341 13.627 -0.246) 13.829 10.172 ( -15.079 0.183 3.413) 15.461 10.492 ( 16.117 2.267 -0.180) 16.277 11.180 ( 3.159 12.113 20.422) 23.953 11.613 ( -7.619 10.910 4.862) 14.168 12.129 ( 5.195 20.941 -4.524) 22.044 12.718 ( -7.513 8.020 -20.280) 23.066 13.207 ( -7.086 -11.577 4.241) 14.221 13.477 ( 10.048 -15.638 -6.172) 19.586 14.091 ( 0.613 -6.872 4.098) 8.025 14.297 ( -2.238 -9.756 -4.910) 11.149 18.007 ( 19.925 2.702 2.603) 20.275 18.192 ( -16.991 -0.049 -7.221) 18.462 19.205 ( 19.026 7.820 4.211) 20.997 19.464 ( -20.205 7.896 -8.703) 23.374 20.811 ( 23.298 -10.380 28.719) 38.410 21.925 ( -22.656 -13.846 -26.884) 37.786 23.535 ( 9.324 -4.535 4.028) 11.123 23.792 ( -5.209 -0.069 -7.959) 9.512 ======================= Grid point 405 (217/260) ======================= q-point: (-0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.725 ( -4.099 2.469 6.228) 7.854 2.831 ( -5.362 0.743 4.670) 7.150 3.024 ( 2.290 -3.253 -3.138) 5.066 3.188 ( 7.646 -5.948 0.939) 9.733 3.294 ( 0.615 -0.451 -6.410) 6.455 3.569 ( 10.588 -4.783 -3.763) 12.212 4.582 ( -8.422 9.131 4.803) 13.318 4.772 ( 0.664 3.932 5.835) 7.068 6.083 ( -10.178 3.148 8.827) 13.835 6.318 ( -2.691 9.308 6.092) 11.445 6.676 ( -1.811 5.650 9.927) 11.565 6.815 ( -7.431 -1.856 -0.951) 7.718 6.992 ( -5.930 3.257 -5.841) 8.938 7.188 ( -2.484 -3.653 -8.390) 9.482 8.305 ( 5.297 4.051 10.406) 12.359 8.827 ( 6.627 7.911 -12.243) 16.012 9.330 ( 0.671 -0.540 24.222) 24.237 9.762 ( -5.615 9.476 -0.851) 11.048 9.899 ( -11.488 1.391 0.885) 11.606 10.708 ( 4.886 6.833 6.168) 10.422 11.244 ( 0.652 11.500 8.908) 14.561 11.467 ( -7.992 11.151 8.009) 15.886 12.218 ( 3.479 20.918 0.334) 21.208 12.494 ( -10.536 8.709 -19.781) 24.045 13.110 ( -2.947 -15.189 4.911) 16.233 13.694 ( 12.282 -15.303 -8.304) 21.307 14.085 ( -2.431 -11.598 5.018) 12.868 14.270 ( 0.838 -5.149 -5.472) 7.561 17.909 ( -9.585 -0.053 -10.055) 13.892 18.336 ( 8.145 -1.385 5.828) 10.111 19.044 ( -12.224 8.999 -10.559) 18.490 19.594 ( 15.664 6.448 4.426) 17.508 21.357 ( 15.651 -7.395 16.926) 24.210 21.485 ( -6.832 -14.646 -15.276) 22.238 23.626 ( -4.839 -0.291 -6.518) 8.123 23.724 ( 4.321 -1.920 -0.722) 4.783 ======================= Grid point 406 (218/260) ======================= q-point: (-0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.690 ( -0.701 7.105 11.507) 13.542 2.757 ( -3.218 5.012 5.891) 8.378 3.042 ( 0.236 -3.608 -1.808) 4.042 3.319 ( 2.230 -0.891 -7.668) 8.036 3.419 ( 14.454 -0.780 4.420) 15.135 3.783 ( 10.998 -0.705 -2.731) 11.354 4.410 ( -9.384 10.443 6.205) 15.350 4.777 ( -1.340 1.052 7.422) 7.615 5.822 ( -15.337 0.329 1.731) 15.438 6.231 ( -7.536 8.023 7.358) 13.240 6.551 ( -13.442 -2.618 5.640) 14.810 6.669 ( -6.022 3.052 7.253) 9.909 6.856 ( -4.754 4.408 -11.411) 13.124 7.071 ( -7.407 -4.992 -9.367) 12.943 8.509 ( 11.689 6.547 11.613) 17.730 8.967 ( 8.079 13.125 -5.028) 16.212 9.260 ( -11.395 -0.943 14.931) 18.807 9.683 ( -0.329 7.256 12.392) 14.364 9.772 ( -2.778 3.876 -4.784) 6.755 10.723 ( -4.475 11.428 12.880) 17.791 11.218 ( -5.644 8.684 3.266) 10.860 11.337 ( -5.108 6.798 4.719) 9.725 12.241 ( -3.408 23.550 1.007) 23.817 12.262 ( -6.811 6.713 -18.913) 21.193 13.111 ( 1.888 -16.923 5.404) 17.865 13.920 ( 11.751 -16.840 -11.033) 23.311 14.023 ( -4.040 -12.379 4.127) 13.660 14.303 ( 2.828 -5.153 -4.591) 7.458 17.737 ( -8.273 2.375 -11.211) 14.134 18.267 ( -8.387 -11.351 2.961) 14.421 19.078 ( 11.359 7.975 -6.659) 15.393 19.784 ( 2.636 -3.809 -4.198) 6.251 21.182 ( -3.120 -4.584 -15.354) 16.325 21.921 ( 19.479 -4.402 25.059) 32.043 23.488 ( -4.858 -0.214 -11.975) 12.925 23.820 ( 3.913 0.944 2.189) 4.582 ======================= Grid point 407 (219/260) ======================= q-point: (-0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( -1.887 5.166 12.794) 13.926 2.730 ( 1.329 14.791 8.681) 17.202 3.049 ( 1.118 -1.198 -2.395) 2.902 3.322 ( -1.287 0.197 -6.823) 6.946 3.713 ( 11.722 6.862 5.923) 14.818 3.970 ( 7.560 5.348 1.037) 9.318 4.278 ( -2.986 5.584 8.215) 10.372 4.750 ( -2.720 -0.743 9.275) 9.694 5.541 ( -11.485 -2.826 -2.791) 12.153 6.050 ( -11.687 4.454 8.221) 14.967 6.264 ( -14.718 -1.895 5.123) 15.699 6.536 ( -9.389 -0.963 10.501) 14.119 6.778 ( -1.145 6.137 -15.395) 16.613 6.902 ( -6.649 -3.336 -10.872) 13.174 8.735 ( 6.256 10.906 13.978) 18.801 8.977 ( -3.473 5.165 -0.434) 6.239 9.236 ( 8.485 13.571 8.852) 18.290 9.679 ( -7.101 5.432 8.355) 12.237 9.756 ( 3.022 7.471 7.847) 11.249 10.609 ( -8.048 12.501 12.620) 19.502 11.052 ( -9.562 4.483 2.530) 10.859 11.272 ( -3.118 0.631 -0.134) 3.184 12.084 ( -4.577 17.264 -16.721) 24.466 12.191 ( -4.113 11.913 -2.870) 12.926 13.188 ( 4.501 -16.314 5.181) 17.699 13.933 ( -4.635 -16.741 -0.415) 17.376 14.127 ( 10.029 -13.604 -9.685) 19.480 14.351 ( 2.475 -6.491 -3.931) 7.982 17.491 ( -13.630 -0.853 -2.563) 13.895 18.195 ( -0.677 -18.207 -12.427) 22.054 19.259 ( 6.729 3.922 -3.208) 8.423 19.774 ( 1.076 -9.020 -8.698) 12.576 21.250 ( 9.620 3.087 -3.120) 10.574 22.178 ( 1.012 -2.946 17.646) 17.919 23.463 ( 5.539 2.535 -9.580) 11.353 23.880 ( 1.599 3.420 2.292) 4.416 ======================= Grid point 408 (220/260) ======================= q-point: (-0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.691 ( -2.814 8.205 13.182) 15.780 2.774 ( 0.918 17.200 9.974) 19.904 3.075 ( 1.812 -0.314 -3.867) 4.282 3.237 ( -5.161 3.450 -5.494) 8.290 3.830 ( -0.009 10.394 8.613) 13.499 4.084 ( 3.204 12.419 2.961) 13.163 4.391 ( 11.533 -0.487 10.317) 15.482 4.713 ( -2.212 -0.790 10.341) 10.604 5.393 ( -2.685 -5.068 -4.414) 7.237 5.802 ( -14.670 -0.331 5.297) 15.600 6.026 ( -9.542 -0.507 9.550) 13.510 6.368 ( -7.961 -1.882 9.109) 12.243 6.730 ( -1.315 7.201 -16.024) 17.617 6.795 ( -1.916 -2.765 -11.946) 12.411 8.817 ( 5.224 10.350 8.864) 14.594 9.047 ( 5.017 13.592 7.244) 16.198 9.372 ( -3.012 13.863 11.161) 18.051 9.509 ( -5.422 12.977 6.847) 15.643 9.852 ( 5.477 4.475 13.094) 14.882 10.486 ( -6.354 14.491 4.931) 16.573 10.907 ( -4.075 -3.368 2.117) 5.695 11.199 ( -3.641 -3.205 -2.263) 5.353 12.007 ( -2.159 20.273 -10.244) 22.817 12.099 ( -2.556 6.849 -9.568) 12.041 13.298 ( 5.506 -15.081 4.849) 16.771 13.830 ( -5.384 -16.707 -2.901) 17.791 14.284 ( 7.430 -14.500 -9.897) 19.063 14.380 ( 1.058 -7.013 -4.083) 8.184 17.254 ( -9.898 -9.280 6.956) 15.247 18.073 ( -8.193 -16.933 -25.368) 31.581 19.416 ( 10.547 -2.656 0.695) 10.899 19.807 ( 1.520 -4.953 -6.158) 8.047 21.490 ( 14.024 2.204 0.868) 14.223 22.050 ( -13.826 -3.017 8.240) 16.375 23.645 ( 11.850 5.710 -3.936) 13.731 23.885 ( -1.675 5.305 1.730) 5.826 ======================= Grid point 409 (221/260) ======================= q-point: ( 0.00 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.819 ( -1.467 4.948 10.947) 12.103 3.033 ( -2.898 2.536 6.013) 7.141 3.064 ( -2.586 2.849 1.324) 4.069 3.228 ( 2.116 0.231 0.332) 2.154 3.919 ( -7.853 3.357 15.806) 17.965 4.439 ( 7.398 9.475 -2.323) 12.244 4.657 ( 6.001 1.541 11.674) 13.216 4.723 ( 9.416 -2.289 8.417) 12.835 5.310 ( -2.168 -0.339 -4.843) 5.317 5.385 ( -12.177 -6.243 -6.345) 15.084 5.966 ( -2.333 1.118 21.327) 21.483 6.265 ( -1.633 -0.534 5.386) 5.653 6.732 ( 2.649 -1.189 -13.201) 13.517 6.782 ( -0.531 2.519 -16.949) 17.144 9.064 ( -14.246 2.202 9.639) 17.340 9.321 ( 15.175 10.167 3.210) 18.546 9.575 ( -0.912 6.889 19.680) 20.871 9.859 ( 3.864 -2.178 5.749) 7.261 9.956 ( 6.513 8.222 13.456) 17.061 10.618 ( -8.147 5.476 -9.834) 13.895 10.864 ( 3.908 2.729 10.586) 11.609 11.009 ( -0.645 -7.808 -0.094) 7.836 12.164 ( -6.420 9.940 1.154) 11.889 12.367 ( 3.379 8.683 -9.674) 13.432 13.146 ( 6.627 -9.122 -1.126) 11.332 13.362 ( -2.831 -12.796 -12.022) 17.785 14.141 ( 2.244 -6.352 -2.306) 7.120 14.294 ( 0.090 -1.756 -10.573) 10.718 16.903 ( -7.418 -5.232 12.723) 15.629 17.693 ( -1.416 -4.946 -27.486) 27.963 19.544 ( 6.855 -1.646 1.431) 7.194 19.700 ( -5.894 -1.483 -7.011) 9.278 21.732 ( -14.154 -0.257 3.917) 14.688 21.775 ( 13.720 -0.651 1.471) 13.814 23.891 ( -5.540 2.561 0.909) 6.170 23.937 ( 7.313 1.245 -1.773) 7.627 ======================= Grid point 410 (222/260) ======================= q-point: ( 0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.802 ( -1.647 6.433 10.549) 12.465 2.991 ( -2.144 2.238 7.630) 8.235 3.027 ( -1.154 -1.478 0.422) 1.922 3.284 ( 2.252 1.276 1.095) 2.811 3.795 ( -7.852 1.636 15.813) 17.731 4.513 ( -1.955 12.731 -7.140) 14.726 4.671 ( -3.075 0.398 1.738) 3.555 4.966 ( 9.054 -3.501 0.822) 9.742 5.117 ( -1.816 -4.308 1.332) 4.862 5.433 ( 5.918 -1.268 8.908) 10.770 6.010 ( 3.686 1.156 20.092) 20.460 6.302 ( 4.103 -0.222 4.563) 6.140 6.776 ( 4.867 3.522 -15.850) 16.951 6.829 ( 7.470 -2.673 -13.716) 15.845 8.893 ( -1.808 1.199 4.283) 4.801 9.259 ( -14.025 8.848 16.614) 23.474 9.759 ( -3.840 3.161 7.553) 9.043 9.849 ( 0.823 -0.788 -3.076) 3.280 10.095 ( 6.062 15.360 14.100) 21.714 10.570 ( 4.472 3.520 -0.302) 5.699 10.981 ( 11.789 0.422 6.263) 13.356 11.112 ( 5.921 -6.561 -2.363) 9.148 12.075 ( -1.631 12.949 3.416) 13.491 12.441 ( 5.154 2.862 -6.869) 9.052 13.249 ( 2.233 -5.750 -6.554) 9.000 13.315 ( 2.041 -10.809 -9.670) 14.646 14.153 ( -0.552 -7.699 -2.401) 8.083 14.251 ( -2.466 -1.917 -11.136) 11.566 16.878 ( 2.193 -4.308 15.296) 16.042 17.711 ( 7.960 -5.108 -19.981) 22.107 19.489 ( -11.553 0.037 -5.320) 12.720 19.605 ( -2.872 -2.801 0.005) 4.012 21.477 ( -12.356 1.059 3.557) 12.901 22.083 ( 16.800 -2.600 1.401) 17.058 23.700 ( -13.140 2.126 -1.459) 13.391 24.032 ( 2.233 1.055 -1.883) 3.105 ======================= Grid point 411 (223/260) ======================= q-point: ( 0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.807 ( 0.574 6.339 7.909) 10.152 2.967 ( -1.442 0.017 6.139) 6.306 3.017 ( -0.091 -2.101 -0.400) 2.141 3.297 ( -1.345 1.782 1.449) 2.662 3.642 ( -10.363 -0.113 12.563) 16.286 4.228 ( -20.309 2.863 -10.770) 23.166 4.691 ( 3.885 7.869 -4.263) 9.756 4.992 ( -3.653 -7.804 -6.281) 10.663 5.320 ( 17.128 1.047 8.679) 19.230 5.631 ( 10.664 0.520 23.623) 25.924 6.188 ( 10.547 0.400 13.601) 17.216 6.424 ( 6.900 1.045 4.212) 8.151 6.900 ( 9.427 4.220 -14.509) 17.810 6.973 ( 9.072 -3.696 -13.145) 16.394 8.961 ( -12.499 7.335 10.239) 17.745 9.042 ( 9.720 -0.537 1.965) 9.931 9.491 ( -15.978 -3.679 4.970) 17.132 9.797 ( -7.746 7.085 -0.077) 10.498 10.225 ( 3.628 15.500 15.523) 22.234 10.703 ( 6.138 0.269 0.701) 6.183 11.101 ( -4.556 -2.273 1.364) 5.271 11.387 ( 22.462 1.272 1.591) 22.554 12.144 ( 7.194 15.456 4.350) 17.594 12.540 ( 5.751 -4.546 -2.420) 7.721 13.226 ( -0.607 -3.494 -16.349) 16.729 13.381 ( 2.931 -6.038 -2.112) 7.036 14.110 ( -3.314 -6.491 -3.267) 7.987 14.172 ( -2.817 -4.790 -10.225) 11.637 17.031 ( 10.143 -1.286 14.522) 17.760 17.938 ( 17.391 -5.905 -12.507) 22.220 19.279 ( -7.253 1.093 -1.293) 7.448 19.446 ( -12.551 -3.399 0.102) 13.003 21.232 ( -13.525 2.331 2.885) 14.024 22.431 ( 17.424 -3.949 0.107) 17.867 23.369 ( -19.267 1.173 -3.849) 19.683 24.032 ( -1.407 0.580 -2.795) 3.183 ======================= Grid point 412 (224/260) ======================= q-point: ( 0.30 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.839 ( 1.088 5.395 3.931) 6.763 2.960 ( -0.326 -1.122 4.311) 4.467 3.014 ( -0.080 -3.569 -2.788) 4.530 3.239 ( -4.439 4.435 1.374) 6.424 3.440 ( -10.521 -3.654 6.714) 13.005 3.783 ( -21.211 -0.527 -12.709) 24.733 4.758 ( 2.871 7.601 -0.522) 8.142 4.905 ( -3.274 -5.585 -1.759) 6.708 5.718 ( 19.873 3.678 9.849) 22.483 5.905 ( 12.356 -0.852 21.573) 24.875 6.443 ( 12.461 -0.132 9.109) 15.435 6.572 ( 6.961 2.762 4.061) 8.519 7.026 ( 4.378 0.716 -9.886) 10.836 7.163 ( 11.858 -0.276 -13.581) 18.032 8.685 ( -12.990 5.361 6.216) 15.366 9.053 ( -15.649 -4.859 1.900) 16.496 9.532 ( 21.493 1.697 0.485) 21.565 9.620 ( -8.160 5.634 3.882) 10.649 10.283 ( -0.608 13.970 15.385) 20.790 10.683 ( -8.756 -4.681 -14.707) 17.745 11.071 ( 2.818 2.986 21.193) 21.588 11.755 ( 12.309 3.440 0.134) 12.781 12.314 ( 8.052 18.632 1.421) 20.347 12.676 ( 8.313 -11.447 3.075) 14.477 13.167 ( -2.801 -2.382 -17.546) 17.927 13.383 ( -2.742 -2.179 -3.100) 4.677 14.031 ( -3.097 -2.991 -3.342) 5.450 14.123 ( -0.551 -8.440 -7.732) 11.459 17.311 ( 15.414 0.973 9.480) 18.122 18.329 ( 22.730 -3.709 -7.061) 24.089 19.072 ( -18.505 1.773 -1.131) 18.624 19.323 ( 6.344 -4.990 7.569) 11.064 20.930 ( -17.477 3.233 2.393) 17.934 22.676 ( -1.154 -4.026 -14.798) 15.380 23.015 ( -6.817 -1.060 6.095) 9.206 23.980 ( -2.955 0.338 -4.272) 5.205 ======================= Grid point 413 (225/260) ======================= q-point: ( 0.40 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.845 ( -1.455 2.921 1.789) 3.722 2.948 ( -1.874 -1.050 0.927) 2.340 2.996 ( -1.230 -3.518 -3.894) 5.390 3.171 ( -1.105 3.958 0.501) 4.140 3.288 ( -5.637 -4.261 -1.798) 7.291 3.391 ( -14.318 -2.742 -7.117) 16.222 4.794 ( 0.420 3.597 3.559) 5.077 4.863 ( -1.218 -0.383 1.132) 1.706 6.087 ( 13.005 6.448 15.438) 21.190 6.183 ( 12.567 -2.443 11.957) 17.518 6.686 ( 8.899 1.891 4.202) 10.021 6.712 ( 7.306 1.404 6.079) 9.608 7.045 ( -0.300 -0.611 -7.755) 7.784 7.321 ( 4.405 1.284 -11.255) 12.155 8.516 ( -4.535 6.351 2.618) 8.231 8.735 ( -13.916 -7.181 0.570) 15.670 9.464 ( -6.768 5.528 9.288) 12.753 10.030 ( 22.593 3.448 -2.950) 23.044 10.256 ( -2.746 8.699 7.529) 11.828 10.418 ( -13.249 -4.698 -6.187) 15.359 11.224 ( 6.986 4.607 23.199) 24.662 11.860 ( -0.814 3.917 0.176) 4.005 12.451 ( 5.669 19.425 1.078) 20.264 12.871 ( 9.691 -12.489 4.905) 16.551 13.044 ( -6.125 -2.433 -16.564) 17.827 13.261 ( -8.243 -1.935 -4.773) 9.720 13.988 ( -1.302 -2.848 -0.382) 3.154 14.122 ( 1.698 -6.723 -7.657) 10.330 17.664 ( 18.720 1.487 3.709) 19.142 18.575 ( -15.004 0.482 -5.412) 15.958 18.882 ( 18.396 1.084 1.878) 18.523 19.584 ( 13.734 -3.853 8.750) 16.734 20.586 ( -14.658 2.331 7.297) 16.539 22.261 ( -26.192 -4.648 -23.103) 35.233 23.200 ( 13.474 -2.625 8.488) 16.139 23.902 ( -4.076 0.208 -6.460) 7.641 ======================= Grid point 414 (226/260) ======================= q-point: (-0.50 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.795 ( -2.930 -0.410 3.186) 4.348 2.908 ( -1.937 0.917 0.945) 2.343 2.967 ( -0.776 -1.940 -2.922) 3.593 3.073 ( -5.474 -1.478 -10.778) 12.178 3.261 ( 1.927 -1.682 0.513) 2.609 3.300 ( 4.554 -2.378 -0.650) 5.179 4.786 ( -2.197 1.479 5.090) 5.738 4.846 ( -1.101 2.657 3.406) 4.458 6.238 ( -0.563 2.581 15.872) 16.091 6.416 ( 7.762 2.898 4.810) 9.580 6.795 ( 2.907 5.329 2.627) 6.615 6.830 ( -0.421 -2.405 7.349) 7.744 7.042 ( 2.763 -1.051 -7.539) 8.098 7.277 ( -5.899 0.915 -9.922) 11.580 8.393 ( -8.313 3.718 6.253) 11.046 8.677 ( 8.673 -4.065 -5.879) 11.239 9.386 ( -3.382 4.110 16.571) 17.405 10.048 ( -8.000 5.299 -12.858) 16.044 10.170 ( -13.014 -0.377 11.092) 17.104 10.527 ( 18.622 0.864 0.217) 18.643 11.393 ( 5.447 6.352 18.641) 20.433 11.776 ( -6.720 3.937 3.001) 8.346 12.549 ( 4.040 17.749 1.513) 18.266 12.858 ( -8.107 3.866 -9.841) 13.323 13.021 ( -4.825 -6.092 -1.993) 8.023 13.134 ( 5.037 -14.525 -2.289) 15.543 13.959 ( -2.068 -4.155 1.358) 4.835 14.154 ( 2.706 -3.614 -8.693) 9.795 18.048 ( 18.411 1.042 2.691) 18.635 18.190 ( -17.764 -0.065 -5.410) 18.570 19.342 ( 22.044 4.204 4.184) 22.828 19.586 ( -15.852 2.981 -8.072) 18.037 20.653 ( 20.466 -4.025 25.390) 32.859 21.693 ( -25.128 -6.607 -26.176) 36.882 23.467 ( 11.536 -1.751 6.392) 13.305 23.790 ( -5.855 -0.054 -9.419) 11.091 ======================= Grid point 415 (227/260) ======================= q-point: (-0.40 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.767 ( -0.629 1.299 7.114) 7.259 2.885 ( -0.109 3.878 1.080) 4.027 2.971 ( 0.799 -1.419 -2.712) 3.163 3.040 ( 3.868 -6.704 -2.232) 8.055 3.329 ( 6.256 2.764 -2.456) 7.267 3.465 ( 10.769 -4.379 -1.815) 11.766 4.718 ( -5.656 3.533 5.462) 8.620 4.825 ( -1.934 1.120 4.763) 5.261 6.126 ( -12.128 0.998 8.418) 14.797 6.483 ( -1.564 5.443 3.240) 6.525 6.714 ( -10.046 -2.313 10.034) 14.386 6.832 ( -1.691 3.786 1.201) 4.317 7.043 ( -3.363 0.654 -8.279) 8.960 7.120 ( -6.498 -2.183 -10.326) 12.394 8.362 ( 5.194 1.253 8.027) 9.642 8.908 ( 13.675 1.076 -6.201) 15.054 9.369 ( -3.089 2.317 23.139) 23.459 9.891 ( -6.647 3.114 -4.965) 8.862 9.919 ( -11.250 0.316 3.759) 11.865 10.810 ( 9.248 2.551 3.008) 10.054 11.470 ( -0.985 7.898 10.667) 13.309 11.630 ( -8.505 3.269 5.119) 10.452 12.588 ( -2.814 12.957 -2.702) 13.532 12.721 ( -1.555 8.786 -2.602) 9.294 12.844 ( -8.867 -5.568 -0.512) 10.483 13.318 ( 10.288 -18.219 -3.358) 21.190 13.910 ( -2.817 -4.294 2.109) 5.552 14.192 ( 2.724 -2.117 -10.192) 10.760 17.907 ( -8.839 -0.057 -8.571) 12.313 18.312 ( 2.270 -0.716 7.844) 8.198 19.214 ( -11.057 5.443 -14.853) 19.300 19.677 ( 8.635 1.526 2.215) 9.044 21.234 ( 2.038 -3.548 -4.771) 6.285 21.260 ( 15.033 -5.789 9.494) 18.698 23.630 ( -5.737 0.606 -10.456) 11.942 23.683 ( 7.025 -1.625 2.444) 7.613 ======================= Grid point 416 (228/260) ======================= q-point: (-0.30 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.781 ( 0.046 2.092 9.234) 9.468 2.917 ( 2.881 7.115 1.295) 7.785 2.991 ( 2.172 1.072 0.395) 2.454 3.165 ( 6.546 -9.941 0.980) 11.943 3.528 ( 14.368 7.060 -0.095) 16.009 3.708 ( 13.720 -5.598 -0.862) 14.844 4.575 ( -9.873 4.453 6.624) 12.696 4.785 ( -2.865 -0.074 4.757) 5.554 5.833 ( -16.993 0.460 2.334) 17.158 6.374 ( -10.185 5.515 5.408) 12.783 6.479 ( -14.194 -4.005 9.576) 17.585 6.738 ( -8.102 2.875 3.068) 9.128 6.929 ( -4.033 2.353 -13.581) 14.361 6.982 ( -5.973 -3.522 -10.455) 12.545 8.599 ( 15.429 2.075 9.781) 18.385 9.111 ( 1.192 1.277 3.018) 3.488 9.313 ( -0.431 4.145 9.883) 10.726 9.763 ( -2.936 1.587 19.482) 19.766 9.835 ( -0.893 1.415 -7.846) 8.023 10.899 ( -1.303 4.463 7.677) 8.975 11.388 ( -8.307 5.859 2.826) 10.550 11.455 ( -9.725 2.975 4.913) 11.294 12.459 ( -6.395 11.199 -6.977) 14.662 12.653 ( -8.019 8.440 2.292) 11.865 12.797 ( 4.248 -6.016 0.547) 7.385 13.482 ( 5.744 -18.780 -5.317) 20.345 13.884 ( 0.993 -3.005 1.300) 3.422 14.226 ( 2.652 -2.004 -11.028) 11.519 17.800 ( -2.172 2.922 -12.921) 13.424 18.074 ( -20.841 -6.142 5.677) 22.457 19.249 ( 11.847 6.836 -10.880) 17.477 19.653 ( -8.130 -6.363 -7.460) 12.737 21.141 ( 4.986 -0.300 -10.255) 11.407 21.847 ( 22.352 -2.086 25.518) 33.988 23.484 ( -3.963 -0.095 -14.650) 15.177 23.829 ( 5.892 0.076 3.378) 6.793 ======================= Grid point 417 (229/260) ======================= q-point: (-0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.797 ( 0.008 2.448 9.533) 9.842 2.981 ( 3.404 2.812 -0.538) 4.448 3.053 ( 2.718 7.801 3.916) 9.142 3.259 ( 2.272 -6.370 0.973) 6.832 3.866 ( 17.215 7.333 4.897) 19.341 3.994 ( 14.411 -2.980 3.188) 15.057 4.367 ( -11.099 2.241 9.490) 14.774 4.733 ( -2.880 -0.359 3.895) 4.858 5.514 ( -13.778 -0.207 -1.744) 13.889 6.129 ( -14.802 3.458 6.650) 16.591 6.207 ( -14.445 -3.440 8.253) 16.988 6.537 ( -11.526 0.651 5.711) 12.879 6.849 ( -4.430 -1.202 -11.588) 12.464 6.872 ( -0.287 2.032 -17.019) 17.142 8.913 ( 4.667 6.447 11.074) 13.637 9.006 ( 4.683 -1.926 6.307) 8.089 9.487 ( 11.017 7.406 5.202) 14.258 9.773 ( -2.786 3.369 15.812) 16.405 9.816 ( -0.745 -0.337 7.701) 7.745 10.810 ( -7.488 5.374 10.546) 14.007 11.164 ( -12.891 3.877 -3.582) 13.930 11.284 ( -8.495 0.451 3.278) 9.117 12.347 ( -3.544 11.678 -7.343) 14.242 12.498 ( -7.555 7.254 -0.306) 10.479 12.898 ( 5.527 -6.521 0.387) 8.557 13.507 ( -1.373 -17.918 -5.981) 18.939 13.963 ( 5.923 -3.378 -1.261) 6.934 14.260 ( 2.678 -2.247 -10.827) 11.377 17.515 ( -22.368 2.277 3.783) 22.800 17.893 ( 0.685 -9.168 -20.989) 22.915 19.356 ( -2.460 4.564 -5.352) 7.452 19.596 ( 8.318 -6.665 -8.207) 13.453 21.305 ( 10.679 1.596 -1.638) 10.922 22.130 ( 1.090 -1.317 16.295) 16.384 23.497 ( 8.338 0.764 -10.174) 13.177 23.925 ( 3.191 1.006 2.730) 4.318 ======================= Grid point 418 (230/260) ======================= q-point: (-0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.815 ( -0.141 3.412 10.236) 10.790 3.043 ( 2.200 -1.201 -1.678) 3.016 3.086 ( -0.187 11.110 6.094) 12.673 3.247 ( -3.013 -3.127 0.625) 4.387 4.045 ( -5.207 8.222 12.328) 15.707 4.254 ( 10.690 1.945 3.580) 11.440 4.363 ( 13.227 -0.731 12.197) 18.007 4.692 ( -1.651 -0.650 3.886) 4.272 5.326 ( -3.946 -1.281 -5.234) 6.678 5.770 ( -20.283 -1.642 -3.683) 20.679 6.019 ( -6.969 -0.146 18.790) 20.041 6.350 ( -7.723 -0.173 5.981) 9.770 6.754 ( -2.318 -1.053 -12.438) 12.696 6.839 ( -0.946 2.745 -17.873) 18.107 8.980 ( 10.841 4.590 2.425) 12.020 9.229 ( 2.682 3.929 12.918) 13.766 9.616 ( -4.611 9.442 18.570) 21.336 9.769 ( 7.939 3.846 7.291) 11.445 9.813 ( -1.602 -1.284 13.252) 13.410 10.735 ( -0.327 6.270 3.253) 7.071 10.899 ( -12.221 1.279 -2.674) 12.575 11.123 ( -8.111 -2.724 2.722) 8.978 12.279 ( -3.699 8.472 -2.731) 9.639 12.370 ( -3.368 11.175 -6.959) 13.588 13.016 ( 6.403 -8.606 -0.649) 10.746 13.444 ( -3.237 -15.715 -8.461) 18.139 14.073 ( 4.898 -4.878 -2.244) 7.268 14.290 ( 2.021 -2.107 -10.407) 10.809 17.126 ( -16.704 -2.941 8.694) 19.059 17.816 ( -3.980 -6.643 -30.203) 31.180 19.382 ( 6.634 -0.743 0.554) 6.698 19.732 ( 4.040 -1.900 -6.829) 8.159 21.526 ( 11.498 0.993 0.968) 11.581 22.005 ( -12.842 -1.150 6.712) 14.536 23.722 ( 12.980 1.740 -3.554) 13.570 23.958 ( -0.646 1.667 2.076) 2.740 ======================= Grid point 459 (231/260) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( -2.771 0.000 -3.724) 4.642 2.065 ( 2.771 0.000 3.724) 4.642 2.744 ( -3.228 0.000 -2.281) 3.953 2.744 ( 3.228 0.000 2.281) 3.953 3.735 ( 0.352 0.000 -1.944) 1.976 3.735 ( -0.352 0.000 1.944) 1.976 4.570 ( 3.785 0.000 -2.027) 4.294 4.570 ( -3.785 0.000 2.027) 4.294 5.749 ( 8.633 0.000 -11.459) 14.346 5.749 ( -8.633 0.000 11.459) 14.346 5.860 ( -4.917 0.000 -5.805) 7.608 5.860 ( 4.917 0.000 5.805) 7.608 6.983 ( -8.577 0.000 2.185) 8.851 6.983 ( 8.577 0.000 -2.185) 8.851 8.213 ( -5.409 0.000 -11.504) 12.712 8.213 ( 5.409 0.000 11.504) 12.712 8.814 ( 1.820 0.000 -6.600) 6.846 8.814 ( -1.820 0.000 6.600) 6.846 9.570 ( -7.969 0.000 -27.594) 28.721 9.570 ( 7.969 0.000 27.594) 28.721 11.204 ( -1.105 0.000 -25.937) 25.960 11.204 ( 1.105 0.000 25.937) 25.960 11.589 ( 4.704 0.000 -11.576) 12.495 11.589 ( -4.704 0.000 11.576) 12.495 13.971 ( -4.442 0.000 -9.978) 10.922 13.971 ( 4.442 0.000 9.978) 10.922 14.956 ( 6.158 0.000 -7.212) 9.483 14.956 ( -6.158 0.000 7.212) 9.483 18.295 ( -25.148 0.000 -4.567) 25.559 18.295 ( 25.148 0.000 4.567) 25.559 19.989 ( -3.662 0.000 -1.454) 3.940 19.989 ( 3.662 0.000 1.454) 3.940 22.032 ( -33.927 0.000 10.975) 35.658 22.032 ( 33.927 0.000 -10.975) 35.658 23.251 ( -8.969 0.000 -5.189) 10.362 23.251 ( 8.969 0.000 5.189) 10.362 ======================= Grid point 461 (232/260) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( 8.687 0.000 -4.754) 9.902 2.247 ( 14.069 0.000 1.589) 14.158 2.721 ( 1.339 0.000 -4.283) 4.487 2.862 ( 8.434 0.000 -1.553) 8.576 3.684 ( -5.009 0.000 0.519) 5.036 3.696 ( -3.720 0.000 -1.688) 4.086 4.486 ( -3.995 0.000 -1.873) 4.412 4.606 ( 0.346 0.000 -4.729) 4.742 5.653 ( -2.997 0.000 12.409) 12.766 5.841 ( 3.163 0.000 -2.026) 3.756 5.940 ( 11.800 0.000 -9.068) 14.882 6.056 ( 12.956 0.000 7.136) 14.791 6.852 ( -4.560 0.000 -1.600) 4.833 7.169 ( 9.936 0.000 -1.474) 10.045 8.118 ( -2.051 0.000 -6.544) 6.858 8.338 ( 3.671 0.000 18.304) 18.669 8.834 ( 2.373 0.000 11.372) 11.617 8.878 ( 5.629 0.000 -4.098) 6.963 9.422 ( -1.570 0.000 -33.773) 33.809 9.833 ( 14.209 0.000 17.830) 22.800 11.129 ( -2.310 0.000 -22.135) 22.256 11.266 ( 0.166 0.000 28.727) 28.727 11.488 ( -7.365 0.000 9.328) 11.885 11.645 ( 3.913 0.000 -18.520) 18.929 13.875 ( -3.572 0.000 -9.313) 9.975 14.083 ( 4.851 0.000 10.321) 11.404 14.819 ( -8.774 0.000 6.150) 10.714 15.033 ( 2.806 0.000 -8.266) 8.729 17.822 ( -21.061 0.000 4.164) 21.468 18.762 ( 18.206 0.000 9.120) 20.362 19.858 ( -8.976 0.000 -4.027) 9.838 20.007 ( -2.737 0.000 2.873) 3.968 21.364 ( -31.474 0.000 7.687) 32.399 22.562 ( 18.630 0.000 -18.684) 26.385 23.115 ( -0.999 0.000 -3.493) 3.633 23.441 ( 8.912 0.000 3.207) 9.471 ======================= Grid point 462 (233/260) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.350 ( 13.727 0.000 -3.020) 14.055 2.553 ( 14.270 0.000 -9.558) 17.175 2.798 ( 8.154 0.000 5.895) 10.062 3.058 ( 11.449 0.000 -5.494) 12.698 3.547 ( -8.123 0.000 -2.290) 8.440 3.592 ( -6.335 0.000 -0.525) 6.356 4.415 ( -2.857 0.000 -3.151) 4.253 4.578 ( -2.013 0.000 -4.850) 5.251 5.663 ( 1.471 0.000 11.418) 11.512 5.940 ( 5.854 0.000 -0.059) 5.855 6.168 ( 11.981 0.000 -4.234) 12.707 6.357 ( 14.854 0.000 7.965) 16.855 6.792 ( -0.814 0.000 -8.325) 8.365 7.347 ( 7.137 0.000 3.284) 7.856 8.105 ( 1.488 0.000 -6.040) 6.220 8.409 ( 0.434 0.000 18.601) 18.606 8.940 ( 4.687 0.000 22.599) 23.080 9.029 ( 9.997 0.000 -4.085) 10.799 9.393 ( 5.250 0.000 -35.281) 35.670 10.181 ( 17.912 0.000 6.737) 19.137 11.035 ( -3.312 0.000 -18.410) 18.705 11.262 ( -8.036 0.000 14.238) 16.349 11.382 ( -2.840 0.000 28.100) 28.243 11.692 ( 5.132 0.000 -27.842) 28.311 13.796 ( -2.714 0.000 -8.165) 8.604 14.191 ( 3.868 0.000 11.203) 11.851 14.633 ( -10.788 0.000 4.755) 11.790 15.032 ( -1.501 0.000 -9.479) 9.597 17.514 ( -10.616 0.000 10.746) 15.105 18.959 ( -0.661 0.000 3.865) 3.921 19.627 ( -12.803 0.000 -8.410) 15.318 19.821 ( -17.977 0.000 2.521) 18.153 21.003 ( -3.381 0.000 17.692) 18.012 22.628 ( -4.153 0.000 -21.019) 21.426 23.272 ( 13.430 0.000 -4.506) 14.166 23.604 ( 7.001 0.000 0.342) 7.009 ======================= Grid point 463 (234/260) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.623 ( 13.042 0.000 0.799) 13.067 2.711 ( 6.306 0.000 -16.427) 17.596 3.103 ( 17.710 0.000 15.590) 23.594 3.269 ( 7.727 0.000 -5.158) 9.290 3.393 ( -3.043 0.000 -8.421) 8.953 3.456 ( -7.051 0.000 0.766) 7.092 4.347 ( -3.925 0.000 -1.710) 4.281 4.505 ( -4.765 0.000 -5.137) 7.007 5.741 ( 4.318 0.000 10.640) 11.483 6.034 ( 3.328 0.000 -3.918) 5.141 6.389 ( 10.093 0.000 3.905) 10.822 6.632 ( 10.329 0.000 6.504) 12.206 6.790 ( 3.107 0.000 -12.584) 12.962 7.429 ( -0.746 0.000 7.090) 7.130 8.152 ( 4.587 0.000 -6.069) 7.608 8.432 ( -0.871 0.000 13.880) 13.908 9.075 ( 3.459 0.000 33.547) 33.725 9.201 ( 7.650 0.000 -20.483) 21.865 9.548 ( 16.071 0.000 -20.542) 26.081 10.520 ( 13.892 0.000 -1.526) 13.976 10.946 ( -2.279 0.000 -15.295) 15.464 11.054 ( -12.399 0.000 9.416) 15.569 11.437 ( 0.856 0.000 39.995) 40.005 11.745 ( 5.566 0.000 -36.600) 37.021 13.745 ( -0.724 0.000 -6.781) 6.820 14.257 ( -1.315 0.000 15.539) 15.595 14.430 ( -8.001 0.000 0.730) 8.035 14.939 ( -5.971 0.000 -10.594) 12.161 17.451 ( 2.189 0.000 13.176) 13.356 18.778 ( -15.906 0.000 -1.288) 15.958 19.343 ( -13.244 0.000 -12.048) 17.905 19.402 ( -20.602 0.000 -0.715) 20.614 21.209 ( 15.138 0.000 30.979) 34.480 22.461 ( -7.854 0.000 -22.567) 23.895 23.505 ( 10.104 0.000 -4.584) 11.095 23.714 ( 4.147 0.000 -1.925) 4.572 ======================= Grid point 464 (235/260) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.802 ( 5.487 0.000 -10.696) 12.022 2.836 ( 7.039 0.000 3.785) 7.992 3.211 ( -4.162 0.000 -2.153) 4.686 3.319 ( -6.316 0.000 0.887) 6.378 3.474 ( 14.938 0.000 15.830) 21.766 3.546 ( 11.893 0.000 -13.852) 18.257 4.251 ( -5.140 0.000 0.831) 5.207 4.364 ( -8.264 0.000 -5.447) 9.898 5.861 ( 5.436 0.000 10.427) 11.759 6.047 ( -0.924 0.000 -8.315) 8.366 6.576 ( 7.297 0.000 10.163) 12.511 6.735 ( 1.739 0.000 -11.936) 12.062 6.918 ( 9.554 0.000 1.398) 9.656 7.335 ( -9.123 0.000 5.087) 10.445 8.261 ( 6.551 0.000 -4.021) 7.687 8.423 ( -2.178 0.000 8.454) 8.730 9.185 ( 1.064 0.000 38.948) 38.962 9.262 ( 4.054 0.000 -34.617) 34.853 9.905 ( 20.613 0.000 -9.156) 22.555 10.588 ( -9.517 0.000 1.060) 9.576 10.905 ( 0.670 0.000 -11.680) 11.700 10.916 ( -0.954 0.000 6.635) 6.703 11.552 ( 3.146 0.000 44.138) 44.249 11.763 ( 2.666 0.000 -42.352) 42.436 13.762 ( 3.964 0.000 -6.254) 7.404 14.105 ( -12.661 0.000 11.091) 16.831 14.433 ( 4.858 0.000 5.857) 7.609 14.769 ( -8.681 0.000 -10.765) 13.829 17.633 ( 13.132 0.000 12.285) 17.982 18.398 ( -20.466 0.000 -4.752) 21.010 19.079 ( -11.313 0.000 2.614) 11.611 19.092 ( -8.944 0.000 -12.685) 15.521 21.596 ( 16.521 0.000 34.484) 38.237 22.241 ( -10.120 0.000 -27.092) 28.920 23.657 ( 5.899 0.000 -1.669) 6.131 23.760 ( 0.836 0.000 -2.654) 2.782 ======================= Grid point 465 (236/260) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.880 ( 2.914 0.000 -5.862) 6.546 2.880 ( -2.914 0.000 5.862) 6.546 3.209 ( -4.073 0.000 1.284) 4.270 3.209 ( 4.073 0.000 -1.284) 4.270 3.673 ( 0.360 0.000 -15.162) 15.166 3.673 ( -0.360 0.000 15.162) 15.166 4.214 ( -3.334 0.000 -3.478) 4.818 4.214 ( 3.334 0.000 3.478) 4.818 5.977 ( -4.109 0.000 -10.056) 10.863 5.977 ( 4.109 0.000 10.056) 10.863 6.701 ( -2.907 0.000 -13.264) 13.579 6.701 ( 2.907 0.000 13.264) 13.579 7.128 ( -11.174 0.000 0.546) 11.187 7.128 ( 11.174 0.000 -0.546) 11.187 8.368 ( 4.583 0.000 -4.528) 6.443 8.368 ( -4.583 0.000 4.528) 6.443 9.251 ( 1.474 0.000 -39.131) 39.159 9.251 ( -1.474 0.000 39.131) 39.159 10.288 ( 18.692 0.000 -6.387) 19.753 10.288 ( -18.692 0.000 6.387) 19.753 10.917 ( 1.438 0.000 -7.095) 7.239 10.917 ( -1.438 0.000 7.095) 7.239 11.691 ( -2.056 0.000 -44.379) 44.427 11.691 ( 2.056 0.000 44.379) 44.427 13.889 ( 9.886 0.000 -7.747) 12.560 13.889 ( -9.886 0.000 7.747) 12.560 14.579 ( -8.125 0.000 -9.343) 12.382 14.579 ( 8.125 0.000 9.343) 12.382 17.983 ( -19.304 0.000 -9.209) 21.388 17.983 ( 19.304 0.000 9.209) 21.388 18.977 ( 0.013 0.000 -9.115) 9.115 18.977 ( -0.013 0.000 9.115) 9.115 21.956 ( -13.487 0.000 -32.071) 34.791 21.956 ( 13.487 0.000 32.071) 34.791 23.739 ( -2.485 0.000 -1.333) 2.820 23.739 ( 2.485 0.000 1.333) 2.820 ======================= Grid point 471 (237/260) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( 0.184 13.520 -3.021) 13.855 2.221 ( -0.184 13.520 3.021) 13.855 2.814 ( -2.193 6.082 -1.564) 6.651 2.814 ( 2.193 6.082 1.564) 6.651 3.728 ( 0.653 0.286 -1.919) 2.047 3.728 ( -0.653 0.286 1.919) 2.047 4.637 ( -4.619 5.347 -1.402) 7.203 4.637 ( 4.619 5.347 1.402) 7.203 5.731 ( 6.418 -3.159 -5.748) 9.176 5.731 ( -6.418 -3.159 5.748) 9.176 5.904 ( -0.593 5.408 -5.504) 7.739 5.904 ( 0.593 5.408 5.504) 7.739 6.886 ( 3.320 -7.890 -7.079) 11.108 6.886 ( -3.320 -7.890 7.079) 11.108 8.390 ( -4.708 15.329 -9.835) 18.811 8.390 ( 4.708 15.329 9.835) 18.811 8.886 ( 2.550 6.855 -5.034) 8.879 8.886 ( -2.550 6.855 5.034) 8.879 9.706 ( -7.516 12.004 -25.295) 28.990 9.706 ( 7.516 12.004 25.295) 28.990 11.175 ( -0.943 -2.620 -16.920) 17.148 11.175 ( 0.943 -2.620 16.920) 17.148 11.609 ( 3.801 2.080 -8.459) 9.504 11.609 ( -3.801 2.080 8.459) 9.504 13.939 ( -4.214 -3.251 -10.260) 11.558 13.939 ( 4.214 -3.251 10.260) 11.558 14.860 ( 5.630 -8.952 -7.634) 13.042 14.860 ( -5.630 -8.952 7.634) 13.042 18.156 ( -17.886 -12.616 -9.117) 23.711 18.156 ( 17.886 -12.616 9.117) 23.711 19.924 ( -4.937 -5.629 -2.029) 7.757 19.924 ( 4.937 -5.629 2.029) 7.757 21.961 ( -23.816 -5.324 4.738) 24.860 21.961 ( 23.816 -5.324 -4.738) 24.860 23.389 ( -9.370 11.184 -2.154) 14.749 23.389 ( 9.370 11.184 2.154) 14.749 ======================= Grid point 473 (238/260) ======================= q-point: ( 0.10 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 4.560 9.034 0.900) 10.160 2.440 ( 14.634 14.826 -4.503) 21.313 2.802 ( 1.518 6.954 -2.192) 7.448 2.906 ( 6.644 3.765 -1.441) 7.771 3.673 ( -4.745 -0.205 0.493) 4.775 3.708 ( -2.633 1.902 -0.644) 3.311 4.487 ( -7.432 1.867 -4.521) 8.897 4.731 ( 3.060 8.431 -4.301) 9.947 5.625 ( -2.716 -3.296 9.018) 9.978 5.831 ( 3.393 -1.205 0.772) 3.682 6.004 ( 10.566 6.025 -7.321) 14.197 6.066 ( 12.341 1.513 7.677) 14.612 6.769 ( -3.834 -6.403 2.103) 7.754 7.071 ( 10.402 -8.378 -4.237) 14.013 8.290 ( -3.605 14.939 -5.964) 16.484 8.499 ( 4.172 13.559 13.066) 19.286 8.839 ( 0.030 3.879 5.009) 6.335 9.024 ( 7.845 10.700 1.772) 13.386 9.534 ( -4.515 10.034 -26.431) 28.630 9.969 ( 14.693 11.866 13.426) 23.172 11.124 ( -1.213 -0.660 -14.106) 14.174 11.233 ( 1.543 -2.562 16.867) 17.130 11.498 ( -7.367 1.122 6.144) 9.658 11.683 ( 4.233 3.772 -11.421) 12.750 13.833 ( -4.070 -4.041 -8.200) 10.007 14.056 ( 5.048 -2.752 9.247) 10.889 14.721 ( -8.807 -9.044 6.083) 14.013 14.939 ( 2.902 -8.796 -8.122) 12.319 17.729 ( -18.253 -8.278 4.131) 20.464 18.621 ( 19.966 -13.527 8.364) 25.526 19.727 ( -13.606 -9.897 -3.744) 17.236 19.965 ( -1.434 -4.044 2.957) 5.211 21.378 ( -27.154 1.472 5.274) 27.700 22.476 ( 21.334 -7.393 -13.793) 26.458 23.213 ( -6.426 8.939 -1.284) 11.083 23.567 ( 7.969 9.800 -0.288) 12.634 ======================= Grid point 474 (239/260) ======================= q-point: ( 0.20 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 11.289 4.240 0.689) 12.078 2.681 ( 8.125 8.875 -14.551) 18.882 2.911 ( 10.669 9.312 8.461) 16.496 3.060 ( 9.084 0.013 -4.901) 10.322 3.548 ( -7.280 0.954 -1.819) 7.564 3.627 ( -5.343 3.620 0.660) 6.487 4.343 ( -5.835 -2.192 -5.834) 8.537 4.751 ( -0.119 10.790 -5.198) 11.977 5.648 ( 2.814 -2.078 10.276) 10.855 5.930 ( 6.133 -0.368 2.232) 6.537 6.214 ( 10.807 4.092 -3.827) 12.173 6.363 ( 14.997 0.693 8.017) 17.020 6.735 ( 0.252 -4.232 -3.712) 5.635 7.258 ( 8.216 -7.808 -0.348) 11.340 8.226 ( -2.132 10.917 -3.004) 11.522 8.581 ( 0.737 14.842 10.823) 18.384 8.936 ( 8.953 1.569 10.505) 13.891 9.177 ( 6.704 11.246 4.335) 13.791 9.439 ( 0.400 5.129 -25.178) 25.699 10.314 ( 17.361 10.924 1.968) 20.606 11.081 ( -0.431 4.132 -12.663) 13.327 11.259 ( -4.798 -0.537 9.697) 10.832 11.376 ( -3.494 0.511 19.602) 19.918 11.745 ( 4.876 5.228 -19.848) 21.096 13.749 ( -2.977 -4.583 -7.342) 9.152 14.162 ( 3.580 -2.976 10.643) 11.617 14.536 ( -10.517 -8.810 4.418) 14.413 14.940 ( -1.354 -8.581 -9.193) 12.648 17.476 ( -8.111 -3.333 10.499) 13.680 18.879 ( 2.805 -9.186 4.074) 10.433 19.398 ( -17.240 -13.220 -7.088) 22.852 19.885 ( -7.899 0.220 4.288) 8.990 21.011 ( -8.509 1.621 12.438) 15.158 22.652 ( -1.051 0.393 -21.037) 21.067 23.229 ( 8.601 -1.594 1.993) 8.971 23.696 ( 5.194 6.842 -2.631) 8.984 ======================= Grid point 475 (240/260) ======================= q-point: ( 0.30 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.624 ( 12.821 1.153 0.905) 12.904 2.754 ( 3.856 3.697 -13.399) 14.424 3.134 ( 5.067 0.484 10.977) 12.100 3.261 ( 12.106 -2.949 -8.396) 15.025 3.420 ( -2.741 5.495 -1.714) 6.376 3.514 ( -5.497 4.722 1.098) 7.329 4.242 ( -3.273 -2.994 -4.603) 6.393 4.700 ( -4.416 11.370 -4.407) 12.969 5.757 ( 6.015 1.005 10.136) 11.829 6.053 ( 5.251 1.865 -1.444) 5.757 6.406 ( 8.649 1.792 2.924) 9.304 6.642 ( 10.078 0.988 7.227) 12.441 6.768 ( 5.113 -1.506 -9.612) 10.991 7.364 ( 1.237 -5.988 3.942) 7.275 8.205 ( 0.869 5.630 -0.596) 5.728 8.561 ( -3.364 10.903 3.759) 12.013 9.152 ( 6.566 6.584 25.332) 26.985 9.276 ( 3.874 6.424 -15.389) 17.120 9.549 ( 15.546 1.490 -11.379) 19.323 10.586 ( 8.123 5.144 -7.175) 11.997 11.064 ( -3.456 7.159 -4.115) 8.952 11.108 ( -3.788 7.884 0.856) 8.789 11.436 ( 2.612 0.867 32.858) 32.973 11.802 ( 4.918 5.743 -29.731) 30.678 13.695 ( -0.974 -4.886 -6.283) 8.019 14.205 ( -4.351 -5.579 15.289) 16.846 14.354 ( -4.929 -6.287 0.272) 7.994 14.854 ( -5.461 -7.909 -10.099) 13.941 17.452 ( 3.510 0.113 12.974) 13.441 18.755 ( -13.491 -3.154 -0.898) 13.884 19.076 ( -12.591 -11.707 -7.834) 18.893 19.644 ( -15.752 10.060 -3.141) 18.952 21.107 ( 12.175 -8.054 27.408) 31.053 22.484 ( -9.692 1.198 -22.888) 24.884 23.442 ( 10.464 -4.738 0.366) 11.493 23.764 ( 2.216 3.592 -3.609) 5.554 ======================= Grid point 476 (241/260) ======================= q-point: ( 0.40 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.805 ( 4.967 0.343 -9.955) 11.130 2.857 ( 7.166 1.946 3.675) 8.285 3.136 ( -1.978 -5.398 1.918) 6.061 3.317 ( -4.539 -0.841 -0.450) 4.639 3.483 ( 4.602 -2.001 -6.573) 8.270 3.536 ( 6.896 -0.472 5.598) 8.895 4.218 ( 2.464 3.795 -2.139) 5.005 4.556 ( -9.194 11.310 -2.906) 14.863 5.907 ( 6.759 4.083 9.885) 12.652 6.102 ( 0.100 4.926 -7.027) 8.583 6.575 ( 7.334 0.172 8.570) 11.281 6.748 ( 2.171 1.323 -9.058) 9.408 6.924 ( 9.488 0.473 1.918) 9.692 7.305 ( -7.333 -2.809 3.729) 8.693 8.265 ( 4.636 1.424 2.291) 5.364 8.479 ( -4.772 4.701 -1.629) 6.894 9.267 ( 2.151 5.538 17.835) 18.798 9.316 ( 2.502 6.602 -10.785) 12.891 9.922 ( 20.872 1.615 -8.205) 22.485 10.559 ( -9.388 -0.996 -0.114) 9.442 10.975 ( 0.188 8.241 -3.595) 8.993 11.113 ( -1.142 13.347 -1.166) 13.447 11.582 ( 5.332 3.807 38.116) 38.675 11.818 ( 2.089 5.599 -37.026) 37.505 13.704 ( 3.351 -5.540 -5.897) 8.757 14.022 ( -12.377 -7.809 9.910) 17.674 14.390 ( 4.801 -3.869 6.372) 8.867 14.700 ( -7.766 -6.405 -10.196) 14.328 17.647 ( 13.384 1.334 11.772) 17.875 18.407 ( -19.861 0.825 -4.526) 20.387 18.924 ( -0.926 -5.589 -3.058) 6.438 19.304 ( -16.229 10.944 -6.246) 20.546 21.476 ( 17.531 -10.498 32.891) 38.721 22.214 ( -13.012 -2.995 -26.974) 30.098 23.618 ( 7.046 -3.238 0.729) 7.789 23.773 ( -0.651 0.904 -3.225) 3.412 ======================= Grid point 477 (242/260) ======================= q-point: ( 0.50 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.884 ( 3.802 0.258 -5.647) 6.812 2.884 ( -3.802 0.258 5.647) 6.812 3.194 ( -6.499 -1.608 0.413) 6.708 3.194 ( 6.499 -1.608 -0.413) 6.708 3.574 ( 2.152 -7.358 -12.173) 14.386 3.574 ( -2.152 -7.358 12.173) 14.386 4.351 ( -9.468 10.704 -1.272) 14.347 4.351 ( 9.468 10.704 1.272) 14.347 6.040 ( -4.405 5.619 -9.517) 11.897 6.040 ( 4.405 5.619 9.517) 11.897 6.711 ( -3.133 0.997 -12.646) 13.066 6.711 ( 3.133 0.997 12.646) 13.066 7.124 ( -6.977 -0.397 -2.854) 7.548 7.124 ( 6.977 -0.397 2.854) 7.548 8.374 ( -3.437 0.915 -6.541) 7.446 8.374 ( 3.437 0.915 6.541) 7.446 9.319 ( 1.912 5.942 -25.809) 26.554 9.319 ( -1.912 5.942 25.809) 26.554 10.290 ( 8.396 0.580 -6.280) 10.501 10.290 ( -8.396 0.580 6.280) 10.501 11.039 ( 4.123 10.418 -4.466) 12.062 11.039 ( -4.123 10.418 4.466) 12.062 11.742 ( -2.319 5.292 -41.857) 42.254 11.742 ( 2.319 5.292 41.857) 42.254 13.816 ( 8.544 -6.767 -7.322) 13.131 13.816 ( -8.544 -6.767 7.322) 13.131 14.528 ( -7.379 -4.712 -9.125) 12.646 14.528 ( 7.379 -4.712 9.125) 12.646 17.997 ( -19.246 1.279 -8.503) 21.080 17.997 ( 19.246 1.279 8.503) 21.080 19.023 ( -6.169 4.284 -7.999) 10.972 19.023 ( 6.169 4.284 7.999) 10.972 21.872 ( -15.829 -7.675 -31.902) 36.431 21.872 ( 15.829 -7.675 31.902) 36.431 23.726 ( -3.534 -1.224 -2.199) 4.339 23.726 ( 3.534 -1.224 2.199) 4.339 ======================= Grid point 483 (243/260) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( 7.831 16.885 -5.508) 19.411 2.558 ( -7.831 16.885 5.508) 19.411 2.955 ( -0.492 6.223 -1.125) 6.343 2.955 ( 0.492 6.223 1.125) 6.343 3.797 ( -0.153 7.056 -4.202) 8.213 3.797 ( 0.153 7.056 4.202) 8.213 4.746 ( -6.462 4.277 -2.096) 8.028 4.746 ( 6.462 4.277 2.096) 8.028 5.615 ( -5.976 -7.316 -5.293) 10.829 5.615 ( 5.976 -7.316 5.293) 10.829 6.068 ( 1.353 9.026 -12.585) 15.546 6.068 ( -1.353 9.026 12.585) 15.546 6.709 ( 5.264 -7.951 -10.335) 14.062 6.709 ( -5.264 -7.951 10.335) 14.062 8.767 ( -1.206 18.084 -5.431) 18.920 8.767 ( 1.206 18.084 5.431) 18.920 9.110 ( 5.149 14.970 -5.975) 16.921 9.110 ( -5.149 14.970 5.975) 16.921 10.008 ( -8.388 14.812 -15.190) 22.814 10.008 ( 8.388 14.812 15.190) 22.814 11.105 ( 3.126 -3.684 -1.527) 5.067 11.105 ( -3.126 -3.684 1.527) 5.067 11.694 ( 1.658 6.609 -9.428) 11.632 11.694 ( -1.658 6.609 9.428) 11.632 13.821 ( -4.130 -8.529 -10.650) 14.255 13.821 ( 4.130 -8.529 10.650) 14.255 14.603 ( 4.403 -14.489 -6.955) 16.664 14.603 ( -4.403 -14.489 6.955) 16.664 17.814 ( -7.367 -18.391 -16.028) 25.483 17.814 ( 7.367 -18.391 16.028) 25.483 19.787 ( -6.416 -6.725 -2.925) 9.745 19.787 ( 6.416 -6.725 2.925) 9.745 21.859 ( -22.251 -3.837 2.901) 22.765 21.859 ( 22.251 -3.837 -2.901) 22.765 23.635 ( -8.794 10.951 0.723) 14.063 23.635 ( 8.794 10.951 -0.723) 14.063 ======================= Grid point 485 (244/260) ======================= q-point: ( 0.10 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( -0.632 14.862 4.262) 15.474 2.766 ( 11.566 14.514 -9.050) 20.648 2.954 ( 1.208 5.948 -1.149) 6.177 2.998 ( 3.162 4.677 2.533) 6.188 3.730 ( -4.235 6.645 -0.233) 7.883 3.811 ( -1.175 8.206 1.440) 8.414 4.553 ( -10.148 3.452 -7.183) 12.903 4.879 ( 5.551 4.845 -6.086) 9.557 5.498 ( -2.117 -8.404 3.471) 9.335 5.792 ( 7.294 -2.588 8.033) 11.155 6.141 ( 8.678 5.838 -0.937) 10.501 6.162 ( 7.300 7.890 3.711) 11.372 6.640 ( -1.543 -5.158 6.992) 8.825 6.868 ( 10.184 -9.894 -8.844) 16.728 8.677 ( -6.223 20.280 -3.176) 21.450 8.758 ( 1.088 8.748 2.757) 9.237 9.088 ( -0.124 20.324 4.107) 20.735 9.294 ( 10.431 14.574 0.045) 17.922 9.787 ( -9.654 12.305 -12.054) 19.746 10.260 ( 13.804 14.054 5.862) 20.553 11.074 ( 1.356 -4.029 -0.695) 4.307 11.205 ( 5.286 -0.036 -2.384) 5.799 11.557 ( -7.474 5.637 6.005) 11.123 11.817 ( 6.383 9.367 -5.589) 12.638 13.695 ( -5.210 -9.541 -6.515) 12.673 13.950 ( 5.271 -8.069 8.178) 12.640 14.470 ( -8.185 -13.527 4.365) 16.402 14.680 ( 2.762 -15.124 -6.883) 16.844 17.513 ( -11.232 -11.141 4.467) 16.439 18.220 ( 19.801 -22.942 6.218) 30.937 19.542 ( -15.327 -6.757 -2.747) 16.974 19.851 ( -1.132 -6.318 2.710) 6.967 21.425 ( -20.153 2.806 2.478) 20.497 22.304 ( 21.022 -8.058 -7.292) 23.665 23.428 ( -11.205 10.080 0.480) 15.080 23.775 ( 5.218 8.989 -2.591) 10.712 ======================= Grid point 486 (245/260) ======================= q-point: ( 0.20 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.533 ( 5.597 10.026 2.674) 11.789 2.876 ( 1.499 9.319 -14.247) 17.090 3.032 ( 6.521 -0.329 -4.458) 7.906 3.089 ( 3.900 3.742 10.228) 11.568 3.636 ( -4.989 7.239 -1.584) 8.933 3.752 ( -4.902 8.299 2.272) 9.903 4.356 ( -6.811 2.948 -8.225) 11.078 4.934 ( 0.884 5.557 -8.599) 10.276 5.556 ( 6.955 -5.996 6.812) 11.434 5.948 ( 7.395 1.967 9.447) 12.157 6.320 ( 8.350 5.475 -1.861) 10.157 6.394 ( 14.272 2.323 6.740) 15.954 6.662 ( 2.486 -2.151 3.306) 4.663 7.058 ( 9.692 -10.284 -6.792) 15.679 8.525 ( -8.136 16.434 1.211) 18.377 8.892 ( 8.746 8.552 -2.568) 12.499 9.068 ( 0.067 14.733 1.104) 14.775 9.444 ( 2.965 12.944 3.742) 13.797 9.616 ( -3.811 11.500 -5.125) 13.155 10.555 ( 13.596 10.463 -3.380) 17.485 11.158 ( 7.046 1.644 -3.618) 8.090 11.255 ( -1.366 0.692 -2.605) 3.021 11.466 ( -1.262 9.640 14.811) 17.717 11.928 ( 6.305 12.512 -11.952) 18.416 13.595 ( -3.620 -10.360 -6.095) 12.553 14.043 ( 1.749 -9.336 11.327) 14.783 14.304 ( -8.314 -11.442 1.471) 14.220 14.685 ( -0.942 -15.112 -7.821) 17.042 17.395 ( -2.038 -3.756 10.503) 11.339 18.533 ( 8.819 -21.694 1.834) 23.490 19.234 ( -13.934 -2.759 -3.229) 14.567 19.803 ( -2.840 -7.015 6.589) 10.035 21.086 ( -13.960 5.110 5.552) 15.869 22.591 ( 7.029 -5.710 -16.864) 19.141 23.254 ( -3.912 3.251 5.362) 7.391 23.836 ( 1.672 5.910 -3.774) 7.209 ======================= Grid point 487 (246/260) ======================= q-point: ( 0.30 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( 8.697 4.305 0.178) 9.705 2.857 ( 0.050 5.600 -11.060) 12.397 3.119 ( -3.074 -1.552 8.640) 9.301 3.155 ( 6.680 -4.896 -5.451) 9.915 3.520 ( -6.584 1.918 -2.262) 7.221 3.641 ( -6.164 5.801 2.416) 8.802 4.300 ( 2.517 8.213 -5.206) 10.045 4.884 ( -4.258 5.182 -6.372) 9.251 5.768 ( 11.921 0.315 7.711) 14.201 6.118 ( 7.786 4.221 5.350) 10.347 6.467 ( 6.438 3.852 2.620) 7.946 6.672 ( 9.998 1.727 8.718) 13.377 6.752 ( 7.703 0.235 -5.897) 9.704 7.202 ( 4.920 -8.680 -2.793) 10.361 8.387 ( -5.587 10.834 4.247) 12.908 8.814 ( -9.800 11.254 -11.203) 18.660 9.294 ( 11.873 6.455 8.338) 15.879 9.444 ( 2.074 8.563 -1.005) 8.867 9.671 ( 8.414 10.637 0.110) 13.563 10.693 ( -0.130 4.269 -5.427) 6.907 11.192 ( -1.595 6.911 -1.139) 7.184 11.303 ( 6.281 6.081 -4.879) 10.012 11.564 ( 6.667 13.030 22.521) 26.859 12.015 ( 4.862 14.924 -20.892) 26.131 13.532 ( -1.522 -10.892 -5.780) 12.425 13.997 ( -9.350 -13.618 12.675) 20.821 14.217 ( 0.553 -6.481 1.312) 6.636 14.620 ( -3.863 -13.802 -8.454) 16.640 17.462 ( 6.452 0.987 12.656) 14.239 18.592 ( -0.357 -11.374 -3.565) 11.925 18.956 ( -13.763 -0.197 -3.528) 14.209 19.758 ( -5.420 0.137 2.474) 5.959 20.959 ( 1.269 -4.341 18.550) 19.093 22.473 ( -12.575 -2.549 -23.886) 27.114 23.341 ( 8.853 -4.515 7.129) 12.231 23.835 ( -0.953 2.902 -4.026) 5.054 ======================= Grid point 488 (247/260) ======================= q-point: ( 0.40 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.818 ( 3.788 0.947 -7.543) 8.494 2.906 ( 6.609 2.006 -0.013) 6.907 3.031 ( -4.649 -3.896 4.318) 7.446 3.260 ( 1.996 -4.253 -1.424) 4.909 3.378 ( -4.559 -6.506 -5.112) 9.446 3.530 ( -5.601 -0.570 4.065) 6.944 4.409 ( 8.132 12.119 -1.907) 14.719 4.756 ( -7.523 7.075 -3.161) 10.801 6.014 ( 10.608 5.694 7.753) 14.320 6.231 ( 2.307 6.811 -2.642) 7.661 6.601 ( 6.656 2.635 7.608) 10.446 6.790 ( 2.572 2.609 -5.842) 6.896 6.933 ( 8.959 0.218 3.425) 9.594 7.224 ( -2.487 -4.502 -0.919) 5.225 8.341 ( 0.276 5.350 6.722) 8.596 8.590 ( -9.571 5.249 -12.175) 16.351 9.390 ( 2.175 7.174 10.366) 12.793 9.524 ( 0.697 11.000 -1.849) 11.176 9.971 ( 19.929 2.986 -7.022) 21.340 10.569 ( -10.483 1.780 4.865) 11.693 11.208 ( 3.496 12.579 -7.867) 15.242 11.351 ( -1.050 8.444 0.809) 8.547 11.764 ( 7.713 13.653 28.260) 32.319 12.030 ( 0.784 15.206 -29.094) 32.838 13.526 ( 2.333 -11.463 -5.844) 13.076 13.796 ( -11.298 -12.906 9.135) 19.433 14.279 ( 4.183 -6.566 5.943) 9.795 14.512 ( -5.259 -11.120 -8.505) 14.955 17.685 ( 13.787 2.175 10.229) 17.304 18.428 ( -17.399 1.085 -4.511) 18.008 18.859 ( 8.024 -0.530 -0.126) 8.043 19.523 ( -16.817 9.284 -5.858) 20.082 21.207 ( 17.111 -13.766 29.914) 37.110 22.104 ( -18.916 -7.333 -27.383) 34.079 23.536 ( 8.710 -4.256 5.069) 10.939 23.787 ( -3.226 0.310 -3.887) 5.061 ======================= Grid point 489 (248/260) ======================= q-point: ( 0.50 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( 4.328 0.038 -4.602) 6.318 2.887 ( -4.328 0.038 4.602) 6.318 3.132 ( -9.318 -4.385 -0.172) 10.300 3.132 ( 9.318 -4.385 0.172) 10.300 3.426 ( 4.913 -5.972 -6.935) 10.387 3.426 ( -4.913 -5.972 6.935) 10.387 4.585 ( -9.062 10.482 -0.608) 13.870 4.585 ( 9.062 10.482 0.608) 13.870 6.190 ( -4.730 7.971 -7.797) 12.112 6.190 ( 4.730 7.971 7.797) 12.112 6.745 ( -4.038 2.229 -11.177) 12.091 6.745 ( 4.038 2.229 11.177) 12.091 7.111 ( -5.009 -0.808 -6.736) 8.433 7.111 ( 5.009 -0.808 6.736) 8.433 8.417 ( -3.537 3.027 -14.397) 15.131 8.417 ( 3.537 3.027 14.397) 15.131 9.473 ( -2.309 8.047 -11.252) 14.025 9.473 ( 2.309 8.047 11.252) 14.025 10.322 ( 12.203 2.395 -9.818) 15.845 10.322 ( -12.203 2.395 9.818) 15.845 11.287 ( 3.265 11.816 -10.280) 15.999 11.287 ( -3.265 11.816 10.280) 15.999 11.940 ( -4.133 13.915 -32.168) 35.292 11.940 ( 4.133 13.915 32.168) 35.292 13.615 ( 6.786 -11.993 -7.522) 15.699 13.615 ( -6.786 -11.993 7.522) 15.699 14.390 ( -5.453 -8.257 -7.779) 12.587 14.390 ( 5.453 -8.257 7.779) 12.587 18.033 ( -19.169 2.038 -6.705) 20.410 18.033 ( 19.169 2.038 6.705) 20.410 19.148 ( -16.264 7.295 -6.827) 19.087 19.148 ( 16.264 7.295 6.827) 19.087 21.652 ( -20.518 -12.643 -31.129) 39.368 21.652 ( 20.518 -12.643 31.129) 39.368 23.690 ( -5.628 -2.095 -4.426) 7.461 23.690 ( 5.628 -2.095 4.426) 7.461 ======================= Grid point 495 (249/260) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.867 ( 4.365 11.015 -7.940) 14.263 2.867 ( -4.365 11.015 7.940) 14.263 3.065 ( 0.449 4.978 -5.233) 7.237 3.065 ( -0.449 4.978 5.233) 7.237 4.011 ( 1.696 11.965 -9.712) 15.503 4.011 ( -1.696 11.965 9.712) 15.503 4.804 ( -6.037 1.475 -3.026) 6.912 4.804 ( 6.037 1.475 3.026) 6.912 5.442 ( -10.246 -8.784 -5.845) 14.708 5.442 ( 10.246 -8.784 5.845) 14.708 6.241 ( 0.517 6.639 -14.759) 16.192 6.241 ( -0.517 6.639 14.759) 16.192 6.577 ( 3.875 -4.310 -8.890) 10.612 6.577 ( -3.875 -4.310 8.890) 10.612 9.075 ( -7.364 11.096 -0.755) 13.339 9.075 ( 7.364 11.096 0.755) 13.339 9.502 ( -2.083 20.127 -3.912) 20.609 9.502 ( 2.083 20.127 3.912) 20.609 10.252 ( -9.355 7.249 -7.276) 13.893 10.252 ( 9.355 7.249 7.276) 13.893 11.034 ( -1.807 -2.806 -6.895) 7.660 11.034 ( 1.807 -2.806 6.895) 7.660 11.910 ( 4.715 13.899 -5.898) 15.818 11.910 ( -4.715 13.899 5.898) 15.818 13.555 ( -5.390 -16.807 -9.224) 19.916 13.555 ( 5.390 -16.807 9.224) 19.916 14.315 ( -0.352 -11.416 -2.433) 11.677 14.315 ( 0.352 -11.416 2.433) 11.677 17.450 ( -0.337 -14.987 -19.694) 24.750 17.450 ( 0.337 -14.987 19.694) 24.750 19.663 ( -6.583 -4.728 -3.624) 8.878 19.663 ( 6.583 -4.728 3.624) 8.878 21.802 ( -17.353 -1.767 1.554) 17.512 21.802 ( 17.353 -1.767 -1.554) 17.512 23.821 ( -6.260 6.506 0.229) 9.032 23.821 ( 6.260 6.506 -0.229) 9.032 ======================= Grid point 497 (250/260) ======================= q-point: ( 0.10 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.774 ( -3.343 12.573 5.461) 14.110 2.961 ( 3.079 3.239 -7.103) 8.392 3.065 ( 0.145 3.003 -2.085) 3.659 3.113 ( 3.846 8.904 3.953) 10.474 3.927 ( -5.753 10.175 4.719) 12.606 4.044 ( -0.229 13.327 -2.525) 13.566 4.598 ( -11.157 0.378 -9.108) 14.408 4.926 ( 5.224 -0.324 -8.422) 9.916 5.311 ( -0.303 -8.062 3.262) 8.702 5.719 ( 13.540 -4.231 11.354) 18.170 6.274 ( 5.790 5.818 -6.306) 10.350 6.311 ( 4.233 5.678 9.827) 12.113 6.565 ( 1.385 -1.934 7.791) 8.146 6.688 ( 8.407 -6.623 -10.066) 14.693 8.886 ( -3.271 5.088 0.431) 6.063 9.107 ( -9.478 18.390 1.851) 20.771 9.520 ( 3.339 16.096 -5.654) 17.384 9.629 ( 6.081 16.916 -3.953) 18.406 10.003 ( -10.110 8.817 0.284) 13.418 10.495 ( 11.611 7.174 2.768) 13.927 11.000 ( 4.930 -2.125 -4.538) 7.030 11.185 ( 6.781 -2.143 -1.474) 7.263 11.783 ( -4.770 15.867 7.792) 18.310 12.077 ( 9.206 14.722 -4.964) 18.060 13.417 ( -5.886 -16.809 -6.716) 19.034 13.687 ( 4.827 -16.896 8.978) 19.733 14.221 ( -5.464 -9.022 -1.200) 10.616 14.360 ( 1.106 -13.682 -2.385) 13.932 17.309 ( -3.032 -7.338 6.709) 10.395 17.744 ( 16.823 -20.621 3.025) 26.784 19.445 ( -12.293 -2.771 -2.371) 12.823 19.722 ( -2.113 -5.533 2.751) 6.531 21.484 ( -14.972 2.532 1.433) 15.252 22.160 ( 18.282 -5.398 -3.399) 19.363 23.602 ( -13.639 6.145 0.650) 14.973 23.925 ( 2.779 5.205 -2.473) 6.398 ======================= Grid point 498 (251/260) ======================= q-point: ( 0.20 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( 0.313 9.983 3.592) 10.614 2.985 ( 1.149 -0.473 -9.264) 9.347 3.048 ( -1.261 2.459 -3.354) 4.346 3.171 ( 0.062 5.818 7.175) 9.238 3.780 ( -10.384 5.507 2.755) 12.072 3.943 ( -10.203 8.198 -1.897) 13.225 4.443 ( -0.392 4.987 -7.950) 9.393 4.957 ( -0.224 -3.337 -10.797) 11.303 5.459 ( 13.341 -2.101 5.666) 14.646 5.988 ( 11.044 1.283 13.899) 17.799 6.425 ( 6.289 4.194 2.454) 7.948 6.454 ( 11.694 3.080 3.434) 12.571 6.645 ( 5.187 0.360 4.854) 7.113 6.859 ( 10.094 -8.074 -10.405) 16.593 8.863 ( -13.790 14.341 3.148) 20.143 8.983 ( 11.560 2.716 -3.701) 12.438 9.396 ( -11.151 11.576 -9.130) 18.485 9.665 ( -2.995 8.042 3.748) 9.364 9.933 ( 1.403 17.920 -0.195) 17.976 10.709 ( 7.821 3.542 -0.175) 8.587 11.197 ( 14.315 3.486 -10.035) 17.826 11.261 ( 1.549 -0.183 3.355) 3.700 11.782 ( 3.284 19.183 9.294) 21.567 12.251 ( 9.205 16.887 -7.882) 20.785 13.305 ( -4.174 -17.042 -6.651) 18.764 13.756 ( -0.406 -16.722 11.769) 20.452 14.112 ( -4.279 -7.045 -3.318) 8.885 14.352 ( -1.154 -14.952 -3.535) 15.408 17.344 ( 4.232 -0.656 12.412) 13.130 18.077 ( 15.330 -20.053 -0.506) 25.247 19.230 ( -8.952 1.697 -0.205) 9.114 19.633 ( -4.914 -8.322 5.707) 11.223 21.198 ( -14.359 4.968 2.603) 15.415 22.458 ( 10.311 -6.041 -10.952) 16.210 23.323 ( -12.469 2.659 4.240) 13.436 23.934 ( -1.092 3.327 -3.258) 4.783 ======================= Grid point 499 (252/260) ======================= q-point: ( 0.30 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.790 ( 2.758 5.461 0.912) 6.185 2.949 ( -2.413 2.252 -12.180) 12.619 3.034 ( -0.292 -3.565 -1.037) 3.724 3.159 ( -1.249 2.955 8.087) 8.700 3.517 ( -14.834 -1.194 -4.629) 15.586 3.707 ( -11.996 0.401 3.209) 12.425 4.518 ( 6.877 10.637 -4.600) 13.476 4.913 ( -2.222 -1.737 -6.190) 6.802 5.791 ( 17.673 1.970 4.656) 18.382 6.211 ( 9.124 4.038 11.465) 15.199 6.555 ( 6.115 4.278 4.551) 8.741 6.700 ( 10.016 0.606 8.379) 13.073 6.780 ( 8.406 2.262 -6.038) 10.594 7.029 ( 8.128 -7.232 -7.434) 13.177 8.607 ( -11.624 8.782 2.507) 14.783 8.988 ( -13.326 5.727 -9.198) 17.175 9.426 ( 16.696 5.192 -2.139) 17.615 9.602 ( -1.885 6.570 7.175) 9.909 9.951 ( 0.426 13.926 -6.832) 15.517 10.750 ( -3.698 1.283 4.918) 6.286 11.328 ( 4.734 5.223 7.814) 10.524 11.434 ( 9.837 7.960 -13.847) 18.757 11.921 ( 8.115 19.543 10.743) 23.732 12.394 ( 6.286 19.521 -13.050) 24.308 13.230 ( -1.925 -17.589 -6.593) 18.882 13.690 ( -7.980 -14.704 11.366) 20.225 14.074 ( 0.892 -7.055 -1.087) 7.194 14.310 ( -2.148 -14.435 -4.349) 15.228 17.495 ( 8.450 2.091 12.758) 15.444 18.355 ( 14.064 -10.083 -5.505) 18.160 19.005 ( -14.622 4.046 0.890) 15.198 19.660 ( 5.375 -8.161 8.303) 12.823 20.944 ( -10.398 2.133 9.249) 14.078 22.389 ( -14.558 -4.753 -23.311) 27.892 23.260 ( 5.274 -3.128 11.239) 12.803 23.881 ( -3.397 1.489 -3.910) 5.389 ======================= Grid point 500 (253/260) ======================= q-point: ( 0.40 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.844 ( 1.845 1.524 -3.512) 4.250 2.916 ( 2.507 -0.560 -4.665) 5.326 2.982 ( -4.690 -1.644 1.047) 5.079 3.178 ( -1.961 -4.162 2.511) 5.242 3.253 ( -5.883 -3.224 -3.829) 7.724 3.495 ( -9.789 -2.911 3.335) 10.743 4.652 ( 6.659 9.903 -2.241) 12.142 4.850 ( -3.400 2.232 -2.253) 4.649 6.129 ( 14.519 4.831 3.770) 15.759 6.364 ( 3.760 5.326 4.346) 7.835 6.682 ( 5.744 4.702 6.949) 10.168 6.848 ( 3.181 2.453 -4.682) 6.169 6.929 ( 7.342 -0.574 4.771) 8.775 7.136 ( 2.904 -3.571 -6.209) 7.729 8.448 ( -3.654 3.838 0.591) 5.332 8.695 ( -13.192 4.826 -4.377) 14.713 9.553 ( 0.649 7.302 13.744) 15.577 9.719 ( 1.798 6.763 -14.507) 16.107 10.044 ( 15.380 3.735 -7.131) 17.359 10.622 ( -10.165 2.883 11.616) 15.703 11.443 ( 4.677 8.765 6.101) 11.659 11.529 ( 2.549 9.826 -11.212) 15.125 12.111 ( 8.348 18.343 14.640) 24.910 12.421 ( -1.327 20.161 -18.069) 27.106 13.226 ( 3.241 -16.603 -6.233) 18.028 13.517 ( -10.363 -13.004 9.116) 18.963 14.122 ( 3.260 -7.998 2.626) 9.027 14.257 ( -2.432 -12.346 -4.695) 13.431 17.731 ( 13.871 1.996 8.051) 16.162 18.448 ( -12.599 0.686 -5.660) 13.829 18.897 ( 13.325 3.760 4.621) 14.596 19.666 ( -9.497 3.750 -2.843) 10.599 20.952 ( 10.491 -9.406 24.624) 28.370 21.927 ( -24.782 -8.722 -27.201) 37.817 23.451 ( 9.867 -3.557 9.171) 13.932 23.787 ( -5.401 -0.251 -4.977) 7.349 ======================= Grid point 501 (254/260) ======================= q-point: ( 0.50 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( 1.756 -0.054 -4.140) 4.498 2.887 ( -1.756 -0.054 4.140) 4.498 3.023 ( -3.091 -5.329 -2.038) 6.489 3.023 ( 3.091 -5.329 2.038) 6.489 3.331 ( -3.069 -3.317 -1.459) 4.748 3.331 ( 3.069 -3.317 1.459) 4.748 4.766 ( -4.726 6.524 0.077) 8.057 4.766 ( 4.726 6.524 -0.077) 8.057 6.345 ( -3.455 6.190 -4.736) 8.525 6.345 ( 3.455 6.190 4.736) 8.525 6.805 ( -4.262 3.347 -9.025) 10.527 6.805 ( 4.262 3.347 9.025) 10.527 7.090 ( -4.882 -1.231 -8.986) 10.300 7.090 ( 4.882 -1.231 8.986) 10.300 8.484 ( -0.252 2.952 -13.060) 13.392 8.484 ( 0.252 2.952 13.060) 13.392 9.631 ( -4.179 6.373 -16.536) 18.207 9.631 ( 4.179 6.373 16.536) 18.207 10.380 ( 14.490 2.778 -10.748) 18.254 10.380 ( -14.490 2.778 10.748) 18.254 11.518 ( -0.052 10.306 -13.397) 16.903 11.518 ( 0.052 10.306 13.397) 16.903 12.296 ( -6.438 18.346 -19.807) 27.755 12.296 ( 6.438 18.346 19.807) 27.755 13.337 ( 7.796 -13.706 -7.667) 17.534 13.337 ( -7.796 -13.706 7.667) 17.534 14.194 ( -2.316 -9.808 -5.746) 11.601 14.194 ( 2.316 -9.808 5.746) 11.601 18.076 ( -19.191 1.903 -4.716) 19.853 18.076 ( 19.191 1.903 4.716) 19.853 19.312 ( -21.637 7.754 -6.711) 23.944 19.312 ( 21.637 7.754 6.711) 23.944 21.376 ( -24.088 -12.637 -29.478) 40.110 21.376 ( 24.088 -12.637 29.478) 40.110 23.645 ( -7.719 -2.016 -6.991) 10.608 23.645 ( 7.719 -2.016 6.991) 10.608 ======================= Grid point 507 (255/260) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.989 ( 0.366 1.872 -6.004) 6.300 2.989 ( -0.366 1.872 6.004) 6.300 3.176 ( 2.741 3.936 -5.279) 7.132 3.176 ( -2.741 3.936 5.279) 7.132 4.223 ( 6.259 6.303 -15.108) 17.526 4.223 ( -6.259 6.303 15.108) 17.526 4.826 ( -4.081 0.849 -1.939) 4.598 4.826 ( 4.081 0.849 1.939) 4.598 5.278 ( -12.624 -5.400 -2.667) 13.987 5.278 ( 12.624 -5.400 2.667) 13.987 6.325 ( -0.436 1.539 -10.221) 10.346 6.325 ( 0.436 1.539 10.221) 10.346 6.532 ( 1.523 -0.381 -2.382) 2.853 6.532 ( -1.523 -0.381 2.382) 2.853 9.238 ( 18.534 4.120 -8.031) 20.615 9.238 ( -18.534 4.120 8.031) 20.615 9.845 ( 2.473 10.116 -5.800) 11.920 9.845 ( -2.473 10.116 5.800) 11.920 10.315 ( -5.929 -0.012 -19.901) 20.766 10.315 ( 5.929 -0.012 19.901) 20.766 10.996 ( -4.803 -0.785 -2.678) 5.555 10.996 ( 4.803 -0.785 2.678) 5.555 12.221 ( 4.093 12.403 -4.988) 13.981 12.221 ( -4.093 12.403 4.988) 13.981 13.186 ( -5.706 -14.263 -5.666) 16.374 13.186 ( 5.706 -14.263 5.666) 16.374 14.155 ( -1.176 -3.778 -3.889) 5.548 14.155 ( 1.176 -3.778 3.889) 5.548 17.226 ( 3.411 -5.626 -20.690) 21.711 17.226 ( -3.411 -5.626 20.690) 21.711 19.595 ( -6.355 -1.658 -3.971) 7.675 19.595 ( 6.355 -1.658 3.971) 7.675 21.779 ( -14.168 -0.493 1.063) 14.216 21.779 ( 14.168 -0.493 -1.063) 14.216 23.909 ( -7.292 2.044 0.723) 7.608 23.909 ( 7.292 2.044 -0.723) 7.608 ======================= Grid point 509 (256/260) ======================= q-point: ( 0.10 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( -2.300 4.161 0.834) 4.827 2.988 ( -0.876 0.171 -0.264) 0.931 3.111 ( -2.426 1.801 3.923) 4.952 3.268 ( 3.845 4.220 -2.258) 6.139 4.092 ( -9.695 4.528 13.189) 16.984 4.306 ( 1.691 9.114 -11.417) 14.706 4.580 ( -13.374 -1.093 -9.528) 16.458 4.863 ( 0.099 -4.539 -9.988) 10.971 5.213 ( 5.889 -1.240 6.575) 8.913 5.634 ( 18.640 -2.966 9.805) 21.269 6.351 ( 5.089 1.418 -9.931) 11.249 6.390 ( 3.404 1.842 14.092) 14.614 6.553 ( 3.409 0.227 2.987) 4.538 6.603 ( 5.654 -1.616 -5.438) 8.009 8.964 ( -6.456 2.049 2.948) 7.387 9.397 ( -9.205 7.838 -2.451) 12.336 9.749 ( 3.161 6.449 -3.567) 8.019 9.836 ( -10.231 1.871 -1.098) 10.459 10.223 ( 4.358 10.266 -14.227) 18.077 10.543 ( 9.281 -1.720 10.831) 14.367 10.991 ( 8.441 0.580 -4.495) 9.581 11.139 ( 6.523 -1.493 1.806) 6.931 12.163 ( -0.713 17.528 5.924) 18.515 12.351 ( 7.750 6.875 -2.303) 10.613 13.069 ( -4.649 -11.698 -6.713) 14.266 13.312 ( 5.550 -15.123 4.525) 16.733 14.097 ( -3.746 -2.940 -4.666) 6.667 14.158 ( -1.308 -4.975 3.213) 6.065 17.233 ( 3.162 0.228 15.357) 15.681 17.405 ( 13.891 -10.677 -5.766) 18.444 19.413 ( -9.444 -0.602 -2.705) 9.842 19.636 ( -3.501 -2.266 3.239) 5.280 21.523 ( -12.262 1.002 1.256) 12.366 22.083 ( 16.146 -1.888 -1.682) 16.342 23.686 ( -14.738 1.944 0.311) 14.869 23.996 ( 1.514 1.606 -1.918) 2.924 ======================= Grid point 510 (257/260) ======================= q-point: ( 0.20 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.913 ( -1.826 4.563 1.098) 5.036 2.964 ( -1.099 -1.128 -2.069) 2.600 3.074 ( -2.350 0.709 2.684) 3.637 3.287 ( -1.768 3.437 -2.059) 4.379 3.859 ( -15.739 1.937 7.758) 17.654 4.050 ( -19.978 2.062 -6.227) 21.027 4.553 ( 7.570 4.589 -9.114) 12.706 4.845 ( 0.322 -5.162 -7.665) 9.247 5.458 ( 16.368 0.839 4.735) 17.060 5.996 ( 15.038 -0.152 13.491) 20.203 6.487 ( 8.190 1.568 -2.476) 8.699 6.503 ( 6.715 1.219 12.537) 14.274 6.667 ( 7.548 1.358 -0.310) 7.676 6.735 ( 8.909 -3.535 -9.962) 13.824 9.024 ( 10.683 1.164 -1.263) 10.821 9.080 ( -18.433 5.414 -0.647) 19.222 9.525 ( -15.048 2.173 -0.554) 15.214 9.789 ( -3.010 3.281 -0.041) 4.452 10.269 ( 0.856 10.969 -19.207) 22.135 10.710 ( 4.802 -2.161 12.387) 13.460 11.257 ( 5.664 0.019 6.839) 8.880 11.289 ( 19.320 3.497 -10.169) 22.111 12.216 ( 4.727 20.649 4.613) 21.680 12.516 ( 9.031 1.328 -0.846) 9.168 12.978 ( -3.361 -7.903 -8.492) 12.077 13.405 ( 2.392 -14.161 4.065) 14.926 14.003 ( -4.144 -2.920 -5.194) 7.258 14.123 ( -2.514 -5.879 3.150) 7.128 17.371 ( 6.523 2.509 18.873) 20.125 17.744 ( 21.033 -10.163 -6.561) 24.263 19.286 ( -2.635 2.883 1.996) 4.386 19.481 ( -10.927 -5.287 3.784) 12.715 21.275 ( -13.388 2.000 1.722) 13.646 22.365 ( 10.573 -2.429 -7.727) 13.319 23.359 ( -16.315 0.818 3.437) 16.693 23.978 ( -2.455 1.005 -2.780) 3.843 ======================= Grid point 511 (258/260) ======================= q-point: ( 0.30 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.889 ( -0.700 3.392 0.620) 3.519 2.940 ( -0.973 -1.831 -3.697) 4.239 3.020 ( -3.333 1.075 -0.204) 3.508 3.204 ( -5.495 0.389 -3.577) 6.568 3.523 ( -17.157 2.096 1.016) 17.314 3.670 ( -16.532 -2.990 1.186) 16.842 4.697 ( 7.202 5.760 -5.407) 10.690 4.852 ( 1.063 -3.104 -2.969) 4.425 5.833 ( 19.626 1.388 2.524) 19.837 6.270 ( 10.260 1.429 13.611) 17.105 6.636 ( 7.106 3.209 8.355) 11.428 6.692 ( 8.539 -1.391 6.239) 10.666 6.835 ( 8.635 2.721 -8.239) 12.241 6.909 ( 10.356 -4.125 -8.981) 14.315 8.725 ( -15.869 2.520 -2.447) 16.253 9.078 ( -12.729 2.550 1.898) 13.120 9.490 ( 17.480 1.245 -5.468) 18.358 9.706 ( -4.376 2.749 5.396) 7.471 10.174 ( -5.713 5.943 -21.039) 22.596 10.762 ( -2.198 0.142 15.993) 16.144 11.406 ( 7.614 2.060 10.805) 13.378 11.601 ( 12.415 5.784 -13.587) 19.292 12.345 ( 7.022 20.180 3.076) 21.588 12.703 ( 9.873 -2.862 -0.968) 10.324 12.893 ( -3.891 -2.909 -9.797) 10.935 13.394 ( -4.502 -12.228 3.464) 13.483 13.947 ( -0.012 -3.854 -4.903) 6.236 14.080 ( -2.191 -6.108 3.457) 7.352 17.537 ( 7.772 1.394 13.415) 15.567 18.198 ( 24.697 -4.208 -6.689) 25.930 19.100 ( -16.805 3.933 4.476) 17.830 19.488 ( 10.824 -6.239 9.135) 15.477 20.997 ( -14.375 1.828 5.031) 15.339 22.307 ( -16.048 -2.378 -22.036) 27.363 23.214 ( 2.718 -1.163 12.926) 13.260 23.900 ( -4.639 0.406 -3.993) 6.135 ======================= Grid point 512 (259/260) ======================= q-point: ( 0.40 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.880 ( -1.110 1.562 1.455) 2.406 2.910 ( -0.320 -0.325 -5.408) 5.427 2.956 ( -2.533 0.290 -1.337) 2.879 3.057 ( -8.348 -5.369 -5.193) 11.202 3.283 ( -5.364 3.645 2.250) 6.864 3.414 ( -9.794 -4.247 3.300) 11.173 4.804 ( 4.209 4.444 -2.778) 6.721 4.866 ( 0.359 -0.484 -0.264) 0.658 6.202 ( 16.211 1.911 0.198) 16.325 6.441 ( 4.154 1.882 9.125) 10.202 6.779 ( 5.365 3.889 5.356) 8.520 6.864 ( 7.613 -1.327 4.540) 8.963 6.925 ( 2.308 0.541 -0.585) 2.442 7.081 ( 6.260 -1.470 -11.148) 12.870 8.494 ( -5.254 0.848 -4.872) 7.216 8.779 ( -15.527 2.459 5.127) 16.536 9.663 ( -0.583 2.742 11.149) 11.496 9.803 ( 5.434 1.661 -19.504) 20.314 10.108 ( 9.750 1.788 -8.976) 13.372 10.673 ( -9.739 1.480 14.988) 17.936 11.575 ( 6.828 3.595 11.231) 13.626 11.724 ( 2.868 6.472 -12.358) 14.242 12.489 ( 6.732 16.973 3.813) 18.653 12.778 ( -6.055 3.437 -9.139) 11.489 12.897 ( 9.809 -5.314 -2.257) 11.382 13.258 ( -8.702 -11.096 2.800) 14.377 13.974 ( 2.689 -4.774 -3.844) 6.693 14.049 ( -1.685 -5.907 3.469) 7.055 17.762 ( 13.773 0.798 6.403) 15.210 18.457 ( -8.603 0.205 -6.973) 11.076 18.982 ( 15.176 3.059 8.774) 17.794 19.686 ( 1.342 -0.762 1.878) 2.431 20.834 ( 0.981 -2.221 18.044) 18.207 21.780 ( -28.851 -4.207 -26.551) 39.434 23.398 ( 10.437 -1.385 11.668) 15.716 23.781 ( -6.587 -0.196 -5.958) 8.884 ======================= Grid point 513 (260/260) ======================= q-point: ( 0.50 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.885 ( -1.173 -0.136 -5.991) 6.106 2.885 ( 1.173 -0.136 5.991) 6.106 2.939 ( 0.532 -2.132 -2.407) 3.260 2.939 ( -0.532 -2.132 2.407) 3.260 3.283 ( -2.273 -1.217 -0.517) 2.630 3.283 ( 2.273 -1.217 0.517) 2.630 4.857 ( 0.761 2.155 -1.883) 2.961 4.857 ( -0.761 2.155 1.883) 2.961 6.434 ( 3.815 2.148 -3.721) 5.745 6.434 ( -3.815 2.148 3.721) 5.745 6.870 ( -3.071 2.253 -5.432) 6.634 6.870 ( 3.071 2.253 5.432) 6.634 7.062 ( -5.554 -1.154 -11.124) 12.487 7.062 ( 5.554 -1.155 11.124) 12.487 8.529 ( 5.477 1.193 -7.458) 9.329 8.529 ( -5.477 1.193 7.458) 9.329 9.722 ( -3.799 2.196 -17.489) 18.031 9.722 ( 3.799 2.196 17.489) 18.031 10.425 ( 16.761 1.210 -10.414) 19.770 10.425 ( -16.761 1.210 10.414) 19.770 11.697 ( -2.963 5.396 -11.283) 12.853 11.697 ( 2.963 5.396 11.283) 12.853 12.632 ( -5.370 11.299 -8.991) 15.406 12.632 ( 5.370 11.299 8.991) 15.406 13.083 ( -0.609 -8.910 -2.717) 9.335 13.083 ( 0.609 -8.910 2.717) 9.335 14.018 ( 1.538 -5.462 -5.098) 7.628 14.018 ( -1.538 -5.462 5.098) 7.628 18.106 ( -19.274 0.788 -3.492) 19.604 18.106 ( 19.274 0.788 3.492) 19.604 19.442 ( -21.917 3.704 -6.379) 23.125 19.442 ( 21.917 3.704 6.379) 23.125 21.171 ( -25.127 -5.686 -27.637) 37.782 21.171 ( 25.127 -5.686 27.637) 37.782 23.614 ( -9.003 -0.833 -8.672) 12.528 23.614 ( 9.003 -0.833 8.672) 12.528 =================== 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 3/32400 10.0 1398.470 2605.171 2254.744 0.000 69.263 0.000 3/32400 20.0 491.305 471.463 638.509 0.000 58.829 0.000 3/32400 30.0 193.464 161.991 227.016 0.000 25.354 0.000 3/32400 40.0 99.724 80.581 112.941 0.000 13.300 0.000 3/32400 50.0 61.328 48.794 68.527 0.000 8.185 0.000 3/32400 60.0 42.238 33.362 47.031 0.000 5.578 0.000 3/32400 70.0 31.413 24.746 35.022 0.000 4.082 0.000 3/32400 80.0 24.672 19.439 27.603 0.000 3.147 0.000 3/32400 90.0 20.170 15.923 22.670 0.000 2.525 0.000 3/32400 100.0 16.999 13.458 19.201 0.000 2.090 0.000 3/32400 110.0 14.668 11.652 16.650 0.000 1.773 0.000 3/32400 120.0 12.896 10.279 14.707 0.000 1.534 0.000 3/32400 130.0 11.511 9.204 13.183 0.000 1.350 0.000 3/32400 140.0 10.403 8.341 11.958 0.000 1.205 0.000 3/32400 150.0 9.498 7.633 10.953 0.000 1.088 0.000 3/32400 160.0 8.747 7.043 10.114 0.000 0.992 0.000 3/32400 170.0 8.115 6.542 9.402 0.000 0.913 0.000 3/32400 180.0 7.575 6.112 8.791 0.000 0.846 0.000 3/32400 190.0 7.110 5.739 8.261 0.000 0.789 0.000 3/32400 200.0 6.704 5.412 7.796 0.000 0.741 0.000 3/32400 210.0 6.347 5.123 7.384 0.000 0.699 0.000 3/32400 220.0 6.030 4.864 7.017 0.000 0.662 0.000 3/32400 230.0 5.747 4.632 6.688 0.000 0.629 0.000 3/32400 240.0 5.492 4.423 6.390 0.000 0.601 0.000 3/32400 250.0 5.261 4.233 6.119 0.000 0.575 0.000 3/32400 260.0 5.051 4.059 5.873 0.000 0.551 0.000 3/32400 270.0 4.859 3.900 5.646 0.000 0.530 0.000 3/32400 280.0 4.682 3.753 5.438 0.000 0.511 0.000 3/32400 290.0 4.519 3.618 5.245 0.000 0.494 0.000 3/32400 300.0 4.368 3.492 5.066 0.000 0.477 0.000 3/32400 310.0 4.228 3.376 4.900 0.000 0.462 0.000 3/32400 320.0 4.097 3.267 4.744 0.000 0.448 0.000 3/32400 330.0 3.974 3.165 4.599 0.000 0.435 0.000 3/32400 340.0 3.859 3.069 4.463 0.000 0.423 0.000 3/32400 350.0 3.751 2.980 4.335 0.000 0.412 0.000 3/32400 360.0 3.649 2.895 4.214 0.000 0.401 0.000 3/32400 370.0 3.553 2.816 4.100 0.000 0.391 0.000 3/32400 380.0 3.462 2.740 3.992 0.000 0.381 0.000 3/32400 390.0 3.375 2.669 3.890 0.000 0.372 0.000 3/32400 400.0 3.293 2.602 3.793 0.000 0.364 0.000 3/32400 410.0 3.215 2.537 3.701 0.000 0.355 0.000 3/32400 420.0 3.141 2.476 3.614 0.000 0.348 0.000 3/32400 430.0 3.070 2.418 3.530 0.000 0.340 0.000 3/32400 440.0 3.003 2.363 3.451 0.000 0.333 0.000 3/32400 450.0 2.938 2.310 3.375 0.000 0.326 0.000 3/32400 460.0 2.876 2.260 3.302 0.000 0.320 0.000 3/32400 470.0 2.817 2.211 3.232 0.000 0.313 0.000 3/32400 480.0 2.760 2.165 3.166 0.000 0.307 0.000 3/32400 490.0 2.706 2.121 3.102 0.000 0.302 0.000 3/32400 500.0 2.653 2.078 3.040 0.000 0.296 0.000 3/32400 510.0 2.603 2.037 2.981 0.000 0.291 0.000 3/32400 520.0 2.554 1.998 2.925 0.000 0.286 0.000 3/32400 530.0 2.508 1.960 2.870 0.000 0.281 0.000 3/32400 540.0 2.463 1.924 2.817 0.000 0.276 0.000 3/32400 550.0 2.419 1.889 2.767 0.000 0.271 0.000 3/32400 560.0 2.377 1.855 2.718 0.000 0.267 0.000 3/32400 570.0 2.337 1.823 2.671 0.000 0.262 0.000 3/32400 580.0 2.298 1.791 2.625 0.000 0.258 0.000 3/32400 590.0 2.260 1.761 2.581 0.000 0.254 0.000 3/32400 600.0 2.223 1.731 2.539 0.000 0.250 0.000 3/32400 610.0 2.188 1.703 2.497 0.000 0.246 0.000 3/32400 620.0 2.154 1.676 2.458 0.000 0.242 0.000 3/32400 630.0 2.120 1.649 2.419 0.000 0.239 0.000 3/32400 640.0 2.088 1.623 2.382 0.000 0.235 0.000 3/32400 650.0 2.057 1.598 2.345 0.000 0.232 0.000 3/32400 660.0 2.026 1.574 2.310 0.000 0.229 0.000 3/32400 670.0 1.997 1.551 2.276 0.000 0.225 0.000 3/32400 680.0 1.968 1.528 2.243 0.000 0.222 0.000 3/32400 690.0 1.940 1.506 2.211 0.000 0.219 0.000 3/32400 700.0 1.913 1.484 2.179 0.000 0.216 0.000 3/32400 710.0 1.887 1.463 2.149 0.000 0.213 0.000 3/32400 720.0 1.861 1.443 2.119 0.000 0.211 0.000 3/32400 730.0 1.837 1.423 2.091 0.000 0.208 0.000 3/32400 740.0 1.812 1.404 2.063 0.000 0.205 0.000 3/32400 750.0 1.789 1.385 2.035 0.000 0.203 0.000 3/32400 760.0 1.766 1.367 2.009 0.000 0.200 0.000 3/32400 770.0 1.743 1.349 1.983 0.000 0.198 0.000 3/32400 780.0 1.721 1.332 1.958 0.000 0.195 0.000 3/32400 790.0 1.700 1.315 1.933 0.000 0.193 0.000 3/32400 800.0 1.679 1.299 1.909 0.000 0.191 0.000 3/32400 810.0 1.659 1.283 1.886 0.000 0.188 0.000 3/32400 820.0 1.639 1.267 1.863 0.000 0.186 0.000 3/32400 830.0 1.620 1.252 1.841 0.000 0.184 0.000 3/32400 840.0 1.601 1.237 1.819 0.000 0.182 0.000 3/32400 850.0 1.582 1.223 1.798 0.000 0.180 0.000 3/32400 860.0 1.564 1.208 1.777 0.000 0.178 0.000 3/32400 870.0 1.546 1.195 1.757 0.000 0.176 0.000 3/32400 880.0 1.529 1.181 1.737 0.000 0.174 0.000 3/32400 890.0 1.512 1.168 1.718 0.000 0.172 0.000 3/32400 900.0 1.496 1.155 1.699 0.000 0.170 0.000 3/32400 910.0 1.480 1.142 1.680 0.000 0.168 0.000 3/32400 920.0 1.464 1.130 1.662 0.000 0.167 0.000 3/32400 930.0 1.448 1.118 1.644 0.000 0.165 0.000 3/32400 940.0 1.433 1.106 1.627 0.000 0.163 0.000 3/32400 950.0 1.418 1.094 1.610 0.000 0.162 0.000 3/32400 960.0 1.404 1.083 1.593 0.000 0.160 0.000 3/32400 970.0 1.389 1.072 1.577 0.000 0.158 0.000 3/32400 980.0 1.375 1.061 1.561 0.000 0.157 0.000 3/32400 990.0 1.362 1.050 1.545 0.000 0.155 0.000 3/32400 1000.0 1.348 1.040 1.530 0.000 0.154 0.000 3/32400 Thermal conductivity related properties were written into "kappa-m10910.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:30:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|