----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 17:17:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.649113040093259 0.000000000000000 0.000000000000000 b 0.000000000000000 5.580623740000000 0.000000000000000 c -2.142030708188198 0.000000000000000 5.251996201903755 Atomic positions (fractional): *1 Fe 0.21184894704873 0.50917533015774 0.70262893327894 55.845 2 Fe 0.78815105295127 0.49082466984226 0.29737106672106 55.845 3 Fe 0.78815105295127 0.00917533015774 0.79737106672106 55.845 4 Fe 0.21184894704873 0.99082466984226 0.20262893327894 55.845 *5 As 0.64638206975766 0.63279132940443 0.87212600023237 74.922 6 As 0.35361793024234 0.13279132940443 0.62787399976763 74.922 7 As 0.64638206975766 0.86720867059557 0.37212600023238 74.922 8 As 0.35361793024234 0.36720867059557 0.12787399976763 74.922 *9 S 0.84810815763818 0.13358018666725 0.17754475034916 32.065 10 S 0.15189184236182 0.63358018666725 0.32245524965084 32.065 11 S 0.84810815763818 0.36641981333275 0.67754475034916 32.065 12 S 0.15189184236182 0.86641981333275 0.82245524965084 32.065 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.649113040093259 0.000000000000000 0.000000000000000 b 0.000000000000000 5.580623740000000 0.000000000000000 c -2.142030708188198 0.000000000000000 5.251996201903755 Atomic positions (fractional): *1 Fe 0.21184894704873 0.50917533015774 0.70262893327894 55.845 > 1 2 Fe 0.78815105295127 0.49082466984226 0.29737106672106 55.845 > 2 3 Fe 0.78815105295127 0.00917533015774 0.79737106672106 55.845 > 3 4 Fe 0.21184894704873 0.99082466984226 0.20262893327894 55.845 > 4 *5 As 0.64638206975766 0.63279132940443 0.87212600023237 74.922 > 5 6 As 0.35361793024234 0.13279132940443 0.62787399976763 74.922 > 6 7 As 0.64638206975766 0.86720867059557 0.37212600023238 74.922 > 7 8 As 0.35361793024234 0.36720867059557 0.12787399976763 74.922 > 8 *9 S 0.84810815763818 0.13358018666725 0.17754475034916 32.065 > 9 10 S 0.15189184236182 0.63358018666725 0.32245524965084 32.065 > 10 11 S 0.84810815763818 0.36641981333275 0.67754475034916 32.065 > 11 12 S 0.15189184236182 0.86641981333275 0.82245524965084 32.065 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.298226080186518 0.000000000000000 0.000000000000000 b 0.000000000000000 16.741871220000000 0.000000000000000 c -4.284061416376396 0.000000000000000 10.503992403807510 Atomic positions (fractional): *1 Fe 0.10592447352437 0.16972511005258 0.35131446663947 55.845 > 1 2 Fe 0.60592447352437 0.16972511005258 0.35131446663947 55.845 > 1 3 Fe 0.10592447352437 0.50305844338591 0.35131446663947 55.845 > 1 4 Fe 0.60592447352437 0.50305844338591 0.35131446663947 55.845 > 1 5 Fe 0.10592447352437 0.83639177671925 0.35131446663947 55.845 > 1 6 Fe 0.60592447352437 0.83639177671925 0.35131446663947 55.845 > 1 7 Fe 0.10592447352437 0.16972511005258 0.85131446663947 55.845 > 1 8 Fe 0.60592447352437 0.16972511005258 0.85131446663947 55.845 > 1 9 Fe 0.10592447352437 0.50305844338591 0.85131446663947 55.845 > 1 10 Fe 0.60592447352437 0.50305844338591 0.85131446663947 55.845 > 1 11 Fe 0.10592447352437 0.83639177671925 0.85131446663947 55.845 > 1 12 Fe 0.60592447352437 0.83639177671925 0.85131446663947 55.845 > 1 13 Fe 0.39407552647563 0.16360822328075 0.14868553336053 55.845 > 2 14 Fe 0.89407552647563 0.16360822328075 0.14868553336053 55.845 > 2 15 Fe 0.39407552647563 0.49694155661409 0.14868553336053 55.845 > 2 16 Fe 0.89407552647563 0.49694155661409 0.14868553336053 55.845 > 2 17 Fe 0.39407552647563 0.83027488994742 0.14868553336053 55.845 > 2 18 Fe 0.89407552647563 0.83027488994742 0.14868553336053 55.845 > 2 19 Fe 0.39407552647563 0.16360822328075 0.64868553336053 55.845 > 2 20 Fe 0.89407552647563 0.16360822328075 0.64868553336053 55.845 > 2 21 Fe 0.39407552647563 0.49694155661409 0.64868553336053 55.845 > 2 22 Fe 0.89407552647563 0.49694155661409 0.64868553336053 55.845 > 2 23 Fe 0.39407552647563 0.83027488994742 0.64868553336053 55.845 > 2 24 Fe 0.89407552647563 0.83027488994742 0.64868553336053 55.845 > 2 25 Fe 0.39407552647563 0.00305844338591 0.39868553336053 55.845 > 3 26 Fe 0.89407552647563 0.00305844338591 0.39868553336053 55.845 > 3 27 Fe 0.39407552647563 0.33639177671925 0.39868553336053 55.845 > 3 28 Fe 0.89407552647563 0.33639177671925 0.39868553336053 55.845 > 3 29 Fe 0.39407552647563 0.66972511005258 0.39868553336053 55.845 > 3 30 Fe 0.89407552647563 0.66972511005258 0.39868553336053 55.845 > 3 31 Fe 0.39407552647563 0.00305844338591 0.89868553336053 55.845 > 3 32 Fe 0.89407552647563 0.00305844338591 0.89868553336053 55.845 > 3 33 Fe 0.39407552647563 0.33639177671925 0.89868553336053 55.845 > 3 34 Fe 0.89407552647563 0.33639177671925 0.89868553336053 55.845 > 3 35 Fe 0.39407552647563 0.66972511005258 0.89868553336053 55.845 > 3 36 Fe 0.89407552647563 0.66972511005258 0.89868553336053 55.845 > 3 37 Fe 0.10592447352437 0.33027488994742 0.10131446663947 55.845 > 4 38 Fe 0.60592447352437 0.33027488994742 0.10131446663947 55.845 > 4 39 Fe 0.10592447352437 0.66360822328075 0.10131446663947 55.845 > 4 40 Fe 0.60592447352437 0.66360822328075 0.10131446663947 55.845 > 4 41 Fe 0.10592447352437 0.99694155661409 0.10131446663947 55.845 > 4 42 Fe 0.60592447352437 0.99694155661409 0.10131446663947 55.845 > 4 43 Fe 0.10592447352437 0.33027488994742 0.60131446663947 55.845 > 4 44 Fe 0.60592447352437 0.33027488994742 0.60131446663947 55.845 > 4 45 Fe 0.10592447352437 0.66360822328075 0.60131446663947 55.845 > 4 46 Fe 0.60592447352437 0.66360822328075 0.60131446663947 55.845 > 4 47 Fe 0.10592447352437 0.99694155661409 0.60131446663947 55.845 > 4 48 Fe 0.60592447352437 0.99694155661409 0.60131446663947 55.845 > 4 *49 As 0.32319103487883 0.21093044313481 0.43606300011619 74.922 > 5 50 As 0.82319103487883 0.21093044313481 0.43606300011619 74.922 > 5 51 As 0.32319103487883 0.54426377646814 0.43606300011619 74.922 > 5 52 As 0.82319103487883 0.54426377646814 0.43606300011619 74.922 > 5 53 As 0.32319103487883 0.87759710980148 0.43606300011619 74.922 > 5 54 As 0.82319103487883 0.87759710980148 0.43606300011619 74.922 > 5 55 As 0.32319103487883 0.21093044313481 0.93606300011619 74.922 > 5 56 As 0.82319103487883 0.21093044313481 0.93606300011619 74.922 > 5 57 As 0.32319103487883 0.54426377646814 0.93606300011619 74.922 > 5 58 As 0.82319103487883 0.54426377646814 0.93606300011619 74.922 > 5 59 As 0.32319103487883 0.87759710980148 0.93606300011619 74.922 > 5 60 As 0.82319103487883 0.87759710980148 0.93606300011619 74.922 > 5 61 As 0.17680896512117 0.04426377646814 0.31393699988381 74.922 > 6 62 As 0.67680896512117 0.04426377646814 0.31393699988381 74.922 > 6 63 As 0.17680896512117 0.37759710980148 0.31393699988381 74.922 > 6 64 As 0.67680896512117 0.37759710980148 0.31393699988381 74.922 > 6 65 As 0.17680896512117 0.71093044313481 0.31393699988381 74.922 > 6 66 As 0.67680896512117 0.71093044313481 0.31393699988381 74.922 > 6 67 As 0.17680896512117 0.04426377646814 0.81393699988381 74.922 > 6 68 As 0.67680896512117 0.04426377646814 0.81393699988381 74.922 > 6 69 As 0.17680896512117 0.37759710980148 0.81393699988381 74.922 > 6 70 As 0.67680896512117 0.37759710980148 0.81393699988381 74.922 > 6 71 As 0.17680896512117 0.71093044313481 0.81393699988381 74.922 > 6 72 As 0.67680896512117 0.71093044313481 0.81393699988381 74.922 > 6 73 As 0.32319103487883 0.28906955686519 0.18606300011619 74.922 > 7 74 As 0.82319103487883 0.28906955686519 0.18606300011619 74.922 > 7 75 As 0.32319103487883 0.62240289019852 0.18606300011619 74.922 > 7 76 As 0.82319103487883 0.62240289019852 0.18606300011619 74.922 > 7 77 As 0.32319103487883 0.95573622353186 0.18606300011619 74.922 > 7 78 As 0.82319103487883 0.95573622353186 0.18606300011619 74.922 > 7 79 As 0.32319103487883 0.28906955686519 0.68606300011619 74.922 > 7 80 As 0.82319103487883 0.28906955686519 0.68606300011619 74.922 > 7 81 As 0.32319103487883 0.62240289019852 0.68606300011619 74.922 > 7 82 As 0.82319103487883 0.62240289019852 0.68606300011619 74.922 > 7 83 As 0.32319103487883 0.95573622353186 0.68606300011619 74.922 > 7 84 As 0.82319103487883 0.95573622353186 0.68606300011619 74.922 > 7 85 As 0.17680896512117 0.12240289019852 0.06393699988381 74.922 > 8 86 As 0.67680896512117 0.12240289019852 0.06393699988381 74.922 > 8 87 As 0.17680896512117 0.45573622353186 0.06393699988381 74.922 > 8 88 As 0.67680896512117 0.45573622353186 0.06393699988381 74.922 > 8 89 As 0.17680896512117 0.78906955686519 0.06393699988381 74.922 > 8 90 As 0.67680896512117 0.78906955686519 0.06393699988381 74.922 > 8 91 As 0.17680896512117 0.12240289019852 0.56393699988381 74.922 > 8 92 As 0.67680896512117 0.12240289019852 0.56393699988381 74.922 > 8 93 As 0.17680896512117 0.45573622353186 0.56393699988381 74.922 > 8 94 As 0.67680896512117 0.45573622353186 0.56393699988381 74.922 > 8 95 As 0.17680896512117 0.78906955686519 0.56393699988381 74.922 > 8 96 As 0.67680896512117 0.78906955686519 0.56393699988381 74.922 > 8 *97 S 0.42405407881909 0.04452672888908 0.08877237517458 32.065 > 9 98 S 0.92405407881909 0.04452672888908 0.08877237517458 32.065 > 9 99 S 0.42405407881909 0.37786006222242 0.08877237517458 32.065 > 9 100 S 0.92405407881909 0.37786006222242 0.08877237517458 32.065 > 9 101 S 0.42405407881909 0.71119339555575 0.08877237517458 32.065 > 9 102 S 0.92405407881909 0.71119339555575 0.08877237517458 32.065 > 9 103 S 0.42405407881909 0.04452672888908 0.58877237517458 32.065 > 9 104 S 0.92405407881909 0.04452672888908 0.58877237517458 32.065 > 9 105 S 0.42405407881909 0.37786006222242 0.58877237517458 32.065 > 9 106 S 0.92405407881909 0.37786006222242 0.58877237517458 32.065 > 9 107 S 0.42405407881909 0.71119339555575 0.58877237517458 32.065 > 9 108 S 0.92405407881909 0.71119339555575 0.58877237517458 32.065 > 9 109 S 0.07594592118091 0.21119339555575 0.16122762482542 32.065 > 10 110 S 0.57594592118091 0.21119339555575 0.16122762482542 32.065 > 10 111 S 0.07594592118091 0.54452672888908 0.16122762482542 32.065 > 10 112 S 0.57594592118091 0.54452672888908 0.16122762482542 32.065 > 10 113 S 0.07594592118091 0.87786006222242 0.16122762482542 32.065 > 10 114 S 0.57594592118091 0.87786006222242 0.16122762482542 32.065 > 10 115 S 0.07594592118091 0.21119339555575 0.66122762482542 32.065 > 10 116 S 0.57594592118091 0.21119339555575 0.66122762482542 32.065 > 10 117 S 0.07594592118091 0.54452672888908 0.66122762482542 32.065 > 10 118 S 0.57594592118091 0.54452672888908 0.66122762482542 32.065 > 10 119 S 0.07594592118091 0.87786006222242 0.66122762482542 32.065 > 10 120 S 0.57594592118091 0.87786006222242 0.66122762482542 32.065 > 10 121 S 0.42405407881909 0.12213993777758 0.33877237517458 32.065 > 11 122 S 0.92405407881909 0.12213993777758 0.33877237517458 32.065 > 11 123 S 0.42405407881909 0.45547327111092 0.33877237517458 32.065 > 11 124 S 0.92405407881909 0.45547327111092 0.33877237517458 32.065 > 11 125 S 0.42405407881909 0.78880660444425 0.33877237517458 32.065 > 11 126 S 0.92405407881909 0.78880660444425 0.33877237517458 32.065 > 11 127 S 0.42405407881909 0.12213993777758 0.83877237517458 32.065 > 11 128 S 0.92405407881909 0.12213993777758 0.83877237517458 32.065 > 11 129 S 0.42405407881909 0.45547327111092 0.83877237517458 32.065 > 11 130 S 0.92405407881909 0.45547327111092 0.83877237517458 32.065 > 11 131 S 0.42405407881909 0.78880660444425 0.83877237517458 32.065 > 11 132 S 0.92405407881909 0.78880660444425 0.83877237517458 32.065 > 11 133 S 0.07594592118091 0.28880660444425 0.41122762482542 32.065 > 12 134 S 0.57594592118091 0.28880660444425 0.41122762482542 32.065 > 12 135 S 0.07594592118091 0.62213993777758 0.41122762482542 32.065 > 12 136 S 0.57594592118091 0.62213993777758 0.41122762482542 32.065 > 12 137 S 0.07594592118091 0.95547327111092 0.41122762482542 32.065 > 12 138 S 0.57594592118091 0.95547327111092 0.41122762482542 32.065 > 12 139 S 0.07594592118091 0.28880660444425 0.91122762482542 32.065 > 12 140 S 0.57594592118091 0.28880660444425 0.91122762482542 32.065 > 12 141 S 0.07594592118091 0.62213993777758 0.91122762482542 32.065 > 12 142 S 0.57594592118091 0.62213993777758 0.91122762482542 32.065 > 12 143 S 0.07594592118091 0.95547327111092 0.91122762482542 32.065 > 12 144 S 0.57594592118091 0.95547327111092 0.91122762482542 32.065 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 22.6421988 0.0000000 -0.0606895 0.0000000 24.9142382 0.0000000 -0.0606918 0.0000000 22.8790224 -------------------------- Born effective charges -------------------------- 1 Fe -6.2027022 -0.1579597 0.0263300 -0.4604035 -6.2058036 0.5145513 0.1456678 0.0150310 -6.3649965 2 Fe -6.2027022 -0.1579597 0.0263300 -0.4604035 -6.2058036 0.5145513 0.1456678 0.0150310 -6.3649965 3 Fe -6.2027022 0.1579597 0.0263300 0.4604035 -6.2058036 -0.5145513 0.1456678 -0.0150310 -6.3649965 4 Fe -6.2027022 0.1579597 0.0263300 0.4604035 -6.2058036 -0.5145513 0.1456678 -0.0150310 -6.3649965 5 As 3.3910093 0.0613894 0.3280189 -0.1178759 3.4131895 0.1669656 -0.2455808 -0.1477158 3.7027964 6 As 3.3910093 -0.0613894 0.3280189 0.1178759 3.4131895 -0.1669656 -0.2455808 0.1477158 3.7027964 7 As 3.3910093 -0.0613894 0.3280189 0.1178759 3.4131895 -0.1669656 -0.2455808 0.1477158 3.7027964 8 As 3.3910093 0.0613894 0.3280189 -0.1178759 3.4131895 0.1669656 -0.2455808 -0.1477158 3.7027964 9 S 2.8116929 -0.1644226 -0.3543488 -0.3163095 2.7926141 0.3782527 0.0999131 0.3995088 2.6622001 10 S 2.8116929 0.1644226 -0.3543488 0.3163095 2.7926141 -0.3782527 0.0999131 -0.3995088 2.6622001 11 S 2.8116929 0.1644226 -0.3543488 0.3163095 2.7926141 -0.3782527 0.0999131 -0.3995088 2.6622001 12 S 2.8116929 -0.1644226 -0.3543488 -0.3163095 2.7926141 0.3782527 0.0999131 0.3995088 2.6622001 ---------------------------------------------------------------------------- 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: 2034 Number of blocks in projector: 2034 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: 432 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 246 Use standard eigh solver. Tree of FC basis block matrices: - (2034, 2008), data: False |-- (246, 243), data: True |-- (246, 243), data: True |-- (246, 243), data: True |-- (432, 427), data: True |-- (432, 426), data: True |-- (432, 426), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.006 Solver_block: 100 / 400 - Time: 4.636 Solver_block: 200 / 400 - Time: 4.650 Solver_block: 300 / 400 - Time: 4.643 Solver_block: 400 / 400 - Time: 4.638 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 18.760 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) 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: 2034 Number of blocks in projector: 2034 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: 432 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 246 Use standard eigh solver. Tree of FC basis block matrices: - (2034, 2008), data: False |-- (246, 243), data: True |-- (246, 243), data: True |-- (246, 243), data: True |-- (432, 427), data: True |-- (432, 426), data: True |-- (432, 426), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 17:18:16]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 17:18:17]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.649113040093259 0.000000000000000 0.000000000000000 b 0.000000000000000 5.580623740000000 0.000000000000000 c -2.142030708188198 0.000000000000000 5.251996201903755 Atomic positions (fractional): 1 Fe 0.21184894704873 0.50917533015774 0.70262893327894 55.845 2 Fe 0.78815105295127 0.49082466984226 0.29737106672106 55.845 3 Fe 0.78815105295127 0.00917533015774 0.79737106672106 55.845 4 Fe 0.21184894704873 0.99082466984226 0.20262893327894 55.845 5 As 0.64638206975766 0.63279132940443 0.87212600023237 74.922 6 As 0.35361793024234 0.13279132940443 0.62787399976763 74.922 7 As 0.64638206975766 0.86720867059557 0.37212600023238 74.922 8 As 0.35361793024234 0.36720867059557 0.12787399976763 74.922 9 S 0.84810815763818 0.13358018666725 0.17754475034916 32.065 10 S 0.15189184236182 0.63358018666725 0.32245524965084 32.065 11 S 0.84810815763818 0.36641981333275 0.67754475034916 32.065 12 S 0.15189184236182 0.86641981333275 0.82245524965084 32.065 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.298226080186518 0.000000000000000 0.000000000000000 b 0.000000000000000 16.741871220000000 0.000000000000000 c -4.284061416376396 0.000000000000000 10.503992403807510 Atomic positions (fractional): 1 Fe 0.10592447352437 0.16972511005258 0.35131446663947 55.845 > 1 2 Fe 0.60592447352437 0.16972511005258 0.35131446663947 55.845 > 1 3 Fe 0.10592447352437 0.50305844338591 0.35131446663947 55.845 > 1 4 Fe 0.60592447352437 0.50305844338591 0.35131446663947 55.845 > 1 5 Fe 0.10592447352437 0.83639177671925 0.35131446663947 55.845 > 1 6 Fe 0.60592447352437 0.83639177671925 0.35131446663947 55.845 > 1 7 Fe 0.10592447352437 0.16972511005258 0.85131446663947 55.845 > 1 8 Fe 0.60592447352437 0.16972511005258 0.85131446663947 55.845 > 1 9 Fe 0.10592447352437 0.50305844338591 0.85131446663947 55.845 > 1 10 Fe 0.60592447352437 0.50305844338591 0.85131446663947 55.845 > 1 11 Fe 0.10592447352437 0.83639177671925 0.85131446663947 55.845 > 1 12 Fe 0.60592447352437 0.83639177671925 0.85131446663947 55.845 > 1 13 Fe 0.39407552647563 0.16360822328075 0.14868553336053 55.845 > 13 14 Fe 0.89407552647563 0.16360822328075 0.14868553336053 55.845 > 13 15 Fe 0.39407552647563 0.49694155661409 0.14868553336053 55.845 > 13 16 Fe 0.89407552647563 0.49694155661409 0.14868553336053 55.845 > 13 17 Fe 0.39407552647563 0.83027488994742 0.14868553336053 55.845 > 13 18 Fe 0.89407552647563 0.83027488994742 0.14868553336053 55.845 > 13 19 Fe 0.39407552647563 0.16360822328075 0.64868553336053 55.845 > 13 20 Fe 0.89407552647563 0.16360822328075 0.64868553336053 55.845 > 13 21 Fe 0.39407552647563 0.49694155661409 0.64868553336053 55.845 > 13 22 Fe 0.89407552647563 0.49694155661409 0.64868553336053 55.845 > 13 23 Fe 0.39407552647563 0.83027488994742 0.64868553336053 55.845 > 13 24 Fe 0.89407552647563 0.83027488994742 0.64868553336053 55.845 > 13 25 Fe 0.39407552647563 0.00305844338591 0.39868553336053 55.845 > 25 26 Fe 0.89407552647563 0.00305844338591 0.39868553336053 55.845 > 25 27 Fe 0.39407552647563 0.33639177671925 0.39868553336053 55.845 > 25 28 Fe 0.89407552647563 0.33639177671925 0.39868553336053 55.845 > 25 29 Fe 0.39407552647563 0.66972511005258 0.39868553336053 55.845 > 25 30 Fe 0.89407552647563 0.66972511005258 0.39868553336053 55.845 > 25 31 Fe 0.39407552647563 0.00305844338591 0.89868553336053 55.845 > 25 32 Fe 0.89407552647563 0.00305844338591 0.89868553336053 55.845 > 25 33 Fe 0.39407552647563 0.33639177671925 0.89868553336053 55.845 > 25 34 Fe 0.89407552647563 0.33639177671925 0.89868553336053 55.845 > 25 35 Fe 0.39407552647563 0.66972511005258 0.89868553336053 55.845 > 25 36 Fe 0.89407552647563 0.66972511005258 0.89868553336053 55.845 > 25 37 Fe 0.10592447352437 0.33027488994742 0.10131446663947 55.845 > 37 38 Fe 0.60592447352437 0.33027488994742 0.10131446663947 55.845 > 37 39 Fe 0.10592447352437 0.66360822328075 0.10131446663947 55.845 > 37 40 Fe 0.60592447352437 0.66360822328075 0.10131446663947 55.845 > 37 41 Fe 0.10592447352437 0.99694155661409 0.10131446663947 55.845 > 37 42 Fe 0.60592447352437 0.99694155661409 0.10131446663947 55.845 > 37 43 Fe 0.10592447352437 0.33027488994742 0.60131446663947 55.845 > 37 44 Fe 0.60592447352437 0.33027488994742 0.60131446663947 55.845 > 37 45 Fe 0.10592447352437 0.66360822328075 0.60131446663947 55.845 > 37 46 Fe 0.60592447352437 0.66360822328075 0.60131446663947 55.845 > 37 47 Fe 0.10592447352437 0.99694155661409 0.60131446663947 55.845 > 37 48 Fe 0.60592447352437 0.99694155661409 0.60131446663947 55.845 > 37 49 As 0.32319103487883 0.21093044313481 0.43606300011619 74.922 > 49 50 As 0.82319103487883 0.21093044313481 0.43606300011619 74.922 > 49 51 As 0.32319103487883 0.54426377646814 0.43606300011619 74.922 > 49 52 As 0.82319103487883 0.54426377646814 0.43606300011619 74.922 > 49 53 As 0.32319103487883 0.87759710980148 0.43606300011619 74.922 > 49 54 As 0.82319103487883 0.87759710980148 0.43606300011619 74.922 > 49 55 As 0.32319103487883 0.21093044313481 0.93606300011619 74.922 > 49 56 As 0.82319103487883 0.21093044313481 0.93606300011619 74.922 > 49 57 As 0.32319103487883 0.54426377646814 0.93606300011619 74.922 > 49 58 As 0.82319103487883 0.54426377646814 0.93606300011619 74.922 > 49 59 As 0.32319103487883 0.87759710980148 0.93606300011619 74.922 > 49 60 As 0.82319103487883 0.87759710980148 0.93606300011619 74.922 > 49 61 As 0.17680896512117 0.04426377646814 0.31393699988381 74.922 > 61 62 As 0.67680896512117 0.04426377646814 0.31393699988381 74.922 > 61 63 As 0.17680896512117 0.37759710980148 0.31393699988381 74.922 > 61 64 As 0.67680896512117 0.37759710980148 0.31393699988381 74.922 > 61 65 As 0.17680896512117 0.71093044313481 0.31393699988381 74.922 > 61 66 As 0.67680896512117 0.71093044313481 0.31393699988381 74.922 > 61 67 As 0.17680896512117 0.04426377646814 0.81393699988381 74.922 > 61 68 As 0.67680896512117 0.04426377646814 0.81393699988381 74.922 > 61 69 As 0.17680896512117 0.37759710980148 0.81393699988381 74.922 > 61 70 As 0.67680896512117 0.37759710980148 0.81393699988381 74.922 > 61 71 As 0.17680896512117 0.71093044313481 0.81393699988381 74.922 > 61 72 As 0.67680896512117 0.71093044313481 0.81393699988381 74.922 > 61 73 As 0.32319103487883 0.28906955686519 0.18606300011619 74.922 > 73 74 As 0.82319103487883 0.28906955686519 0.18606300011619 74.922 > 73 75 As 0.32319103487883 0.62240289019852 0.18606300011619 74.922 > 73 76 As 0.82319103487883 0.62240289019852 0.18606300011619 74.922 > 73 77 As 0.32319103487883 0.95573622353186 0.18606300011619 74.922 > 73 78 As 0.82319103487883 0.95573622353186 0.18606300011619 74.922 > 73 79 As 0.32319103487883 0.28906955686519 0.68606300011619 74.922 > 73 80 As 0.82319103487883 0.28906955686519 0.68606300011619 74.922 > 73 81 As 0.32319103487883 0.62240289019852 0.68606300011619 74.922 > 73 82 As 0.82319103487883 0.62240289019852 0.68606300011619 74.922 > 73 83 As 0.32319103487883 0.95573622353186 0.68606300011619 74.922 > 73 84 As 0.82319103487883 0.95573622353186 0.68606300011619 74.922 > 73 85 As 0.17680896512117 0.12240289019852 0.06393699988381 74.922 > 85 86 As 0.67680896512117 0.12240289019852 0.06393699988381 74.922 > 85 87 As 0.17680896512117 0.45573622353186 0.06393699988381 74.922 > 85 88 As 0.67680896512117 0.45573622353186 0.06393699988381 74.922 > 85 89 As 0.17680896512117 0.78906955686519 0.06393699988381 74.922 > 85 90 As 0.67680896512117 0.78906955686519 0.06393699988381 74.922 > 85 91 As 0.17680896512117 0.12240289019852 0.56393699988381 74.922 > 85 92 As 0.67680896512117 0.12240289019852 0.56393699988381 74.922 > 85 93 As 0.17680896512117 0.45573622353186 0.56393699988381 74.922 > 85 94 As 0.67680896512117 0.45573622353186 0.56393699988381 74.922 > 85 95 As 0.17680896512117 0.78906955686519 0.56393699988381 74.922 > 85 96 As 0.67680896512117 0.78906955686519 0.56393699988381 74.922 > 85 97 S 0.42405407881909 0.04452672888908 0.08877237517458 32.065 > 97 98 S 0.92405407881909 0.04452672888908 0.08877237517458 32.065 > 97 99 S 0.42405407881909 0.37786006222242 0.08877237517458 32.065 > 97 100 S 0.92405407881909 0.37786006222242 0.08877237517458 32.065 > 97 101 S 0.42405407881909 0.71119339555575 0.08877237517458 32.065 > 97 102 S 0.92405407881909 0.71119339555575 0.08877237517458 32.065 > 97 103 S 0.42405407881909 0.04452672888908 0.58877237517458 32.065 > 97 104 S 0.92405407881909 0.04452672888908 0.58877237517458 32.065 > 97 105 S 0.42405407881909 0.37786006222242 0.58877237517458 32.065 > 97 106 S 0.92405407881909 0.37786006222242 0.58877237517458 32.065 > 97 107 S 0.42405407881909 0.71119339555575 0.58877237517458 32.065 > 97 108 S 0.92405407881909 0.71119339555575 0.58877237517458 32.065 > 97 109 S 0.07594592118091 0.21119339555575 0.16122762482542 32.065 > 109 110 S 0.57594592118091 0.21119339555575 0.16122762482542 32.065 > 109 111 S 0.07594592118091 0.54452672888908 0.16122762482542 32.065 > 109 112 S 0.57594592118091 0.54452672888908 0.16122762482542 32.065 > 109 113 S 0.07594592118091 0.87786006222242 0.16122762482542 32.065 > 109 114 S 0.57594592118091 0.87786006222242 0.16122762482542 32.065 > 109 115 S 0.07594592118091 0.21119339555575 0.66122762482542 32.065 > 109 116 S 0.57594592118091 0.21119339555575 0.66122762482542 32.065 > 109 117 S 0.07594592118091 0.54452672888908 0.66122762482542 32.065 > 109 118 S 0.57594592118091 0.54452672888908 0.66122762482542 32.065 > 109 119 S 0.07594592118091 0.87786006222242 0.66122762482542 32.065 > 109 120 S 0.57594592118091 0.87786006222242 0.66122762482542 32.065 > 109 121 S 0.42405407881909 0.12213993777758 0.33877237517458 32.065 > 121 122 S 0.92405407881909 0.12213993777758 0.33877237517458 32.065 > 121 123 S 0.42405407881909 0.45547327111092 0.33877237517458 32.065 > 121 124 S 0.92405407881909 0.45547327111092 0.33877237517458 32.065 > 121 125 S 0.42405407881909 0.78880660444425 0.33877237517458 32.065 > 121 126 S 0.92405407881909 0.78880660444425 0.33877237517458 32.065 > 121 127 S 0.42405407881909 0.12213993777758 0.83877237517458 32.065 > 121 128 S 0.92405407881909 0.12213993777758 0.83877237517458 32.065 > 121 129 S 0.42405407881909 0.45547327111092 0.83877237517458 32.065 > 121 130 S 0.92405407881909 0.45547327111092 0.83877237517458 32.065 > 121 131 S 0.42405407881909 0.78880660444425 0.83877237517458 32.065 > 121 132 S 0.92405407881909 0.78880660444425 0.83877237517458 32.065 > 121 133 S 0.07594592118091 0.28880660444425 0.41122762482542 32.065 > 133 134 S 0.57594592118091 0.28880660444425 0.41122762482542 32.065 > 133 135 S 0.07594592118091 0.62213993777758 0.41122762482542 32.065 > 133 136 S 0.57594592118091 0.62213993777758 0.41122762482542 32.065 > 133 137 S 0.07594592118091 0.95547327111092 0.41122762482542 32.065 > 133 138 S 0.57594592118091 0.95547327111092 0.41122762482542 32.065 > 133 139 S 0.07594592118091 0.28880660444425 0.91122762482542 32.065 > 133 140 S 0.57594592118091 0.28880660444425 0.91122762482542 32.065 > 133 141 S 0.07594592118091 0.62213993777758 0.91122762482542 32.065 > 133 142 S 0.57594592118091 0.62213993777758 0.91122762482542 32.065 > 133 143 S 0.07594592118091 0.95547327111092 0.91122762482542 32.065 > 133 144 S 0.57594592118091 0.95547327111092 0.91122762482542 32.065 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 22.6421988 0.0000000 -0.0606895 0.0000000 24.9142382 0.0000000 -0.0606918 0.0000000 22.8790224 -------------------------- Born effective charges -------------------------- 1 Fe -6.2027022 -0.1579597 0.0263300 -0.4604035 -6.2058036 0.5145513 0.1456678 0.0150310 -6.3649965 2 Fe -6.2027022 -0.1579597 0.0263300 -0.4604035 -6.2058036 0.5145513 0.1456678 0.0150310 -6.3649965 3 Fe -6.2027022 0.1579597 0.0263300 0.4604035 -6.2058036 -0.5145513 0.1456678 -0.0150310 -6.3649965 4 Fe -6.2027022 0.1579597 0.0263300 0.4604035 -6.2058036 -0.5145513 0.1456678 -0.0150310 -6.3649965 5 As 3.3910093 0.0613894 0.3280189 -0.1178759 3.4131895 0.1669656 -0.2455808 -0.1477158 3.7027964 6 As 3.3910093 -0.0613894 0.3280189 0.1178759 3.4131895 -0.1669656 -0.2455808 0.1477158 3.7027964 7 As 3.3910093 -0.0613894 0.3280189 0.1178759 3.4131895 -0.1669656 -0.2455808 0.1477158 3.7027964 8 As 3.3910093 0.0613894 0.3280189 -0.1178759 3.4131895 0.1669656 -0.2455808 -0.1477158 3.7027964 9 S 2.8116929 -0.1644226 -0.3543488 -0.3163095 2.7926141 0.3782527 0.0999131 0.3995088 2.6622001 10 S 2.8116929 0.1644226 -0.3543488 0.3163095 2.7926141 -0.3782527 0.0999131 -0.3995088 2.6622001 11 S 2.8116929 0.1644226 -0.3543488 0.3163095 2.7926141 -0.3782527 0.0999131 -0.3995088 2.6622001 12 S 2.8116929 -0.1644226 -0.3543488 -0.3163095 2.7926141 0.3782527 0.0999131 0.3995088 2.6622001 ---------------------------------------------------------------------------- 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] [-0.0038 0.0000 0.0093] [ 0.0038 0.0000 -0.0093] 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] [-0.0038 0.0000 0.0093] [ 0.0038 0.0000 -0.0093] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0038 0.0000 0.0093] [ 0.0038 0.0000 -0.0093] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (zx) -0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 17:18:38]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 17:18:38]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.649113040093259 0.000000000000000 0.000000000000000 b 0.000000000000000 5.580623740000000 0.000000000000000 c -2.142030708188198 0.000000000000000 5.251996201903755 Atomic positions (fractional): 1 Fe 0.21184894704873 0.50917533015774 0.70262893327894 55.845 2 Fe 0.78815105295127 0.49082466984226 0.29737106672106 55.845 3 Fe 0.78815105295127 0.00917533015774 0.79737106672106 55.845 4 Fe 0.21184894704873 0.99082466984226 0.20262893327894 55.845 5 As 0.64638206975766 0.63279132940443 0.87212600023237 74.922 6 As 0.35361793024234 0.13279132940443 0.62787399976763 74.922 7 As 0.64638206975766 0.86720867059557 0.37212600023238 74.922 8 As 0.35361793024234 0.36720867059557 0.12787399976763 74.922 9 S 0.84810815763818 0.13358018666725 0.17754475034916 32.065 10 S 0.15189184236182 0.63358018666725 0.32245524965084 32.065 11 S 0.84810815763818 0.36641981333275 0.67754475034916 32.065 12 S 0.15189184236182 0.86641981333275 0.82245524965084 32.065 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.298226080186518 0.000000000000000 0.000000000000000 b 0.000000000000000 16.741871220000000 0.000000000000000 c -4.284061416376396 0.000000000000000 10.503992403807510 Atomic positions (fractional): 1 Fe 0.10592447352437 0.16972511005258 0.35131446663947 55.845 > 1 2 Fe 0.60592447352437 0.16972511005258 0.35131446663947 55.845 > 1 3 Fe 0.10592447352437 0.50305844338591 0.35131446663947 55.845 > 1 4 Fe 0.60592447352437 0.50305844338591 0.35131446663947 55.845 > 1 5 Fe 0.10592447352437 0.83639177671925 0.35131446663947 55.845 > 1 6 Fe 0.60592447352437 0.83639177671925 0.35131446663947 55.845 > 1 7 Fe 0.10592447352437 0.16972511005258 0.85131446663947 55.845 > 1 8 Fe 0.60592447352437 0.16972511005258 0.85131446663947 55.845 > 1 9 Fe 0.10592447352437 0.50305844338591 0.85131446663947 55.845 > 1 10 Fe 0.60592447352437 0.50305844338591 0.85131446663947 55.845 > 1 11 Fe 0.10592447352437 0.83639177671925 0.85131446663947 55.845 > 1 12 Fe 0.60592447352437 0.83639177671925 0.85131446663947 55.845 > 1 13 Fe 0.39407552647563 0.16360822328075 0.14868553336053 55.845 > 13 14 Fe 0.89407552647563 0.16360822328075 0.14868553336053 55.845 > 13 15 Fe 0.39407552647563 0.49694155661409 0.14868553336053 55.845 > 13 16 Fe 0.89407552647563 0.49694155661409 0.14868553336053 55.845 > 13 17 Fe 0.39407552647563 0.83027488994742 0.14868553336053 55.845 > 13 18 Fe 0.89407552647563 0.83027488994742 0.14868553336053 55.845 > 13 19 Fe 0.39407552647563 0.16360822328075 0.64868553336053 55.845 > 13 20 Fe 0.89407552647563 0.16360822328075 0.64868553336053 55.845 > 13 21 Fe 0.39407552647563 0.49694155661409 0.64868553336053 55.845 > 13 22 Fe 0.89407552647563 0.49694155661409 0.64868553336053 55.845 > 13 23 Fe 0.39407552647563 0.83027488994742 0.64868553336053 55.845 > 13 24 Fe 0.89407552647563 0.83027488994742 0.64868553336053 55.845 > 13 25 Fe 0.39407552647563 0.00305844338591 0.39868553336053 55.845 > 25 26 Fe 0.89407552647563 0.00305844338591 0.39868553336053 55.845 > 25 27 Fe 0.39407552647563 0.33639177671925 0.39868553336053 55.845 > 25 28 Fe 0.89407552647563 0.33639177671925 0.39868553336053 55.845 > 25 29 Fe 0.39407552647563 0.66972511005258 0.39868553336053 55.845 > 25 30 Fe 0.89407552647563 0.66972511005258 0.39868553336053 55.845 > 25 31 Fe 0.39407552647563 0.00305844338591 0.89868553336053 55.845 > 25 32 Fe 0.89407552647563 0.00305844338591 0.89868553336053 55.845 > 25 33 Fe 0.39407552647563 0.33639177671925 0.89868553336053 55.845 > 25 34 Fe 0.89407552647563 0.33639177671925 0.89868553336053 55.845 > 25 35 Fe 0.39407552647563 0.66972511005258 0.89868553336053 55.845 > 25 36 Fe 0.89407552647563 0.66972511005258 0.89868553336053 55.845 > 25 37 Fe 0.10592447352437 0.33027488994742 0.10131446663947 55.845 > 37 38 Fe 0.60592447352437 0.33027488994742 0.10131446663947 55.845 > 37 39 Fe 0.10592447352437 0.66360822328075 0.10131446663947 55.845 > 37 40 Fe 0.60592447352437 0.66360822328075 0.10131446663947 55.845 > 37 41 Fe 0.10592447352437 0.99694155661409 0.10131446663947 55.845 > 37 42 Fe 0.60592447352437 0.99694155661409 0.10131446663947 55.845 > 37 43 Fe 0.10592447352437 0.33027488994742 0.60131446663947 55.845 > 37 44 Fe 0.60592447352437 0.33027488994742 0.60131446663947 55.845 > 37 45 Fe 0.10592447352437 0.66360822328075 0.60131446663947 55.845 > 37 46 Fe 0.60592447352437 0.66360822328075 0.60131446663947 55.845 > 37 47 Fe 0.10592447352437 0.99694155661409 0.60131446663947 55.845 > 37 48 Fe 0.60592447352437 0.99694155661409 0.60131446663947 55.845 > 37 49 As 0.32319103487883 0.21093044313481 0.43606300011619 74.922 > 49 50 As 0.82319103487883 0.21093044313481 0.43606300011619 74.922 > 49 51 As 0.32319103487883 0.54426377646814 0.43606300011619 74.922 > 49 52 As 0.82319103487883 0.54426377646814 0.43606300011619 74.922 > 49 53 As 0.32319103487883 0.87759710980148 0.43606300011619 74.922 > 49 54 As 0.82319103487883 0.87759710980148 0.43606300011619 74.922 > 49 55 As 0.32319103487883 0.21093044313481 0.93606300011619 74.922 > 49 56 As 0.82319103487883 0.21093044313481 0.93606300011619 74.922 > 49 57 As 0.32319103487883 0.54426377646814 0.93606300011619 74.922 > 49 58 As 0.82319103487883 0.54426377646814 0.93606300011619 74.922 > 49 59 As 0.32319103487883 0.87759710980148 0.93606300011619 74.922 > 49 60 As 0.82319103487883 0.87759710980148 0.93606300011619 74.922 > 49 61 As 0.17680896512117 0.04426377646814 0.31393699988381 74.922 > 61 62 As 0.67680896512117 0.04426377646814 0.31393699988381 74.922 > 61 63 As 0.17680896512117 0.37759710980148 0.31393699988381 74.922 > 61 64 As 0.67680896512117 0.37759710980148 0.31393699988381 74.922 > 61 65 As 0.17680896512117 0.71093044313481 0.31393699988381 74.922 > 61 66 As 0.67680896512117 0.71093044313481 0.31393699988381 74.922 > 61 67 As 0.17680896512117 0.04426377646814 0.81393699988381 74.922 > 61 68 As 0.67680896512117 0.04426377646814 0.81393699988381 74.922 > 61 69 As 0.17680896512117 0.37759710980148 0.81393699988381 74.922 > 61 70 As 0.67680896512117 0.37759710980148 0.81393699988381 74.922 > 61 71 As 0.17680896512117 0.71093044313481 0.81393699988381 74.922 > 61 72 As 0.67680896512117 0.71093044313481 0.81393699988381 74.922 > 61 73 As 0.32319103487883 0.28906955686519 0.18606300011619 74.922 > 73 74 As 0.82319103487883 0.28906955686519 0.18606300011619 74.922 > 73 75 As 0.32319103487883 0.62240289019852 0.18606300011619 74.922 > 73 76 As 0.82319103487883 0.62240289019852 0.18606300011619 74.922 > 73 77 As 0.32319103487883 0.95573622353186 0.18606300011619 74.922 > 73 78 As 0.82319103487883 0.95573622353186 0.18606300011619 74.922 > 73 79 As 0.32319103487883 0.28906955686519 0.68606300011619 74.922 > 73 80 As 0.82319103487883 0.28906955686519 0.68606300011619 74.922 > 73 81 As 0.32319103487883 0.62240289019852 0.68606300011619 74.922 > 73 82 As 0.82319103487883 0.62240289019852 0.68606300011619 74.922 > 73 83 As 0.32319103487883 0.95573622353186 0.68606300011619 74.922 > 73 84 As 0.82319103487883 0.95573622353186 0.68606300011619 74.922 > 73 85 As 0.17680896512117 0.12240289019852 0.06393699988381 74.922 > 85 86 As 0.67680896512117 0.12240289019852 0.06393699988381 74.922 > 85 87 As 0.17680896512117 0.45573622353186 0.06393699988381 74.922 > 85 88 As 0.67680896512117 0.45573622353186 0.06393699988381 74.922 > 85 89 As 0.17680896512117 0.78906955686519 0.06393699988381 74.922 > 85 90 As 0.67680896512117 0.78906955686519 0.06393699988381 74.922 > 85 91 As 0.17680896512117 0.12240289019852 0.56393699988381 74.922 > 85 92 As 0.67680896512117 0.12240289019852 0.56393699988381 74.922 > 85 93 As 0.17680896512117 0.45573622353186 0.56393699988381 74.922 > 85 94 As 0.67680896512117 0.45573622353186 0.56393699988381 74.922 > 85 95 As 0.17680896512117 0.78906955686519 0.56393699988381 74.922 > 85 96 As 0.67680896512117 0.78906955686519 0.56393699988381 74.922 > 85 97 S 0.42405407881909 0.04452672888908 0.08877237517458 32.065 > 97 98 S 0.92405407881909 0.04452672888908 0.08877237517458 32.065 > 97 99 S 0.42405407881909 0.37786006222242 0.08877237517458 32.065 > 97 100 S 0.92405407881909 0.37786006222242 0.08877237517458 32.065 > 97 101 S 0.42405407881909 0.71119339555575 0.08877237517458 32.065 > 97 102 S 0.92405407881909 0.71119339555575 0.08877237517458 32.065 > 97 103 S 0.42405407881909 0.04452672888908 0.58877237517458 32.065 > 97 104 S 0.92405407881909 0.04452672888908 0.58877237517458 32.065 > 97 105 S 0.42405407881909 0.37786006222242 0.58877237517458 32.065 > 97 106 S 0.92405407881909 0.37786006222242 0.58877237517458 32.065 > 97 107 S 0.42405407881909 0.71119339555575 0.58877237517458 32.065 > 97 108 S 0.92405407881909 0.71119339555575 0.58877237517458 32.065 > 97 109 S 0.07594592118091 0.21119339555575 0.16122762482542 32.065 > 109 110 S 0.57594592118091 0.21119339555575 0.16122762482542 32.065 > 109 111 S 0.07594592118091 0.54452672888908 0.16122762482542 32.065 > 109 112 S 0.57594592118091 0.54452672888908 0.16122762482542 32.065 > 109 113 S 0.07594592118091 0.87786006222242 0.16122762482542 32.065 > 109 114 S 0.57594592118091 0.87786006222242 0.16122762482542 32.065 > 109 115 S 0.07594592118091 0.21119339555575 0.66122762482542 32.065 > 109 116 S 0.57594592118091 0.21119339555575 0.66122762482542 32.065 > 109 117 S 0.07594592118091 0.54452672888908 0.66122762482542 32.065 > 109 118 S 0.57594592118091 0.54452672888908 0.66122762482542 32.065 > 109 119 S 0.07594592118091 0.87786006222242 0.66122762482542 32.065 > 109 120 S 0.57594592118091 0.87786006222242 0.66122762482542 32.065 > 109 121 S 0.42405407881909 0.12213993777758 0.33877237517458 32.065 > 121 122 S 0.92405407881909 0.12213993777758 0.33877237517458 32.065 > 121 123 S 0.42405407881909 0.45547327111092 0.33877237517458 32.065 > 121 124 S 0.92405407881909 0.45547327111092 0.33877237517458 32.065 > 121 125 S 0.42405407881909 0.78880660444425 0.33877237517458 32.065 > 121 126 S 0.92405407881909 0.78880660444425 0.33877237517458 32.065 > 121 127 S 0.42405407881909 0.12213993777758 0.83877237517458 32.065 > 121 128 S 0.92405407881909 0.12213993777758 0.83877237517458 32.065 > 121 129 S 0.42405407881909 0.45547327111092 0.83877237517458 32.065 > 121 130 S 0.92405407881909 0.45547327111092 0.83877237517458 32.065 > 121 131 S 0.42405407881909 0.78880660444425 0.83877237517458 32.065 > 121 132 S 0.92405407881909 0.78880660444425 0.83877237517458 32.065 > 121 133 S 0.07594592118091 0.28880660444425 0.41122762482542 32.065 > 133 134 S 0.57594592118091 0.28880660444425 0.41122762482542 32.065 > 133 135 S 0.07594592118091 0.62213993777758 0.41122762482542 32.065 > 133 136 S 0.57594592118091 0.62213993777758 0.41122762482542 32.065 > 133 137 S 0.07594592118091 0.95547327111092 0.41122762482542 32.065 > 133 138 S 0.57594592118091 0.95547327111092 0.41122762482542 32.065 > 133 139 S 0.07594592118091 0.28880660444425 0.91122762482542 32.065 > 133 140 S 0.57594592118091 0.28880660444425 0.91122762482542 32.065 > 133 141 S 0.07594592118091 0.62213993777758 0.91122762482542 32.065 > 133 142 S 0.57594592118091 0.62213993777758 0.91122762482542 32.065 > 133 143 S 0.07594592118091 0.95547327111092 0.91122762482542 32.065 > 133 144 S 0.57594592118091 0.95547327111092 0.91122762482542 32.065 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 22.6421988 0.0000000 -0.0606895 0.0000000 24.9142382 0.0000000 -0.0606918 0.0000000 22.8790224 -------------------------- Born effective charges -------------------------- 1 Fe -6.2027022 -0.1579597 0.0263300 -0.4604035 -6.2058036 0.5145513 0.1456678 0.0150310 -6.3649965 2 Fe -6.2027022 -0.1579597 0.0263300 -0.4604035 -6.2058036 0.5145513 0.1456678 0.0150310 -6.3649965 3 Fe -6.2027022 0.1579597 0.0263300 0.4604035 -6.2058036 -0.5145513 0.1456678 -0.0150310 -6.3649965 4 Fe -6.2027022 0.1579597 0.0263300 0.4604035 -6.2058036 -0.5145513 0.1456678 -0.0150310 -6.3649965 5 As 3.3910093 0.0613894 0.3280189 -0.1178759 3.4131895 0.1669656 -0.2455808 -0.1477158 3.7027964 6 As 3.3910093 -0.0613894 0.3280189 0.1178759 3.4131895 -0.1669656 -0.2455808 0.1477158 3.7027964 7 As 3.3910093 -0.0613894 0.3280189 0.1178759 3.4131895 -0.1669656 -0.2455808 0.1477158 3.7027964 8 As 3.3910093 0.0613894 0.3280189 -0.1178759 3.4131895 0.1669656 -0.2455808 -0.1477158 3.7027964 9 S 2.8116929 -0.1644226 -0.3543488 -0.3163095 2.7926141 0.3782527 0.0999131 0.3995088 2.6622001 10 S 2.8116929 0.1644226 -0.3543488 0.3163095 2.7926141 -0.3782527 0.0999131 -0.3995088 2.6622001 11 S 2.8116929 0.1644226 -0.3543488 0.3163095 2.7926141 -0.3782527 0.0999131 -0.3995088 2.6622001 12 S 2.8116929 -0.1644226 -0.3543488 -0.3163095 2.7926141 0.3782527 0.0999131 0.3995088 2.6622001 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 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: 0.76, Number of G-points: 299, Lambda: 0.38 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: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 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 4.295 ( 0.000 0.000 0.000) 0.000 4.472 ( 0.000 0.000 0.000) 0.000 5.474 ( 0.000 0.000 0.000) 0.000 5.494 ( 0.000 0.000 0.000) 0.000 5.546 ( 0.000 0.000 0.000) 0.000 5.617 ( 0.000 0.000 0.000) 0.000 6.314 ( 0.000 0.000 0.000) 0.000 6.397 ( 0.000 0.000 0.000) 0.000 6.667 ( 0.000 0.000 0.000) 0.000 7.260 ( 0.000 0.000 0.000) 0.000 7.735 ( 0.000 0.000 0.000) 0.000 7.936 ( 0.000 0.000 0.000) 0.000 8.168 ( 0.000 0.000 0.000) 0.000 8.183 ( 0.000 0.000 0.000) 0.000 8.451 ( 0.000 0.000 0.000) 0.000 8.497 ( 0.000 0.000 0.000) 0.000 8.669 ( 0.000 0.000 0.000) 0.000 9.037 ( 0.000 0.000 0.000) 0.000 9.310 ( 0.000 0.000 0.000) 0.000 10.314 ( 0.000 0.000 0.000) 0.000 10.617 ( 0.000 0.000 0.000) 0.000 10.709 ( 0.000 0.000 0.000) 0.000 10.797 ( 0.000 0.000 0.000) 0.000 10.903 ( 0.000 0.000 0.000) 0.000 10.973 ( 0.000 0.000 0.000) 0.000 11.086 ( 0.000 0.000 0.000) 0.000 11.167 ( 0.000 0.000 0.000) 0.000 11.451 ( 0.000 0.000 0.000) 0.000 11.780 ( 0.000 0.000 0.000) 0.000 12.939 ( 0.000 0.000 0.000) 0.000 13.809 ( 0.000 0.000 0.000) 0.000 13.879 ( 0.000 0.000 0.000) 0.000 14.101 ( 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: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.743 ( 34.300 0.000 17.770) 38.630 0.821 ( 42.935 0.000 7.423) 43.571 1.413 ( 68.391 0.000 25.620) 73.032 4.291 ( -0.289 0.000 -0.994) 1.035 4.499 ( 3.568 0.000 -2.645) 4.441 5.454 ( -0.224 0.000 -4.394) 4.400 5.517 ( -1.173 0.000 -4.468) 4.619 5.542 ( 3.470 0.000 3.866) 5.195 5.635 ( 1.128 0.000 2.715) 2.940 6.316 ( -0.342 0.000 1.202) 1.250 6.388 ( -1.298 0.000 0.562) 1.414 6.692 ( -1.007 0.000 -1.981) 2.222 7.242 ( 0.328 0.000 -5.315) 5.326 7.771 ( 2.670 0.000 2.067) 3.377 7.854 ( -6.076 0.000 -5.065) 7.910 8.156 ( -3.456 0.000 6.764) 7.596 8.238 ( 4.583 0.000 1.052) 4.702 8.436 ( -2.246 0.000 1.759) 2.853 8.706 ( 3.528 0.000 0.835) 3.626 9.035 ( -7.831 0.000 -7.728) 11.003 9.105 ( 6.138 0.000 1.904) 6.427 9.384 ( -2.032 0.000 -5.052) 5.445 10.338 ( 1.889 0.000 -0.287) 1.911 10.537 ( -2.322 0.000 -13.174) 13.377 10.731 ( 2.724 0.000 -0.702) 2.813 10.808 ( -2.706 0.000 7.813) 8.268 10.895 ( -2.134 0.000 2.531) 3.310 10.965 ( -1.442 0.000 2.538) 2.919 11.163 ( 5.956 0.000 -5.365) 8.017 11.182 ( 1.340 0.000 0.843) 1.583 11.776 ( 0.018 0.000 -1.246) 1.246 12.189 ( -29.308 0.000 70.991) 76.803 12.949 ( 1.027 0.000 0.111) 1.033 13.877 ( -0.852 0.000 1.652) 1.859 14.093 ( 0.083 0.000 -2.483) 2.484 14.444 ( 19.019 0.000 -50.731) 54.179 ======================= Grid point 2 (3/260) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 32.514 0.000 17.140) 36.755 1.619 ( 40.940 0.000 7.515) 41.624 2.772 ( 63.880 0.000 24.953) 68.581 4.257 ( -2.356 0.000 -2.665) 3.558 4.521 ( 0.180 0.000 -3.958) 3.963 5.430 ( 2.547 0.000 -5.686) 6.231 5.452 ( -0.744 0.000 -7.614) 7.651 5.632 ( 3.754 0.000 1.202) 3.941 5.720 ( 4.452 0.000 7.814) 8.993 6.319 ( -0.583 0.000 1.920) 2.007 6.356 ( -2.813 0.000 0.340) 2.833 6.648 ( -3.764 0.000 1.549) 4.071 7.210 ( 0.518 0.000 -4.800) 4.828 7.695 ( -6.133 0.000 -6.193) 8.716 7.833 ( 1.697 0.000 2.388) 2.930 8.132 ( -5.133 0.000 7.680) 9.237 8.353 ( 6.110 0.000 3.604) 7.094 8.407 ( -2.236 0.000 1.442) 2.660 8.696 ( -20.496 0.000 -12.551) 24.033 8.793 ( 5.316 0.000 0.732) 5.366 9.251 ( 7.537 0.000 3.102) 8.150 9.369 ( 1.883 0.000 -0.325) 1.911 10.352 ( 0.156 0.000 -1.333) 1.342 10.385 ( -2.981 0.000 -13.728) 14.048 10.785 ( 3.844 0.000 -1.717) 4.210 10.797 ( -5.430 0.000 7.754) 9.466 10.858 ( -3.332 0.000 1.251) 3.559 10.975 ( 0.312 0.000 3.938) 3.951 11.227 ( 2.571 0.000 1.714) 3.090 11.234 ( 4.441 0.000 -1.804) 4.793 11.760 ( -0.417 0.000 -2.385) 2.421 12.183 ( -13.569 0.000 32.649) 35.356 12.974 ( 1.576 0.000 0.084) 1.578 13.875 ( -1.248 0.000 3.228) 3.461 14.069 ( 0.076 0.000 -4.503) 4.503 14.403 ( 6.606 0.000 -22.976) 23.907 ======================= Grid point 3 (4/260) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( 29.444 0.000 15.780) 33.406 2.371 ( 37.575 0.000 7.576) 38.331 3.908 ( 25.559 0.000 15.428) 29.854 4.259 ( 24.161 0.000 2.670) 24.308 4.406 ( -9.852 0.000 -5.146) 11.116 5.398 ( 1.219 0.000 -7.735) 7.830 5.475 ( 5.406 0.000 -2.519) 5.965 5.714 ( 6.394 0.000 -2.021) 6.706 5.864 ( 3.897 0.000 8.622) 9.462 6.291 ( -4.304 0.000 -0.761) 4.370 6.324 ( -0.494 0.000 2.234) 2.288 6.586 ( -4.438 0.000 1.747) 4.769 7.195 ( 1.050 0.000 -3.147) 3.317 7.577 ( -1.986 0.000 -5.716) 6.051 7.828 ( -5.168 0.000 -1.440) 5.365 8.089 ( -5.731 0.000 7.383) 9.346 8.141 ( -24.317 0.000 -12.447) 27.318 8.436 ( -0.451 0.000 2.446) 2.488 8.482 ( 4.407 0.000 4.478) 6.282 8.895 ( 6.113 0.000 -0.624) 6.145 9.390 ( 4.833 0.000 3.216) 5.805 9.417 ( 2.868 0.000 0.439) 2.901 10.265 ( -0.158 0.000 -9.721) 9.722 10.329 ( -1.206 0.000 -1.636) 2.032 10.708 ( -9.790 0.000 5.507) 11.232 10.819 ( -1.403 0.000 -0.288) 1.432 10.828 ( 2.289 0.000 -1.595) 2.790 11.036 ( 3.424 0.000 3.029) 4.572 11.281 ( 1.521 0.000 -0.463) 1.590 11.296 ( 3.371 0.000 2.499) 4.196 11.725 ( -1.245 0.000 -3.176) 3.412 12.182 ( -7.105 0.000 17.853) 19.215 13.002 ( 1.491 0.000 -0.023) 1.492 13.882 ( -1.098 0.000 4.627) 4.756 14.032 ( 0.013 0.000 -5.816) 5.816 14.352 ( 2.180 0.000 -12.329) 12.520 ======================= Grid point 4 (5/260) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( 23.861 0.000 12.782) 27.069 3.050 ( 32.666 0.000 7.453) 33.505 3.817 ( -13.636 0.000 -5.311) 14.634 4.105 ( -19.049 0.000 -6.345) 20.078 5.194 ( 42.194 0.000 14.229) 44.528 5.404 ( 8.274 0.000 -1.158) 8.354 5.552 ( 3.203 0.000 0.757) 3.292 5.830 ( 8.702 0.000 -4.160) 9.645 5.953 ( -0.637 0.000 6.760) 6.790 6.208 ( -3.459 0.000 -1.330) 3.706 6.334 ( -0.092 0.000 1.892) 1.895 6.524 ( -3.229 0.000 0.830) 3.334 7.190 ( -1.374 0.000 -2.297) 2.676 7.381 ( -29.654 0.000 -15.725) 33.565 7.540 ( 1.308 0.000 -3.942) 4.153 7.893 ( -3.945 0.000 1.667) 4.283 8.043 ( -4.404 0.000 5.352) 6.931 8.468 ( 1.463 0.000 1.224) 1.907 8.556 ( 0.925 0.000 2.736) 2.888 8.999 ( 5.860 0.000 -1.091) 5.960 9.453 ( 0.423 0.000 1.739) 1.789 9.464 ( 1.902 0.000 0.462) 1.958 10.260 ( 5.271 0.000 -4.004) 6.620 10.296 ( -1.133 0.000 -1.108) 1.585 10.550 ( -10.598 0.000 2.067) 10.798 10.798 ( -0.779 0.000 -0.161) 0.796 10.847 ( 0.951 0.000 -0.704) 1.183 11.124 ( 4.414 0.000 1.237) 4.584 11.279 ( -1.432 0.000 0.064) 1.434 11.374 ( 3.003 0.000 2.496) 3.905 11.674 ( -1.692 0.000 -2.921) 3.376 12.187 ( -3.002 0.000 8.200) 8.732 13.023 ( 0.888 0.000 -0.065) 0.890 13.904 ( -0.651 0.000 5.615) 5.653 13.988 ( 0.023 0.000 -6.307) 6.307 14.309 ( 0.473 0.000 -5.592) 5.612 ======================= Grid point 5 (6/260) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.045 ( 0.000 0.000 0.000) 0.000 3.565 ( -0.000 0.000 -0.000) 0.000 3.603 ( 0.000 0.000 0.000) 0.000 3.714 ( 0.000 0.000 0.000) 0.000 5.361 ( 0.000 0.000 0.000) 0.000 5.585 ( 0.000 0.000 0.000) 0.000 5.903 ( 0.000 0.000 0.000) 0.000 5.926 ( 0.000 0.000 0.000) 0.000 5.942 ( 0.000 0.000 0.000) 0.000 6.170 ( 0.000 0.000 -0.000) 0.000 6.336 ( 0.000 0.000 0.000) 0.000 6.503 ( 0.000 0.000 0.000) 0.000 6.842 ( 0.000 0.000 0.000) 0.000 7.215 ( 0.000 0.000 0.000) 0.000 7.542 ( 0.000 0.000 0.000) 0.000 7.867 ( 0.000 0.000 0.000) 0.000 8.021 ( 0.000 0.000 0.000) 0.000 8.487 ( 0.000 0.000 0.000) 0.000 8.570 ( 0.000 0.000 -0.000) 0.000 9.055 ( 0.000 0.000 0.000) 0.000 9.455 ( 0.000 0.000 0.000) 0.000 9.484 ( 0.000 0.000 -0.000) 0.000 10.281 ( 0.000 0.000 0.000) 0.000 10.363 ( 0.000 0.000 0.000) 0.000 10.395 ( -0.000 0.000 0.000) 0.000 10.790 ( 0.000 0.000 -0.000) 0.000 10.853 ( 0.000 0.000 0.000) 0.000 11.183 ( 0.000 0.000 0.000) 0.000 11.251 ( 0.000 0.000 -0.000) 0.000 11.416 ( 0.000 0.000 -0.000) 0.000 11.643 ( 0.000 0.000 0.000) 0.000 12.191 ( 0.000 0.000 0.000) 0.000 13.031 ( 0.000 0.000 0.000) 0.000 13.932 ( 0.000 0.000 -0.000) 0.000 13.952 ( 0.000 0.000 0.000) 0.000 14.292 ( 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: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.780 ( 0.000 39.128 0.000) 39.128 0.986 ( 0.000 48.978 0.000) 48.978 1.566 ( 0.000 77.063 0.000) 77.063 4.346 ( 0.000 4.936 0.000) 4.936 4.529 ( 0.000 5.722 0.000) 5.722 5.312 ( 0.000 -14.794 0.000) 14.794 5.443 ( 0.000 -7.238 0.000) 7.238 5.629 ( 0.000 1.141 0.000) 1.141 5.702 ( 0.000 7.480 0.000) 7.480 6.322 ( 0.000 0.089 0.000) 0.089 6.395 ( 0.000 -0.259 0.000) 0.259 6.657 ( 0.000 -1.068 0.000) 1.068 7.251 ( 0.000 -0.992 0.000) 0.992 7.590 ( 0.000 -12.362 0.000) 12.362 7.987 ( 0.000 -3.974 0.000) 3.974 8.156 ( 0.000 -0.911 0.000) 0.911 8.496 ( 0.000 5.342 0.000) 5.342 8.509 ( 0.000 0.681 0.000) 0.681 8.618 ( 0.000 8.111 0.000) 8.111 8.893 ( 0.000 -1.446 0.000) 1.446 8.923 ( 0.000 -10.136 0.000) 10.136 9.342 ( 0.000 2.226 0.000) 2.226 10.264 ( 0.000 -6.254 0.000) 6.254 10.573 ( 0.000 -4.343 0.000) 4.343 10.649 ( 0.000 -1.179 0.000) 1.179 10.834 ( 0.000 2.364 0.000) 2.364 10.869 ( 0.000 -2.076 0.000) 2.076 11.095 ( 0.000 8.745 0.000) 8.745 11.124 ( 0.000 2.317 0.000) 2.317 11.466 ( 0.000 1.512 0.000) 1.512 11.710 ( 0.000 1.555 0.000) 1.555 11.776 ( 0.000 -0.255 0.000) 0.255 12.977 ( 0.000 3.791 0.000) 3.791 13.800 ( 0.000 -0.862 0.000) 0.862 14.108 ( 0.000 0.628 0.000) 0.628 14.647 ( 0.000 -3.726 0.000) 3.726 ======================= Grid point 12 (8/260) ======================= q-point: ( 0.10 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.172 ( 18.563 35.256 17.837) 43.654 1.377 ( 32.754 32.604 16.143) 48.954 1.980 ( 43.813 55.518 6.238) 70.998 4.339 ( -0.595 4.720 -0.748) 4.816 4.556 ( 3.607 5.588 -2.841) 7.233 5.351 ( 2.852 -12.890 2.516) 13.439 5.420 ( -0.703 -5.112 -1.930) 5.509 5.636 ( 1.826 1.398 -2.264) 3.227 5.670 ( -1.394 6.934 -1.870) 7.316 6.305 ( -1.539 -0.759 0.791) 1.889 6.393 ( -0.869 -0.094 0.820) 1.198 6.660 ( -0.822 -2.164 0.447) 2.358 7.229 ( -0.996 -1.218 -2.280) 2.770 7.638 ( 4.020 -11.692 1.688) 12.479 7.865 ( -9.784 -2.465 -5.180) 11.341 8.151 ( -2.373 -0.329 3.251) 4.039 8.289 ( -3.946 5.859 -0.289) 7.070 8.536 ( -1.083 6.817 2.778) 7.441 8.715 ( 3.631 -0.414 0.149) 3.658 8.859 ( 0.341 -5.836 1.716) 6.093 9.113 ( 4.228 -7.564 -2.903) 9.139 9.363 ( 2.018 1.809 0.219) 2.719 10.269 ( 2.255 -7.561 -0.586) 7.912 10.508 ( -2.232 -1.997 -9.411) 9.876 10.648 ( -1.638 -2.747 3.943) 5.077 10.824 ( -1.854 1.691 3.263) 4.117 10.865 ( -0.333 -0.993 -0.734) 1.279 11.039 ( -2.322 5.796 1.100) 6.340 11.153 ( 0.767 3.528 1.024) 3.752 11.415 ( 2.669 9.880 -6.333) 12.035 11.765 ( 0.713 -0.924 -2.200) 2.490 11.969 ( -2.698 -10.532 38.091) 39.612 12.979 ( 0.681 3.470 -0.618) 3.590 13.838 ( 3.287 -2.005 -1.013) 3.981 14.088 ( -1.486 0.163 -0.989) 1.792 14.542 ( 0.647 1.814 -20.707) 20.797 ======================= Grid point 13 (9/260) ======================= q-point: ( 0.20 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( 24.953 24.182 18.833) 39.524 2.046 ( 32.865 31.986 9.182) 46.771 3.022 ( 57.282 26.103 18.289) 65.552 4.305 ( -2.292 4.675 -2.373) 5.722 4.580 ( 0.559 5.658 -4.113) 7.017 5.395 ( 2.018 -3.321 -3.263) 5.074 5.424 ( 2.685 -5.825 -2.492) 6.881 5.647 ( 0.699 2.160 0.291) 2.289 5.696 ( 5.336 -0.577 0.996) 5.459 6.286 ( -1.561 -2.241 1.346) 3.045 6.368 ( -2.600 -0.084 0.472) 2.644 6.628 ( -3.369 -1.821 1.591) 4.146 7.199 ( -0.264 -1.099 -2.336) 2.595 7.648 ( -9.248 -4.973 -5.655) 11.926 7.727 ( 4.106 -10.076 1.448) 10.977 8.134 ( -3.288 -0.089 6.944) 7.684 8.261 ( -2.311 -0.745 -0.306) 2.448 8.555 ( 0.807 6.358 3.429) 7.269 8.650 ( -11.927 -1.401 -6.570) 13.689 8.874 ( 3.248 5.150 -0.041) 6.089 9.130 ( 3.154 -9.917 -0.154) 10.408 9.425 ( 4.538 3.330 0.689) 5.670 10.299 ( 2.011 -6.918 -7.089) 10.108 10.404 ( -2.169 2.081 -4.459) 5.377 10.655 ( -1.385 -6.911 5.210) 8.765 10.817 ( -1.407 1.188 2.510) 3.114 10.848 ( -0.992 0.332 -0.478) 1.150 11.022 ( -1.928 4.439 3.439) 5.937 11.177 ( 1.481 1.345 0.722) 2.127 11.448 ( 3.681 10.292 -2.327) 11.176 11.754 ( 0.166 -0.338 -2.985) 3.009 12.104 ( -6.915 -6.321 26.693) 28.289 12.993 ( 1.355 2.484 -0.686) 2.912 13.877 ( 0.755 -0.280 1.808) 1.979 14.053 ( -0.601 -1.233 -3.303) 3.576 14.423 ( 1.076 0.725 -16.855) 16.904 ======================= Grid point 14 (10/260) ======================= q-point: ( 0.30 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.287 ( 25.729 16.477 17.494) 35.207 2.683 ( 32.301 26.156 7.062) 42.159 4.013 ( 16.182 10.174 10.134) 21.635 4.343 ( 30.197 8.973 5.174) 31.924 4.479 ( -8.476 6.959 -4.943) 12.029 5.408 ( 2.486 0.513 -6.612) 7.082 5.459 ( 4.549 -1.810 -1.443) 5.105 5.701 ( 5.064 -1.930 0.147) 5.422 5.826 ( 5.692 -2.386 4.773) 7.802 6.258 ( -2.948 -2.513 0.084) 3.875 6.318 ( -2.347 -1.215 0.644) 2.720 6.570 ( -4.222 -1.659 1.297) 4.718 7.187 ( 0.177 -0.918 -1.203) 1.524 7.473 ( -6.082 -8.997 -4.607) 11.797 7.789 ( 1.342 -5.474 -0.494) 5.658 8.053 ( -18.121 -3.348 -11.348) 21.641 8.135 ( -4.015 -0.890 6.870) 8.006 8.380 ( -8.423 4.836 1.532) 9.832 8.634 ( 4.010 5.366 2.611) 7.190 8.953 ( 5.060 5.126 -0.606) 7.228 9.207 ( 3.873 -11.903 1.402) 12.595 9.515 ( 4.086 3.611 1.369) 5.622 10.247 ( 1.102 -2.295 -8.794) 9.156 10.370 ( -1.033 3.599 -0.746) 3.818 10.643 ( -5.480 -6.425 5.647) 10.159 10.812 ( 0.055 0.048 -0.743) 0.746 10.832 ( -0.355 1.273 0.394) 1.379 11.023 ( -0.396 1.686 3.218) 3.655 11.214 ( 1.935 -0.364 0.547) 2.043 11.497 ( 2.691 9.936 -0.137) 10.295 11.726 ( -0.629 0.353 -3.790) 3.858 12.148 ( -5.147 -3.171 16.448) 17.524 13.013 ( 1.292 1.566 -0.556) 2.105 13.897 ( -0.806 1.059 4.235) 4.439 14.021 ( 0.468 -1.360 -5.035) 5.237 14.331 ( -0.184 -1.902 -10.920) 11.086 ======================= Grid point 15 (11/260) ======================= q-point: ( 0.40 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.834 ( 22.139 12.405 14.275) 29.117 3.279 ( 29.132 20.198 6.356) 36.014 3.880 ( -13.259 6.413 -6.216) 15.986 4.209 ( -17.193 9.954 -5.544) 20.626 5.241 ( 36.669 4.276 12.732) 39.051 5.420 ( 7.727 1.542 -1.826) 8.088 5.548 ( 5.091 0.006 1.714) 5.371 5.812 ( 7.400 -2.622 -1.430) 7.980 5.933 ( 2.446 -0.834 4.586) 5.264 6.183 ( -3.595 -2.461 -1.798) 4.713 6.311 ( -0.158 -2.384 1.627) 2.891 6.509 ( -2.809 -1.550 0.384) 3.231 7.178 ( -1.384 -0.980 -0.761) 1.859 7.362 ( -4.944 -11.670 -4.515) 13.455 7.432 ( -26.474 2.876 -12.661) 29.486 7.902 ( 4.102 -4.294 -1.455) 6.114 8.104 ( -5.297 2.250 5.968) 8.291 8.313 ( -2.595 0.118 1.955) 3.251 8.715 ( 2.767 4.938 1.813) 5.944 9.033 ( 4.412 3.727 -1.117) 5.882 9.270 ( 2.028 -11.489 1.051) 11.713 9.569 ( 1.012 3.535 0.646) 3.733 10.259 ( 5.444 -0.236 -3.532) 6.494 10.346 ( -0.918 4.453 -0.698) 4.600 10.539 ( -9.031 -1.727 2.635) 9.565 10.801 ( -0.438 0.296 -0.550) 0.763 10.843 ( 0.836 0.081 -0.043) 0.841 11.055 ( 1.397 -2.459 2.106) 3.526 11.244 ( 0.913 -0.614 0.239) 1.126 11.541 ( 1.766 9.573 1.645) 9.872 11.680 ( -1.261 0.938 -3.834) 4.143 12.168 ( -2.466 -1.931 7.921) 8.517 13.028 ( 0.757 0.930 -0.334) 1.245 13.912 ( -1.082 0.281 4.498) 4.635 13.998 ( 0.911 0.889 -4.754) 4.922 14.263 ( -0.619 -4.255 -5.439) 6.933 ======================= Grid point 16 (12/260) ======================= q-point: (-0.50 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.158 ( 0.000 11.344 -0.000) 11.344 3.656 ( 0.000 7.441 0.000) 7.441 3.781 ( -0.000 17.905 -0.000) 17.905 3.821 ( 0.000 10.275 0.000) 10.275 5.379 ( 0.000 1.804 -0.000) 1.804 5.576 ( 0.000 -0.864 0.000) 0.864 5.790 ( 0.000 -6.079 -0.000) 6.079 5.898 ( 0.000 -4.281 0.000) 4.281 6.037 ( 0.000 4.508 0.000) 4.508 6.151 ( 0.000 -0.124 -0.000) 0.124 6.314 ( 0.000 -2.248 0.000) 2.248 6.494 ( 0.000 -1.077 0.000) 1.077 6.925 ( 0.000 8.077 0.000) 8.077 7.205 ( 0.000 -0.674 0.000) 0.674 7.333 ( 0.000 -15.236 0.000) 15.236 7.955 ( 0.000 -2.507 0.000) 2.507 8.060 ( 0.000 3.661 0.000) 3.661 8.297 ( 0.000 -1.811 0.000) 1.811 8.747 ( 0.000 5.313 0.000) 5.313 9.074 ( 0.000 2.587 0.000) 2.587 9.291 ( 0.000 -10.911 0.000) 10.911 9.575 ( 0.000 3.442 -0.000) 3.442 10.326 ( 0.000 4.062 0.000) 4.062 10.362 ( 0.000 -0.004 0.000) 0.004 10.408 ( -0.000 0.810 0.000) 0.810 10.795 ( 0.000 0.461 -0.000) 0.461 10.851 ( 0.000 -0.016 0.000) 0.016 11.080 ( 0.000 -4.324 0.000) 4.324 11.251 ( 0.000 -0.159 -0.000) 0.159 11.572 ( 0.000 10.162 0.000) 10.162 11.645 ( 0.000 0.309 0.000) 0.309 12.175 ( 0.000 -1.624 0.000) 1.624 13.034 ( 0.000 0.698 0.000) 0.698 13.920 ( 0.000 -1.135 -0.000) 1.135 13.988 ( 0.000 3.126 0.000) 3.126 14.237 ( 0.000 -5.369 0.000) 5.369 ======================= Grid point 22 (13/260) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( 0.000 38.863 0.000) 38.863 1.938 ( 0.000 46.343 0.000) 46.343 3.034 ( 0.000 69.245 0.000) 69.245 4.474 ( 0.000 7.121 0.000) 7.121 4.693 ( 0.000 10.370 0.000) 10.370 4.929 ( 0.000 -23.251 0.000) 23.251 5.281 ( 0.000 -8.158 0.000) 8.158 5.654 ( 0.000 1.002 0.000) 1.002 5.850 ( 0.000 6.979 0.000) 6.979 6.294 ( 0.000 -2.928 0.000) 2.928 6.387 ( 0.000 -0.477 0.000) 0.477 6.620 ( 0.000 -2.722 0.000) 2.722 7.216 ( 0.000 -2.682 0.000) 2.682 7.325 ( 0.000 -12.863 0.000) 12.863 7.862 ( 0.000 -8.453 0.000) 8.453 8.150 ( 0.000 0.813 0.000) 0.813 8.448 ( 0.000 -10.860 0.000) 10.860 8.641 ( 0.000 8.036 0.000) 8.036 8.727 ( 0.000 -5.292 0.000) 5.292 8.739 ( 0.000 3.166 0.000) 3.166 8.897 ( 0.000 2.352 0.000) 2.352 9.375 ( 0.000 0.894 0.000) 0.894 10.089 ( 0.000 -9.154 0.000) 9.154 10.457 ( 0.000 -6.979 0.000) 6.979 10.702 ( 0.000 5.060 0.000) 5.060 10.843 ( 0.000 -0.540 0.000) 0.540 10.895 ( 0.000 3.471 0.000) 3.471 11.145 ( 0.000 -0.292 0.000) 0.292 11.259 ( 0.000 7.323 0.000) 7.323 11.505 ( 0.000 2.055 0.000) 2.055 11.748 ( 0.000 2.103 0.000) 2.103 11.776 ( 0.000 0.406 0.000) 0.406 13.088 ( 0.000 7.284 0.000) 7.284 13.772 ( 0.000 -2.082 0.000) 2.082 14.124 ( 0.000 0.928 0.000) 0.928 14.545 ( 0.000 -6.321 0.000) 6.321 ======================= Grid point 23 (14/260) ======================= q-point: ( 0.10 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 20.214 33.720 16.744) 42.731 2.109 ( 17.129 40.708 9.516) 45.179 3.224 ( 20.939 63.193 1.241) 66.583 4.465 ( -0.928 7.376 -0.216) 7.437 4.706 ( 2.975 8.292 -3.403) 9.444 5.004 ( 5.380 -20.413 5.710) 21.869 5.291 ( 1.243 -6.882 -0.262) 6.998 5.663 ( 2.481 1.187 -3.065) 4.118 5.815 ( -2.181 7.076 -3.786) 8.316 6.269 ( -2.196 -3.081 -0.189) 3.788 6.383 ( -0.920 -0.745 0.316) 1.225 6.611 ( -1.356 -2.978 0.570) 3.321 7.187 ( -2.386 -3.233 0.733) 4.084 7.381 ( 4.769 -12.688 0.523) 13.565 7.753 ( -9.806 -7.853 -3.508) 13.044 8.153 ( -0.460 1.126 1.663) 2.060 8.407 ( -5.864 1.224 1.254) 6.120 8.572 ( -1.442 -8.931 -1.935) 9.251 8.671 ( 1.132 6.194 1.692) 6.520 8.864 ( 3.472 0.725 1.251) 3.761 8.964 ( 2.217 -3.377 1.652) 4.364 9.400 ( 3.036 0.999 -0.615) 3.255 10.086 ( 0.972 -8.749 -0.845) 8.844 10.435 ( -1.171 -5.560 -2.273) 6.120 10.681 ( -2.521 4.806 0.813) 5.487 10.839 ( -0.608 0.130 0.837) 1.043 10.895 ( 0.109 3.348 -0.391) 3.373 11.124 ( -0.974 2.090 -0.469) 2.353 11.253 ( -1.671 5.986 1.966) 6.519 11.538 ( 3.464 2.957 -1.607) 4.829 11.756 ( 2.156 0.539 -4.341) 4.877 11.856 ( 0.878 -2.242 16.776) 16.948 13.086 ( 0.024 7.164 -0.478) 7.180 13.796 ( 2.920 -2.559 -1.072) 4.028 14.097 ( -2.742 0.657 -0.298) 2.836 14.500 ( -1.650 -4.820 -7.204) 8.823 ======================= Grid point 24 (15/260) ======================= q-point: ( 0.20 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( 17.320 33.645 16.368) 41.230 2.660 ( 29.001 29.361 14.828) 43.852 3.775 ( 36.144 44.905 7.391) 58.116 4.436 ( -1.426 8.367 -1.663) 8.649 4.729 ( 1.403 8.390 -3.883) 9.351 5.170 ( 7.649 -16.772 6.659) 19.600 5.325 ( 3.246 -4.041 -0.497) 5.207 5.711 ( 5.888 1.290 -3.937) 7.200 5.735 ( -2.512 6.075 -5.113) 8.328 6.230 ( -2.103 -3.602 0.504) 4.202 6.349 ( -2.862 -1.349 -0.835) 3.272 6.578 ( -3.067 -3.346 0.846) 4.617 7.158 ( -1.880 -3.399 1.705) 4.242 7.475 ( 4.056 -12.994 0.381) 13.617 7.520 ( -10.455 -7.649 -4.998) 13.885 8.156 ( -1.420 2.385 4.109) 4.959 8.298 ( -7.254 3.000 -1.285) 7.954 8.572 ( 0.600 -8.658 -0.503) 8.693 8.679 ( -3.815 6.420 2.695) 7.940 8.905 ( 0.921 -8.070 -0.967) 8.180 8.980 ( 3.068 2.384 -0.702) 3.948 9.468 ( 4.627 0.651 -0.051) 4.673 10.124 ( 3.699 -8.157 -1.822) 9.140 10.404 ( -0.848 -2.839 0.273) 2.975 10.632 ( -3.700 3.808 1.352) 5.479 10.836 ( -0.321 0.839 0.292) 0.944 10.893 ( -0.266 3.716 0.301) 3.737 11.116 ( -0.843 3.994 1.885) 4.497 11.230 ( -1.828 3.744 1.133) 4.318 11.589 ( 3.254 3.571 -1.267) 4.995 11.760 ( 1.926 1.332 -4.534) 5.103 11.986 ( -0.873 -4.867 17.152) 17.850 13.084 ( 0.233 6.566 -0.831) 6.622 13.850 ( 3.598 -2.683 -0.651) 4.535 14.034 ( -3.521 -0.441 -1.007) 3.689 14.400 ( -2.752 -3.171 -8.959) 9.894 ======================= Grid point 25 (16/260) ======================= q-point: ( 0.30 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.748 ( 19.182 28.045 16.432) 37.743 3.242 ( 26.277 27.635 10.104) 39.449 4.255 ( -2.774 12.082 0.200) 12.398 4.636 ( 22.655 15.916 4.153) 27.997 4.676 ( 8.173 15.894 0.336) 17.875 5.348 ( 7.473 -9.819 3.136) 12.732 5.415 ( 7.016 -0.227 0.546) 7.041 5.669 ( -0.447 1.330 -2.315) 2.707 5.819 ( 8.020 1.503 -2.084) 8.421 6.198 ( -2.314 -3.671 -0.102) 4.341 6.276 ( -3.499 -2.406 -1.633) 4.550 6.516 ( -3.928 -3.926 -0.130) 5.555 7.140 ( -2.257 -5.322 2.415) 6.265 7.288 ( -8.959 -7.236 -4.886) 12.509 7.582 ( 5.429 -13.182 0.576) 14.268 8.049 ( -17.765 3.091 -9.534) 20.397 8.162 ( -1.742 3.507 4.718) 6.132 8.527 ( -4.763 6.230 0.333) 7.849 8.655 ( 0.440 -2.965 4.180) 5.144 8.946 ( 4.039 -12.584 -1.119) 13.263 9.052 ( 4.470 3.542 -0.543) 5.729 9.550 ( 3.930 -0.161 0.613) 3.981 10.172 ( 4.171 -4.111 -3.240) 6.693 10.416 ( 0.355 -0.954 2.983) 3.152 10.572 ( -4.597 1.963 2.169) 5.449 10.827 ( -0.571 0.993 -0.546) 1.269 10.894 ( -0.040 4.796 0.912) 4.883 11.103 ( -2.544 5.442 2.485) 6.501 11.220 ( 0.376 0.497 -0.007) 0.623 11.630 ( 1.764 3.050 0.182) 3.528 11.757 ( 1.710 3.065 -5.244) 6.310 12.068 ( -1.941 -4.508 12.895) 13.797 13.082 ( 0.283 5.576 -0.895) 5.654 13.907 ( 2.065 -0.816 1.786) 2.850 13.970 ( -1.510 -3.090 -2.673) 4.356 14.283 ( -3.565 -2.944 -7.460) 8.776 ======================= Grid point 26 (17/260) ======================= q-point: ( 0.40 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.197 ( 18.029 22.965 14.370) 32.541 3.737 ( 22.688 23.731 6.499) 33.468 4.069 ( -11.725 12.090 -6.818) 18.170 4.467 ( -12.425 14.754 -4.331) 19.769 5.310 ( 20.089 0.776 8.577) 21.857 5.451 ( 5.683 0.453 -1.934) 6.020 5.580 ( 8.824 3.608 4.391) 10.496 5.711 ( 4.483 -5.870 2.164) 7.696 5.962 ( 7.662 1.873 0.356) 7.896 6.138 ( 0.948 0.637 -2.651) 2.886 6.244 ( -0.173 -3.919 0.959) 4.038 6.457 ( -1.684 -3.680 -0.527) 4.081 7.076 ( -5.186 -13.578 -0.992) 14.568 7.173 ( -2.087 -0.908 -0.532) 2.337 7.567 ( -23.576 9.322 -10.843) 27.573 7.678 ( 2.966 -14.261 -0.571) 14.577 8.160 ( -1.413 4.769 2.720) 5.669 8.466 ( -3.053 9.538 1.857) 10.185 8.708 ( 2.133 -5.024 2.033) 5.825 9.003 ( 2.707 -14.856 -0.634) 15.114 9.117 ( 3.194 3.390 -0.677) 4.707 9.599 ( 1.204 -0.530 0.116) 1.321 10.249 ( 6.488 -0.450 -1.035) 6.586 10.436 ( -0.147 1.635 1.472) 2.205 10.494 ( -6.157 0.867 1.961) 6.519 10.813 ( -0.464 0.756 -0.492) 1.015 10.901 ( 0.088 5.887 0.510) 5.909 11.077 ( -1.526 3.858 1.357) 4.365 11.233 ( 0.709 -0.848 0.010) 1.106 11.652 ( 0.151 1.755 1.286) 2.180 11.748 ( 1.350 5.455 -4.408) 7.142 12.110 ( -1.337 -3.919 6.894) 8.042 13.081 ( 0.162 4.673 -0.596) 4.714 13.907 ( -2.041 -0.785 1.095) 2.445 13.990 ( 3.890 -2.944 -0.575) 4.912 14.171 ( -3.830 -3.826 -4.945) 7.332 ======================= Grid point 27 (18/260) ======================= q-point: (-0.50 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.487 ( -0.000 21.130 -0.000) 21.130 3.859 ( 0.000 12.587 0.000) 12.587 4.093 ( -0.000 16.229 -0.000) 16.229 4.212 ( 0.000 22.696 0.000) 22.696 5.422 ( 0.000 1.707 0.000) 1.707 5.561 ( 0.000 -0.118 -0.000) 0.118 5.680 ( 0.000 -4.706 -0.000) 4.706 5.783 ( 0.000 -6.570 0.000) 6.570 5.971 ( 0.000 -8.650 0.000) 8.650 6.247 ( 0.000 -4.259 0.000) 4.259 6.278 ( -0.000 7.252 0.000) 7.252 6.473 ( 0.000 1.471 0.000) 1.471 7.026 ( -0.000 -14.288 0.000) 14.288 7.107 ( 0.000 5.957 0.000) 5.957 7.245 ( 0.000 8.613 0.000) 8.613 7.713 ( 0.000 -15.505 0.000) 15.505 8.156 ( 0.000 5.793 0.000) 5.793 8.445 ( 0.000 10.139 0.000) 10.139 8.738 ( 0.000 -4.927 0.000) 4.927 9.026 ( 0.000 -15.953 -0.000) 15.953 9.145 ( 0.000 3.234 0.000) 3.234 9.606 ( 0.000 -0.354 -0.000) 0.354 10.364 ( 0.000 0.162 0.000) 0.162 10.387 ( -0.000 -0.454 0.000) 0.454 10.440 ( 0.000 4.847 0.000) 4.847 10.806 ( 0.000 0.608 0.000) 0.608 10.903 ( 0.000 6.162 0.000) 6.162 11.070 ( 0.000 2.546 0.000) 2.546 11.239 ( 0.000 -1.137 -0.000) 1.137 11.657 ( 0.000 0.885 -0.000) 0.885 11.744 ( 0.000 6.803 0.000) 6.803 12.123 ( 0.000 -3.730 0.000) 3.730 13.080 ( 0.000 4.309 0.000) 4.309 13.891 ( 0.000 -1.749 0.000) 1.749 14.049 ( 0.000 2.365 0.000) 2.365 14.093 ( 0.000 -8.460 0.000) 8.460 ======================= Grid point 33 (19/260) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( 0.000 38.068 0.000) 38.068 2.817 ( 0.000 41.524 0.000) 41.524 4.190 ( 0.000 33.688 0.000) 33.688 4.399 ( 0.000 -28.235 0.000) 28.235 4.632 ( 0.000 14.762 0.000) 14.762 4.921 ( 0.000 11.773 0.000) 11.773 5.195 ( 0.000 3.536 0.000) 3.536 5.657 ( 0.000 -0.804 0.000) 0.804 5.918 ( 0.000 -2.488 0.000) 2.488 6.263 ( 0.000 2.541 0.000) 2.541 6.368 ( 0.000 -2.399 0.000) 2.399 6.552 ( 0.000 -3.601 0.000) 3.601 7.103 ( 0.000 -9.322 0.000) 9.322 7.135 ( 0.000 -5.718 0.000) 5.718 7.679 ( 0.000 -8.772 0.000) 8.772 8.073 ( 0.000 -21.704 0.000) 21.704 8.217 ( 0.000 4.800 0.000) 4.800 8.722 ( 0.000 2.041 0.000) 2.041 8.743 ( 0.000 -2.585 0.000) 2.585 8.753 ( 0.000 1.404 0.000) 1.404 8.991 ( 0.000 7.614 0.000) 7.614 9.370 ( 0.000 -1.640 0.000) 1.640 9.970 ( 0.000 -1.971 0.000) 1.971 10.305 ( 0.000 -8.085 0.000) 8.085 10.804 ( 0.000 4.387 0.000) 4.387 10.843 ( 0.000 0.491 0.000) 0.491 10.964 ( 0.000 3.353 0.000) 3.353 11.122 ( 0.000 -1.676 0.000) 1.676 11.383 ( 0.000 5.228 0.000) 5.228 11.533 ( 0.000 0.532 0.000) 0.532 11.786 ( 0.000 1.614 0.000) 1.614 11.791 ( 0.000 0.967 0.000) 0.967 13.257 ( 0.000 9.358 0.000) 9.358 13.712 ( 0.000 -4.067 0.000) 4.067 14.147 ( 0.000 1.515 0.000) 1.515 14.409 ( 0.000 -6.964 0.000) 6.964 ======================= Grid point 34 (20/260) ======================= q-point: ( 0.10 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( 16.916 34.252 12.802) 40.289 2.918 ( 9.349 39.302 5.705) 40.799 4.269 ( 7.683 26.935 1.692) 28.061 4.476 ( 6.334 -27.101 4.675) 28.221 4.650 ( 2.530 18.892 -0.134) 19.061 4.945 ( 2.171 9.909 0.601) 10.161 5.230 ( 3.795 5.212 0.225) 6.451 5.672 ( 2.878 -0.293 -2.432) 3.779 5.901 ( -0.316 -0.636 -4.011) 4.073 6.225 ( -2.897 0.995 -1.874) 3.591 6.364 ( -0.400 -1.670 -0.954) 1.965 6.540 ( -1.430 -3.612 0.059) 3.885 7.089 ( -2.875 -6.661 3.609) 8.103 7.165 ( 3.886 -8.959 -1.903) 9.949 7.589 ( -8.087 -7.442 -2.792) 11.339 8.105 ( 2.269 -22.202 1.741) 22.386 8.221 ( -0.433 5.061 2.215) 5.541 8.595 ( -7.227 3.895 -1.207) 8.298 8.763 ( 1.255 1.776 0.023) 2.175 8.809 ( 1.412 -4.520 -0.706) 4.787 9.010 ( 0.489 6.281 2.474) 6.768 9.391 ( 2.543 -2.085 -0.716) 3.366 9.979 ( 1.261 -1.303 0.749) 1.962 10.304 ( -0.139 -7.302 0.470) 7.318 10.785 ( -1.991 4.796 -0.119) 5.194 10.848 ( 0.363 0.785 0.299) 0.915 10.965 ( 0.092 3.453 0.176) 3.459 11.131 ( 0.987 -1.006 -0.077) 1.412 11.368 ( -2.140 5.371 1.301) 5.926 11.558 ( 2.156 -0.414 0.582) 2.271 11.784 ( 2.339 1.828 -4.154) 5.106 11.838 ( 0.602 -0.234 8.215) 8.240 13.254 ( -0.179 9.385 -0.383) 9.395 13.728 ( 2.016 -4.519 -0.926) 5.035 14.117 ( -3.123 1.516 -0.255) 3.481 14.382 ( -1.720 -6.545 -3.092) 7.440 ======================= Grid point 35 (21/260) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.966 ( 16.455 32.139 14.785) 39.016 3.256 ( 21.578 30.722 11.967) 39.404 4.427 ( 5.152 7.717 3.341) 9.863 4.666 ( 11.026 -12.864 5.157) 17.710 4.752 ( 8.832 17.403 1.444) 19.569 4.991 ( 1.727 5.300 2.051) 5.940 5.338 ( 8.298 10.888 1.128) 13.736 5.729 ( 5.917 0.731 -4.122) 7.248 5.850 ( -0.474 3.782 -6.953) 7.929 6.159 ( -2.753 -1.879 -1.029) 3.488 6.330 ( -1.878 -0.889 -3.242) 3.851 6.497 ( -3.329 -3.970 -0.555) 5.210 7.052 ( -4.026 -7.001 2.517) 8.459 7.239 ( 4.905 -10.106 0.165) 11.235 7.396 ( -9.780 -3.960 -3.414) 11.090 8.153 ( 0.594 -21.159 2.458) 21.309 8.236 ( 0.120 5.728 3.222) 6.573 8.474 ( -5.435 3.726 -1.403) 6.737 8.761 ( -5.568 -2.394 0.950) 6.135 8.787 ( 1.611 -1.934 -4.100) 4.811 9.045 ( 2.446 4.963 1.130) 5.647 9.443 ( 3.679 -3.224 -0.543) 4.922 10.036 ( 3.785 -0.369 2.325) 4.458 10.316 ( 0.511 -5.428 2.670) 6.071 10.735 ( -3.482 5.415 0.104) 6.439 10.854 ( 0.023 0.869 -0.176) 0.887 10.973 ( 0.664 4.132 0.656) 4.236 11.154 ( 1.095 -0.175 1.066) 1.538 11.327 ( -3.437 5.740 1.130) 6.786 11.603 ( 2.429 -1.437 0.097) 2.824 11.803 ( 2.884 2.424 -3.963) 5.468 11.915 ( 0.478 -2.415 9.569) 9.881 13.245 ( -0.393 9.330 -0.729) 9.366 13.766 ( 3.162 -5.736 -1.526) 6.725 14.043 ( -4.647 1.507 -0.255) 4.892 14.308 ( -3.261 -5.582 -4.484) 7.867 ======================= Grid point 36 (22/260) ======================= q-point: ( 0.30 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.339 ( 14.965 30.053 13.654) 36.243 3.760 ( 23.043 24.604 11.567) 35.639 4.450 ( -3.460 6.221 0.053) 7.119 4.842 ( -0.294 4.533 -1.513) 4.788 4.962 ( 14.922 2.322 5.559) 16.092 5.104 ( 8.455 -8.747 9.058) 15.167 5.534 ( 10.453 13.103 2.654) 16.971 5.739 ( -0.091 4.234 -7.795) 8.872 5.879 ( 7.761 3.813 -2.789) 9.085 6.121 ( -0.716 -2.704 -0.240) 2.807 6.256 ( -2.305 0.213 -5.317) 5.799 6.425 ( -3.017 -3.337 -1.292) 4.680 6.966 ( -6.242 -8.921 -1.563) 10.999 7.229 ( -5.556 -0.244 0.947) 5.642 7.343 ( 4.617 -9.593 0.729) 10.671 8.095 ( -9.528 -4.121 -2.816) 10.756 8.264 ( -0.016 6.354 2.795) 6.941 8.407 ( 0.766 -9.537 -0.551) 9.584 8.654 ( -5.723 -1.050 2.184) 6.215 8.778 ( 0.518 -5.042 -4.982) 7.107 9.109 ( 3.731 3.808 0.491) 5.353 9.505 ( 3.323 -4.276 -0.160) 5.418 10.137 ( 5.373 1.031 2.749) 6.123 10.360 ( 1.189 -3.635 4.535) 5.932 10.667 ( -4.212 5.760 0.236) 7.139 10.843 ( -1.009 0.386 -0.357) 1.137 10.999 ( 1.350 5.136 1.029) 5.409 11.180 ( 0.323 0.154 2.223) 2.251 11.267 ( -3.405 6.170 -0.434) 7.060 11.641 ( 1.754 -1.553 -0.141) 2.347 11.824 ( 2.729 3.089 -4.107) 5.819 11.982 ( -0.498 -3.896 8.468) 9.334 13.230 ( -0.566 9.029 -0.890) 9.091 13.810 ( 2.945 -7.815 -1.959) 8.578 13.964 ( -3.785 1.795 0.472) 4.216 14.210 ( -4.028 -4.354 -4.129) 7.227 ======================= Grid point 37 (23/260) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.697 ( 14.426 25.875 12.387) 32.110 4.191 ( 17.625 21.623 6.519) 28.648 4.320 ( -8.694 11.910 -4.869) 15.528 4.743 ( -7.248 11.646 -2.822) 14.005 5.259 ( 12.047 -5.423 7.201) 15.047 5.344 ( 9.701 -10.361 8.424) 16.505 5.649 ( 1.461 1.980 -2.182) 3.289 5.709 ( 0.843 6.094 -0.656) 6.187 5.887 ( -5.539 -7.018 -5.377) 10.433 6.142 ( 0.550 -3.963 1.715) 4.353 6.226 ( 2.755 -3.953 -6.434) 8.038 6.455 ( 7.547 5.732 2.656) 9.843 6.865 ( -0.067 -1.753 -2.749) 3.261 7.180 ( -2.600 1.458 2.765) 4.066 7.418 ( 2.679 -10.206 0.928) 10.592 7.790 ( -17.624 11.134 -7.897) 22.291 8.278 ( -0.204 6.737 1.948) 7.016 8.483 ( 5.423 -15.172 1.681) 16.200 8.604 ( -2.567 -0.052 3.650) 4.462 8.729 ( -1.744 -11.005 -5.724) 12.527 9.172 ( 2.695 3.375 0.202) 4.324 9.549 ( 1.579 -4.411 -0.162) 4.688 10.261 ( 6.253 1.845 2.345) 6.929 10.403 ( -0.325 -2.142 3.364) 4.001 10.596 ( -3.641 6.240 -0.013) 7.225 10.821 ( -1.001 -0.157 -0.130) 1.022 11.028 ( 0.995 5.496 0.874) 5.653 11.192 ( -1.668 3.756 3.451) 5.366 11.214 ( -0.669 3.014 -2.873) 4.217 11.662 ( 0.715 -0.931 0.007) 1.174 11.839 ( 1.897 3.509 -3.063) 5.029 12.019 ( -0.778 -4.798 5.117) 7.057 13.215 ( -0.457 8.596 -0.648) 8.632 13.826 ( 0.230 -8.631 -1.709) 8.802 13.938 ( 0.288 0.347 1.243) 1.323 14.116 ( -3.551 -2.650 -2.730) 5.204 ======================= Grid point 38 (24/260) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.957 ( -0.000 24.474 -0.000) 24.474 4.135 ( 0.000 14.425 0.000) 14.425 4.435 ( -0.000 17.087 -0.000) 17.087 4.608 ( 0.000 15.951 0.000) 15.951 5.409 ( 0.000 -3.184 0.000) 3.184 5.537 ( -0.000 -4.004 -0.000) 4.004 5.599 ( 0.000 -4.403 0.000) 4.403 5.730 ( -0.000 3.945 0.000) 3.945 5.754 ( 0.000 -11.722 0.000) 11.722 6.159 ( 0.000 -4.058 -0.000) 4.058 6.209 ( 0.000 -10.638 0.000) 10.638 6.548 ( 0.000 -6.283 0.000) 6.283 6.948 ( -0.000 14.601 0.000) 14.601 7.152 ( 0.000 1.347 -0.000) 1.347 7.446 ( 0.000 -10.198 0.000) 10.198 7.532 ( 0.000 16.632 0.000) 16.632 8.284 ( 0.000 6.849 0.000) 6.849 8.554 ( 0.000 -5.288 -0.000) 5.288 8.620 ( 0.000 -1.726 0.000) 1.726 8.654 ( -0.000 -20.981 -0.000) 20.981 9.198 ( 0.000 3.229 0.000) 3.229 9.561 ( 0.000 -4.134 -0.000) 4.134 10.370 ( 0.000 0.426 0.000) 0.426 10.376 ( -0.000 0.059 0.000) 0.059 10.558 ( 0.000 6.497 0.000) 6.497 10.811 ( 0.000 -0.403 0.000) 0.403 11.041 ( 0.000 5.355 0.000) 5.355 11.180 ( 0.000 9.227 0.000) 9.227 11.205 ( 0.000 -2.214 -0.000) 2.214 11.668 ( 0.000 -0.506 0.000) 0.506 11.845 ( 0.000 3.650 0.000) 3.650 12.030 ( 0.000 -5.174 0.000) 5.174 13.208 ( 0.000 8.382 0.000) 8.382 13.817 ( 0.000 -7.530 0.000) 7.530 13.958 ( 0.000 -2.843 0.000) 2.843 14.066 ( 0.000 -0.788 -0.000) 0.788 ======================= Grid point 44 (25/260) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.067 ( 0.000 36.416 0.000) 36.416 3.574 ( 0.000 33.962 0.000) 33.962 3.766 ( 0.000 -33.586 0.000) 33.586 4.139 ( 0.000 -21.531 0.000) 21.531 5.052 ( 0.000 10.823 0.000) 10.823 5.106 ( 0.000 4.774 0.000) 4.774 5.607 ( 0.000 27.847 0.000) 27.847 5.646 ( 0.000 1.216 0.000) 1.216 5.801 ( 0.000 -1.492 0.000) 1.492 6.199 ( 0.000 -16.888 0.000) 16.888 6.394 ( 0.000 8.404 0.000) 8.404 6.508 ( 0.000 -2.033 0.000) 2.033 6.958 ( 0.000 -4.486 0.000) 4.486 6.990 ( 0.000 -7.406 0.000) 7.406 7.565 ( 0.000 -1.282 0.000) 1.282 7.682 ( 0.000 -13.972 0.000) 13.972 8.372 ( 0.000 10.021 0.000) 10.021 8.588 ( 0.000 -10.662 0.000) 10.662 8.761 ( 0.000 1.496 0.000) 1.496 8.774 ( 0.000 0.195 0.000) 0.195 9.163 ( 0.000 8.474 0.000) 8.474 9.303 ( 0.000 -5.244 0.000) 5.244 10.008 ( 0.000 5.094 0.000) 5.094 10.143 ( 0.000 -7.890 0.000) 7.890 10.858 ( 0.000 0.742 0.000) 0.742 10.859 ( 0.000 1.085 0.000) 1.085 11.028 ( 0.000 3.038 0.000) 3.038 11.082 ( 0.000 -2.374 0.000) 2.374 11.470 ( 0.000 3.557 0.000) 3.557 11.523 ( 0.000 -1.617 0.000) 1.617 11.807 ( 0.000 0.521 0.000) 0.521 11.808 ( 0.000 0.521 0.000) 0.521 13.445 ( 0.000 9.064 0.000) 9.064 13.605 ( 0.000 -6.798 0.000) 6.798 14.192 ( 0.000 3.259 0.000) 3.259 14.281 ( 0.000 -5.601 0.000) 5.601 ======================= Grid point 45 (26/260) ======================= q-point: ( 0.10 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.223 ( 12.679 33.832 9.429) 37.340 3.639 ( 5.977 31.823 3.485) 32.566 3.883 ( 9.516 -30.983 7.562) 33.282 4.184 ( 3.871 -20.404 2.702) 20.943 5.040 ( -1.380 9.939 0.978) 10.082 5.110 ( -0.245 3.445 0.581) 3.502 5.624 ( 2.553 15.958 -0.718) 16.176 5.708 ( 6.634 9.891 -1.409) 11.993 5.815 ( 2.879 1.018 -3.347) 4.531 6.188 ( -0.441 -13.546 -2.437) 13.771 6.374 ( -1.007 7.732 -2.499) 8.188 6.497 ( -1.047 -2.220 -0.503) 2.506 6.961 ( -1.271 -4.299 2.548) 5.157 6.999 ( 2.698 -7.390 -2.125) 8.149 7.511 ( -5.121 0.988 -0.891) 5.291 7.681 ( -0.691 -16.680 1.187) 16.736 8.374 ( -0.701 9.610 2.356) 9.920 8.568 ( -3.298 -8.072 3.097) 9.254 8.744 ( -0.483 0.764 -3.205) 3.330 8.771 ( 0.070 -1.053 -2.388) 2.611 9.169 ( 0.070 8.350 1.284) 8.448 9.313 ( 1.148 -5.746 -0.050) 5.860 10.025 ( 1.321 5.098 1.929) 5.608 10.154 ( 0.734 -7.400 1.741) 7.637 10.853 ( -0.636 1.847 -0.404) 1.995 10.863 ( 0.362 0.441 -0.022) 0.571 11.032 ( 0.406 3.303 0.462) 3.360 11.093 ( 1.094 -2.662 0.259) 2.889 11.463 ( -1.143 4.140 0.951) 4.399 11.530 ( 0.390 -2.417 0.829) 2.585 11.816 ( 1.750 1.272 -1.119) 2.436 11.833 ( 1.018 -0.436 3.028) 3.224 13.444 ( 0.112 9.295 -0.480) 9.308 13.611 ( 0.929 -7.220 -0.697) 7.312 14.165 ( -2.708 3.471 -0.633) 4.448 14.257 ( -2.050 -5.669 -1.447) 6.199 ======================= Grid point 46 (27/260) ======================= q-point: ( 0.20 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.580 ( 15.934 29.604 12.602) 35.904 3.845 ( 13.486 26.119 7.275) 30.282 4.167 ( 12.655 -25.245 10.952) 30.289 4.324 ( 9.415 -17.154 6.348) 20.572 5.025 ( -1.228 7.522 1.502) 7.768 5.097 ( -2.085 1.527 1.341) 2.911 5.680 ( 4.275 9.399 -1.678) 10.461 5.814 ( 5.009 -4.073 -3.216) 7.212 5.860 ( 6.044 15.485 -4.811) 17.305 6.142 ( -1.757 -7.377 -4.616) 8.877 6.332 ( -1.072 6.789 -3.487) 7.708 6.462 ( -2.011 -1.910 -1.424) 3.117 6.948 ( -0.907 -0.192 0.240) 0.958 7.063 ( 5.147 -8.299 -0.109) 9.766 7.400 ( -6.249 5.646 0.243) 8.425 7.681 ( -0.194 -22.173 2.208) 22.284 8.383 ( -0.667 8.550 3.568) 9.289 8.526 ( -4.305 -2.660 4.187) 6.568 8.680 ( -3.152 -0.673 -6.415) 7.179 8.737 ( -1.393 -3.786 -4.381) 5.955 9.189 ( 1.380 8.296 1.111) 8.483 9.342 ( 2.233 -6.686 -0.013) 7.049 10.088 ( 3.286 4.749 4.260) 7.177 10.200 ( 2.043 -6.038 4.108) 7.583 10.824 ( -2.300 3.234 -0.261) 3.977 10.861 ( -0.763 -0.522 -0.303) 0.973 11.053 ( 1.388 3.820 0.915) 4.166 11.121 ( 1.433 -2.820 0.911) 3.292 11.444 ( -1.765 5.727 0.980) 6.072 11.545 ( 0.704 -4.201 0.754) 4.326 11.846 ( 2.269 1.905 -0.903) 3.097 11.879 ( 1.224 -1.507 3.637) 4.123 13.440 ( -0.093 9.845 -0.898) 9.886 13.624 ( 1.212 -8.385 -1.267) 8.566 14.097 ( -4.056 3.876 -0.873) 5.678 14.193 ( -3.423 -5.625 -2.169) 6.932 ======================= Grid point 47 (28/260) ======================= q-point: ( 0.30 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.907 ( 12.059 26.069 10.090) 30.444 4.194 ( 16.558 13.466 7.400) 22.589 4.414 ( 8.506 -6.873 9.254) 14.326 4.638 ( 16.283 -15.939 10.344) 25.024 5.020 ( -0.590 3.700 1.900) 4.200 5.069 ( -1.952 -0.159 3.930) 4.391 5.726 ( 2.018 5.906 -2.833) 6.854 5.842 ( 2.351 -2.649 -4.805) 5.970 5.891 ( -0.239 6.632 -5.172) 8.413 6.074 ( -1.905 -7.476 -5.000) 9.193 6.274 ( -3.053 6.384 -4.378) 8.322 6.419 ( -1.460 -3.907 -1.890) 4.579 6.963 ( 4.820 10.836 -1.684) 11.978 7.158 ( 4.133 -7.119 1.727) 8.411 7.329 ( -2.305 9.874 2.834) 10.528 7.725 ( 3.124 -25.641 3.199) 26.028 8.397 ( -1.019 7.249 2.055) 7.603 8.453 ( -6.576 6.847 -0.053) 9.494 8.569 ( -3.302 -5.038 -3.876) 7.163 8.653 ( -3.599 -7.995 -5.809) 10.518 9.233 ( 2.636 7.867 0.845) 8.340 9.389 ( 2.712 -7.185 0.165) 7.682 10.195 ( 4.632 4.077 5.104) 8.008 10.281 ( 2.942 -4.284 5.220) 7.366 10.771 ( -3.340 4.368 -0.061) 5.499 10.832 ( -2.034 -1.680 -0.185) 2.644 11.087 ( 1.305 3.699 1.136) 4.084 11.149 ( 0.589 -2.537 1.265) 2.895 11.419 ( -1.401 8.115 0.353) 8.243 11.565 ( 1.145 -5.969 0.265) 6.083 11.877 ( 1.880 2.289 -1.187) 3.191 11.920 ( 0.407 -2.351 3.353) 4.115 13.427 ( -0.505 10.367 -1.100) 10.437 13.631 ( 0.641 -9.864 -1.548) 10.005 14.022 ( -3.392 3.940 -0.546) 5.227 14.114 ( -3.511 -5.035 -1.960) 6.443 ======================= Grid point 48 (29/260) ======================= q-point: ( 0.40 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.171 ( 10.390 20.235 8.153) 24.164 4.417 ( 4.028 -2.192 1.830) 4.938 4.625 ( 7.997 18.134 3.855) 20.191 4.860 ( 0.153 -2.551 0.338) 2.578 5.123 ( 11.078 -4.464 9.280) 15.125 5.163 ( 7.581 -6.713 11.252) 15.137 5.690 ( -2.936 2.386 -5.158) 6.397 5.752 ( -8.685 -3.899 -8.509) 12.769 5.855 ( 0.708 5.966 -1.662) 6.234 6.009 ( -1.743 -9.456 -2.644) 9.972 6.179 ( -2.817 4.565 -4.617) 7.077 6.359 ( -3.124 -11.099 -2.408) 11.779 7.106 ( 9.713 11.573 -0.791) 15.129 7.218 ( 0.806 -2.015 3.236) 3.897 7.368 ( 4.209 15.128 3.506) 16.089 7.809 ( 2.123 -17.110 1.769) 17.332 8.270 ( -6.167 3.995 -3.570) 8.169 8.429 ( 0.489 7.720 0.482) 7.750 8.468 ( -6.661 -11.256 -3.961) 13.666 8.578 ( -1.022 -6.713 -0.877) 6.846 9.283 ( 2.045 7.304 0.503) 7.601 9.432 ( 1.789 -7.069 0.153) 7.293 10.311 ( 4.351 2.730 3.587) 6.265 10.361 ( 1.912 -2.258 3.555) 4.625 10.714 ( -2.802 5.328 0.018) 6.020 10.795 ( -1.778 -2.650 0.047) 3.192 11.108 ( 0.219 2.911 0.806) 3.029 11.158 ( -0.219 -2.359 0.728) 2.479 11.405 ( -0.391 10.580 -0.031) 10.587 11.588 ( 1.080 -6.923 0.056) 7.007 11.895 ( 1.117 2.252 -1.181) 2.777 11.940 ( -0.340 -2.824 2.170) 3.577 13.409 ( -0.566 10.591 -0.811) 10.637 13.625 ( -0.075 -10.805 -1.156) 10.867 13.977 ( -1.451 3.126 -0.069) 3.447 14.050 ( -2.288 -3.836 -1.137) 4.609 ======================= Grid point 49 (30/260) ======================= q-point: (-0.50 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.365 ( -0.000 12.895 -0.000) 12.895 4.385 ( 0.000 8.741 0.000) 8.741 4.728 ( 0.000 11.239 0.000) 11.239 4.815 ( -0.000 3.862 0.000) 3.862 5.323 ( 0.000 -2.689 0.000) 2.689 5.416 ( -0.000 -11.418 -0.000) 11.418 5.508 ( 0.000 2.655 0.000) 2.655 5.604 ( 0.000 -4.972 0.000) 4.972 5.855 ( 0.000 6.004 0.000) 6.004 5.983 ( 0.000 -9.399 -0.000) 9.399 6.135 ( 0.000 3.610 0.000) 3.610 6.316 ( 0.000 -12.631 -0.000) 12.631 7.189 ( -0.000 2.431 0.000) 2.431 7.243 ( 0.000 -0.933 -0.000) 0.933 7.471 ( -0.000 22.190 -0.000) 22.190 7.789 ( 0.000 2.400 0.000) 2.400 8.247 ( 0.000 -11.691 0.000) 11.691 8.340 ( -0.000 -12.283 0.000) 12.283 8.439 ( 0.000 6.854 -0.000) 6.854 8.571 ( 0.000 -5.309 0.000) 5.309 9.304 ( 0.000 7.045 0.000) 7.045 9.449 ( 0.000 -6.880 -0.000) 6.880 10.379 ( 0.000 0.391 0.000) 0.391 10.381 ( -0.000 0.163 -0.000) 0.163 10.686 ( 0.000 5.930 0.000) 5.930 10.779 ( 0.000 -3.113 0.000) 3.113 11.111 ( 0.000 2.502 0.000) 2.502 11.158 ( 0.000 -2.368 0.000) 2.368 11.402 ( 0.000 11.624 -0.000) 11.624 11.598 ( 0.000 -7.106 0.000) 7.106 11.900 ( 0.000 2.090 -0.000) 2.090 11.944 ( 0.000 -2.960 0.000) 2.960 13.401 ( 0.000 10.615 0.000) 10.615 13.619 ( 0.000 -11.010 0.000) 11.010 13.965 ( 0.000 2.342 0.000) 2.342 14.024 ( 0.000 -3.018 -0.000) 3.018 ======================= Grid point 99 (31/260) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( 14.316 0.000 40.463) 42.921 0.836 ( -9.915 0.000 43.403) 44.521 1.392 ( -8.639 0.000 72.273) 72.787 4.336 ( -2.373 0.000 3.706) 4.401 4.453 ( -2.358 0.000 -2.164) 3.200 5.396 ( -1.125 0.000 -6.012) 6.117 5.510 ( 3.905 0.000 2.102) 4.434 5.531 ( -3.480 0.000 -1.263) 3.702 5.711 ( -1.454 0.000 7.350) 7.493 6.304 ( 1.504 0.000 -1.353) 2.023 6.394 ( 0.700 0.000 -0.319) 0.769 6.644 ( 0.637 0.000 -3.290) 3.351 7.582 ( -23.237 0.000 -6.850) 24.226 7.884 ( -2.857 0.000 -3.869) 4.809 7.900 ( -14.377 0.000 8.588) 16.747 8.186 ( 3.270 0.000 2.199) 3.941 8.288 ( -0.032 0.000 8.445) 8.445 8.413 ( 3.812 0.000 -3.413) 5.117 8.649 ( 1.086 0.000 -2.101) 2.365 8.675 ( 25.146 0.000 -3.881) 25.444 9.069 ( 1.053 0.000 3.251) 3.417 9.328 ( 0.014 0.000 2.038) 2.038 10.320 ( -0.263 0.000 -0.086) 0.277 10.393 ( -0.750 0.000 -15.647) 15.665 10.690 ( -0.144 0.000 -1.205) 1.213 10.834 ( 0.982 0.000 -2.556) 2.738 10.961 ( 1.955 0.000 -0.943) 2.171 11.026 ( -0.518 0.000 11.742) 11.754 11.147 ( -4.400 0.000 4.891) 6.579 11.165 ( 1.034 0.000 -0.132) 1.043 11.763 ( -0.652 0.000 -1.696) 1.817 12.557 ( 66.981 0.000 -6.117) 67.260 12.983 ( 3.244 0.000 4.025) 5.170 13.866 ( 2.029 0.000 -1.482) 2.513 14.100 ( -2.355 0.000 -0.021) 2.355 14.294 ( -62.626 0.000 -0.854) 62.632 ======================= Grid point 100 (32/260) ======================= q-point: ( 0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( 21.282 0.000 33.260) 39.486 1.458 ( 19.263 0.000 42.472) 46.637 2.182 ( 41.209 0.000 52.283) 66.571 4.322 ( -2.584 0.000 3.692) 4.507 4.440 ( 2.996 0.000 -3.783) 4.826 5.318 ( -1.421 0.000 -8.209) 8.331 5.430 ( -5.269 0.000 -4.543) 6.957 5.607 ( 3.571 0.000 3.661) 5.114 5.770 ( 1.910 0.000 9.268) 9.463 6.311 ( 0.981 0.000 -1.562) 1.844 6.389 ( -1.045 0.000 -0.557) 1.185 6.653 ( 1.411 0.000 -3.124) 3.428 7.257 ( -9.750 0.000 1.382) 9.847 7.754 ( -7.468 0.000 -4.791) 8.873 7.874 ( -1.137 0.000 7.651) 7.735 8.258 ( 1.336 0.000 3.405) 3.657 8.356 ( 0.843 0.000 10.822) 10.854 8.424 ( -0.017 0.000 -3.841) 3.841 8.682 ( 4.847 0.000 -3.745) 6.125 8.753 ( -3.849 0.000 -14.344) 14.851 9.174 ( 6.473 0.000 5.255) 8.338 9.344 ( 0.340 0.000 0.227) 0.409 10.259 ( -1.642 0.000 -14.495) 14.587 10.334 ( 1.371 0.000 -0.221) 1.389 10.685 ( 1.813 0.000 -2.881) 3.404 10.825 ( 0.435 0.000 -2.957) 2.989 10.994 ( 1.477 0.000 0.139) 1.484 11.049 ( -5.754 0.000 9.650) 11.235 11.170 ( 2.106 0.000 4.320) 4.806 11.197 ( 2.304 0.000 0.662) 2.397 11.737 ( -0.515 0.000 -2.765) 2.812 12.800 ( -8.721 0.000 -1.879) 8.921 13.132 ( -11.163 0.000 11.915) 16.328 13.864 ( 13.429 0.000 -6.666) 14.993 13.890 ( 1.659 0.000 -1.010) 1.943 14.052 ( -2.459 0.000 -1.054) 2.676 ======================= Grid point 101 (33/260) ======================= q-point: ( 0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( 29.834 0.000 24.438) 38.565 2.084 ( 17.447 0.000 41.971) 45.452 3.368 ( 53.182 0.000 36.315) 64.399 4.277 ( -6.576 0.000 4.447) 7.938 4.463 ( 0.109 0.000 -2.356) 2.359 5.262 ( 4.240 0.000 -10.677) 11.488 5.304 ( -2.934 0.000 -7.804) 8.337 5.672 ( 1.335 0.000 3.281) 3.542 5.904 ( 4.209 0.000 9.906) 10.763 6.317 ( 1.279 0.000 -2.280) 2.615 6.345 ( -3.097 0.000 -1.471) 3.428 6.628 ( -1.379 0.000 -3.375) 3.646 7.173 ( -1.872 0.000 0.201) 1.883 7.585 ( -6.591 0.000 -4.992) 8.268 7.898 ( -2.391 0.000 3.309) 4.083 8.261 ( -3.814 0.000 5.382) 6.596 8.303 ( -10.500 0.000 -12.705) 16.482 8.489 ( 4.340 0.000 10.361) 11.233 8.526 ( -8.247 0.000 -2.516) 8.622 8.750 ( 6.256 0.000 -5.539) 8.356 9.340 ( 6.751 0.000 5.758) 8.873 9.370 ( 2.534 0.000 0.311) 2.553 10.144 ( -0.245 0.000 -11.154) 11.157 10.342 ( -0.560 0.000 0.163) 0.583 10.712 ( 4.169 0.000 -4.845) 6.392 10.809 ( 0.086 0.000 -2.580) 2.581 10.961 ( -10.360 0.000 6.059) 12.002 11.021 ( 1.572 0.000 0.620) 1.690 11.248 ( 2.822 0.000 3.353) 4.382 11.258 ( 3.609 0.000 1.513) 3.913 11.703 ( -0.800 0.000 -3.497) 3.588 12.585 ( -14.555 0.000 6.639) 15.997 13.067 ( -4.961 0.000 9.871) 11.048 13.910 ( 1.621 0.000 -1.983) 2.561 14.003 ( -2.410 0.000 -0.037) 2.410 14.057 ( 12.917 0.000 -11.700) 17.428 ======================= Grid point 102 (34/260) ======================= q-point: ( 0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( 30.443 0.000 19.700) 36.261 2.671 ( 15.903 0.000 37.641) 40.863 4.101 ( -14.745 0.000 7.430) 16.511 4.350 ( -12.028 0.000 -0.677) 12.047 4.554 ( 51.018 0.000 24.521) 56.605 5.245 ( 3.495 0.000 -8.453) 9.147 5.342 ( 12.881 0.000 -10.715) 16.755 5.715 ( 1.489 0.000 2.027) 2.515 6.022 ( 1.489 0.000 6.816) 6.977 6.263 ( -4.361 0.000 -1.884) 4.750 6.322 ( 1.296 0.000 -2.967) 3.237 6.568 ( -2.552 0.000 -2.808) 3.795 7.164 ( 0.462 0.000 -0.430) 0.631 7.476 ( -1.528 0.000 -4.494) 4.747 7.673 ( -22.344 0.000 -14.252) 26.502 8.034 ( -8.215 0.000 1.462) 8.344 8.218 ( -5.528 0.000 5.715) 7.951 8.461 ( -0.469 0.000 0.047) 0.471 8.607 ( 0.386 0.000 7.134) 7.145 8.836 ( 8.291 0.000 -4.219) 9.303 9.427 ( 3.086 0.000 0.599) 3.143 9.465 ( 2.668 0.000 4.074) 4.870 10.113 ( 4.350 0.000 -6.220) 7.590 10.323 ( -1.708 0.000 0.842) 1.905 10.753 ( 4.427 0.000 -5.532) 7.085 10.774 ( -9.213 0.000 0.782) 9.246 10.803 ( -3.501 0.000 -0.300) 3.514 11.061 ( 2.846 0.000 -0.753) 2.944 11.304 ( 0.620 0.000 3.414) 3.470 11.339 ( 3.869 0.000 1.968) 4.340 11.660 ( -1.029 0.000 -3.476) 3.626 12.404 ( -10.514 0.000 4.051) 11.267 13.067 ( -2.230 0.000 6.644) 7.008 13.905 ( 0.857 0.000 -6.209) 6.268 13.984 ( -1.264 0.000 4.753) 4.918 14.162 ( 7.255 0.000 -6.933) 10.034 ======================= Grid point 103 (35/260) ======================= q-point: ( 0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.156 ( 8.261 0.000 31.325) 32.396 3.286 ( 27.297 0.000 16.813) 32.059 3.824 ( -18.545 0.000 5.792) 19.428 4.042 ( -21.767 0.000 -0.108) 21.767 5.254 ( 8.173 0.000 -4.358) 9.262 5.497 ( 9.726 0.000 -7.342) 12.186 5.580 ( 38.101 0.000 14.652) 40.821 5.761 ( 4.045 0.000 -2.201) 4.605 6.041 ( -2.664 0.000 1.885) 3.263 6.191 ( -2.258 0.000 -0.145) 2.262 6.316 ( 0.771 0.000 -4.198) 4.268 6.514 ( -1.382 0.000 -1.102) 1.768 7.067 ( -26.157 0.000 -10.959) 28.360 7.188 ( -0.182 0.000 -2.764) 2.770 7.466 ( 3.281 0.000 -3.327) 4.673 7.944 ( -5.572 0.000 3.426) 6.541 8.146 ( -7.042 0.000 5.016) 8.646 8.470 ( 1.109 0.000 -1.023) 1.509 8.606 ( -2.513 0.000 0.908) 2.672 8.973 ( 7.454 0.000 0.174) 7.456 9.475 ( 1.570 0.000 0.639) 1.695 9.490 ( -1.608 0.000 1.773) 2.394 10.201 ( 8.452 0.000 -2.735) 8.884 10.304 ( -1.229 0.000 1.795) 2.176 10.567 ( -11.603 0.000 0.157) 11.604 10.785 ( -0.023 0.000 -1.018) 1.018 10.786 ( 3.631 0.000 -5.190) 6.334 11.100 ( 3.204 0.000 -4.351) 5.403 11.322 ( -1.806 0.000 5.047) 5.360 11.402 ( 1.600 0.000 0.116) 1.604 11.632 ( 0.431 0.000 -1.055) 1.140 12.262 ( -7.170 0.000 -0.809) 7.216 13.075 ( -1.696 0.000 5.151) 5.423 13.864 ( 0.227 0.000 -6.568) 6.571 14.015 ( -0.085 0.000 5.903) 5.904 14.234 ( 4.914 0.000 -2.092) 5.341 ======================= Grid point 104 (36/260) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.172 ( -25.464 0.000 12.284) 28.272 3.574 ( -28.380 0.000 2.620) 28.501 3.783 ( 5.632 0.000 17.869) 18.735 3.856 ( 21.057 0.000 12.848) 24.668 5.353 ( 5.414 0.000 -0.670) 5.456 5.542 ( 0.967 0.000 -4.823) 4.918 5.773 ( -26.221 0.000 -11.239) 28.528 5.808 ( 3.996 0.000 -8.500) 9.393 5.988 ( -3.691 0.000 1.784) 4.100 6.186 ( 0.934 0.000 1.480) 1.750 6.288 ( 0.399 0.000 -5.115) 5.130 6.473 ( -1.358 0.000 -2.670) 2.996 6.990 ( 24.526 0.000 12.883) 27.704 7.209 ( 2.988 0.000 -0.420) 3.017 7.524 ( 4.681 0.000 -1.686) 4.976 7.884 ( -2.917 0.000 1.754) 3.404 8.045 ( -6.791 0.000 2.179) 7.132 8.468 ( -0.400 0.000 -2.027) 2.066 8.564 ( -1.782 0.000 -1.382) 2.255 9.053 ( 0.313 0.000 0.430) 0.532 9.463 ( -1.710 0.000 0.744) 1.865 9.487 ( -0.645 0.000 0.432) 0.777 10.310 ( 0.032 0.000 2.769) 2.770 10.344 ( 9.435 0.000 -3.352) 10.013 10.402 ( -7.061 0.000 2.102) 7.367 10.782 ( 0.417 0.000 -0.796) 0.899 10.806 ( 2.624 0.000 -4.504) 5.213 11.094 ( 1.008 0.000 -8.586) 8.645 11.327 ( -2.257 0.000 7.044) 7.397 11.385 ( -1.879 0.000 -3.018) 3.555 11.669 ( 2.526 0.000 2.530) 3.575 12.131 ( -4.983 0.000 -5.844) 7.680 13.078 ( -1.994 0.000 4.356) 4.790 13.825 ( 0.583 0.000 -5.936) 5.965 14.059 ( 0.136 0.000 6.008) 6.010 14.317 ( 4.506 0.000 2.488) 5.147 ======================= Grid point 105 (37/260) ======================= q-point: (-0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.690 ( -34.552 0.000 8.863) 35.671 3.014 ( -35.982 0.000 3.651) 36.167 4.010 ( 2.380 0.000 13.848) 14.051 4.277 ( 15.148 0.000 11.499) 19.018 4.926 ( -48.063 0.000 -11.145) 49.338 5.468 ( 2.824 0.000 4.295) 5.140 5.500 ( -1.082 0.000 -4.418) 4.549 5.751 ( -1.580 0.000 -10.940) 11.053 5.942 ( -5.146 0.000 4.303) 6.708 6.232 ( 2.810 0.000 1.123) 3.026 6.259 ( 1.149 0.000 -5.807) 5.919 6.466 ( 2.991 0.000 -5.166) 5.969 7.226 ( 1.914 0.000 1.727) 2.578 7.593 ( 3.370 0.000 1.118) 3.551 7.664 ( 26.818 0.000 12.418) 29.553 7.894 ( 6.635 0.000 2.584) 7.120 7.966 ( -1.444 0.000 -2.230) 2.657 8.426 ( -2.017 0.000 -3.115) 3.711 8.516 ( -2.663 0.000 -2.060) 3.367 8.991 ( -5.833 0.000 -1.386) 5.995 9.435 ( -2.573 0.000 -0.046) 2.573 9.462 ( -2.367 0.000 0.368) 2.396 10.341 ( 0.837 0.000 3.167) 3.276 10.367 ( -0.299 0.000 7.149) 7.156 10.475 ( 8.730 0.000 -5.916) 10.545 10.789 ( 1.077 0.000 -1.115) 1.550 10.813 ( 1.663 0.000 -4.070) 4.396 11.017 ( -1.588 0.000 -9.986) 10.112 11.316 ( -2.813 0.000 -3.526) 4.511 11.340 ( -2.170 0.000 6.511) 6.863 11.733 ( 2.012 0.000 3.195) 3.775 11.996 ( -3.703 0.000 -10.645) 11.270 13.067 ( -2.615 0.000 3.877) 4.677 13.802 ( 1.323 0.000 -5.068) 5.237 14.102 ( -0.116 0.000 5.628) 5.629 14.434 ( 4.871 0.000 7.014) 8.540 ======================= Grid point 106 (38/260) ======================= q-point: (-0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( -38.256 0.000 12.138) 40.136 2.369 ( -40.930 0.000 7.250) 41.567 3.647 ( -53.320 0.000 -7.872) 53.898 4.355 ( -6.857 0.000 9.433) 11.662 4.540 ( 5.981 0.000 8.631) 10.501 5.460 ( -0.082 0.000 -3.254) 3.255 5.542 ( 0.432 0.000 7.400) 7.412 5.632 ( -2.769 0.000 -9.765) 10.150 5.848 ( -8.973 0.000 5.566) 10.559 6.248 ( 2.090 0.000 -5.557) 5.937 6.290 ( 3.345 0.000 -0.634) 3.405 6.502 ( 6.013 0.000 -6.477) 8.838 7.280 ( 1.521 0.000 5.568) 5.772 7.673 ( 4.224 0.000 3.704) 5.618 7.832 ( 0.697 0.000 0.336) 0.774 7.964 ( 3.708 0.000 -4.807) 6.071 8.346 ( 8.948 0.000 1.562) 9.083 8.397 ( 17.394 0.000 3.747) 17.793 8.432 ( -5.102 0.000 -1.572) 5.338 8.865 ( -6.061 0.000 -2.866) 6.705 9.356 ( -6.174 0.000 -0.348) 6.183 9.416 ( -2.901 0.000 0.611) 2.964 10.375 ( 0.318 0.000 2.325) 2.346 10.478 ( 3.801 0.000 12.215) 12.793 10.561 ( 7.552 0.000 -9.841) 12.405 10.797 ( -0.062 0.000 -6.066) 6.066 10.805 ( 1.969 0.000 -1.651) 2.570 10.921 ( -0.911 0.000 -7.295) 7.352 11.244 ( -2.432 0.000 -2.944) 3.818 11.336 ( -3.220 0.000 5.513) 6.384 11.778 ( 0.675 0.000 2.411) 2.504 11.841 ( -3.497 0.000 -15.253) 15.648 13.042 ( -3.119 0.000 3.543) 4.720 13.799 ( 2.076 0.000 -4.058) 4.558 14.133 ( -0.665 0.000 4.707) 4.754 14.592 ( 5.503 0.000 11.505) 12.753 ======================= Grid point 107 (39/260) ======================= q-point: (-0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( -39.827 0.000 19.050) 44.149 1.688 ( -43.943 0.000 14.065) 46.139 2.512 ( -66.730 0.000 1.622) 66.749 4.364 ( -2.625 0.000 7.491) 7.938 4.612 ( -3.135 0.000 5.359) 6.209 5.450 ( 1.085 0.000 -3.032) 3.220 5.523 ( -2.339 0.000 -6.904) 7.290 5.584 ( -1.165 0.000 5.754) 5.871 5.742 ( -6.907 0.000 6.308) 9.354 6.249 ( 2.413 0.000 -4.964) 5.519 6.338 ( 2.833 0.000 -1.339) 3.133 6.585 ( 7.515 0.000 -4.716) 8.872 7.379 ( 3.300 0.000 12.962) 13.376 7.797 ( 6.179 0.000 3.313) 7.012 7.820 ( -2.304 0.000 0.728) 2.417 8.014 ( 5.138 0.000 -3.342) 6.129 8.328 ( -5.474 0.000 0.085) 5.475 8.343 ( 2.704 0.000 -4.514) 5.262 8.750 ( -4.405 0.000 -2.801) 5.220 8.812 ( 15.704 0.000 -2.422) 15.889 9.225 ( -8.002 0.000 0.132) 8.003 9.383 ( -0.957 0.000 1.040) 1.413 10.371 ( -1.672 0.000 -0.774) 1.842 10.556 ( 2.929 0.000 -9.512) 9.953 10.685 ( 6.264 0.000 10.232) 11.998 10.725 ( -1.165 0.000 -7.336) 7.428 10.835 ( 2.869 0.000 -1.769) 3.371 10.905 ( 2.103 0.000 -1.502) 2.584 11.191 ( -1.476 0.000 -2.120) 2.583 11.316 ( -3.104 0.000 6.404) 7.117 11.639 ( -6.122 0.000 -17.837) 18.859 11.792 ( -0.390 0.000 1.088) 1.156 13.010 ( -3.147 0.000 3.264) 4.534 13.815 ( 2.494 0.000 -3.070) 3.956 14.145 ( -1.346 0.000 3.310) 3.573 14.796 ( 7.050 0.000 13.906) 15.591 ======================= Grid point 108 (40/260) ======================= q-point: (-0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.964 ( -41.958 0.000 18.266) 45.762 1.068 ( -40.624 0.000 28.248) 49.480 1.505 ( -54.653 0.000 43.284) 69.717 4.355 ( -3.093 0.000 4.943) 5.831 4.541 ( -6.385 0.000 1.577) 6.577 5.437 ( 0.643 0.000 -4.628) 4.672 5.471 ( 0.286 0.000 -2.159) 2.178 5.580 ( -2.432 0.000 1.834) 3.045 5.702 ( -3.329 0.000 6.858) 7.623 6.269 ( 3.134 0.000 -2.840) 4.230 6.373 ( 2.027 0.000 -0.838) 2.193 6.662 ( 3.770 0.000 -5.380) 6.570 7.697 ( 20.607 0.000 27.415) 34.296 7.773 ( -2.973 0.000 0.158) 2.977 7.898 ( 3.315 0.000 -1.220) 3.533 8.101 ( 5.112 0.000 1.443) 5.312 8.262 ( -2.706 0.000 3.186) 4.180 8.388 ( 5.074 0.000 -2.475) 5.645 8.674 ( -2.186 0.000 -1.833) 2.853 8.760 ( -14.855 0.000 -26.423) 30.313 9.099 ( -5.769 0.000 1.203) 5.893 9.367 ( -2.598 0.000 -1.938) 3.241 10.330 ( -0.996 0.000 -0.337) 1.051 10.501 ( 1.042 0.000 -14.440) 14.478 10.686 ( 0.648 0.000 -1.625) 1.750 10.817 ( 2.095 0.000 1.699) 2.697 10.913 ( 3.705 0.000 8.946) 9.683 10.947 ( 2.158 0.000 -0.721) 2.275 11.163 ( -0.242 0.000 -1.237) 1.260 11.295 ( -9.383 0.000 -4.125) 10.250 11.523 ( 14.086 0.000 17.920) 22.793 11.784 ( -0.792 0.000 -0.358) 0.870 12.982 ( -2.548 0.000 3.018) 3.949 13.840 ( 2.428 0.000 -2.212) 3.284 14.133 ( -1.969 0.000 1.622) 2.551 14.973 ( 1.080 0.000 -4.101) 4.241 ======================= Grid point 109 (41/260) ======================= q-point: ( 0.00 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( 15.930 33.216 26.660) 45.474 1.359 ( -0.468 33.256 35.068) 48.332 1.990 ( -12.963 55.980 42.910) 71.715 4.382 ( -1.752 4.508 3.174) 5.785 4.512 ( -2.783 5.740 -1.946) 6.669 5.332 ( 2.308 -12.509 1.893) 12.860 5.372 ( -0.082 -3.850 -5.149) 6.430 5.645 ( -1.993 1.568 1.201) 2.806 5.712 ( -2.974 4.619 2.483) 6.029 6.307 ( 1.192 -0.438 -1.747) 2.160 6.395 ( 0.734 0.019 -0.134) 0.746 6.631 ( 1.517 -1.189 -2.849) 3.440 7.376 ( -10.077 -9.077 5.729) 14.723 7.626 ( 1.893 -14.758 4.685) 15.599 7.883 ( -0.960 -2.922 -6.622) 7.302 8.268 ( -1.239 -1.249 8.055) 8.244 8.400 ( -9.885 7.360 -3.316) 12.762 8.529 ( 2.547 5.116 -1.404) 5.885 8.615 ( 8.343 2.473 -1.320) 8.801 8.778 ( 7.150 3.926 -7.902) 11.356 8.982 ( 1.915 -7.236 5.406) 9.233 9.359 ( -0.425 2.128 1.739) 2.781 10.214 ( -0.202 -8.295 -6.171) 10.341 10.435 ( -0.757 1.793 -7.944) 8.179 10.694 ( -0.980 0.505 0.751) 1.334 10.822 ( 1.317 -0.330 -2.013) 2.428 10.912 ( -0.710 -2.778 3.007) 4.155 11.101 ( -2.869 5.136 2.756) 6.497 11.193 ( 0.467 4.879 5.995) 7.744 11.295 ( 1.606 8.057 -4.839) 9.534 11.723 ( 1.747 -3.416 -1.695) 4.195 12.166 ( 24.787 -17.379 17.229) 34.832 12.994 ( -1.352 3.028 2.258) 4.012 13.835 ( -2.543 -1.620 2.641) 4.008 14.072 ( -0.351 0.070 -3.372) 3.391 14.503 ( -18.420 4.876 -9.519) 21.300 ======================= Grid point 110 (42/260) ======================= q-point: ( 0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 16.155 28.174 32.243) 45.765 1.799 ( 18.845 33.930 27.467) 47.548 2.480 ( 32.532 33.239 43.856) 63.926 4.370 ( -2.688 4.728 3.535) 6.487 4.494 ( 2.904 5.275 -3.946) 7.200 5.317 ( -0.729 -0.872 -7.055) 7.146 5.361 ( -0.471 -6.979 -1.668) 7.191 5.657 ( 0.772 3.229 3.026) 4.492 5.698 ( 0.113 -4.424 5.728) 7.238 6.299 ( -0.114 -1.418 -1.652) 2.179 6.391 ( -0.856 -0.174 -1.079) 1.388 6.638 ( 0.980 -1.450 -2.714) 3.229 7.248 ( -6.080 -0.572 2.063) 6.446 7.706 ( 2.605 -14.076 5.122) 15.204 7.740 ( -8.543 -2.308 -6.183) 10.796 8.273 ( -3.084 0.857 4.256) 5.325 8.307 ( -2.853 0.122 4.491) 5.322 8.565 ( 1.745 7.577 0.430) 7.787 8.673 ( 1.001 -2.094 -4.958) 5.475 8.788 ( 2.072 3.708 -7.817) 8.897 9.096 ( 3.719 -6.510 4.167) 8.578 9.372 ( 1.496 1.775 0.711) 2.428 10.166 ( 1.066 -7.123 -9.521) 11.938 10.386 ( 0.217 2.798 -3.201) 4.257 10.673 ( -0.579 -0.310 -0.679) 0.945 10.825 ( 0.872 0.306 -2.595) 2.755 10.911 ( -2.228 -3.551 3.895) 5.723 11.090 ( -1.397 2.888 3.964) 5.099 11.226 ( -1.694 4.630 6.194) 7.917 11.329 ( 4.664 8.831 -3.323) 10.525 11.717 ( 0.168 -1.765 -2.960) 3.450 12.515 ( -0.124 -22.944 13.684) 26.715 13.002 ( -0.224 0.573 4.117) 4.163 13.832 ( 1.650 -1.237 1.180) 2.376 14.040 ( 0.159 0.963 -5.383) 5.471 14.225 ( -4.302 13.370 -9.102) 16.736 ======================= Grid point 111 (43/260) ======================= q-point: ( 0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( 16.937 18.982 35.524) 43.693 2.333 ( 22.556 32.349 22.572) 45.440 3.533 ( 49.479 17.455 33.593) 62.300 4.321 ( -6.510 4.470 3.943) 8.827 4.517 ( 0.691 5.358 -2.632) 6.009 5.273 ( 3.219 0.680 -8.940) 9.526 5.308 ( -0.198 -0.127 -7.357) 7.360 5.672 ( -0.083 0.131 2.652) 2.657 5.826 ( 5.261 -6.931 9.561) 12.928 6.285 ( -0.168 -2.576 -1.701) 3.091 6.344 ( -2.706 -1.011 -3.009) 4.171 6.613 ( -1.565 -1.551 -2.800) 3.562 7.193 ( -1.866 1.644 1.168) 2.747 7.540 ( -8.366 -4.533 -5.059) 10.777 7.779 ( 1.603 -11.765 3.553) 12.394 8.175 ( -9.877 -2.048 -9.063) 13.561 8.291 ( -3.725 -2.134 7.707) 8.822 8.533 ( -7.943 3.508 -3.246) 9.270 8.623 ( 2.397 5.667 4.016) 7.348 8.822 ( 5.678 6.218 -5.161) 9.876 9.182 ( 2.779 -10.777 4.685) 12.075 9.444 ( 5.322 2.603 1.320) 6.070 10.115 ( 1.470 -2.790 -9.172) 9.699 10.381 ( -0.039 3.093 -0.484) 3.131 10.675 ( 1.899 -2.908 -2.281) 4.155 10.818 ( 0.479 0.872 -2.355) 2.557 10.883 ( -4.735 -3.127 4.078) 6.988 11.078 ( -2.497 3.780 2.048) 4.972 11.244 ( -0.643 1.868 5.885) 6.208 11.398 ( 5.322 8.542 -2.713) 10.423 11.692 ( -0.343 -0.935 -3.584) 3.720 12.483 ( -9.811 -9.657 10.012) 17.022 13.031 ( -0.703 -0.637 5.387) 5.470 13.890 ( 3.670 -1.791 -0.569) 4.124 13.995 ( -1.413 -0.173 -3.209) 3.511 14.161 ( 2.692 6.645 -8.765) 11.324 ======================= Grid point 112 (44/260) ======================= q-point: ( 0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.815 ( 14.572 14.008 35.207) 40.597 2.916 ( 26.210 24.755 17.159) 39.927 4.141 ( -14.752 4.438 5.716) 16.431 4.429 ( -9.997 7.365 -0.250) 12.420 4.651 ( 48.415 9.764 23.451) 54.675 5.258 ( 3.792 1.457 -8.845) 9.733 5.361 ( 11.676 1.709 -8.483) 14.533 5.702 ( 1.718 -1.210 1.532) 2.601 5.967 ( 2.794 -5.229 7.350) 9.443 6.235 ( -4.486 -2.629 -2.178) 5.638 6.294 ( 0.951 -2.752 -3.696) 4.705 6.550 ( -2.925 -1.883 -2.626) 4.359 7.181 ( -0.541 1.515 0.338) 1.644 7.393 ( -4.537 -7.750 -3.512) 9.643 7.709 ( -18.866 3.102 -11.221) 22.169 7.879 ( -3.777 -11.422 -1.793) 12.163 8.275 ( -4.544 -1.344 6.722) 8.224 8.406 ( -5.816 4.057 0.597) 7.116 8.717 ( 2.703 3.916 6.202) 7.817 8.890 ( 6.698 5.771 -5.645) 10.490 9.260 ( 2.432 -11.597 3.740) 12.426 9.540 ( 3.514 2.493 1.087) 4.443 10.114 ( 4.840 0.013 -5.234) 7.129 10.368 ( -1.239 3.972 0.382) 4.178 10.685 ( -0.802 -5.310 -1.916) 5.701 10.794 ( -5.620 1.004 0.048) 5.709 10.811 ( 0.469 1.459 -1.864) 2.413 11.056 ( -0.367 1.389 0.052) 1.438 11.284 ( -0.206 0.041 6.208) 6.211 11.471 ( 4.719 8.388 -2.266) 9.888 11.655 ( -0.688 -0.316 -3.440) 3.522 12.368 ( -8.871 -3.733 5.038) 10.863 13.054 ( -0.926 -0.288 5.019) 5.112 13.914 ( 0.771 0.244 -5.947) 6.002 13.979 ( 0.341 -0.743 3.892) 3.977 14.162 ( 3.239 0.118 -6.027) 6.844 ======================= Grid point 113 (45/260) ======================= q-point: ( 0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.265 ( 7.323 10.846 28.847) 31.677 3.484 ( 24.420 18.079 14.919) 33.849 3.861 ( -17.477 4.573 4.280) 18.565 4.166 ( -19.688 11.202 1.074) 22.677 5.283 ( 7.068 2.795 -4.844) 9.013 5.464 ( 14.260 -2.430 -3.218) 14.819 5.616 ( 22.759 2.147 8.177) 24.279 5.771 ( 10.219 1.514 0.051) 10.330 6.013 ( -0.811 -2.386 2.184) 3.334 6.157 ( -1.764 -3.299 -0.647) 3.796 6.289 ( 0.879 -2.746 -4.046) 4.968 6.497 ( -0.800 -1.659 -0.910) 2.054 7.136 ( -21.566 6.208 -7.336) 23.611 7.182 ( -2.964 -0.541 -4.322) 5.268 7.356 ( -1.873 -9.154 -0.317) 9.349 7.890 ( 1.936 -5.963 0.095) 6.270 8.212 ( -7.401 -1.057 4.966) 8.975 8.322 ( -3.491 1.431 -0.884) 3.875 8.773 ( -0.363 6.010 3.447) 6.938 8.986 ( 6.934 2.707 -2.627) 7.894 9.312 ( 0.365 -10.748 3.012) 11.168 9.574 ( 0.347 2.664 -0.077) 2.688 10.207 ( 8.162 0.610 -2.462) 8.547 10.352 ( -0.966 4.251 1.136) 4.505 10.560 ( -10.069 -1.346 0.008) 10.159 10.760 ( 2.063 -0.427 -4.327) 4.813 10.810 ( 0.879 1.339 -1.783) 2.397 11.056 ( 0.610 -1.539 -2.116) 2.687 11.315 ( -1.525 -0.288 6.333) 6.521 11.518 ( 2.309 8.001 -3.847) 9.173 11.638 ( 1.078 0.770 -0.162) 1.335 12.247 ( -6.773 -1.618 -0.221) 6.967 13.070 ( -1.151 -0.023 4.492) 4.637 13.872 ( 0.058 0.324 -6.125) 6.134 14.025 ( 0.556 0.993 5.086) 5.212 14.191 ( 3.492 -4.080 -1.962) 5.718 ======================= Grid point 114 (46/260) ======================= q-point: (-0.50 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.233 ( -25.003 7.501 8.018) 27.307 3.759 ( -26.906 15.480 2.032) 31.108 3.851 ( 6.144 6.723 17.755) 19.954 3.982 ( 20.063 12.666 12.944) 27.027 5.373 ( 4.914 1.926 -0.611) 5.313 5.529 ( 0.384 -1.295 -5.051) 5.228 5.672 ( -8.369 -5.757 -10.283) 14.454 5.869 ( -7.949 -0.085 -4.475) 9.123 6.009 ( -5.259 3.329 -1.075) 6.316 6.168 ( 0.449 -0.795 1.588) 1.832 6.263 ( 0.477 -2.420 -5.041) 5.612 6.468 ( -1.579 -0.522 -2.322) 2.856 7.053 ( 19.475 5.825 10.878) 23.055 7.190 ( 4.671 -1.484 -0.325) 4.912 7.367 ( 1.192 -11.716 2.927) 12.134 7.928 ( 2.803 -1.529 -2.037) 3.787 8.094 ( -8.343 0.563 2.763) 8.807 8.271 ( -0.879 -1.540 -2.555) 3.110 8.763 ( -2.454 7.018 0.944) 7.494 9.055 ( 1.504 1.363 -1.287) 2.403 9.314 ( -2.057 -9.734 2.055) 10.159 9.572 ( -0.196 3.037 -0.237) 3.053 10.336 ( 5.974 1.180 -1.219) 6.210 10.358 ( 2.452 2.245 -0.161) 3.328 10.403 ( -6.845 -0.249 1.228) 6.959 10.768 ( 2.095 -0.773 -3.871) 4.469 10.812 ( 0.854 0.740 -2.168) 2.445 11.033 ( -0.570 -2.300 -4.666) 5.233 11.321 ( -2.816 -0.410 5.808) 6.467 11.502 ( 0.453 7.604 -4.641) 8.920 11.689 ( 2.638 2.313 2.945) 4.580 12.123 ( -5.076 -0.946 -5.211) 7.336 13.077 ( -1.599 0.288 4.060) 4.373 13.835 ( 0.720 0.714 -5.729) 5.818 14.064 ( -0.203 0.451 4.946) 4.971 14.264 ( 4.450 -5.126 2.680) 7.298 ======================= Grid point 115 (47/260) ======================= q-point: (-0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.752 ( -32.242 8.787 5.101) 33.805 3.243 ( -32.675 18.869 2.256) 37.799 4.079 ( 3.255 6.703 13.759) 15.648 4.370 ( 13.534 8.939 11.015) 19.606 5.000 ( -43.489 6.947 -9.972) 45.155 5.480 ( 0.758 -0.195 0.790) 1.111 5.489 ( -0.892 -0.168 -2.494) 2.654 5.716 ( -3.292 -2.703 -8.317) 9.344 5.942 ( -4.574 0.237 3.291) 5.640 6.210 ( 2.007 -1.972 -0.040) 2.814 6.247 ( 2.358 -1.277 -3.634) 4.516 6.462 ( 2.834 -0.441 -4.560) 5.387 7.185 ( 1.877 -3.868 0.056) 4.299 7.435 ( 3.758 -11.141 4.253) 12.503 7.687 ( 25.573 1.898 11.646) 28.163 7.945 ( 0.721 -4.381 2.413) 5.054 8.006 ( 0.071 3.831 -3.204) 4.994 8.254 ( 1.892 -0.598 -3.878) 4.356 8.702 ( -4.627 6.510 -0.122) 7.988 9.017 ( -3.698 3.013 -2.444) 5.360 9.275 ( -3.589 -9.969 1.461) 10.696 9.554 ( -1.856 3.344 -0.619) 3.875 10.356 ( -0.870 -1.573 6.611) 6.851 10.371 ( 0.395 2.119 0.962) 2.360 10.451 ( 7.076 -2.325 -5.965) 9.542 10.777 ( 2.181 -0.636 -4.719) 5.238 10.807 ( 0.267 0.282 -1.620) 1.666 10.980 ( -0.793 0.002 -5.237) 5.297 11.295 ( -3.839 -0.267 3.442) 5.163 11.486 ( 0.602 8.666 -2.333) 8.994 11.752 ( 1.652 2.017 3.230) 4.151 11.989 ( -3.979 -0.675 -9.663) 10.472 13.071 ( -2.167 0.784 3.676) 4.339 13.817 ( 1.586 1.273 -5.032) 5.427 14.091 ( -0.668 -1.375 4.621) 4.868 14.384 ( 5.217 -4.585 6.788) 9.711 ======================= Grid point 116 (48/260) ======================= q-point: (-0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -34.547 12.494 8.001) 37.598 2.642 ( -36.893 21.081 2.065) 42.541 3.848 ( -45.369 19.335 -2.889) 49.402 4.402 ( -8.775 5.050 7.817) 12.791 4.610 ( 5.030 6.523 8.370) 11.744 5.424 ( -0.893 -4.028 -4.469) 6.082 5.477 ( -3.858 -6.578 -1.976) 7.878 5.661 ( 0.423 3.603 1.650) 3.985 5.862 ( -7.699 1.099 5.038) 9.267 6.220 ( 2.074 -2.159 -4.041) 5.029 6.297 ( 3.568 0.152 -1.037) 3.719 6.496 ( 5.387 -0.576 -5.976) 8.067 7.226 ( 1.775 -4.926 2.837) 5.955 7.561 ( 6.807 -8.405 4.445) 11.693 7.806 ( -4.220 -6.053 1.363) 7.503 8.009 ( 2.827 2.828 -4.633) 6.120 8.183 ( 6.472 -4.724 -0.315) 8.019 8.396 ( 18.523 2.039 4.059) 19.072 8.610 ( -4.586 6.711 -0.226) 8.131 8.917 ( -4.376 4.805 -3.623) 7.440 9.212 ( -4.547 -9.836 1.650) 10.961 9.495 ( -4.012 3.457 -0.516) 5.321 10.355 ( -1.272 -5.274 -3.554) 6.485 10.453 ( 3.142 -2.317 11.228) 11.888 10.510 ( 4.916 -2.194 -6.276) 8.268 10.769 ( 1.203 0.985 -5.012) 5.247 10.811 ( 1.468 0.408 -1.343) 2.031 10.948 ( 1.249 3.561 -3.877) 5.410 11.244 ( -3.741 0.666 1.692) 4.159 11.482 ( -0.063 9.358 -0.485) 9.371 11.787 ( 0.247 0.858 0.230) 0.922 11.841 ( -3.693 0.238 -11.472) 12.054 13.054 ( -2.576 1.469 3.305) 4.440 13.818 ( 2.205 1.679 -3.993) 4.860 14.107 ( -1.003 -2.703 3.963) 4.901 14.541 ( 5.442 -4.729 9.998) 12.326 ======================= Grid point 117 (49/260) ======================= q-point: (-0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( -33.223 18.879 15.187) 41.120 1.965 ( -40.691 20.769 0.546) 45.688 2.921 ( -53.975 37.512 9.131) 66.361 4.397 ( -2.265 3.462 6.511) 7.714 4.672 ( -3.223 5.634 5.315) 8.389 5.360 ( -2.622 -11.999 -6.129) 13.726 5.409 ( -0.680 -4.285 -1.337) 4.541 5.696 ( -0.158 6.703 3.941) 7.777 5.769 ( -6.381 2.377 6.130) 9.163 6.236 ( 3.020 -1.088 -3.722) 4.915 6.343 ( 2.703 0.317 -1.495) 3.105 6.564 ( 6.186 -1.692 -4.658) 7.926 7.293 ( 1.829 -6.815 7.448) 10.260 7.714 ( -0.305 -8.698 1.330) 8.804 7.739 ( 3.383 -6.873 1.856) 7.882 8.058 ( 5.681 3.369 -0.422) 6.619 8.234 ( 3.223 -0.029 -2.816) 4.280 8.506 ( -2.558 5.706 -1.216) 6.371 8.705 ( 6.178 -2.761 -0.848) 6.820 8.831 ( -1.718 3.147 -4.012) 5.381 9.159 ( -2.466 -7.828 1.271) 8.305 9.420 ( -3.976 3.347 0.318) 5.207 10.280 ( -1.952 -9.438 -6.268) 11.497 10.528 ( 2.212 -1.047 -4.909) 5.485 10.600 ( 3.056 -3.753 8.792) 10.036 10.771 ( 1.819 3.209 -0.325) 3.703 10.835 ( 2.543 0.308 -1.507) 2.972 10.968 ( 3.315 5.387 -1.907) 6.607 11.197 ( -2.569 1.823 1.220) 3.378 11.484 ( 0.531 9.663 1.596) 9.808 11.644 ( -5.084 0.772 -17.402) 18.146 11.806 ( -0.861 1.497 2.388) 2.947 13.030 ( -2.565 2.239 2.916) 4.483 13.833 ( 2.044 1.474 -2.591) 3.615 14.111 ( -1.290 -3.054 2.611) 4.220 14.709 ( 4.404 -7.365 10.483) 13.547 ======================= Grid point 118 (50/260) ======================= q-point: (-0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( -33.204 24.595 12.106) 43.058 1.350 ( -24.385 30.367 23.074) 45.268 2.211 ( -39.329 54.814 28.518) 73.244 4.393 ( -2.367 3.792 4.186) 6.124 4.602 ( -6.408 5.882 1.821) 8.887 5.302 ( 0.044 -13.397 -1.622) 13.495 5.396 ( 0.542 -4.717 -3.129) 5.686 5.683 ( -2.897 3.050 1.645) 4.517 5.740 ( -2.481 5.974 4.179) 7.702 6.274 ( 3.540 0.053 -2.348) 4.248 6.375 ( 1.789 0.141 -0.724) 1.935 6.622 ( 3.098 -2.655 -3.565) 5.418 7.397 ( 0.350 -12.775 12.855) 18.127 7.630 ( -4.561 -11.830 0.280) 12.682 7.867 ( 6.098 -4.130 -3.228) 8.041 8.206 ( 4.678 0.785 5.481) 7.249 8.320 ( 11.794 5.640 3.007) 13.414 8.480 ( 1.051 6.032 -2.075) 6.465 8.669 ( -5.847 0.346 -5.657) 8.143 8.766 ( -0.970 2.381 -6.567) 7.052 9.067 ( -8.272 -7.744 -3.156) 11.763 9.370 ( -2.258 2.524 1.295) 3.626 10.239 ( 1.049 -8.206 -3.501) 8.984 10.502 ( 0.329 0.062 -8.226) 8.233 10.676 ( 1.178 -0.833 3.347) 3.644 10.808 ( 1.199 0.040 0.354) 1.251 10.886 ( 1.638 -1.330 2.947) 3.625 11.052 ( 5.764 7.116 2.643) 9.531 11.175 ( -1.488 2.699 2.214) 3.795 11.410 ( -7.014 4.623 -13.599) 15.985 11.580 ( 9.149 4.355 6.374) 11.971 11.820 ( 1.531 2.787 4.276) 5.329 13.008 ( -2.083 2.902 2.451) 4.332 13.846 ( 0.418 0.072 -0.419) 0.596 14.099 ( -1.295 -2.207 0.258) 2.572 14.781 ( -4.554 -11.691 1.225) 12.606 ======================= Grid point 119 (51/260) ======================= q-point: ( 0.00 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( 10.058 33.746 25.081) 43.232 2.112 ( 0.951 40.939 18.851) 45.081 3.231 ( -7.290 62.978 20.512) 66.634 4.502 ( -0.713 6.828 2.448) 7.288 4.665 ( -3.352 8.529 -2.314) 9.452 4.999 ( 3.440 -19.678 6.584) 21.034 5.258 ( 0.639 -6.713 -2.092) 7.060 5.645 ( -2.742 0.365 -0.740) 2.864 5.856 ( -3.942 7.294 0.801) 8.329 6.264 ( 0.774 -3.804 -2.906) 4.849 6.392 ( -0.027 -0.358 0.145) 0.387 6.595 ( 1.540 -2.515 -2.549) 3.898 7.267 ( -2.135 -4.178 4.612) 6.579 7.337 ( 0.648 -13.010 1.348) 13.096 7.787 ( -0.757 -6.431 -5.491) 8.490 8.241 ( -1.707 -1.022 7.204) 7.474 8.434 ( 3.951 -11.284 -1.430) 12.041 8.549 ( -3.374 5.744 -4.690) 8.147 8.696 ( -1.776 2.731 -3.051) 4.463 8.842 ( 1.883 -0.309 3.060) 3.606 8.884 ( 6.360 2.111 1.563) 6.881 9.388 ( -1.340 0.514 1.424) 2.021 10.040 ( 0.239 -7.763 -4.611) 9.032 10.420 ( -0.425 -3.611 -3.602) 5.118 10.728 ( -0.787 3.116 1.784) 3.676 10.823 ( 1.228 0.233 -1.637) 2.059 10.908 ( -0.554 2.301 1.436) 2.768 11.170 ( -3.507 1.003 1.875) 4.102 11.287 ( 2.499 4.715 3.656) 6.469 11.435 ( 2.774 5.490 -4.789) 7.795 11.678 ( 2.088 -0.106 -2.381) 3.169 11.980 ( 5.516 -4.401 11.789) 13.740 13.095 ( -0.805 6.887 0.828) 6.983 13.796 ( -2.210 -2.527 2.382) 4.116 14.083 ( 1.291 0.912 -4.222) 4.508 14.489 ( -5.618 -4.305 -5.088) 8.716 ======================= Grid point 120 (52/260) ======================= q-point: ( 0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.359 ( 9.981 31.413 30.091) 44.631 2.409 ( 24.239 31.484 21.276) 45.072 3.449 ( 15.214 56.188 22.765) 62.505 4.498 ( -2.612 7.508 3.361) 8.631 4.636 ( 2.745 8.072 -4.072) 9.448 5.131 ( 5.065 -15.583 6.376) 17.582 5.262 ( 1.515 -4.181 -2.431) 5.068 5.615 ( 0.940 -0.834 -0.969) 1.586 5.776 ( -5.048 5.694 0.015) 7.610 6.242 ( -0.532 -4.331 -2.763) 5.165 6.373 ( -1.746 -1.593 -1.687) 2.904 6.595 ( 0.170 -2.968 -2.022) 3.595 7.232 ( -3.331 -1.396 3.475) 5.011 7.408 ( 4.153 -14.518 2.256) 15.268 7.650 ( -9.260 -6.316 -5.922) 12.678 8.253 ( -2.439 -0.515 7.426) 7.833 8.393 ( -5.966 4.313 -2.794) 7.874 8.537 ( 3.153 -10.699 -1.617) 11.270 8.679 ( 1.599 3.937 -1.206) 4.417 8.886 ( 3.580 4.237 -1.596) 5.772 8.973 ( -1.025 -4.297 2.677) 5.165 9.393 ( 2.081 0.155 -0.062) 2.088 10.028 ( 2.400 -5.370 -4.208) 7.232 10.400 ( 0.753 -1.746 -1.950) 2.724 10.704 ( -2.597 3.338 1.010) 4.348 10.830 ( 0.768 0.103 -1.564) 1.745 10.902 ( -1.196 2.482 1.548) 3.160 11.151 ( -0.582 2.501 2.781) 3.785 11.314 ( -2.481 3.901 4.494) 6.448 11.477 ( 4.928 5.439 -4.054) 8.385 11.688 ( 1.317 -0.300 -3.037) 3.324 12.170 ( 3.553 -11.551 13.438) 18.073 13.087 ( -0.648 6.718 0.809) 6.798 13.795 ( 0.843 -2.588 1.119) 2.942 14.055 ( -0.964 0.783 -4.326) 4.501 14.350 ( -4.188 0.566 -7.384) 8.508 ======================= Grid point 121 (53/260) ======================= q-point: ( 0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.760 ( 12.344 28.140 29.101) 42.322 2.987 ( 21.901 29.955 18.995) 41.687 4.084 ( 34.232 35.868 24.238) 55.189 4.451 ( -5.419 8.307 3.126) 10.399 4.665 ( 1.818 8.942 -2.955) 9.591 5.241 ( 4.849 -7.125 -0.818) 8.657 5.284 ( 4.416 -0.240 -3.438) 5.602 5.672 ( 1.844 -1.674 0.110) 2.493 5.714 ( 0.776 -0.451 4.111) 4.208 6.214 ( -0.411 -4.671 -2.592) 5.358 6.303 ( -3.745 -2.642 -3.883) 6.006 6.562 ( -2.396 -3.815 -2.196) 5.012 7.209 ( -2.215 -1.280 3.262) 4.145 7.419 ( -11.353 -6.601 -4.664) 13.937 7.502 ( 4.777 -14.020 1.671) 14.906 8.205 ( -11.875 3.730 -7.823) 14.701 8.265 ( -2.534 0.074 6.049) 6.559 8.553 ( -0.000 -3.860 -0.698) 3.922 8.709 ( 0.925 3.156 0.162) 3.292 8.940 ( 1.855 -0.464 -0.094) 1.915 8.951 ( 0.699 -5.473 2.459) 6.041 9.464 ( 5.414 -0.592 -0.274) 5.453 10.057 ( 3.881 -1.836 -3.453) 5.510 10.416 ( 1.710 -0.440 -0.531) 1.844 10.662 ( -2.927 2.367 1.169) 3.941 10.826 ( -0.124 0.185 -1.113) 1.135 10.891 ( -0.795 3.302 0.327) 3.412 11.165 ( -1.085 4.474 2.464) 5.222 11.285 ( -3.514 1.834 4.607) 6.078 11.541 ( 5.291 4.963 -3.532) 8.068 11.682 ( 0.699 0.668 -3.664) 3.789 12.268 ( -2.250 -10.407 10.716) 15.107 13.086 ( -0.396 5.716 1.387) 5.895 13.838 ( 3.425 -3.519 -0.295) 4.920 13.995 ( -2.233 0.230 -3.367) 4.046 14.243 ( -2.386 1.142 -6.628) 7.136 ======================= Grid point 122 (54/260) ======================= q-point: ( 0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.194 ( 12.463 22.996 28.532) 38.706 3.475 ( 20.044 28.337 14.458) 37.600 4.283 ( -13.606 9.364 3.105) 16.806 4.617 ( -6.008 10.789 -0.173) 12.351 4.925 ( 35.955 15.507 17.558) 42.913 5.298 ( 5.415 1.626 -6.670) 8.744 5.410 ( 12.338 4.327 -1.415) 13.151 5.671 ( 0.953 -1.877 1.390) 2.523 5.851 ( 6.304 -4.630 5.247) 9.419 6.164 ( -4.972 -4.401 -3.066) 7.314 6.218 ( 0.232 -4.475 -4.900) 6.640 6.489 ( -3.302 -4.258 -2.114) 5.788 7.181 ( -5.750 -10.713 0.547) 12.171 7.222 ( -5.004 0.243 -0.788) 5.071 7.599 ( 4.971 -12.868 0.921) 13.825 7.839 ( -20.569 6.987 -11.315) 24.493 8.248 ( -3.804 0.630 3.899) 5.483 8.528 ( -2.466 4.346 -0.321) 5.007 8.729 ( 0.724 -1.552 3.685) 4.064 8.987 ( 1.600 -15.119 5.212) 16.072 9.015 ( 5.334 5.383 -3.085) 8.182 9.550 ( 3.925 -1.454 -0.562) 4.223 10.121 ( 5.745 1.224 -1.949) 6.188 10.437 ( 0.895 1.385 -0.764) 1.817 10.613 ( -4.063 -0.108 1.320) 4.273 10.810 ( -0.858 0.903 -0.833) 1.498 10.877 ( -0.112 4.975 -1.939) 5.340 11.127 ( -3.223 5.205 -0.241) 6.127 11.284 ( -1.365 -0.491 6.096) 6.266 11.612 ( 5.079 4.345 -2.144) 7.020 11.660 ( 0.242 2.063 -4.310) 4.784 12.260 ( -5.013 -6.658 6.088) 10.321 13.092 ( -0.414 4.449 2.207) 4.984 13.889 ( 2.169 -3.363 -3.602) 5.384 13.953 ( 0.477 -1.174 0.584) 1.395 14.164 ( -2.116 -0.341 -4.386) 4.882 ======================= Grid point 123 (55/260) ======================= q-point: ( 0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.574 ( 6.308 19.506 23.401) 31.111 3.902 ( 16.317 21.271 10.237) 28.696 4.024 ( -13.540 12.019 3.136) 18.375 4.442 ( -14.115 15.397 1.671) 20.954 5.355 ( 6.200 3.907 -5.632) 9.242 5.417 ( 12.453 -2.168 -0.626) 12.655 5.624 ( 2.963 -1.236 -0.733) 3.293 5.798 ( 8.211 -1.092 6.904) 10.784 5.965 ( 1.753 -4.349 -0.446) 4.710 6.110 ( 9.230 2.094 -0.725) 9.493 6.211 ( 1.323 -4.667 -3.523) 5.996 6.460 ( 1.969 -0.745 1.615) 2.653 7.060 ( -4.464 -12.802 0.100) 13.559 7.194 ( -2.276 0.676 1.908) 3.046 7.376 ( -20.192 12.066 -7.444) 24.672 7.681 ( 3.499 -13.257 0.112) 13.711 8.192 ( -3.874 2.191 0.583) 4.489 8.473 ( -3.057 7.887 -0.782) 8.495 8.771 ( -0.287 -4.335 4.431) 6.205 9.049 ( 0.834 -15.590 5.012) 16.397 9.086 ( 4.690 5.170 -2.562) 7.436 9.588 ( 1.326 -1.218 -1.097) 2.108 10.228 ( 7.315 1.657 -1.650) 7.680 10.437 ( -0.009 2.388 -1.166) 2.657 10.519 ( -7.318 -0.332 0.513) 7.344 10.790 ( 0.048 2.002 -1.983) 2.818 10.865 ( 0.778 5.383 -2.945) 6.185 11.076 ( -1.663 3.128 -1.501) 3.848 11.303 ( -1.751 -1.101 5.975) 6.323 11.632 ( 0.066 2.459 -3.702) 4.445 11.690 ( 4.648 4.975 -0.687) 6.843 12.191 ( -5.465 -4.000 1.097) 6.861 13.101 ( -0.590 3.661 2.815) 4.655 13.864 ( 0.016 -1.293 -4.507) 4.689 14.023 ( 4.385 -3.061 2.836) 6.053 14.103 ( -2.152 -2.783 -1.830) 3.966 ======================= Grid point 124 (56/260) ======================= q-point: (-0.50 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.491 ( -22.073 17.982 2.413) 28.573 4.036 ( 4.714 11.802 14.688) 19.422 4.092 ( -15.750 16.963 1.687) 23.209 4.325 ( 10.763 19.454 10.428) 24.556 5.413 ( 0.199 0.796 -1.084) 1.359 5.503 ( 0.846 -0.475 -5.757) 5.838 5.557 ( -2.440 -5.925 -10.477) 12.281 5.812 ( -5.574 -3.657 2.072) 6.981 5.997 ( 2.286 -5.757 1.516) 6.377 6.185 ( 1.023 -4.421 -5.564) 7.180 6.263 ( -1.185 6.588 -1.240) 6.807 6.470 ( -6.117 3.069 -0.302) 6.851 7.055 ( -0.540 -10.239 2.827) 10.636 7.157 ( 2.632 -0.803 3.849) 4.732 7.308 ( 14.283 10.672 7.153) 19.211 7.713 ( 0.010 -14.944 0.062) 14.944 8.136 ( -1.812 4.617 -1.823) 5.284 8.417 ( -1.472 9.366 -2.664) 9.848 8.766 ( -3.280 -5.299 2.870) 6.861 9.077 ( -1.716 -12.960 4.510) 13.829 9.129 ( 1.450 3.369 -1.673) 4.031 9.595 ( 0.527 -0.688 -1.050) 1.361 10.330 ( 5.056 -1.189 -5.104) 7.282 10.376 ( -5.848 -1.795 0.280) 6.124 10.441 ( -0.029 5.214 0.328) 5.225 10.787 ( 1.401 1.610 -2.571) 3.342 10.860 ( 0.895 5.356 -2.855) 6.135 11.043 ( -0.343 2.743 -2.695) 3.860 11.305 ( -2.540 -1.253 5.135) 5.864 11.614 ( 0.797 3.697 -2.954) 4.799 11.762 ( 3.166 4.344 1.037) 5.474 12.089 ( -5.040 -2.506 -3.291) 6.520 13.110 ( -0.796 3.558 3.014) 4.730 13.843 ( 1.292 -0.132 -4.405) 4.593 14.056 ( -2.412 -2.888 1.055) 3.908 14.139 ( 5.504 -5.579 3.793) 8.706 ======================= Grid point 125 (57/260) ======================= q-point: (-0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.063 ( -25.809 21.500 0.413) 33.594 3.654 ( -27.710 21.297 -2.406) 35.031 4.252 ( 4.225 9.866 11.474) 15.711 4.600 ( 9.584 12.877 9.229) 18.516 5.143 ( -25.148 4.724 -7.122) 26.561 5.401 ( -5.647 -8.409 -8.343) 13.123 5.511 ( -3.299 2.718 -2.037) 4.735 5.718 ( -3.373 4.171 3.517) 6.414 5.966 ( -5.686 2.156 0.473) 6.099 6.158 ( 0.737 -3.234 -2.938) 4.431 6.228 ( 2.407 0.987 2.053) 3.314 6.442 ( 2.407 -1.781 -2.682) 4.020 7.079 ( 1.630 -6.871 -0.076) 7.063 7.234 ( 4.201 -7.722 5.351) 10.291 7.657 ( -1.039 -11.765 1.087) 11.860 7.807 ( 20.909 2.814 10.045) 23.367 8.100 ( -0.261 5.379 -3.251) 6.290 8.400 ( 3.227 9.636 -4.523) 11.123 8.705 ( -5.081 -5.752 1.701) 7.861 9.054 ( -4.028 -9.998 3.749) 11.412 9.106 ( -2.416 2.834 -2.005) 4.230 9.583 ( -1.290 -0.461 -1.391) 1.952 10.260 ( -3.671 -6.185 -2.668) 7.672 10.371 ( 0.804 -1.992 -1.816) 2.812 10.480 ( 3.740 5.036 0.131) 6.274 10.801 ( 2.160 1.135 -2.496) 3.490 10.853 ( 0.594 5.586 -2.645) 6.210 11.030 ( 1.451 4.315 -3.276) 5.609 11.287 ( -3.021 -0.676 3.823) 4.919 11.615 ( 0.963 4.082 -1.781) 4.556 11.811 ( 1.367 3.265 0.821) 3.634 11.970 ( -4.474 -1.168 -6.020) 7.591 13.116 ( -1.012 4.065 2.816) 5.048 13.845 ( 2.397 1.479 -4.319) 5.156 14.029 ( -2.101 -5.379 2.515) 6.298 14.276 ( 5.941 -5.642 5.619) 9.935 ======================= Grid point 126 (58/260) ======================= q-point: (-0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( -25.625 26.798 2.317) 37.150 3.089 ( -32.464 23.196 -5.843) 40.325 4.285 ( -14.183 18.035 4.550) 23.390 4.607 ( -22.570 17.672 3.321) 28.857 4.774 ( 2.914 9.234 6.681) 11.764 5.219 ( -7.196 -15.044 -8.547) 18.739 5.392 ( -5.606 -1.478 -1.532) 5.997 5.773 ( 2.077 7.309 7.515) 10.687 5.880 ( -5.882 0.773 3.174) 6.728 6.165 ( 2.481 -3.511 -3.114) 5.309 6.302 ( 3.256 0.914 1.364) 3.647 6.476 ( 4.251 -1.527 -4.153) 6.136 7.108 ( 2.224 -6.455 -0.731) 6.866 7.391 ( 8.336 -8.201 5.747) 13.030 7.588 ( -5.488 -13.065 1.469) 14.247 8.084 ( 1.541 4.845 -3.154) 5.983 8.159 ( 10.411 0.209 1.211) 10.483 8.501 ( 10.614 7.316 -1.671) 12.999 8.627 ( -4.532 -5.287 1.719) 7.173 8.998 ( -4.747 -5.771 2.925) 8.025 9.031 ( -3.635 0.868 -2.171) 4.322 9.530 ( -3.203 -0.018 -1.294) 3.454 10.168 ( -3.326 -9.250 -6.087) 11.562 10.396 ( 1.468 -4.080 3.492) 5.568 10.552 ( 4.192 4.918 -0.094) 6.463 10.823 ( 1.431 0.703 -1.326) 2.074 10.847 ( 1.357 5.661 -2.645) 6.394 11.046 ( 2.930 5.747 -3.262) 7.228 11.260 ( -2.555 0.686 2.706) 3.784 11.613 ( -0.161 3.344 -1.171) 3.547 11.801 ( -0.670 0.524 -9.021) 9.061 11.867 ( -3.393 2.349 1.184) 4.293 13.115 ( -1.162 4.942 2.377) 5.606 13.857 ( 1.767 2.072 -3.178) 4.185 14.022 ( -0.597 -5.856 2.396) 6.355 14.423 ( 5.380 -6.741 6.597) 10.858 ======================= Grid point 127 (59/260) ======================= q-point: (-0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( -24.393 30.543 5.822) 39.519 2.464 ( -30.849 29.621 -4.230) 42.976 3.806 ( -33.890 46.319 10.011) 58.260 4.503 ( -2.272 7.280 4.831) 9.028 4.811 ( -2.800 6.910 4.499) 8.708 5.045 ( -6.211 -18.456 -5.518) 20.240 5.313 ( -2.464 -4.590 -1.388) 5.392 5.785 ( -5.849 1.348 3.145) 6.777 5.864 ( 0.318 7.649 7.155) 10.478 6.200 ( 3.626 -2.877 -2.593) 5.306 6.353 ( 1.972 0.933 0.179) 2.189 6.529 ( 4.716 -1.874 -3.945) 6.427 7.152 ( 2.563 -7.198 1.089) 7.718 7.486 ( -5.738 -12.052 1.806) 13.470 7.601 ( 9.323 -7.157 3.180) 12.176 8.121 ( 3.872 2.738 0.246) 4.748 8.263 ( 5.772 0.449 -4.484) 7.323 8.566 ( -1.390 -1.562 0.123) 2.095 8.653 ( 3.299 0.169 -0.230) 3.311 8.926 ( -3.899 4.119 -1.060) 5.770 8.975 ( -2.371 -7.774 0.169) 8.129 9.464 ( -3.368 0.568 -0.387) 3.437 10.080 ( -1.114 -8.706 -5.076) 10.139 10.446 ( 0.953 -6.479 2.258) 6.927 10.628 ( 3.743 4.757 1.600) 6.261 10.822 ( -0.096 1.473 -0.789) 1.674 10.872 ( 2.335 3.604 -1.196) 4.458 11.088 ( 3.885 5.903 -1.398) 7.204 11.242 ( -1.288 2.358 1.853) 3.264 11.579 ( -2.524 0.432 -3.467) 4.310 11.695 ( -0.953 4.014 -10.437) 11.223 11.849 ( -2.015 2.391 4.412) 5.408 13.110 ( -1.135 5.868 1.841) 6.254 13.854 ( -0.777 -0.068 -0.393) 0.873 14.042 ( 1.751 -3.205 -0.026) 3.652 14.545 ( 2.944 -8.620 5.395) 10.587 ======================= Grid point 128 (60/260) ======================= q-point: (-0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( -20.221 32.734 10.586) 39.906 2.100 ( -12.284 41.177 9.928) 44.103 3.380 ( -23.964 58.738 16.877) 65.645 4.501 ( -1.311 6.589 2.949) 7.337 4.758 ( -5.534 9.132 1.562) 10.792 4.949 ( -1.580 -21.699 0.634) 21.766 5.274 ( -0.810 -6.534 -1.855) 6.840 5.708 ( -4.525 0.633 1.408) 4.781 5.893 ( -1.761 7.788 3.593) 8.756 6.247 ( 3.261 -2.902 -2.493) 5.027 6.380 ( 1.011 0.436 0.338) 1.152 6.575 ( 3.127 -2.347 -3.014) 4.937 7.215 ( 2.602 -8.050 3.415) 9.124 7.391 ( -5.809 -10.357 1.720) 11.999 7.758 ( 6.693 -6.649 -2.002) 9.645 8.197 ( 1.834 -0.639 4.403) 4.813 8.355 ( 7.170 -5.066 -3.182) 9.338 8.580 ( 2.993 3.476 -1.062) 4.708 8.666 ( 1.229 1.564 0.687) 2.104 8.864 ( -2.844 4.513 0.234) 5.340 8.888 ( -5.816 -6.150 -3.615) 9.204 9.412 ( -2.517 0.888 0.913) 2.821 10.058 ( 1.101 -8.447 -3.344) 9.151 10.451 ( -0.240 -5.645 -2.170) 6.052 10.698 ( 2.046 3.558 2.787) 4.961 10.818 ( 0.484 0.687 -1.227) 1.487 10.899 ( 0.895 2.499 0.384) 2.682 11.171 ( 3.892 2.969 3.896) 6.256 11.232 ( -0.720 4.098 -0.203) 4.166 11.477 ( -2.542 2.539 -7.610) 8.416 11.657 ( 1.700 3.626 -3.163) 5.103 11.865 ( 0.149 1.479 6.432) 6.602 13.102 ( -0.944 6.558 1.278) 6.748 13.827 ( -2.689 -2.199 1.912) 3.965 14.073 ( 2.514 -0.299 -2.667) 3.677 14.581 ( -1.954 -9.052 0.644) 9.283 ======================= Grid point 129 (61/260) ======================= q-point: ( 0.00 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.534 ( 6.097 34.565 19.951) 40.373 2.919 ( 1.377 39.122 10.801) 40.609 4.280 ( -1.843 26.712 9.060) 28.267 4.466 ( 2.092 -23.895 6.555) 24.866 4.675 ( -1.921 15.640 4.488) 16.385 4.918 ( 0.690 10.078 -0.136) 10.103 5.204 ( -0.098 6.006 0.890) 6.073 5.650 ( -2.345 -0.176 -0.672) 2.445 5.928 ( -4.252 -2.666 1.026) 5.122 6.212 ( -0.121 1.582 -4.675) 4.937 6.370 ( -1.205 -2.759 -0.270) 3.023 6.534 ( 1.006 -3.063 -1.920) 3.753 7.092 ( 2.708 -9.386 0.668) 9.792 7.202 ( -3.763 -4.960 5.276) 8.161 7.646 ( -1.818 -6.825 -2.720) 7.569 8.086 ( 1.843 -20.881 1.228) 20.998 8.259 ( 0.500 3.332 3.855) 5.120 8.660 ( -2.422 4.531 -4.258) 6.672 8.737 ( -1.195 1.464 -1.876) 2.663 8.772 ( 3.999 -6.335 1.693) 7.681 8.999 ( 2.527 7.452 -0.245) 7.872 9.373 ( -1.202 -2.154 0.557) 2.529 9.954 ( 1.139 -0.250 -1.088) 1.595 10.309 ( 0.267 -6.932 0.058) 6.938 10.796 ( 0.080 3.052 -0.731) 3.139 10.836 ( 0.712 1.043 -0.989) 1.604 10.974 ( -0.195 3.727 1.316) 3.957 11.152 ( -1.720 -2.035 2.744) 3.825 11.380 ( 2.087 4.422 -0.207) 4.894 11.505 ( 1.985 1.617 -2.283) 3.430 11.718 ( 0.778 3.483 -2.048) 4.115 11.920 ( 1.064 -2.490 7.313) 7.798 13.258 ( -0.427 9.181 0.106) 9.192 13.727 ( -1.587 -4.553 1.466) 5.039 14.108 ( 1.298 1.723 -3.997) 4.543 14.376 ( -1.979 -6.462 -3.295) 7.519 ======================= Grid point 130 (62/260) ======================= q-point: ( 0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.932 ( 16.529 28.753 25.622) 41.909 3.111 ( 10.625 35.480 14.163) 39.652 4.391 ( 5.799 21.354 10.876) 24.655 4.600 ( 6.168 -18.817 7.131) 21.047 4.690 ( 0.925 20.199 4.177) 20.647 4.964 ( 3.605 6.132 1.910) 7.365 5.249 ( 4.074 8.107 1.761) 9.243 5.623 ( 0.914 0.622 -2.563) 2.792 5.845 ( -4.868 -0.704 -1.590) 5.169 6.163 ( -1.219 -1.462 -4.355) 4.753 6.330 ( -2.153 -3.163 -2.770) 4.724 6.525 ( -0.930 -3.478 -1.627) 3.951 7.155 ( 1.751 -9.345 1.223) 9.586 7.173 ( -1.830 -6.380 4.518) 8.029 7.525 ( -8.371 -4.793 -3.232) 10.173 8.144 ( 2.670 -20.778 2.277) 21.072 8.291 ( -0.350 3.463 4.601) 5.769 8.552 ( -5.492 5.893 -3.651) 8.844 8.724 ( 0.874 0.677 -2.657) 2.878 8.823 ( -0.087 -8.140 1.506) 8.278 9.028 ( 0.997 6.701 -1.158) 6.873 9.373 ( 1.765 -2.267 -0.957) 3.028 9.991 ( 3.185 1.770 0.959) 3.767 10.327 ( 1.326 -5.198 1.188) 5.494 10.780 ( -1.442 3.604 -0.372) 3.899 10.840 ( 0.593 0.757 -1.280) 1.601 10.974 ( -0.561 4.146 1.086) 4.323 11.167 ( 0.760 -0.936 3.541) 3.740 11.388 ( -1.587 3.776 0.737) 4.161 11.536 ( 3.163 0.744 -2.416) 4.049 11.726 ( 1.589 3.781 -1.956) 4.544 12.009 ( 1.922 -5.772 8.653) 10.577 13.249 ( -0.585 9.150 -0.113) 9.170 13.723 ( 0.400 -4.729 0.510) 4.773 14.076 ( -1.477 1.536 -3.976) 4.512 14.302 ( -2.711 -4.396 -4.889) 7.112 ======================= Grid point 131 (63/260) ======================= q-point: ( 0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.338 ( 10.410 28.634 22.773) 38.038 3.536 ( 21.338 26.296 16.505) 37.673 4.544 ( -0.889 3.711 7.972) 8.838 4.768 ( 10.522 1.608 5.333) 11.905 4.810 ( 6.987 16.857 4.694) 18.842 5.068 ( 5.687 -2.774 5.367) 8.297 5.382 ( 9.455 15.143 3.485) 18.189 5.653 ( 3.750 -0.219 -3.177) 4.920 5.754 ( -1.714 2.197 -2.586) 3.801 6.117 ( -0.723 -3.834 -3.619) 5.322 6.254 ( -3.537 -2.387 -4.336) 6.084 6.470 ( -3.476 -4.184 -1.978) 5.788 7.091 ( -7.149 -9.442 1.150) 11.898 7.262 ( 5.370 -9.876 1.849) 11.393 7.355 ( -7.729 0.479 -0.470) 7.758 8.174 ( -2.056 -14.635 -1.140) 14.822 8.307 ( -1.405 4.527 3.574) 5.936 8.433 ( -3.837 0.248 -1.906) 4.292 8.722 ( 0.840 -2.032 -2.475) 3.310 8.782 ( -5.170 -6.889 2.114) 8.869 9.050 ( 2.883 6.337 -0.710) 6.998 9.422 ( 4.371 -3.495 -1.423) 5.775 10.073 ( 4.668 3.381 1.857) 6.056 10.370 ( 2.165 -3.706 1.652) 4.599 10.739 ( -3.130 4.321 0.325) 5.345 10.837 ( 0.233 0.698 -1.482) 1.655 10.978 ( 0.538 4.949 0.161) 4.981 11.217 ( 0.905 -0.261 5.096) 5.183 11.336 ( -4.235 4.206 -0.285) 5.976 11.577 ( 3.502 -0.791 -2.566) 4.413 11.740 ( 1.762 4.710 -2.442) 5.590 12.091 ( 0.129 -7.457 7.912) 10.873 13.236 ( -0.722 8.940 -0.064) 8.970 13.746 ( 1.976 -5.855 -0.545) 6.204 14.010 ( -2.684 1.394 -3.214) 4.413 14.216 ( -2.871 -3.257 -4.807) 6.477 ======================= Grid point 132 (64/260) ======================= q-point: ( 0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.683 ( 10.522 24.841 21.198) 34.309 3.991 ( 17.532 23.224 12.500) 31.670 4.479 ( -9.826 9.067 2.984) 13.699 4.823 ( -2.628 8.413 0.152) 8.816 5.102 ( 14.920 0.684 7.711) 16.809 5.247 ( 9.421 -5.246 3.731) 11.410 5.599 ( 5.515 8.238 3.091) 10.385 5.647 ( 3.151 2.583 0.075) 4.075 5.830 ( 8.114 0.402 -2.255) 8.432 6.081 ( -0.241 -2.768 -3.610) 4.555 6.150 ( -2.842 -1.691 -5.544) 6.455 6.418 ( 0.332 -0.165 1.223) 1.278 6.936 ( -8.587 -10.459 -1.160) 13.582 7.268 ( -3.598 3.580 2.641) 5.721 7.366 ( 4.604 -10.054 1.321) 11.137 7.986 ( -14.005 5.159 -7.421) 16.668 8.298 ( -1.403 3.738 0.381) 4.011 8.444 ( 3.062 -12.445 3.449) 13.272 8.694 ( -2.639 -2.342 -0.523) 3.567 8.732 ( -2.411 -8.837 3.631) 9.853 9.111 ( 4.013 5.252 -0.402) 6.622 9.489 ( 3.853 -4.444 -1.398) 6.046 10.176 ( 5.537 4.106 1.167) 6.992 10.414 ( 1.637 -2.612 0.297) 3.097 10.675 ( -4.452 4.688 0.559) 6.490 10.826 ( -0.398 0.426 -1.225) 1.357 10.993 ( 1.404 6.105 -1.207) 6.380 11.246 ( -4.649 3.778 -1.558) 6.190 11.261 ( -0.463 0.945 5.295) 5.399 11.621 ( 3.029 -1.829 -1.853) 3.994 11.755 ( 2.271 5.557 -2.849) 6.645 12.121 ( -2.253 -7.005 5.464) 9.165 13.224 ( -0.718 8.440 0.409) 8.480 13.777 ( 2.130 -7.430 -1.536) 7.881 13.951 ( -1.383 1.007 -1.724) 2.429 14.135 ( -2.803 -2.649 -3.536) 5.232 ======================= Grid point 133 (65/260) ======================= q-point: ( 0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.996 ( 7.416 21.275 17.800) 28.713 4.260 ( -12.239 15.387 -0.324) 19.663 4.340 ( 11.102 17.635 8.426) 22.478 4.732 ( -8.170 12.504 1.585) 15.021 5.365 ( 8.040 -3.610 3.275) 9.402 5.415 ( 10.065 1.656 -3.488) 10.780 5.586 ( -3.933 -1.606 -3.291) 5.374 5.738 ( 1.602 -6.672 2.450) 7.286 5.822 ( -4.381 -4.801 0.068) 6.500 6.082 ( 2.277 -6.520 -7.615) 10.280 6.150 ( 5.273 -3.627 -0.642) 6.432 6.546 ( 6.211 2.569 6.215) 9.155 6.863 ( 3.439 1.337 2.596) 4.512 7.239 ( -2.751 4.481 3.449) 6.288 7.430 ( 1.635 -10.411 0.448) 10.548 7.656 ( -15.062 13.980 -5.372) 21.241 8.266 ( -0.949 4.259 -2.584) 5.071 8.528 ( 2.904 -6.937 0.985) 7.584 8.659 ( -2.517 -5.316 2.391) 6.349 8.720 ( -1.878 -14.147 5.856) 15.426 9.173 ( 2.822 4.422 -0.204) 5.250 9.531 ( 2.143 -4.302 -1.496) 5.033 10.276 ( 5.298 3.016 -1.004) 6.179 10.418 ( -1.055 -1.941 -1.792) 2.845 10.595 ( -4.229 5.597 -0.105) 7.016 10.808 ( -0.485 -0.090 -1.165) 1.266 11.004 ( 1.360 6.852 -2.774) 7.516 11.164 ( -2.435 4.763 -2.809) 6.042 11.280 ( -1.638 0.036 5.322) 5.569 11.649 ( 1.358 -1.011 -1.242) 2.100 11.788 ( 3.422 4.737 -1.995) 6.175 12.093 ( -3.816 -5.479 2.331) 7.072 13.219 ( -0.460 7.927 1.161) 8.024 13.792 ( 1.226 -6.980 -2.013) 7.367 13.944 ( 1.039 -1.814 -0.375) 2.124 14.073 ( -1.673 -1.818 -1.593) 2.940 ======================= Grid point 134 (66/260) ======================= q-point: (-0.50 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.908 ( -18.180 22.468 -1.349) 28.934 4.288 ( 6.207 12.536 11.661) 18.212 4.439 ( -12.097 17.479 0.521) 21.264 4.669 ( 5.055 13.798 5.931) 15.846 5.363 ( -9.083 -5.023 -5.966) 11.972 5.395 ( -6.763 -9.431 -8.692) 14.499 5.554 ( 8.175 3.429 -6.319) 10.887 5.782 ( -1.848 0.522 5.329) 5.664 5.847 ( 6.004 -7.496 6.170) 11.416 6.073 ( 2.597 -6.475 -5.102) 8.643 6.248 ( 4.857 -5.341 1.239) 7.325 6.578 ( -4.853 -2.908 2.729) 6.282 6.976 ( -1.573 9.951 3.020) 10.518 7.170 ( -6.116 2.981 2.128) 7.129 7.440 ( -0.489 -10.099 -0.093) 10.111 7.593 ( 11.650 14.543 5.680) 19.480 8.234 ( 0.106 4.407 -3.908) 5.891 8.537 ( -0.244 -0.142 -3.558) 3.569 8.604 ( -5.631 -9.312 3.757) 11.512 8.781 ( 1.684 -14.557 7.910) 16.653 9.197 ( -0.125 3.608 -0.216) 3.616 9.546 ( 0.788 -4.126 -1.433) 4.438 10.314 ( -1.335 0.058 -6.185) 6.327 10.353 ( -1.829 -0.664 -1.579) 2.506 10.556 ( 0.447 6.116 -0.355) 6.142 10.797 ( 0.536 -0.519 -1.563) 1.732 11.001 ( 0.737 6.685 -3.160) 7.431 11.126 ( 0.633 4.982 -3.328) 6.024 11.283 ( -2.034 0.165 4.647) 5.075 11.656 ( 0.465 -0.179 -1.088) 1.196 11.836 ( 2.864 3.106 -1.180) 4.387 12.027 ( -4.308 -3.351 0.002) 5.458 13.225 ( -0.071 7.818 1.699) 8.001 13.807 ( 2.118 -5.406 -1.458) 5.987 13.945 ( -1.198 -3.908 -0.740) 4.153 14.079 ( 2.869 -2.473 1.190) 3.970 ======================= Grid point 135 (67/260) ======================= q-point: (-0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.554 ( -19.559 26.421 -2.338) 32.956 4.077 ( -23.810 20.996 -5.488) 32.216 4.437 ( 2.605 7.499 7.026) 10.601 4.828 ( 5.279 8.677 5.463) 11.533 5.127 ( -10.455 -5.374 -5.775) 13.097 5.164 ( -11.196 -13.734 -10.170) 20.431 5.607 ( 0.880 5.645 -3.336) 6.615 5.829 ( 0.791 5.725 8.938) 10.644 5.958 ( 2.130 -4.099 0.556) 4.653 6.101 ( 1.583 -1.706 -1.167) 2.603 6.316 ( 0.300 0.248 3.211) 3.234 6.442 ( -6.891 6.612 0.500) 9.563 6.959 ( -1.104 -0.879 6.860) 7.003 7.145 ( 2.203 -1.907 -0.475) 2.953 7.407 ( -2.900 -10.569 0.433) 10.968 7.923 ( 14.784 4.759 5.342) 16.424 8.215 ( 0.878 6.094 -3.422) 7.044 8.481 ( -3.566 -10.039 0.263) 10.657 8.562 ( 0.145 0.960 0.054) 0.973 8.850 ( -0.009 -9.721 5.856) 11.349 9.165 ( -2.953 3.322 -0.599) 4.485 9.535 ( -0.999 -4.345 -1.516) 4.709 10.186 ( -5.356 -0.809 -6.064) 8.131 10.324 ( -0.692 -2.674 -3.219) 4.241 10.594 ( 3.557 5.919 -0.344) 6.915 10.808 ( 1.923 -0.375 -1.713) 2.602 10.985 ( -0.079 6.356 -2.485) 6.825 11.131 ( 2.377 4.761 -3.461) 6.348 11.278 ( -1.601 0.888 3.319) 3.791 11.649 ( -0.324 -1.165 -1.486) 1.916 11.859 ( 1.134 1.789 -3.158) 3.802 11.953 ( -3.992 -0.388 0.884) 4.107 13.239 ( 0.159 8.182 1.720) 8.362 13.849 ( 3.054 -6.090 -0.170) 6.815 13.907 ( -1.667 -1.142 -1.146) 2.323 14.169 ( 5.056 -5.257 2.702) 7.778 ======================= Grid point 136 (68/260) ======================= q-point: (-0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.193 ( -19.716 30.077 -1.437) 35.992 3.568 ( -26.543 24.934 -7.872) 37.258 4.482 ( -1.730 2.713 3.557) 4.796 4.813 ( -11.209 -15.418 -5.510) 19.843 4.923 ( -8.763 7.573 0.495) 11.592 4.989 ( -0.776 1.277 -1.128) 1.872 5.511 ( -9.735 14.286 0.304) 17.291 5.887 ( -4.600 2.967 4.755) 7.251 5.945 ( -0.871 4.957 5.967) 7.806 6.101 ( 2.293 -0.144 -1.778) 2.905 6.350 ( 0.908 3.261 4.433) 5.578 6.433 ( 2.956 -1.937 -1.083) 3.696 6.990 ( 0.732 -4.369 1.359) 4.633 7.246 ( 6.660 -6.113 2.936) 9.505 7.359 ( -2.670 -8.685 2.846) 9.521 8.089 ( 3.779 -10.048 -2.522) 11.027 8.208 ( 0.214 5.748 -3.073) 6.521 8.460 ( -0.866 -6.126 4.421) 7.604 8.626 ( 7.145 3.656 -1.199) 8.115 8.865 ( -1.758 -5.456 3.387) 6.658 9.094 ( -4.039 3.825 -1.024) 5.656 9.491 ( -2.411 -4.008 -1.535) 4.922 10.058 ( -3.932 -1.462 -5.758) 7.124 10.299 ( -0.195 -5.420 -0.708) 5.469 10.662 ( 4.254 5.641 -0.388) 7.076 10.833 ( 1.966 0.138 -1.521) 2.490 10.965 ( -0.418 5.872 -1.456) 6.064 11.150 ( 1.824 3.313 -2.006) 4.281 11.281 ( 0.153 2.487 1.205) 2.767 11.617 ( -1.405 -2.750 -3.340) 4.549 11.827 ( -0.602 2.231 -5.782) 6.226 11.909 ( -3.263 1.332 3.868) 5.233 13.253 ( 0.103 8.701 1.359) 8.807 13.847 ( -3.285 -7.056 1.761) 7.980 13.936 ( 5.591 1.559 -2.437) 6.295 14.282 ( 4.887 -7.324 3.074) 9.326 ======================= Grid point 137 (69/260) ======================= q-point: (-0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.817 ( -22.075 30.897 -0.430) 37.975 3.115 ( -17.999 34.107 -2.037) 38.619 4.430 ( -6.876 6.225 3.452) 9.897 4.573 ( -9.613 -24.729 -3.466) 26.757 4.777 ( -8.223 20.368 3.360) 22.221 4.979 ( -2.020 6.534 0.557) 6.861 5.341 ( -8.601 12.835 1.416) 15.516 5.796 ( -6.526 0.656 2.692) 7.089 5.987 ( -1.499 1.052 6.264) 6.527 6.160 ( 4.592 2.206 -0.961) 5.185 6.381 ( -0.233 1.326 2.378) 2.733 6.483 ( 3.540 -2.517 -2.067) 4.810 7.015 ( 1.905 -5.949 -0.655) 6.281 7.273 ( -4.053 -9.157 4.064) 10.807 7.466 ( 8.682 -5.670 3.655) 10.995 8.094 ( 0.310 -17.392 -3.663) 17.776 8.195 ( 0.894 3.913 -1.220) 4.195 8.504 ( 3.318 -0.794 2.576) 4.275 8.720 ( 3.575 2.801 -2.908) 5.393 8.851 ( -1.505 -3.725 1.179) 4.187 9.020 ( -3.221 5.130 -0.899) 6.123 9.438 ( -2.416 -3.313 -0.836) 4.185 9.976 ( -1.317 -1.298 -3.614) 4.059 10.302 ( 0.184 -7.686 0.761) 7.725 10.732 ( 3.688 5.089 -0.294) 6.292 10.845 ( 0.368 0.873 -1.274) 1.588 10.956 ( 0.208 4.579 -0.458) 4.606 11.166 ( 0.195 1.030 1.432) 1.775 11.301 ( 2.105 4.197 -1.234) 4.855 11.557 ( -1.500 -2.250 -5.199) 5.860 11.773 ( -1.102 3.688 -4.279) 5.755 11.883 ( -2.850 0.809 4.237) 5.170 13.261 ( -0.102 9.061 0.888) 9.105 13.799 ( -3.441 -5.619 1.891) 6.854 14.020 ( 5.636 1.448 -2.595) 6.371 14.373 ( 3.016 -8.540 1.988) 9.273 ======================= Grid point 138 (70/260) ======================= q-point: (-0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.498 ( -13.390 34.739 7.974) 38.075 2.911 ( -7.241 39.288 5.294) 40.299 4.318 ( -8.027 18.789 6.185) 21.347 4.449 ( -3.943 -25.859 2.310) 26.260 4.695 ( -4.304 19.332 4.343) 20.276 4.937 ( -2.240 8.867 -0.172) 9.147 5.237 ( -4.278 7.712 0.893) 8.864 5.710 ( -4.710 -0.289 1.432) 4.931 5.979 ( -3.255 -2.076 3.610) 5.285 6.218 ( 2.848 3.126 -2.862) 5.106 6.383 ( -0.838 -1.055 1.286) 1.862 6.520 ( 2.322 -2.921 -2.184) 4.324 7.048 ( 2.160 -7.751 -0.127) 8.047 7.233 ( -4.085 -6.595 5.251) 9.368 7.617 ( 5.714 -6.737 0.272) 8.838 8.072 ( 0.037 -20.137 -1.718) 20.210 8.221 ( 1.276 3.283 2.002) 4.051 8.616 ( 6.927 -0.324 1.281) 7.052 8.726 ( 0.625 1.802 -2.607) 3.230 8.809 ( -3.150 -1.330 -2.325) 4.135 8.979 ( -0.646 6.854 -0.113) 6.885 9.398 ( -1.942 -2.554 0.366) 3.229 9.953 ( 0.443 -1.371 -1.929) 2.407 10.308 ( -0.007 -8.098 0.194) 8.100 10.782 ( 2.070 3.997 -0.386) 4.518 10.836 ( -0.031 1.143 -1.083) 1.575 10.963 ( 0.501 3.674 0.419) 3.731 11.170 ( -2.067 -1.812 3.599) 4.529 11.336 ( 3.266 5.254 -2.133) 6.544 11.507 ( 0.149 0.393 -4.083) 4.105 11.732 ( -0.487 3.823 -2.782) 4.753 11.877 ( -1.382 -0.226 5.259) 5.442 13.262 ( -0.285 9.183 0.455) 9.198 13.756 ( -2.957 -4.995 1.943) 6.121 14.087 ( 4.037 1.746 -3.365) 5.538 14.408 ( 0.190 -8.312 -0.517) 8.331 ======================= Grid point 139 (71/260) ======================= q-point: ( 0.00 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.218 ( 4.146 33.872 14.902) 37.237 3.635 ( 0.961 31.078 6.495) 31.764 3.881 ( 3.483 -29.979 11.432) 32.273 4.190 ( 0.759 -21.089 5.281) 21.754 5.053 ( 1.375 9.399 0.049) 9.499 5.098 ( 0.520 5.053 -0.870) 5.154 5.652 ( -1.050 4.832 0.939) 5.034 5.656 ( -3.233 23.332 4.381) 23.959 5.802 ( -3.633 -1.299 0.088) 3.859 6.201 ( -2.696 -15.235 0.076) 15.472 6.334 ( 0.192 7.826 -5.476) 9.553 6.477 ( 0.988 -4.486 -3.427) 5.731 6.973 ( -0.301 -1.053 3.143) 3.328 7.067 ( -4.035 -8.155 6.206) 11.013 7.567 ( -1.312 0.343 0.541) 1.461 7.707 ( 0.470 -14.276 2.742) 14.545 8.383 ( 2.059 8.842 0.825) 9.116 8.587 ( 3.369 -10.705 -0.532) 11.236 8.731 ( -1.947 2.226 -2.499) 3.872 8.754 ( -1.265 -0.079 -1.995) 2.364 9.158 ( 1.442 7.953 -0.984) 8.142 9.296 ( 0.030 -5.569 -0.662) 5.608 10.019 ( 1.462 5.923 1.350) 6.248 10.160 ( 1.018 -7.706 1.638) 7.944 10.839 ( 0.360 1.445 -1.495) 2.110 10.853 ( 0.405 0.227 -1.238) 1.322 11.045 ( -0.295 3.297 1.853) 3.793 11.104 ( -0.797 -2.683 2.198) 3.559 11.458 ( 1.643 3.315 -1.146) 3.873 11.506 ( 1.565 -1.353 -1.378) 2.485 11.795 ( 0.226 3.915 0.457) 3.948 11.866 ( 0.122 -3.105 3.772) 4.887 13.445 ( -0.483 9.185 -0.014) 9.198 13.610 ( -0.927 -7.194 0.507) 7.271 14.159 ( 0.665 3.542 -3.410) 4.961 14.251 ( -0.365 -5.665 -2.992) 6.417 ======================= Grid point 140 (72/260) ======================= q-point: ( 0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.512 ( 13.185 29.060 19.380) 37.335 3.760 ( 6.817 27.136 9.049) 29.406 4.115 ( 10.817 -24.989 15.878) 31.521 4.286 ( 4.720 -18.450 8.058) 20.679 5.062 ( -0.575 9.554 1.208) 9.647 5.116 ( 1.439 4.348 -0.130) 4.581 5.621 ( 0.075 4.389 -0.372) 4.405 5.717 ( 3.218 9.061 2.245) 9.874 5.757 ( 0.131 10.458 -2.060) 10.660 6.137 ( -3.143 -10.028 -3.107) 10.958 6.296 ( -0.135 6.723 -4.975) 8.365 6.463 ( -0.130 -4.992 -2.726) 5.690 7.001 ( 0.924 -4.516 2.098) 5.065 7.032 ( -3.683 -6.605 4.438) 8.768 7.512 ( -5.007 4.335 1.275) 6.744 7.730 ( -0.624 -17.692 4.015) 18.153 8.419 ( 0.815 8.801 1.683) 8.997 8.622 ( 0.787 -10.567 -1.204) 10.665 8.655 ( -4.288 3.729 -1.907) 5.994 8.713 ( -1.489 -1.763 -3.093) 3.859 9.173 ( 1.145 7.240 -1.263) 7.438 9.299 ( 1.331 -5.163 -1.374) 5.506 10.077 ( 3.073 6.038 3.441) 7.599 10.207 ( 2.237 -6.596 3.235) 7.679 10.834 ( -0.049 1.758 -1.386) 2.239 10.850 ( 0.397 0.031 -1.438) 1.493 11.055 ( 0.045 3.879 1.957) 4.345 11.125 ( 0.941 -2.992 2.898) 4.271 11.463 ( -0.298 3.578 -0.862) 3.692 11.521 ( 1.203 -2.000 -1.374) 2.708 11.815 ( 1.310 4.798 0.863) 5.048 11.909 ( 1.173 -4.681 4.508) 6.604 13.436 ( -0.386 9.233 -0.395) 9.249 13.603 ( -0.038 -7.350 -0.131) 7.351 14.123 ( -1.694 3.234 -3.706) 5.202 14.205 ( -1.940 -4.853 -3.847) 6.490 ======================= Grid point 141 (73/260) ======================= q-point: ( 0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.871 ( 10.346 24.272 16.728) 31.241 4.022 ( 14.581 19.233 10.751) 26.422 4.414 ( 7.580 -14.463 14.147) 21.605 4.507 ( 13.455 -15.537 12.607) 24.111 5.063 ( -0.736 8.038 2.549) 8.464 5.134 ( 0.066 2.167 2.376) 3.216 5.637 ( 2.165 2.278 -3.262) 4.530 5.722 ( 2.157 -3.342 -5.530) 6.812 5.819 ( 3.261 15.420 -0.142) 15.762 6.056 ( -2.627 -7.357 -4.263) 8.900 6.267 ( -0.107 8.873 -2.851) 9.321 6.429 ( -1.626 -2.907 -1.595) 3.693 6.959 ( -4.003 -0.124 0.843) 4.093 7.083 ( 4.595 -8.734 1.818) 10.035 7.438 ( -4.656 8.874 3.686) 10.678 7.753 ( -0.081 -21.947 5.182) 22.551 8.430 ( -0.510 7.588 0.107) 7.606 8.521 ( -5.768 4.227 -7.693) 10.503 8.626 ( -2.593 -7.036 4.322) 8.655 8.655 ( -2.695 -4.631 -2.473) 5.901 9.193 ( 2.277 7.428 -0.792) 7.810 9.328 ( 3.061 -5.897 -1.393) 6.788 10.169 ( 4.137 5.632 3.831) 7.969 10.280 ( 3.039 -5.213 3.410) 6.931 10.811 ( -1.636 2.666 -0.989) 3.281 10.842 ( -0.270 -0.507 -1.539) 1.642 11.078 ( 0.978 4.989 1.696) 5.360 11.169 ( 0.887 -3.867 3.729) 5.445 11.437 ( -1.460 5.275 -1.515) 5.679 11.530 ( 1.299 -3.741 -1.998) 4.436 11.846 ( 1.326 5.625 0.709) 5.822 11.960 ( 0.666 -5.959 4.360) 7.414 13.424 ( -0.461 9.582 -0.645) 9.615 13.605 ( 0.466 -8.241 -0.740) 8.288 14.056 ( -2.646 3.256 -3.306) 5.341 14.135 ( -2.605 -4.433 -3.778) 6.380 ======================= Grid point 142 (74/260) ======================= q-point: ( 0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.138 ( 8.257 19.535 13.401) 25.088 4.337 ( 11.118 5.702 7.804) 14.732 4.608 ( 3.695 6.782 10.000) 12.635 4.822 ( 9.024 -9.718 7.914) 15.443 5.095 ( 3.202 4.149 6.924) 8.683 5.192 ( 3.725 -2.829 8.068) 9.326 5.622 ( 0.942 2.521 -6.849) 7.358 5.741 ( 2.570 -7.117 -6.691) 10.101 5.810 ( -1.910 7.880 -3.356) 8.775 5.982 ( -2.600 -8.500 -4.594) 10.006 6.210 ( -4.097 8.520 -2.195) 9.706 6.404 ( -1.689 -7.730 0.621) 7.937 6.955 ( 4.863 12.968 0.815) 13.874 7.185 ( 4.965 -8.944 0.977) 10.276 7.414 ( -1.675 13.174 5.880) 14.523 7.809 ( 1.757 -21.894 5.018) 22.530 8.345 ( -7.428 5.339 -5.343) 10.593 8.396 ( -1.822 3.038 -5.091) 6.202 8.589 ( -4.503 -4.994 3.381) 7.527 8.612 ( -2.021 -5.260 2.701) 6.249 9.239 ( 3.110 7.225 -0.309) 7.872 9.379 ( 3.387 -6.458 -1.109) 7.376 10.267 ( 4.207 4.632 2.056) 6.587 10.351 ( 2.622 -3.706 1.506) 4.783 10.763 ( -2.912 3.829 -0.688) 4.859 10.817 ( -1.292 -1.491 -1.246) 2.334 11.105 ( 0.709 5.015 0.680) 5.111 11.193 ( -1.114 -3.826 2.632) 4.775 11.403 ( -0.705 7.833 -1.584) 8.022 11.545 ( 2.107 -5.806 -2.132) 6.534 11.869 ( 0.898 5.894 0.379) 5.974 11.989 ( -0.705 -6.218 3.451) 7.146 13.411 ( -0.521 9.942 -0.487) 9.968 13.607 ( 0.472 -9.444 -0.950) 9.503 13.993 ( -1.859 3.070 -2.467) 4.355 14.066 ( -2.220 -3.948 -3.010) 5.438 ======================= Grid point 143 (75/260) ======================= q-point: ( 0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.353 ( 5.887 13.200 10.186) 17.682 4.468 ( -3.053 2.825 3.392) 5.367 4.691 ( 3.202 16.690 3.759) 17.405 4.879 ( -3.153 0.094 1.977) 3.723 5.291 ( 7.082 -1.115 6.704) 9.816 5.386 ( 8.341 -6.923 8.673) 13.882 5.582 ( -10.026 -0.267 -8.338) 13.043 5.597 ( 0.194 0.097 -2.697) 2.706 5.805 ( 1.992 0.189 -3.999) 4.472 5.900 ( -0.168 -9.773 -6.754) 11.882 6.159 ( -0.397 6.548 1.775) 6.796 6.369 ( -2.462 -12.808 3.170) 13.422 7.098 ( 7.362 10.453 -0.319) 12.789 7.249 ( 1.520 -6.793 0.327) 6.969 7.478 ( 3.233 20.008 7.871) 21.742 7.828 ( -3.386 -4.148 -0.036) 5.354 8.252 ( 0.575 -7.475 2.399) 7.871 8.305 ( -3.111 -3.611 -6.270) 7.875 8.542 ( -4.461 -1.468 5.359) 7.126 8.598 ( -1.590 -4.360 2.269) 5.166 9.286 ( 2.026 6.772 -0.202) 7.072 9.422 ( 2.185 -6.464 -1.073) 6.907 10.336 ( 2.729 2.703 -1.080) 3.990 10.381 ( 0.412 -1.935 -1.484) 2.473 10.705 ( -2.647 5.071 -0.998) 5.806 10.783 ( -1.312 -2.593 -1.308) 3.186 11.108 ( -0.192 3.952 -0.691) 4.017 11.174 ( -1.578 -2.589 0.139) 3.035 11.394 ( 0.273 9.439 -0.620) 9.464 11.569 ( 1.971 -7.051 -1.857) 7.553 11.886 ( 0.749 5.062 0.389) 5.132 11.987 ( -1.824 -5.134 2.406) 5.956 13.403 ( -0.158 10.173 0.186) 10.176 13.610 ( 0.606 -10.309 -0.408) 10.335 13.958 ( -0.382 2.399 -1.812) 3.030 14.019 ( -0.796 -3.312 -1.984) 3.942 ======================= Grid point 144 (76/260) ======================= q-point: (-0.50 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.317 ( -12.172 16.488 -1.285) 20.534 4.466 ( -0.147 2.664 4.976) 5.647 4.751 ( -4.728 12.138 1.958) 13.173 4.844 ( 1.374 3.067 2.857) 4.411 5.210 ( -12.579 -5.771 -11.117) 17.752 5.245 ( -12.788 -6.609 -8.011) 16.474 5.627 ( 7.626 3.631 -1.214) 8.533 5.697 ( 7.871 -4.478 7.375) 11.678 5.839 ( 3.902 1.957 2.039) 4.819 5.927 ( 5.984 -7.397 -1.456) 9.625 6.209 ( 2.280 4.115 5.636) 7.341 6.386 ( 0.295 -11.586 6.171) 13.130 7.155 ( 1.264 4.201 -2.833) 5.222 7.241 ( -2.717 -4.389 -0.075) 5.163 7.496 ( -9.226 21.665 2.818) 23.715 7.805 ( 2.401 -0.146 1.597) 2.887 8.235 ( 0.437 -2.689 -0.181) 2.730 8.356 ( 4.720 -9.705 2.511) 11.080 8.519 ( -1.679 -0.308 5.591) 5.846 8.592 ( -0.429 -5.486 2.280) 5.956 9.300 ( -0.328 6.594 -0.420) 6.615 9.437 ( 0.316 -6.601 -1.174) 6.712 10.327 ( -2.359 0.892 -5.402) 5.962 10.342 ( -1.637 -0.595 -3.691) 4.081 10.675 ( 0.544 5.527 -1.165) 5.675 10.763 ( 0.504 -3.099 -1.636) 3.540 11.097 ( -0.130 3.553 -1.146) 3.736 11.154 ( -0.221 -1.963 -0.815) 2.137 11.393 ( 0.074 9.680 -0.813) 9.714 11.578 ( 0.584 -7.510 -2.316) 7.881 11.901 ( 0.501 3.456 0.382) 3.513 11.965 ( -2.191 -2.994 1.999) 4.215 13.410 ( 0.485 10.424 0.942) 10.478 13.626 ( 1.049 -10.830 0.596) 10.897 13.948 ( 0.637 2.610 -1.677) 3.167 14.016 ( 1.622 -3.702 -0.818) 4.124 ======================= Grid point 145 (77/260) ======================= q-point: (-0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.065 ( -14.225 23.628 -2.737) 27.715 4.402 ( -10.317 -2.634 0.073) 10.649 4.525 ( -15.485 11.870 -6.311) 20.506 4.819 ( -13.638 -11.880 -5.592) 18.932 4.997 ( -0.582 -0.398 -2.339) 2.443 5.014 ( -2.358 -3.363 -4.115) 5.814 5.716 ( 4.375 5.660 -2.383) 7.540 5.840 ( 5.022 -6.463 -0.806) 8.224 5.942 ( 3.109 5.721 7.570) 9.985 6.061 ( 5.912 -4.641 4.684) 8.856 6.300 ( 2.334 3.780 6.898) 8.205 6.443 ( 0.307 -7.433 5.596) 9.309 7.135 ( -5.122 2.669 0.749) 5.824 7.153 ( -3.214 4.455 -0.624) 5.528 7.343 ( -6.188 13.963 0.977) 15.304 7.787 ( -4.882 -20.067 -0.075) 20.653 8.338 ( 6.656 6.036 1.568) 9.121 8.377 ( -1.056 1.626 -0.526) 2.009 8.562 ( 2.251 -0.595 3.076) 3.858 8.657 ( 3.934 -9.258 5.973) 11.699 9.270 ( -2.386 7.011 -0.757) 7.445 9.417 ( -1.446 -7.142 -1.286) 7.399 10.210 ( -4.701 2.520 -6.578) 8.469 10.267 ( -2.801 -2.992 -5.336) 6.729 10.704 ( 3.278 4.907 -1.079) 5.999 10.780 ( 2.579 -2.583 -1.617) 3.992 11.087 ( -0.256 4.032 -0.862) 4.130 11.151 ( 0.141 -2.116 -0.462) 2.171 11.386 ( 0.386 8.723 -1.961) 8.949 11.557 ( -0.389 -7.481 -3.409) 8.230 11.902 ( -0.517 2.455 -0.306) 2.528 11.941 ( -2.362 -1.216 2.391) 3.574 13.430 ( 0.726 10.673 1.232) 10.768 13.650 ( 0.680 -11.127 1.304) 11.224 13.962 ( 2.420 4.312 -1.541) 5.179 14.062 ( 3.636 -5.458 0.112) 6.559 ======================= Grid point 146 (78/260) ======================= q-point: (-0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.775 ( -16.517 27.891 -3.506) 32.604 4.058 ( -19.235 22.831 -6.056) 30.461 4.292 ( -10.949 -21.084 -3.598) 24.028 4.471 ( -15.189 -16.698 -6.202) 23.409 4.993 ( 0.688 3.546 -0.860) 3.713 5.043 ( 2.818 0.173 0.298) 2.839 5.747 ( -0.118 7.943 0.142) 7.945 5.885 ( 0.822 -6.146 -0.184) 6.204 6.017 ( -1.979 8.569 6.750) 11.086 6.162 ( 2.396 -2.532 3.506) 4.944 6.370 ( 0.029 4.030 5.368) 6.713 6.461 ( -0.717 -0.926 1.997) 2.315 7.021 ( -6.652 7.649 4.654) 11.154 7.141 ( -1.433 -4.818 1.189) 5.165 7.318 ( 2.358 7.902 1.812) 8.443 7.700 ( -3.929 -24.601 0.556) 24.919 8.333 ( -0.342 6.354 -3.746) 7.384 8.424 ( 2.509 -1.704 -1.550) 3.406 8.665 ( 5.267 2.336 3.720) 6.858 8.753 ( 2.342 -5.720 3.616) 7.161 9.214 ( -2.879 7.832 -0.957) 8.400 9.373 ( -2.174 -7.472 -1.318) 7.892 10.091 ( -3.441 3.884 -5.342) 7.448 10.188 ( -2.000 -5.521 -3.621) 6.899 10.762 ( 3.861 4.115 -1.140) 5.757 10.820 ( 2.910 -1.689 -1.567) 3.711 11.072 ( -1.160 4.700 -0.006) 4.841 11.147 ( -0.715 -2.636 0.776) 2.839 11.385 ( 1.676 6.938 -3.152) 7.803 11.522 ( -0.181 -6.307 -4.497) 7.748 11.878 ( -1.673 2.494 -0.694) 3.083 11.913 ( -2.808 -0.855 2.447) 3.822 13.449 ( 0.340 10.594 1.047) 10.652 13.661 ( -0.670 -10.419 1.410) 10.536 14.014 ( 4.470 5.305 -1.403) 7.077 14.137 ( 4.416 -6.954 0.426) 8.249 ======================= Grid point 147 (79/260) ======================= q-point: (-0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.431 ( -18.002 30.670 -2.297) 35.637 3.763 ( -11.062 29.817 -0.970) 31.818 4.029 ( -13.425 -28.903 -3.019) 32.012 4.263 ( -7.072 -19.059 -0.166) 20.330 5.004 ( 1.152 6.916 -0.709) 7.047 5.083 ( 1.643 0.444 -0.268) 1.723 5.717 ( -3.856 12.148 2.289) 12.949 5.859 ( -4.891 -1.070 1.645) 5.270 5.960 ( -7.306 10.223 4.800) 13.451 6.217 ( 1.213 -5.574 2.467) 6.215 6.384 ( -0.995 3.794 1.715) 4.281 6.467 ( 1.148 -1.049 -1.331) 2.047 6.971 ( -2.838 3.469 3.831) 5.896 7.111 ( -4.058 -7.766 5.558) 10.376 7.424 ( 6.266 3.266 2.501) 7.496 7.669 ( -0.362 -20.587 0.771) 20.605 8.318 ( 1.539 7.504 -3.130) 8.275 8.458 ( 3.776 -5.308 -2.772) 7.079 8.749 ( 1.979 1.499 0.669) 2.571 8.793 ( 0.504 -2.562 1.062) 2.819 9.165 ( -1.677 8.667 -1.003) 8.885 9.330 ( -1.571 -7.315 -1.090) 7.560 10.020 ( -1.276 5.003 -2.648) 5.802 10.149 ( -0.630 -7.463 -1.116) 7.572 10.815 ( 2.903 3.027 -1.358) 4.409 10.850 ( 1.569 -0.588 -1.556) 2.286 11.050 ( -1.453 4.780 0.966) 5.088 11.136 ( -1.831 -3.389 2.172) 4.422 11.400 ( 2.731 5.176 -3.405) 6.771 11.494 ( 0.865 -4.034 -4.482) 6.091 11.839 ( -2.096 2.793 -0.539) 3.534 11.879 ( -2.821 -1.192 2.363) 3.869 13.456 ( -0.220 10.119 0.708) 10.146 13.649 ( -1.588 -8.979 1.256) 9.204 14.088 ( 4.806 5.014 -1.756) 7.164 14.213 ( 3.671 -7.363 -0.190) 8.229 ======================= Grid point 148 (80/260) ======================= q-point: (-0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.187 ( -9.238 34.206 5.788) 35.901 3.634 ( -4.743 32.569 3.099) 33.058 3.849 ( -6.279 -31.726 4.010) 32.588 4.183 ( -3.162 -21.262 2.601) 21.653 5.024 ( 1.742 8.710 -0.676) 8.908 5.098 ( 0.519 2.672 -0.659) 2.800 5.664 ( -3.726 17.247 3.228) 17.938 5.750 ( -7.751 9.045 2.648) 12.202 5.875 ( -5.512 0.575 2.732) 6.179 6.231 ( -1.373 -13.563 1.865) 13.760 6.366 ( -0.169 6.845 -3.308) 7.604 6.477 ( 1.557 -2.815 -2.873) 4.313 6.963 ( -1.302 1.076 3.559) 3.940 7.087 ( -3.915 -8.446 7.070) 11.690 7.535 ( 3.938 0.039 1.574) 4.241 7.682 ( 0.655 -15.436 1.232) 15.499 8.341 ( 2.590 8.309 -1.140) 8.778 8.520 ( 4.839 -8.488 -1.950) 9.963 8.758 ( -0.143 1.860 -1.132) 2.182 8.789 ( -1.008 -1.137 -0.899) 1.766 9.146 ( 0.352 8.909 -0.868) 8.958 9.305 ( -0.595 -6.621 -0.612) 6.676 10.001 ( 0.261 5.531 -0.522) 5.562 10.143 ( 0.188 -8.130 0.314) 8.139 10.841 ( 1.163 1.799 -1.575) 2.659 10.854 ( 0.385 0.348 -1.304) 1.404 11.040 ( -0.666 3.978 1.489) 4.299 11.116 ( -2.132 -3.435 2.466) 4.735 11.429 ( 2.804 4.005 -2.412) 5.451 11.491 ( 1.680 -2.036 -2.805) 3.852 11.804 ( -1.337 3.231 -0.134) 3.499 11.856 ( -1.692 -1.906 2.815) 3.798 13.453 ( -0.517 9.538 0.358) 9.559 13.628 ( -1.609 -7.786 0.979) 8.011 14.146 ( 3.236 4.249 -2.592) 5.937 14.256 ( 1.770 -6.739 -1.546) 7.137 ======================= Grid point 189 (81/260) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 12.932 0.000 38.483) 40.598 1.643 ( -9.066 0.000 41.183) 42.169 2.734 ( -7.190 0.000 68.160) 68.538 4.374 ( -3.890 0.000 -6.592) 7.654 4.392 ( -1.844 0.000 0.813) 2.016 5.293 ( -3.382 0.000 -4.208) 5.399 5.513 ( -6.333 0.000 -0.190) 6.336 5.569 ( 6.174 0.000 3.983) 7.348 5.867 ( -0.626 0.000 8.768) 8.790 6.245 ( 2.905 0.000 -5.199) 5.956 6.385 ( 0.518 0.000 -0.711) 0.880 6.577 ( 1.935 0.000 -3.079) 3.637 7.477 ( -13.179 0.000 -4.171) 13.824 7.822 ( -4.179 0.000 -2.314) 4.777 8.041 ( -4.254 0.000 5.588) 7.023 8.237 ( 3.744 0.000 2.810) 4.681 8.349 ( -0.576 0.000 -2.817) 2.875 8.411 ( 6.647 0.000 0.340) 6.656 8.564 ( 8.831 0.000 -6.809) 11.151 8.623 ( -3.824 0.000 2.179) 4.401 9.154 ( 2.632 0.000 5.384) 5.993 9.385 ( -2.396 0.000 3.544) 4.278 10.103 ( 0.313 0.000 -13.756) 13.760 10.287 ( 1.285 0.000 -3.424) 3.657 10.688 ( -2.169 0.000 0.848) 2.329 10.756 ( 1.634 0.000 -4.898) 5.163 10.946 ( 2.226 0.000 -0.347) 2.253 11.141 ( 2.262 0.000 -0.790) 2.396 11.255 ( -3.237 0.000 5.947) 6.771 11.262 ( -2.569 0.000 10.895) 11.194 11.719 ( -1.463 0.000 -2.725) 3.093 12.409 ( 33.823 0.000 -9.035) 35.009 13.074 ( 2.189 0.000 5.353) 5.783 13.816 ( 2.703 0.000 -3.962) 4.796 14.107 ( -3.045 0.000 0.810) 3.151 14.272 ( -28.182 0.000 -1.448) 28.219 ======================= Grid point 190 (82/260) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.952 ( 10.227 0.000 37.240) 38.619 2.205 ( 26.588 0.000 36.155) 44.879 3.283 ( 16.114 0.000 60.302) 62.418 4.334 ( 5.265 0.000 -8.059) 9.627 4.385 ( -0.059 0.000 1.249) 1.251 5.181 ( -5.069 0.000 -5.316) 7.346 5.365 ( -9.685 0.000 -1.481) 9.798 5.687 ( 3.092 0.000 4.611) 5.552 5.955 ( 2.824 0.000 9.650) 10.054 6.236 ( 1.568 0.000 -6.768) 6.947 6.366 ( -1.612 0.000 -1.840) 2.446 6.582 ( 0.886 0.000 -3.418) 3.531 7.272 ( -7.809 0.000 0.485) 7.824 7.684 ( -8.717 0.000 -2.432) 9.050 8.013 ( -4.175 0.000 5.779) 7.130 8.278 ( -3.689 0.000 -10.069) 10.724 8.324 ( 2.364 0.000 3.251) 4.019 8.525 ( 7.236 0.000 -5.313) 8.977 8.576 ( -1.213 0.000 -4.765) 4.916 8.597 ( -0.475 0.000 5.902) 5.921 9.291 ( 6.806 0.000 6.500) 9.411 9.363 ( -1.324 0.000 1.360) 1.898 10.018 ( 0.078 0.000 -10.147) 10.147 10.307 ( 3.094 0.000 -3.012) 4.318 10.654 ( -1.579 0.000 -0.055) 1.580 10.751 ( 1.554 0.000 -4.413) 4.678 10.977 ( 1.952 0.000 -1.699) 2.588 11.184 ( 0.473 0.000 1.903) 1.961 11.233 ( -5.680 0.000 5.755) 8.086 11.282 ( 0.602 0.000 6.727) 6.754 11.676 ( -0.987 0.000 -3.448) 3.586 12.650 ( 4.387 0.000 -11.433) 12.245 13.212 ( 5.637 0.000 1.995) 5.980 13.824 ( 2.044 0.000 -5.487) 5.856 13.928 ( -9.870 0.000 6.594) 11.870 14.068 ( -2.353 0.000 2.335) 3.315 ======================= Grid point 191 (83/260) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.482 ( 20.372 0.000 30.863) 36.980 2.887 ( 18.812 0.000 39.686) 43.919 4.127 ( 35.078 0.000 42.664) 55.233 4.386 ( -3.594 0.000 5.364) 6.457 4.408 ( 5.979 0.000 -4.470) 7.465 5.065 ( -0.710 0.000 -8.811) 8.840 5.172 ( -8.034 0.000 -5.170) 9.554 5.747 ( 0.353 0.000 4.374) 4.388 6.070 ( 2.109 0.000 6.735) 7.058 6.216 ( 2.476 0.000 -8.430) 8.786 6.305 ( -3.207 0.000 -2.507) 4.071 6.556 ( -0.864 0.000 -3.446) 3.553 7.190 ( -2.920 0.000 1.018) 3.093 7.515 ( -7.396 0.000 -2.161) 7.705 7.860 ( -15.213 0.000 -8.903) 17.627 8.152 ( -3.147 0.000 0.168) 3.151 8.340 ( -2.395 0.000 2.344) 3.351 8.498 ( -4.201 0.000 -1.423) 4.436 8.579 ( 6.112 0.000 -9.980) 11.703 8.717 ( 5.073 0.000 10.858) 11.985 9.381 ( 2.409 0.000 0.788) 2.534 9.449 ( 5.254 0.000 5.303) 7.466 9.974 ( 2.362 0.000 -6.473) 6.891 10.334 ( 1.669 0.000 -1.914) 2.539 10.639 ( 0.833 0.000 -1.927) 2.099 10.748 ( 1.394 0.000 -3.464) 3.734 10.993 ( 1.944 0.000 -3.376) 3.895 11.053 ( -13.453 0.000 3.748) 13.966 11.282 ( 4.529 0.000 0.883) 4.614 11.351 ( 1.171 0.000 6.773) 6.874 11.634 ( -0.857 0.000 -3.491) 3.595 12.546 ( -6.109 0.000 -7.618) 9.765 13.234 ( -4.164 0.000 6.127) 7.408 13.808 ( 1.258 0.000 -6.840) 6.955 13.963 ( 6.720 0.000 0.677) 6.754 14.062 ( -1.174 0.000 4.444) 4.597 ======================= Grid point 192 (84/260) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.081 ( 23.488 0.000 25.585) 34.732 3.440 ( 10.993 0.000 40.045) 41.527 4.273 ( -16.508 0.000 10.492) 19.560 4.375 ( -10.615 0.000 2.895) 11.003 5.023 ( 19.905 0.000 10.511) 22.510 5.098 ( 14.138 0.000 -14.322) 20.124 5.112 ( 23.622 0.000 7.550) 24.799 5.765 ( -1.394 0.000 2.755) 3.088 6.095 ( -2.135 0.000 0.391) 2.170 6.202 ( 2.927 0.000 -9.095) 9.554 6.235 ( -2.884 0.000 -0.794) 2.991 6.513 ( -1.088 0.000 -2.753) 2.960 7.163 ( -0.839 0.000 -0.061) 0.841 7.410 ( -24.808 0.000 -11.237) 27.234 7.418 ( -1.847 0.000 -1.411) 2.325 8.109 ( -5.840 0.000 5.336) 7.911 8.298 ( -3.883 0.000 2.060) 4.396 8.438 ( -0.527 0.000 -2.449) 2.505 8.586 ( 1.860 0.000 -8.100) 8.311 8.897 ( 6.289 0.000 9.676) 11.541 9.442 ( 3.171 0.000 1.067) 3.345 9.526 ( 0.321 0.000 2.184) 2.208 10.021 ( 6.889 0.000 -3.734) 7.836 10.339 ( 0.056 0.000 -0.283) 0.289 10.653 ( 2.857 0.000 -3.904) 4.838 10.741 ( -1.202 0.000 -2.597) 2.862 10.822 ( -12.382 0.000 1.306) 12.451 10.995 ( 1.879 0.000 -5.694) 5.996 11.359 ( 3.176 0.000 -0.334) 3.194 11.413 ( 0.045 0.000 7.309) 7.309 11.607 ( 0.528 0.000 -1.503) 1.593 12.364 ( -8.040 0.000 -6.743) 10.493 13.205 ( -4.032 0.000 6.665) 7.790 13.775 ( 0.806 0.000 -6.964) 7.010 14.087 ( -0.282 0.000 5.690) 5.697 14.097 ( 7.647 0.000 -0.154) 7.649 ======================= Grid point 193 (85/260) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.659 ( 22.189 0.000 21.328) 30.777 3.792 ( -10.252 0.000 31.023) 32.674 4.025 ( -11.128 0.000 15.774) 19.304 4.102 ( -22.819 0.000 6.483) 23.722 5.153 ( 11.525 0.000 -5.442) 12.746 5.277 ( 15.398 0.000 -15.274) 21.689 5.732 ( -2.791 0.000 -1.514) 3.175 5.783 ( 17.505 0.000 5.099) 18.233 6.040 ( -2.487 0.000 -1.052) 2.700 6.184 ( 2.236 0.000 -8.937) 9.212 6.199 ( -0.710 0.000 0.562) 0.906 6.499 ( 0.230 0.000 -0.383) 0.447 6.952 ( -12.990 0.000 0.676) 13.008 7.160 ( 1.005 0.000 -0.615) 1.179 7.422 ( 2.953 0.000 -1.508) 3.315 8.020 ( -7.471 0.000 4.542) 8.743 8.224 ( -6.942 0.000 2.892) 7.520 8.431 ( 1.139 0.000 -2.834) 3.054 8.538 ( -0.344 0.000 -7.234) 7.242 9.053 ( 3.535 0.000 7.231) 8.049 9.493 ( 1.341 0.000 1.366) 1.915 9.513 ( -2.212 0.000 0.626) 2.299 10.134 ( 8.395 0.000 -4.775) 9.658 10.341 ( 0.152 0.000 0.712) 0.728 10.576 ( -10.393 0.000 1.320) 10.476 10.677 ( 3.467 0.000 -5.187) 6.239 10.763 ( 0.288 0.000 -1.185) 1.220 10.972 ( 0.966 0.000 -8.002) 8.061 11.366 ( -0.526 0.000 -3.768) 3.805 11.458 ( -1.353 0.000 8.276) 8.386 11.647 ( 3.224 0.000 2.489) 4.073 12.173 ( -7.584 0.000 -7.763) 10.853 13.187 ( -3.183 0.000 5.859) 6.667 13.741 ( 0.837 0.000 -6.318) 6.373 14.128 ( 0.037 0.000 6.043) 6.043 14.231 ( 7.134 0.000 1.635) 7.319 ======================= Grid point 194 (86/260) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.457 ( -33.092 0.000 16.274) 36.877 3.684 ( -30.043 0.000 8.752) 31.292 4.160 ( 17.443 0.000 18.386) 25.344 4.203 ( 1.966 0.000 23.199) 23.282 5.348 ( 10.314 0.000 0.573) 10.330 5.369 ( 7.026 0.000 -14.163) 15.810 5.566 ( -30.794 0.000 -8.606) 31.974 5.653 ( -2.613 0.000 -6.425) 6.936 6.015 ( -0.396 0.000 1.230) 1.292 6.150 ( 1.390 0.000 -8.960) 9.067 6.221 ( 1.530 0.000 2.085) 2.586 6.410 ( -4.065 0.000 -3.779) 5.550 7.165 ( 7.106 0.000 1.096) 7.190 7.298 ( 25.865 0.000 13.499) 29.175 7.485 ( 5.533 0.000 -2.458) 6.055 7.936 ( -4.743 0.000 3.716) 6.025 8.091 ( -9.564 0.000 2.356) 9.850 8.415 ( -0.813 0.000 -3.263) 3.363 8.489 ( 0.395 0.000 -6.584) 6.596 9.089 ( -4.141 0.000 3.033) 5.133 9.482 ( -1.810 0.000 1.279) 2.216 9.506 ( -1.028 0.000 1.702) 1.988 10.232 ( 7.963 0.000 -8.298) 11.501 10.356 ( 1.013 0.000 0.232) 1.039 10.481 ( -2.979 0.000 6.270) 6.942 10.695 ( 2.972 0.000 -6.252) 6.922 10.761 ( 0.414 0.000 -1.377) 1.437 10.916 ( -0.372 0.000 -8.141) 8.149 11.309 ( -1.950 0.000 -4.827) 5.206 11.484 ( -2.642 0.000 8.542) 8.941 11.730 ( 3.005 0.000 3.660) 4.736 11.985 ( -6.756 0.000 -9.182) 11.400 13.173 ( -3.045 0.000 5.169) 5.999 13.717 ( 1.323 0.000 -5.399) 5.558 14.171 ( -0.160 0.000 5.678) 5.680 14.379 ( 7.563 0.000 3.753) 8.442 ======================= Grid point 195 (87/260) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.962 ( -35.839 0.000 17.059) 39.692 3.176 ( -35.674 0.000 12.776) 37.893 4.300 ( -12.191 0.000 15.958) 20.082 4.529 ( 10.355 0.000 14.449) 17.776 4.812 ( -38.682 0.000 -0.953) 38.694 5.359 ( 3.535 0.000 -11.578) 12.105 5.557 ( -2.249 0.000 -7.417) 7.751 5.566 ( 7.121 0.000 6.010) 9.318 6.017 ( -2.326 0.000 3.339) 4.069 6.116 ( 2.660 0.000 -9.227) 9.603 6.256 ( 0.587 0.000 1.665) 1.765 6.346 ( 1.098 0.000 -6.820) 6.907 7.261 ( 5.374 0.000 2.153) 5.790 7.577 ( 6.885 0.000 -2.643) 7.375 7.817 ( 7.716 0.000 4.973) 9.180 7.960 ( -5.499 0.000 1.209) 5.630 8.015 ( 20.310 0.000 8.750) 22.114 8.355 ( -2.697 0.000 -4.002) 4.826 8.446 ( -0.518 0.000 -5.820) 5.843 8.977 ( -8.526 0.000 0.375) 8.534 9.451 ( -3.539 0.000 1.648) 3.904 9.485 ( -2.768 0.000 2.169) 3.516 10.301 ( 7.609 0.000 -11.485) 13.777 10.370 ( 1.205 0.000 -2.884) 3.126 10.549 ( 3.180 0.000 11.023) 11.473 10.686 ( 1.282 0.000 -6.657) 6.780 10.759 ( 0.703 0.000 -1.931) 2.055 10.860 ( -0.146 0.000 -4.461) 4.463 11.239 ( -1.905 0.000 -4.548) 4.931 11.484 ( -3.911 0.000 7.344) 8.321 11.793 ( 1.280 0.000 3.040) 3.299 11.801 ( -6.309 0.000 -9.714) 11.583 13.152 ( -3.396 0.000 4.756) 5.844 13.712 ( 2.107 0.000 -4.448) 4.922 14.201 ( -0.741 0.000 4.717) 4.775 14.554 ( 8.480 0.000 5.031) 9.861 ======================= Grid point 196 (88/260) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -37.132 0.000 18.847) 41.641 2.622 ( -38.944 0.000 18.385) 43.065 3.711 ( -54.802 0.000 15.799) 57.034 4.535 ( -5.617 0.000 7.876) 9.674 4.721 ( 1.158 0.000 9.855) 9.923 5.348 ( 3.500 0.000 -8.674) 9.353 5.476 ( -1.433 0.000 -5.493) 5.677 5.669 ( -0.203 0.000 5.297) 5.301 5.958 ( -7.564 0.000 5.496) 9.349 6.117 ( 4.195 0.000 -8.041) 9.070 6.277 ( 1.762 0.000 -0.355) 1.797 6.370 ( 7.492 0.000 -6.511) 9.926 7.402 ( 7.226 0.000 6.785) 9.912 7.687 ( 7.372 0.000 -2.276) 7.715 7.860 ( -0.530 0.000 3.111) 3.155 7.936 ( 1.665 0.000 1.707) 2.384 8.271 ( -1.528 0.000 -5.162) 5.383 8.383 ( -2.230 0.000 -4.505) 5.027 8.489 ( 20.136 0.000 2.397) 20.278 8.832 ( -7.437 0.000 0.269) 7.442 9.371 ( -6.765 0.000 1.899) 7.026 9.447 ( -3.222 0.000 2.721) 4.217 10.320 ( 5.249 0.000 -14.845) 15.746 10.344 ( 0.155 0.000 -7.348) 7.350 10.663 ( 0.367 0.000 -1.941) 1.975 10.734 ( 5.968 0.000 13.404) 14.672 10.761 ( 2.206 0.000 -2.169) 3.094 10.856 ( 1.735 0.000 -1.038) 2.022 11.180 ( -1.228 0.000 -3.877) 4.066 11.453 ( -4.132 0.000 4.906) 6.414 11.623 ( -6.600 0.000 -7.776) 10.200 11.817 ( -0.505 0.000 1.687) 1.761 13.121 ( -3.784 0.000 4.568) 5.932 13.727 ( 2.837 0.000 -3.664) 4.634 14.210 ( -1.546 0.000 3.365) 3.703 14.742 ( 8.726 0.000 3.636) 9.453 ======================= Grid point 197 (89/260) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.909 ( -39.386 0.000 19.249) 43.838 2.092 ( -38.175 0.000 26.452) 46.444 2.932 ( -50.754 0.000 39.103) 64.070 4.494 ( -4.988 0.000 5.073) 7.115 4.710 ( -7.857 0.000 4.443) 9.026 5.354 ( 3.002 0.000 -5.165) 5.974 5.429 ( -0.073 0.000 -3.911) 3.912 5.658 ( -3.170 0.000 1.855) 3.673 5.871 ( -6.247 0.000 6.831) 9.257 6.144 ( 4.783 0.000 -5.998) 7.671 6.316 ( 2.877 0.000 -0.650) 2.950 6.486 ( 8.579 0.000 -4.997) 9.928 7.631 ( 11.933 0.000 9.400) 15.191 7.792 ( 6.120 0.000 -2.657) 6.672 7.854 ( -3.321 0.000 4.603) 5.676 8.030 ( 5.955 0.000 3.633) 6.975 8.248 ( 4.088 0.000 -5.311) 6.702 8.315 ( -1.877 0.000 -2.612) 3.217 8.674 ( 1.681 0.000 -8.128) 8.300 8.729 ( -4.887 0.000 1.420) 5.089 9.250 ( -8.194 0.000 2.411) 8.541 9.419 ( -2.472 0.000 3.076) 3.946 10.278 ( 3.040 0.000 -16.558) 16.835 10.302 ( 1.116 0.000 -5.006) 5.129 10.676 ( 0.737 0.000 2.015) 2.145 10.761 ( 1.662 0.000 -3.701) 4.057 10.895 ( 2.527 0.000 -0.221) 2.536 10.967 ( 6.616 0.000 14.463) 15.905 11.142 ( -0.153 0.000 -3.104) 3.108 11.442 ( -5.010 0.000 5.431) 7.389 11.473 ( 0.719 0.000 -2.914) 3.001 11.803 ( -1.649 0.000 0.109) 1.652 13.086 ( -3.803 0.000 4.557) 5.935 13.756 ( 3.192 0.000 -3.221) 4.534 14.194 ( -2.379 0.000 1.924) 3.060 14.876 ( 4.434 0.000 -3.832) 5.860 ======================= Grid point 198 (90/260) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -29.153 0.000 30.108) 41.909 1.707 ( -29.039 0.000 36.234) 46.435 2.582 ( -29.557 0.000 61.353) 68.102 4.436 ( -4.195 0.000 2.378) 4.822 4.543 ( -10.391 0.000 -1.909) 10.565 5.357 ( -0.587 0.000 -3.372) 3.423 5.446 ( 4.882 0.000 -0.095) 4.882 5.601 ( -4.108 0.000 0.528) 4.142 5.843 ( -3.170 0.000 7.667) 8.296 6.201 ( 5.536 0.000 -4.577) 7.183 6.361 ( 2.327 0.000 -0.319) 2.349 6.561 ( 3.645 0.000 -4.407) 5.719 7.712 ( -6.464 0.000 -5.910) 8.758 7.853 ( 2.359 0.000 -2.409) 3.372 7.983 ( 9.552 0.000 6.912) 11.790 8.156 ( 4.171 0.000 3.217) 5.268 8.310 ( 3.410 0.000 -0.309) 3.424 8.356 ( 10.229 0.000 -1.122) 10.290 8.492 ( -10.524 0.000 -4.894) 11.606 8.672 ( -3.655 0.000 2.653) 4.516 9.145 ( -4.981 0.000 3.403) 6.032 9.397 ( -2.616 0.000 4.065) 4.834 10.197 ( 1.433 0.000 -16.189) 16.252 10.300 ( 0.949 0.000 -3.310) 3.443 10.701 ( -0.184 0.000 2.034) 2.042 10.761 ( 1.756 0.000 -4.659) 4.979 10.919 ( 1.148 0.000 -0.980) 1.509 11.120 ( 0.961 0.000 0.579) 1.121 11.169 ( 3.139 0.000 10.805) 11.251 11.318 ( -7.667 0.000 3.914) 8.609 11.765 ( -1.930 0.000 -1.436) 2.406 11.781 ( 29.191 0.000 6.103) 29.823 13.058 ( -2.992 0.000 4.833) 5.684 13.789 ( 3.105 0.000 -3.253) 4.497 14.156 ( -2.981 0.000 0.849) 3.100 14.750 ( -13.943 0.000 -12.726) 18.878 ======================= Grid point 199 (91/260) ======================= q-point: ( 0.00 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( 14.103 22.625 32.339) 41.911 2.031 ( -3.652 29.501 34.706) 45.697 3.011 ( -9.623 28.124 58.952) 66.022 4.408 ( -1.528 3.888 -3.513) 5.458 4.462 ( -4.052 6.243 -1.920) 7.686 5.284 ( -2.185 -1.397 -3.466) 4.329 5.378 ( 0.314 -8.860 2.628) 9.247 5.686 ( 0.520 4.577 3.247) 5.636 5.795 ( -2.844 -3.632 5.860) 7.458 6.244 ( 2.084 -0.956 -5.101) 5.592 6.385 ( 0.122 0.016 -0.896) 0.904 6.567 ( 2.322 -1.032 -3.208) 4.092 7.413 ( -9.438 -4.289 0.076) 10.367 7.732 ( 2.393 -18.152 4.295) 18.807 7.794 ( -3.918 -3.885 -2.009) 5.872 8.369 ( -5.209 4.246 -1.110) 6.811 8.373 ( 3.445 0.819 0.539) 3.582 8.531 ( 2.857 8.827 1.739) 9.440 8.548 ( 6.972 -2.733 -4.954) 8.979 8.658 ( -1.265 4.811 -2.981) 5.799 9.099 ( 2.712 -4.949 6.364) 8.506 9.406 ( -2.596 1.545 2.802) 4.121 10.043 ( 0.268 -4.996 -9.748) 10.957 10.311 ( 1.669 1.625 -5.793) 6.244 10.698 ( -1.558 1.092 -0.739) 2.041 10.771 ( 0.833 1.463 -2.293) 2.845 10.947 ( 0.631 -0.013 1.336) 1.477 11.182 ( -0.056 -0.469 3.080) 3.116 11.226 ( 0.072 5.865 -0.197) 5.869 11.358 ( -1.491 4.054 8.990) 9.974 11.678 ( 0.465 -3.434 -2.872) 4.501 12.290 ( 23.975 -8.982 -1.309) 25.636 13.067 ( -1.061 0.736 5.107) 5.268 13.850 ( 2.675 2.222 -2.424) 4.239 14.021 ( -5.788 -4.715 -0.435) 7.479 14.365 ( -15.412 4.238 -5.339) 16.852 ======================= Grid point 200 (92/260) ======================= q-point: ( 0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.310 ( 11.719 29.421 30.676) 44.090 2.391 ( 23.102 18.422 31.814) 43.419 3.469 ( 13.815 19.403 55.918) 60.780 4.386 ( 4.941 5.187 -8.003) 10.741 4.434 ( -0.514 4.822 1.646) 5.121 5.198 ( -4.046 1.433 -4.653) 6.331 5.323 ( -6.341 -3.914 -1.067) 7.528 5.728 ( -0.724 3.697 4.374) 5.773 5.855 ( 3.991 -8.859 9.487) 13.580 6.222 ( 0.840 -1.932 -6.809) 7.127 6.356 ( -2.113 -1.046 -2.443) 3.395 6.576 ( 0.957 -0.782 -3.238) 3.465 7.282 ( -5.754 0.973 1.506) 6.027 7.649 ( -8.937 -3.473 -3.211) 10.111 7.804 ( 1.490 -16.821 4.324) 17.432 8.230 ( -7.934 1.737 -6.725) 10.545 8.415 ( -0.577 0.239 2.359) 2.440 8.566 ( -0.053 0.173 -2.329) 2.336 8.614 ( 1.886 1.361 3.089) 3.867 8.649 ( 5.669 9.384 -5.966) 12.481 9.210 ( 2.667 -6.401 6.455) 9.474 9.389 ( 1.110 1.105 1.024) 1.871 9.993 ( 1.026 -2.057 -7.313) 7.666 10.322 ( 3.324 1.170 -4.226) 5.503 10.661 ( -1.906 1.121 -0.397) 2.247 10.768 ( 1.022 1.653 -2.770) 3.384 10.960 ( -0.361 -1.318 1.164) 1.795 11.177 ( -3.761 -0.548 4.833) 6.148 11.272 ( 5.082 6.028 -2.534) 8.282 11.365 ( -3.621 4.451 7.566) 9.496 11.655 ( -0.253 -1.740 -3.401) 3.829 12.544 ( 6.741 -10.249 -6.393) 13.833 13.118 ( 1.279 -3.919 6.449) 7.654 13.881 ( 3.233 2.000 -2.850) 4.751 13.905 ( -5.254 -1.076 -0.946) 5.446 14.159 ( -5.642 6.547 -0.525) 8.659 ======================= Grid point 201 (93/260) ======================= q-point: ( 0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( 17.776 25.574 26.222) 40.714 3.018 ( 17.799 12.837 36.366) 42.475 4.252 ( 32.814 12.758 40.125) 53.381 4.425 ( -4.554 3.994 5.903) 8.458 4.455 ( 6.185 4.718 -4.940) 9.215 5.102 ( -0.041 3.647 -7.711) 8.530 5.179 ( -5.976 0.523 -5.145) 7.903 5.741 ( -1.034 -0.681 4.247) 4.424 6.003 ( 3.580 -6.305 8.175) 10.927 6.190 ( 2.052 -2.697 -8.425) 9.081 6.279 ( -3.881 -2.256 -3.242) 5.538 6.548 ( -1.234 -1.052 -3.650) 3.994 7.221 ( -2.791 2.764 1.338) 4.150 7.467 ( -8.231 -4.640 -2.455) 9.762 7.835 ( -3.064 -9.766 0.801) 10.267 7.961 ( -12.474 -3.776 -10.080) 16.476 8.410 ( -2.791 -0.858 4.448) 5.321 8.509 ( -4.975 3.107 -0.526) 5.889 8.673 ( 7.338 5.900 -7.403) 11.977 8.746 ( 4.062 3.955 5.920) 8.197 9.273 ( 1.381 -8.660 4.297) 9.766 9.476 ( 5.413 0.631 2.056) 5.825 9.980 ( 2.917 0.681 -4.940) 5.777 10.351 ( 2.599 1.252 -3.275) 4.365 10.633 ( -0.494 0.228 -1.053) 1.185 10.769 ( 1.186 1.835 -2.426) 3.265 10.941 ( -3.744 -3.118 1.331) 5.051 11.096 ( -6.522 3.301 0.068) 7.310 11.351 ( 5.414 5.466 -2.112) 7.978 11.378 ( -0.853 2.394 7.696) 8.105 11.623 ( -0.403 -0.794 -3.375) 3.491 12.500 ( -4.507 -4.830 -5.733) 8.747 13.165 ( -1.610 -4.179 7.124) 8.414 13.834 ( -0.119 1.222 -6.659) 6.771 13.944 ( 4.490 -1.453 0.896) 4.803 14.111 ( -1.108 3.752 1.386) 4.151 ======================= Grid point 202 (94/260) ======================= q-point: ( 0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.295 ( 20.689 19.286 22.307) 36.022 3.535 ( 10.386 9.548 37.162) 39.750 4.280 ( -17.381 2.082 8.645) 19.523 4.460 ( -6.585 7.125 2.764) 10.088 5.072 ( 7.738 0.194 -9.196) 12.020 5.091 ( 20.163 5.600 8.607) 22.627 5.212 ( 25.353 8.279 5.012) 27.137 5.749 ( -1.250 -1.467 2.981) 3.550 6.056 ( -1.254 -4.027 1.023) 4.340 6.155 ( -0.695 -3.694 -7.793) 8.652 6.217 ( 0.325 -2.388 -1.548) 2.864 6.493 ( -1.384 -1.938 -3.164) 3.960 7.185 ( -2.113 1.877 -0.165) 2.831 7.345 ( -5.055 -5.054 -1.654) 7.337 7.495 ( -20.842 6.175 -8.020) 23.169 7.894 ( -0.033 -14.906 1.207) 14.955 8.358 ( -5.601 -4.340 0.421) 7.098 8.415 ( -5.490 6.535 2.383) 8.862 8.741 ( 5.890 10.699 -7.966) 14.582 8.877 ( 4.875 -1.946 8.325) 9.842 9.334 ( 1.800 -8.890 3.728) 9.806 9.555 ( 2.029 0.820 0.624) 2.276 10.035 ( 6.636 1.453 -3.432) 7.611 10.362 ( 0.986 1.796 -2.042) 2.892 10.625 ( 0.582 -1.609 -2.268) 2.841 10.767 ( -1.269 2.376 -2.130) 3.434 10.813 ( -8.861 -0.748 0.984) 8.946 11.016 ( -0.777 2.424 -4.308) 5.003 11.402 ( 1.005 1.127 0.464) 1.580 11.444 ( 2.034 5.038 4.644) 7.148 11.606 ( 1.174 -0.026 -1.376) 1.809 12.348 ( -7.275 -1.823 -5.864) 9.520 13.175 ( -2.613 -2.041 6.678) 7.456 13.788 ( 0.495 0.847 -7.116) 7.183 14.043 ( 4.760 -2.980 2.741) 6.249 14.122 ( 0.954 0.982 1.742) 2.216 ======================= Grid point 203 (95/260) ======================= q-point: ( 0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.796 ( 9.467 10.487 22.221) 26.332 3.827 ( -6.025 6.433 19.608) 21.497 4.060 ( -4.542 5.083 18.402) 19.624 4.249 ( -20.296 11.933 7.422) 24.686 5.162 ( 12.287 0.969 -7.759) 14.564 5.297 ( 12.712 1.900 -12.041) 17.612 5.658 ( -1.253 -4.734 -2.394) 5.450 5.859 ( 11.512 4.792 4.830) 13.372 6.021 ( -0.515 -1.730 -0.375) 1.844 6.114 ( 2.681 -5.057 -6.554) 8.701 6.211 ( 0.052 -0.309 -1.211) 1.251 6.493 ( 1.707 -0.323 0.663) 1.859 7.040 ( -11.298 7.862 0.675) 13.781 7.165 ( -1.859 1.026 0.300) 2.144 7.368 ( 1.101 -5.547 1.330) 5.809 7.899 ( -0.238 -9.833 0.578) 9.853 8.254 ( -4.865 -7.071 -1.885) 8.787 8.321 ( -7.603 6.692 2.505) 10.434 8.762 ( 2.023 12.177 -5.316) 13.440 9.014 ( 3.793 -3.454 5.657) 7.637 9.372 ( -0.611 -8.310 3.064) 8.878 9.571 ( 0.186 1.705 0.021) 1.715 10.142 ( 7.965 0.827 -4.794) 9.334 10.363 ( 0.595 1.686 -1.389) 2.264 10.561 ( -8.104 -1.895 0.785) 8.360 10.671 ( 0.195 1.171 -3.512) 3.707 10.785 ( 0.497 1.609 -1.069) 1.994 10.974 ( -0.123 0.879 -6.039) 6.104 11.393 ( -0.822 0.999 -3.088) 3.348 11.492 ( -0.580 4.047 6.001) 7.261 11.659 ( 3.859 1.209 2.142) 4.576 12.171 ( -7.288 -0.337 -7.041) 10.139 13.174 ( -2.562 -0.837 5.816) 6.410 13.750 ( 0.830 0.691 -6.492) 6.582 14.123 ( 0.457 -0.552 5.147) 5.197 14.189 ( 5.850 -4.061 1.641) 7.308 ======================= Grid point 204 (96/260) ======================= q-point: (-0.50 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.450 ( -31.584 2.554 13.974) 34.631 3.847 ( -27.945 12.754 6.786) 31.459 4.219 ( 7.893 5.052 18.299) 20.559 4.307 ( 9.428 10.533 20.111) 24.582 5.339 ( 9.480 -1.063 -9.961) 13.792 5.377 ( 5.601 0.806 -4.554) 7.264 5.481 ( -14.639 -5.271 -7.819) 17.413 5.770 ( -13.090 7.471 -3.909) 15.570 6.011 ( -1.261 -0.130 0.543) 1.379 6.120 ( 2.970 -2.813 -8.042) 9.022 6.220 ( 0.677 0.380 2.227) 2.359 6.414 ( -4.768 0.494 -3.164) 5.743 7.146 ( 1.628 -1.711 0.201) 2.370 7.332 ( 25.417 3.082 12.530) 28.505 7.429 ( 4.522 -4.919 3.914) 7.743 7.898 ( 0.502 -3.971 -0.810) 4.084 8.142 ( -8.551 -5.352 1.619) 10.217 8.214 ( -2.852 2.659 -2.737) 4.764 8.739 ( -0.788 11.619 -4.273) 12.404 9.058 ( -2.317 -2.375 1.899) 3.823 9.358 ( -2.792 -7.961 2.511) 8.802 9.573 ( -0.413 2.128 0.631) 2.258 10.225 ( 6.600 -1.000 -8.735) 10.994 10.367 ( 1.312 0.991 -1.888) 2.504 10.472 ( -3.157 -1.208 5.839) 6.747 10.670 ( 1.979 -0.236 -4.282) 4.723 10.784 ( 0.306 1.575 -1.370) 2.110 10.924 ( -0.383 1.356 -5.797) 5.966 11.341 ( -1.616 1.880 -4.612) 5.236 11.520 ( -1.544 3.625 6.746) 7.813 11.742 ( 2.934 1.068 2.329) 3.895 11.994 ( -6.498 0.864 -7.721) 10.129 13.168 ( -2.670 -0.197 5.085) 5.747 13.726 ( 1.520 0.835 -5.589) 5.852 14.155 ( -0.546 -1.713 4.586) 4.926 14.330 ( 7.375 -4.726 3.879) 9.580 ======================= Grid point 205 (97/260) ======================= q-point: (-0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.974 ( -33.896 4.580 16.459) 37.958 3.340 ( -34.508 13.039 7.317) 37.608 4.361 ( -6.058 5.237 15.107) 17.098 4.610 ( 8.628 7.640 13.470) 17.727 4.901 ( -36.494 8.483 -0.364) 37.468 5.322 ( 2.304 -3.884 -12.329) 13.130 5.496 ( -1.193 -2.736 -2.471) 3.875 5.654 ( 3.311 6.150 3.303) 7.727 5.991 ( -1.943 -2.029 0.751) 2.908 6.115 ( 2.651 -0.591 -6.366) 6.921 6.252 ( 1.099 0.031 1.295) 1.699 6.356 ( 1.137 0.836 -5.519) 5.697 7.191 ( 3.650 -5.638 0.906) 6.777 7.516 ( 4.698 -6.081 3.780) 8.563 7.830 ( 7.960 -0.498 3.061) 8.543 7.951 ( 6.012 1.038 1.452) 6.271 8.041 ( 3.270 -5.119 3.196) 6.864 8.188 ( 4.124 1.436 -1.797) 4.722 8.675 ( -2.997 10.545 -3.768) 11.592 8.975 ( -6.315 0.362 -0.925) 6.392 9.318 ( -4.031 -8.621 2.914) 9.953 9.554 ( -2.476 2.218 0.680) 3.393 10.240 ( 3.147 -6.023 -11.859) 13.668 10.387 ( 3.357 1.829 -4.319) 5.768 10.530 ( 2.452 -2.412 10.260) 10.821 10.676 ( 1.995 1.277 -2.941) 3.776 10.778 ( 0.371 1.480 -1.731) 2.308 10.889 ( 0.516 2.813 -3.620) 4.613 11.277 ( -1.734 2.620 -4.498) 5.486 11.530 ( -2.283 4.188 5.283) 7.118 11.757 ( -2.351 -1.575 -5.332) 6.037 11.860 ( -2.706 3.831 -0.928) 4.781 13.152 ( -3.019 0.297 4.569) 5.485 13.725 ( 2.441 1.221 -4.638) 5.382 14.172 ( -1.065 -3.037 3.868) 5.032 14.500 ( 8.123 -5.111 4.811) 10.736 ======================= Grid point 206 (98/260) ======================= q-point: (-0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.508 ( -33.665 8.283 21.190) 40.632 2.741 ( -39.267 10.997 8.740) 41.704 3.982 ( -45.440 24.011 16.852) 54.086 4.558 ( -6.598 2.865 7.214) 10.187 4.778 ( 0.846 5.229 8.750) 10.228 5.280 ( 1.667 -7.247 -9.092) 11.746 5.420 ( -2.850 -3.851 -2.707) 5.503 5.746 ( 0.864 6.370 4.268) 7.716 5.947 ( -4.755 -1.192 3.160) 5.833 6.121 ( 3.123 0.117 -5.503) 6.328 6.286 ( 2.181 1.015 -0.079) 2.407 6.372 ( 6.056 0.316 -6.151) 8.638 7.292 ( 5.759 -8.865 3.882) 11.261 7.638 ( 5.834 -5.015 3.493) 8.449 7.829 ( -4.053 -6.072 1.153) 7.391 7.970 ( 3.016 3.144 0.524) 4.388 8.119 ( 3.180 -3.909 -4.526) 6.773 8.469 ( 14.613 -0.605 2.409) 14.822 8.592 ( -2.166 10.102 -2.774) 10.697 8.857 ( -5.483 2.478 -1.551) 6.214 9.258 ( -5.033 -8.419 3.085) 10.282 9.501 ( -3.923 2.317 1.233) 4.720 10.182 ( 0.818 -9.097 -11.490) 14.678 10.402 ( 3.184 2.356 -8.580) 9.450 10.645 ( 1.585 -2.151 5.202) 5.848 10.748 ( 6.137 1.585 7.288) 9.659 10.774 ( 0.699 1.565 -1.736) 2.439 10.894 ( 2.206 3.622 -1.643) 4.549 11.218 ( -1.442 3.199 -3.819) 5.186 11.516 ( -1.904 4.789 1.631) 5.405 11.619 ( -6.125 -0.021 -6.593) 8.999 11.850 ( -0.988 3.121 2.044) 3.859 13.127 ( -3.330 0.825 4.246) 5.459 13.745 ( 3.193 1.703 -3.802) 5.249 14.172 ( -1.710 -3.860 2.776) 5.053 14.674 ( 7.536 -6.440 3.349) 10.463 ======================= Grid point 207 (99/260) ======================= q-point: (-0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( -37.921 13.434 15.262) 43.028 2.178 ( -31.639 11.947 27.305) 43.466 3.339 ( -43.671 35.029 32.312) 64.639 4.513 ( -4.629 2.184 4.671) 6.930 4.766 ( -7.215 5.181 4.089) 9.779 5.258 ( 1.891 -9.880 -3.854) 10.773 5.369 ( -1.147 -4.124 -2.515) 4.965 5.743 ( -2.250 5.966 0.504) 6.396 5.878 ( -5.756 1.198 4.893) 7.649 6.154 ( 4.737 0.621 -4.588) 6.624 6.326 ( 2.510 1.160 -0.105) 2.767 6.468 ( 7.908 -1.532 -5.050) 9.508 7.445 ( 6.735 -13.296 6.631) 16.313 7.742 ( -5.176 -8.670 0.354) 10.104 7.759 ( 3.847 -5.098 2.730) 6.946 8.093 ( 9.162 3.581 2.148) 10.069 8.171 ( 6.601 -0.681 -2.601) 7.127 8.493 ( -2.348 7.853 -1.615) 8.354 8.648 ( 1.803 -0.048 -4.080) 4.461 8.763 ( -4.049 2.980 -1.286) 5.190 9.181 ( -6.163 -7.156 1.923) 9.638 9.446 ( -3.449 2.183 2.624) 4.853 10.135 ( 2.316 -8.459 -8.663) 12.328 10.378 ( 1.964 2.657 -9.804) 10.346 10.690 ( 1.050 1.023 2.725) 3.094 10.770 ( 1.025 0.767 -2.975) 3.239 10.909 ( 1.453 -0.632 4.840) 5.093 10.972 ( 8.134 2.085 6.176) 10.424 11.181 ( 0.099 4.778 -1.983) 5.174 11.458 ( -5.909 -0.566 -4.507) 7.453 11.525 ( 1.109 5.541 2.602) 6.221 11.844 ( -0.685 3.623 1.385) 3.939 13.098 ( -3.331 1.371 4.095) 5.454 13.779 ( 3.448 2.095 -3.194) 5.145 14.150 ( -2.508 -4.255 1.474) 5.154 14.780 ( 2.576 -8.470 -2.355) 9.161 ======================= Grid point 208 (100/260) ======================= q-point: (-0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( -22.537 19.847 26.192) 39.848 1.973 ( -18.465 21.647 35.400) 45.417 2.971 ( -29.575 35.961 48.226) 67.034 4.460 ( -3.789 2.710 1.740) 4.973 4.612 ( -9.823 6.252 -1.338) 11.721 5.305 ( 3.705 -9.805 1.981) 10.667 5.333 ( -0.766 -4.299 -2.919) 5.252 5.699 ( -2.464 4.671 0.156) 5.284 5.824 ( -4.342 0.849 4.804) 6.531 6.213 ( 4.846 0.339 -4.091) 6.351 6.368 ( 1.977 0.754 -0.024) 2.116 6.542 ( 4.066 -1.771 -4.273) 6.159 7.558 ( -3.061 -12.557 1.902) 13.064 7.659 ( -0.563 -15.238 3.529) 15.652 7.824 ( 1.424 -4.177 -0.321) 4.425 8.249 ( 7.934 0.408 -0.470) 7.959 8.368 ( 13.911 1.931 0.477) 14.053 8.468 ( 0.087 6.540 -1.027) 6.621 8.548 ( -6.881 5.987 -3.592) 9.803 8.704 ( -2.548 3.828 0.071) 4.599 9.083 ( -5.321 -6.350 3.589) 9.029 9.420 ( -2.329 2.064 3.924) 5.008 10.108 ( 1.341 -6.857 -10.088) 12.272 10.340 ( 1.060 2.083 -7.798) 8.141 10.715 ( 0.031 1.195 0.496) 1.294 10.769 ( 1.089 0.887 -2.228) 2.634 10.930 ( 0.210 0.283 0.793) 0.868 11.140 ( 3.774 0.238 1.791) 4.184 11.215 ( 2.208 7.025 5.488) 9.184 11.339 ( -5.289 0.469 3.376) 6.293 11.638 ( 7.251 -4.013 -0.098) 8.288 11.908 ( 10.784 4.926 3.247) 12.292 13.072 ( -2.841 1.711 4.211) 5.360 13.817 ( 3.195 2.281 -2.794) 4.818 14.103 ( -3.597 -4.594 0.300) 5.842 14.678 ( -10.096 -6.194 -8.710) 14.702 ======================= Grid point 209 (101/260) ======================= q-point: ( 0.00 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( 13.047 32.084 24.370) 42.349 2.628 ( 0.596 29.915 31.213) 43.238 3.789 ( -8.972 45.764 36.719) 59.356 4.522 ( 0.281 6.897 -2.022) 7.192 4.622 ( -5.114 8.993 -2.007) 10.538 5.143 ( 2.929 -13.839 7.043) 15.802 5.231 ( 0.588 -4.666 0.885) 4.785 5.641 ( -3.070 -2.654 0.868) 4.150 5.883 ( -4.491 6.972 1.747) 8.475 6.185 ( 1.009 -4.929 -5.402) 7.382 6.380 ( -1.331 -0.727 -1.557) 2.174 6.534 ( 2.918 -2.304 -3.516) 5.117 7.355 ( -5.354 -1.737 3.920) 6.859 7.389 ( 2.334 -15.306 4.338) 16.080 7.703 ( -3.531 -5.320 -3.055) 7.078 8.352 ( 4.102 -2.445 2.965) 5.622 8.389 ( 1.556 -7.835 -3.994) 8.931 8.498 ( -3.056 3.119 -0.834) 4.446 8.637 ( 0.171 3.397 -1.430) 3.690 8.806 ( 0.902 7.759 -3.365) 8.506 8.979 ( 4.206 -6.858 5.232) 9.597 9.423 ( -3.383 -0.271 1.655) 3.776 9.951 ( 1.148 -3.052 -3.628) 4.878 10.328 ( 1.948 -0.311 -5.756) 6.085 10.729 ( -0.195 1.903 -2.338) 3.021 10.801 ( 0.451 1.008 -0.020) 1.104 10.960 ( -1.211 2.032 3.971) 4.623 11.202 ( -1.402 1.920 1.542) 2.834 11.336 ( 3.901 2.182 -3.002) 5.385 11.411 ( 0.169 3.235 5.662) 6.523 11.641 ( 0.878 0.821 -1.284) 1.759 12.139 ( 10.060 -5.878 4.236) 12.398 13.127 ( -1.465 5.179 2.680) 6.012 13.855 ( -2.198 -2.589 3.525) 4.895 13.970 ( 0.865 0.054 -7.322) 7.373 14.381 ( -6.850 -2.398 -5.828) 9.308 ======================= Grid point 210 (102/260) ======================= q-point: ( 0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.836 ( 21.531 26.991 24.366) 42.259 2.936 ( 9.539 28.516 27.714) 40.893 4.063 ( 8.938 37.977 39.212) 55.315 4.533 ( 4.726 9.097 -6.840) 12.323 4.567 ( -1.604 8.047 2.369) 8.540 5.191 ( 0.256 -5.448 0.230) 5.459 5.244 ( -1.894 -1.370 1.114) 2.589 5.656 ( 2.373 -8.433 5.105) 10.140 5.819 ( -4.285 3.960 4.278) 7.235 6.150 ( 0.460 -5.083 -7.128) 8.767 6.324 ( -3.063 -2.077 -2.973) 4.747 6.544 ( 0.628 -2.600 -3.265) 4.221 7.302 ( -3.616 0.401 3.463) 5.023 7.462 ( 2.725 -15.982 3.232) 16.531 7.557 ( -9.516 -5.296 -3.587) 11.466 8.289 ( -7.598 1.911 -7.898) 11.125 8.382 ( -2.172 -1.929 4.654) 5.486 8.520 ( 2.991 -4.739 0.108) 5.605 8.653 ( 2.788 2.107 -0.498) 3.530 8.824 ( 3.965 7.557 -3.760) 9.325 9.060 ( -0.617 -8.465 5.205) 9.957 9.391 ( 1.053 -0.945 -0.376) 1.464 9.968 ( 2.590 0.449 -1.578) 3.066 10.339 ( 3.236 0.198 -4.508) 5.552 10.704 ( -1.191 2.945 -1.159) 3.382 10.803 ( 0.290 1.325 -0.737) 1.544 10.950 ( -2.631 1.132 3.088) 4.212 11.207 ( -0.453 2.968 2.507) 3.912 11.389 ( 4.102 2.356 -2.591) 5.394 11.419 ( -2.226 3.037 3.528) 5.159 11.640 ( 0.191 1.273 -1.532) 2.001 12.318 ( 6.000 -10.699 2.027) 12.433 13.128 ( -0.891 4.202 3.596) 5.602 13.838 ( -2.012 -3.794 2.827) 5.141 13.935 ( 1.321 1.847 -7.448) 7.786 14.241 ( -4.423 0.977 -4.223) 6.193 ======================= Grid point 211 (103/260) ======================= q-point: ( 0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.311 ( 12.901 24.936 25.574) 37.977 3.386 ( 17.627 23.566 24.129) 38.056 4.534 ( -3.236 8.359 4.473) 10.018 4.591 ( 6.466 9.723 -3.192) 12.105 4.648 ( 21.131 22.412 30.114) 43.077 5.176 ( -0.606 -0.095 -3.002) 3.064 5.211 ( 2.738 6.871 -3.711) 8.275 5.708 ( -1.003 -3.473 3.053) 4.732 5.857 ( 2.808 -6.769 8.617) 11.311 6.113 ( 1.841 -4.723 -7.407) 8.975 6.227 ( -5.332 -2.635 -3.720) 7.015 6.504 ( -2.019 -3.469 -3.814) 5.536 7.268 ( -2.955 -0.751 2.634) 4.029 7.349 ( -10.339 -5.055 -2.518) 11.781 7.535 ( 3.508 -14.683 1.613) 15.182 8.028 ( -14.538 5.586 -9.037) 18.006 8.366 ( -3.529 -2.256 3.651) 5.556 8.545 ( -0.056 -0.848 -0.423) 0.949 8.719 ( 4.136 0.131 1.340) 4.349 8.879 ( 4.877 7.053 -3.623) 9.309 9.065 ( -1.650 -11.472 6.446) 13.262 9.459 ( 5.366 -2.275 -0.182) 5.831 10.012 ( 3.765 2.967 -1.510) 5.026 10.367 ( 3.296 0.163 -4.514) 5.592 10.672 ( -2.064 3.414 0.173) 3.993 10.805 ( 0.564 1.111 -0.836) 1.500 10.913 ( -3.673 1.114 1.437) 4.098 11.180 ( -3.645 5.062 -1.115) 6.336 11.394 ( -2.449 -0.634 5.570) 6.117 11.472 ( 6.342 4.816 -2.755) 8.426 11.625 ( -0.401 1.891 -1.890) 2.704 12.361 ( -1.270 -8.384 -0.678) 8.506 13.145 ( -0.707 2.527 4.740) 5.418 13.824 ( 0.181 -2.490 -3.234) 4.086 13.921 ( 1.618 -0.396 -1.900) 2.526 14.162 ( -2.133 0.696 -2.119) 3.087 ======================= Grid point 212 (104/260) ======================= q-point: ( 0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.718 ( 13.513 20.105 21.387) 32.314 3.826 ( 11.638 19.779 25.119) 34.024 4.378 ( -16.743 7.651 6.812) 19.628 4.634 ( -1.177 10.021 0.662) 10.112 5.092 ( 8.106 1.898 -5.522) 9.990 5.209 ( 9.545 5.155 -2.471) 11.126 5.456 ( 21.771 14.414 10.395) 28.103 5.723 ( 1.944 -0.302 4.942) 5.319 5.935 ( 1.505 -7.739 0.300) 7.889 6.082 ( -5.707 -3.242 -5.181) 8.362 6.136 ( 3.149 -5.217 -1.055) 6.184 6.446 ( -0.482 -2.042 -2.098) 2.967 7.171 ( -7.480 -9.548 0.134) 12.130 7.245 ( -2.056 1.299 1.721) 2.979 7.609 ( 4.032 -12.633 -0.118) 13.262 7.665 ( -19.464 10.078 -5.780) 22.668 8.297 ( -6.080 -1.758 1.248) 6.451 8.516 ( -2.448 3.241 -0.619) 4.109 8.816 ( 3.310 -3.949 5.184) 7.309 8.938 ( 5.591 8.075 -4.993) 11.018 9.110 ( 0.611 -13.092 6.915) 14.819 9.537 ( 3.226 -2.644 -0.577) 4.210 10.083 ( 5.824 3.476 -2.457) 7.214 10.383 ( 2.337 -0.024 -4.996) 5.516 10.628 ( -3.744 2.036 0.948) 4.366 10.802 ( -1.697 -0.036 -0.219) 1.712 10.840 ( -2.917 4.898 -1.772) 5.970 11.090 ( -3.457 4.701 -3.724) 6.922 11.397 ( -1.367 -1.119 3.646) 4.051 11.574 ( 5.044 6.449 0.395) 8.196 11.608 ( 0.849 0.625 -1.468) 1.808 12.285 ( -5.182 -4.502 -3.021) 7.500 13.166 ( -1.133 1.782 5.164) 5.579 13.792 ( 0.474 -0.759 -6.437) 6.499 13.973 ( 3.906 -3.812 1.776) 5.740 14.124 ( -1.447 -0.972 -0.112) 1.747 ======================= Grid point 213 (105/260) ======================= q-point: ( 0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.978 ( -19.171 12.369 14.753) 27.170 4.094 ( 10.604 13.724 13.550) 22.009 4.240 ( 3.004 12.937 17.002) 21.574 4.521 ( -13.273 14.454 6.044) 20.534 5.193 ( 12.463 2.154 -10.660) 16.541 5.343 ( 7.628 2.283 -7.176) 10.719 5.561 ( -5.647 -4.946 -5.105) 9.078 5.902 ( 0.224 -2.113 2.545) 3.316 5.962 ( 0.748 -5.874 -0.462) 5.940 6.034 ( 8.078 -1.070 -5.448) 9.802 6.194 ( 3.449 -1.342 1.057) 3.849 6.528 ( 6.268 5.674 5.228) 9.940 7.094 ( -1.022 -6.349 3.931) 7.537 7.236 ( -1.759 -0.254 2.920) 3.418 7.324 ( -12.441 11.957 1.903) 17.360 7.673 ( 3.437 -11.999 -0.827) 12.509 8.190 ( -5.697 0.016 -0.478) 5.717 8.451 ( -4.224 5.611 -1.254) 7.134 8.865 ( -1.980 -4.423 4.308) 6.484 9.021 ( 6.654 6.452 -3.783) 10.011 9.162 ( -0.500 -12.699 6.062) 14.081 9.568 ( 1.198 -2.006 -0.746) 2.453 10.168 ( 5.951 1.845 -4.883) 7.916 10.377 ( 1.303 -0.721 -5.249) 5.456 10.538 ( -7.002 0.829 1.776) 7.271 10.739 ( -1.505 4.177 -2.714) 5.204 10.826 ( 0.609 3.367 -1.224) 3.634 11.018 ( -1.410 3.370 -4.411) 5.727 11.388 ( -1.607 -1.073 0.985) 2.169 11.592 ( -0.223 4.637 1.297) 4.820 11.693 ( 5.192 2.285 0.852) 5.736 12.153 ( -6.198 -1.558 -4.527) 7.832 13.179 ( -1.508 1.845 4.907) 5.455 13.759 ( 1.088 0.006 -6.215) 6.310 14.074 ( 5.146 -6.569 2.396) 8.681 14.106 ( -0.930 -1.978 1.866) 2.874 ======================= Grid point 214 (106/260) ======================= q-point: (-0.50 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.609 ( -27.291 13.231 9.617) 31.817 4.129 ( -23.883 15.288 3.131) 28.529 4.350 ( 4.192 7.819 15.686) 18.022 4.566 ( 8.465 13.734 13.252) 20.878 5.300 ( 3.664 -3.231 -15.022) 15.796 5.360 ( -10.012 -5.085 -5.168) 12.361 5.406 ( 7.571 0.069 -3.894) 8.514 5.872 ( -4.957 2.597 4.407) 7.123 5.983 ( 2.043 -4.554 -3.817) 6.283 6.074 ( 2.455 -0.955 -4.849) 5.518 6.258 ( 2.377 2.326 0.992) 3.471 6.467 ( -11.487 7.103 0.312) 13.509 7.119 ( -4.006 -0.865 3.563) 5.430 7.242 ( 3.148 -8.314 5.693) 10.556 7.498 ( 20.205 9.471 11.718) 25.204 7.715 ( 1.760 -12.452 0.112) 12.576 8.101 ( -3.397 2.578 -1.507) 4.523 8.358 ( -3.708 7.552 -3.179) 8.994 8.827 ( -4.541 -3.708 2.458) 6.357 9.075 ( 1.681 4.856 -3.381) 6.151 9.170 ( -2.912 -11.086 4.298) 12.242 9.577 ( 0.260 -1.637 -0.464) 1.721 10.186 ( 1.323 -2.308 -9.296) 9.670 10.371 ( 1.925 -1.717 -2.630) 3.684 10.463 ( -2.291 2.102 3.053) 4.358 10.718 ( 1.260 3.545 -3.285) 4.994 10.828 ( 0.497 3.717 -0.991) 3.879 10.976 ( 0.064 3.553 -3.958) 5.320 11.356 ( -1.892 -0.185 -0.920) 2.112 11.605 ( -0.078 3.832 2.255) 4.447 11.764 ( 2.303 1.199 -0.936) 2.760 12.017 ( -5.254 1.389 -3.411) 6.416 13.183 ( -1.758 2.228 4.336) 5.182 13.745 ( 2.203 0.917 -5.531) 6.024 14.088 ( -1.566 -5.575 2.126) 6.169 14.214 ( 6.848 -6.037 3.739) 9.865 ======================= Grid point 215 (107/260) ======================= q-point: (-0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.191 ( -28.131 16.802 12.072) 34.920 3.636 ( -31.940 16.399 0.525) 35.908 4.478 ( -1.021 6.134 11.817) 13.353 4.786 ( 5.882 8.809 9.060) 13.938 5.068 ( -18.832 4.770 -0.908) 19.447 5.193 ( -3.045 -9.092 -12.054) 15.402 5.480 ( -2.416 1.915 -1.114) 3.278 5.827 ( -1.207 10.951 6.509) 12.797 5.956 ( -1.481 -1.263 -2.347) 3.049 6.084 ( 2.004 -2.106 -3.160) 4.294 6.284 ( -0.394 4.102 2.420) 4.779 6.369 ( 1.910 0.396 -3.350) 3.876 7.093 ( -0.840 -3.162 1.915) 3.791 7.357 ( 4.628 -9.109 7.358) 12.591 7.690 ( -2.454 -11.935 2.358) 12.411 7.958 ( 16.131 1.789 4.940) 16.965 8.048 ( -1.145 4.888 -1.758) 5.319 8.325 ( 4.843 8.298 -2.617) 9.958 8.752 ( -5.489 -3.132 2.187) 6.688 9.034 ( -2.423 5.081 -4.601) 7.270 9.129 ( -4.483 -9.843 3.470) 11.359 9.560 ( -1.813 -1.425 -0.597) 2.382 10.106 ( -1.457 -5.941 -10.245) 11.932 10.399 ( 2.542 -2.826 -2.126) 4.355 10.501 ( 2.723 1.992 5.107) 6.121 10.733 ( 2.970 2.717 -2.971) 5.003 10.831 ( 0.432 4.646 -0.343) 4.679 10.965 ( 1.610 4.505 -3.174) 5.741 11.314 ( -1.783 0.977 -1.417) 2.478 11.608 ( -0.666 1.996 -0.737) 2.229 11.742 ( -2.221 0.921 -4.337) 4.959 11.942 ( -2.455 4.005 1.441) 4.914 13.179 ( -1.952 2.839 3.694) 5.051 13.757 ( 3.332 2.030 -4.759) 6.154 14.075 ( -1.714 -6.767 2.282) 7.344 14.369 ( 7.264 -7.588 3.754) 11.155 ======================= Grid point 216 (108/260) ======================= q-point: (-0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.805 ( -26.833 20.664 16.318) 37.594 3.043 ( -34.535 19.208 2.052) 39.571 4.451 ( -15.407 15.561 12.208) 25.070 4.709 ( -17.159 14.685 6.122) 23.399 4.899 ( -0.481 5.405 5.827) 7.962 5.067 ( -3.326 -12.946 -6.564) 14.891 5.370 ( -6.075 0.592 -0.396) 6.116 5.889 ( -1.317 5.239 1.207) 5.535 5.927 ( 0.744 2.087 3.077) 3.792 6.101 ( 2.721 -2.419 -2.941) 4.681 6.319 ( 3.637 2.116 -1.227) 4.383 6.393 ( 2.418 1.909 -2.292) 3.840 7.122 ( 2.340 -6.989 2.591) 7.812 7.505 ( 5.986 -7.806 6.386) 11.728 7.637 ( -5.361 -10.697 3.440) 12.450 8.043 ( 2.946 3.717 -1.432) 4.955 8.113 ( 4.629 0.483 -4.212) 6.277 8.497 ( 9.956 3.652 0.625) 10.623 8.680 ( -4.095 -1.618 2.706) 5.168 8.946 ( -3.226 5.469 -4.769) 7.941 9.070 ( -4.751 -9.441 3.034) 10.995 9.514 ( -2.835 -0.994 0.011) 3.004 10.015 ( -0.634 -6.555 -7.897) 10.283 10.413 ( 1.906 -2.471 -5.431) 6.264 10.608 ( 3.529 0.131 6.838) 7.696 10.772 ( 3.036 0.856 -2.854) 4.254 10.848 ( 1.369 5.385 2.458) 6.076 10.988 ( 3.455 5.446 -2.538) 6.931 11.280 ( -0.975 2.500 -0.699) 2.773 11.552 ( -2.157 -1.528 -7.929) 8.358 11.673 ( -3.106 5.318 0.417) 6.173 11.924 ( -1.740 3.697 2.531) 4.806 13.168 ( -2.050 3.630 3.125) 5.211 13.790 ( 3.767 2.871 -3.831) 6.091 14.059 ( -1.645 -7.314 1.579) 7.661 14.511 ( 5.804 -9.339 2.245) 11.222 ======================= Grid point 217 (109/260) ======================= q-point: (-0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -29.767 23.297 12.942) 39.954 2.586 ( -21.306 27.467 19.256) 39.739 4.119 ( -29.449 38.588 21.635) 53.145 4.592 ( -4.524 6.192 3.763) 8.542 4.890 ( -4.961 6.009 3.409) 8.505 4.984 ( -1.865 -16.844 -0.486) 16.954 5.285 ( -3.160 -3.081 -1.145) 4.559 5.814 ( -5.310 0.963 -0.447) 5.415 5.962 ( -0.883 7.046 2.512) 7.533 6.141 ( 4.030 -2.451 -3.151) 5.673 6.367 ( 1.443 2.671 1.308) 3.306 6.440 ( 5.922 -0.937 -5.410) 8.075 7.204 ( 3.631 -10.159 4.456) 11.672 7.547 ( -7.097 -9.074 4.461) 12.353 7.649 ( 5.275 -6.099 2.389) 8.411 8.131 ( 6.286 0.027 -1.240) 6.407 8.176 ( 7.635 -0.448 -2.353) 8.002 8.576 ( 0.198 2.890 -0.302) 2.913 8.662 ( -0.618 -0.422 1.402) 1.590 8.864 ( -2.167 5.400 -3.733) 6.913 9.000 ( -5.457 -8.976 1.904) 10.676 9.471 ( -2.463 -0.119 1.664) 2.975 9.981 ( 1.652 -6.257 -5.119) 8.252 10.391 ( 1.029 -1.911 -7.359) 7.672 10.702 ( 2.285 0.462 4.316) 4.906 10.783 ( 1.098 0.546 -3.085) 3.320 10.906 ( 0.910 2.142 4.757) 5.296 11.064 ( 7.086 5.742 -1.074) 9.184 11.277 ( 0.139 3.504 1.940) 4.007 11.443 ( -3.121 -0.617 -7.230) 7.899 11.636 ( -1.588 5.500 0.742) 5.773 11.919 ( -0.539 3.213 2.674) 4.215 13.153 ( -2.000 4.443 2.701) 5.571 13.829 ( 2.948 2.664 -2.371) 4.627 14.038 ( -1.345 -6.574 -0.202) 6.713 14.584 ( 1.464 -10.464 -1.283) 10.644 ======================= Grid point 218 (110/260) ======================= q-point: (-0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( -12.183 31.639 20.555) 39.648 2.490 ( -10.002 29.817 28.529) 42.462 3.833 ( -22.384 46.077 29.671) 59.199 4.547 ( -2.609 5.687 1.125) 6.357 4.763 ( -8.621 7.799 -0.937) 11.663 5.027 ( 2.932 -16.827 6.813) 18.389 5.238 ( -1.128 -4.943 -1.173) 5.204 5.717 ( -5.061 -0.237 -0.335) 5.077 5.939 ( -2.876 7.802 1.153) 8.395 6.183 ( 3.112 -3.647 -3.892) 6.175 6.391 ( 0.389 1.402 0.524) 1.546 6.498 ( 4.619 -2.463 -4.982) 7.227 7.301 ( 3.072 -12.457 5.312) 13.887 7.446 ( -7.282 -6.366 3.824) 10.401 7.725 ( 2.217 -5.510 -0.817) 5.995 8.231 ( 7.004 -3.018 -0.827) 7.671 8.329 ( 7.522 -5.008 -0.566) 9.054 8.559 ( -1.497 4.162 -1.490) 4.667 8.651 ( -0.504 3.755 -0.719) 3.856 8.824 ( -0.268 5.857 -1.923) 6.171 8.923 ( -3.625 -7.976 3.872) 9.579 9.451 ( -2.069 0.414 3.230) 3.858 9.971 ( 0.945 -5.789 -5.261) 7.880 10.352 ( 0.856 -1.274 -7.245) 7.406 10.741 ( 0.566 1.392 -0.815) 1.709 10.786 ( 1.059 0.468 -0.436) 1.237 10.940 ( -0.129 1.833 3.976) 4.380 11.192 ( 5.629 4.408 -1.448) 7.295 11.297 ( -0.943 -2.386 5.054) 5.668 11.371 ( 0.144 5.751 -1.770) 6.019 11.631 ( 0.719 2.564 -0.518) 2.713 11.970 ( 4.488 1.382 3.874) 6.088 13.138 ( -1.801 5.062 2.485) 5.919 13.855 ( 0.710 0.674 0.284) 1.019 14.007 ( -0.610 -3.996 -3.434) 5.304 14.532 ( -4.577 -8.127 -5.033) 10.598 ======================= Grid point 219 (111/260) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.963 ( 9.814 31.550 22.274) 39.848 3.237 ( 1.235 31.074 22.432) 38.344 4.496 ( 0.375 4.451 11.275) 12.128 4.612 ( 0.587 -4.785 8.185) 9.499 4.788 ( -3.531 16.521 5.594) 17.796 4.937 ( 2.567 1.361 3.835) 4.811 5.249 ( -0.866 13.887 5.266) 14.877 5.633 ( -3.777 0.846 -1.082) 4.019 5.947 ( -5.651 -4.254 0.449) 7.088 6.104 ( 0.380 0.748 -6.358) 6.413 6.340 ( -2.646 -3.954 -3.245) 5.759 6.484 ( 2.439 -2.545 -2.945) 4.593 7.146 ( 0.501 -8.476 5.085) 9.897 7.314 ( -4.991 -3.328 5.955) 8.452 7.606 ( -3.797 -3.506 -0.849) 5.237 8.116 ( 3.368 -16.646 1.663) 17.064 8.329 ( 1.882 0.087 2.593) 3.205 8.584 ( -3.557 3.818 -3.277) 6.162 8.688 ( -0.440 1.370 -2.723) 3.080 8.811 ( 4.464 -8.680 2.476) 10.070 8.960 ( 1.692 7.278 -3.495) 8.249 9.382 ( -2.624 -3.977 -0.422) 4.783 9.955 ( 2.482 3.467 1.655) 4.574 10.290 ( 2.046 -3.494 -2.230) 4.622 10.768 ( 0.719 1.880 -2.707) 3.373 10.813 ( 0.957 0.421 -0.620) 1.216 11.024 ( -1.309 3.702 3.664) 5.371 11.205 ( -0.759 -2.118 2.384) 3.278 11.360 ( 3.850 2.736 -2.753) 5.466 11.487 ( 0.671 2.503 1.287) 2.893 11.702 ( 0.062 4.857 0.479) 4.881 12.038 ( 3.469 -4.751 4.604) 7.470 13.265 ( -0.830 8.345 0.730) 8.418 13.763 ( -2.531 -6.086 2.101) 6.918 14.002 ( 2.156 2.621 -6.796) 7.597 14.294 ( -2.739 -5.717 -5.030) 8.092 ======================= Grid point 220 (112/260) ======================= q-point: ( 0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.387 ( 18.892 26.994 19.624) 38.349 3.477 ( 6.161 26.864 24.378) 36.795 4.633 ( 5.415 2.826 9.614) 11.390 4.690 ( 2.051 0.337 3.010) 3.657 4.802 ( 2.403 21.425 7.364) 22.782 5.047 ( 3.586 -3.756 7.640) 9.238 5.322 ( 3.816 16.150 7.315) 18.135 5.584 ( -0.121 0.573 -1.187) 1.323 5.837 ( -6.528 -3.764 -0.093) 7.536 6.060 ( 0.028 -2.159 -6.336) 6.694 6.270 ( -2.602 -3.822 -3.093) 5.563 6.481 ( -0.689 -2.947 -2.792) 4.117 7.195 ( 0.446 -10.199 2.916) 10.617 7.259 ( -4.560 -5.646 3.938) 8.257 7.491 ( -7.700 0.049 0.257) 7.705 8.168 ( 1.100 -14.162 -0.771) 14.226 8.368 ( 0.030 -0.154 2.833) 2.837 8.483 ( -4.737 2.631 -2.032) 5.787 8.679 ( 1.144 0.194 -1.749) 2.099 8.869 ( -0.402 -8.898 3.329) 9.509 8.976 ( 2.868 6.781 -3.847) 8.307 9.350 ( 0.946 -3.271 -1.794) 3.849 10.025 ( 3.405 5.010 2.409) 6.519 10.321 ( 2.903 -2.134 -2.067) 4.154 10.762 ( 0.318 2.586 -1.841) 3.190 10.817 ( 0.005 0.346 -0.327) 0.477 11.008 ( -2.320 4.080 2.122) 5.151 11.250 ( 2.139 -0.481 4.790) 5.268 11.375 ( 0.033 0.687 -3.237) 3.309 11.498 ( 0.700 2.351 -0.521) 2.508 11.711 ( 0.249 5.466 0.526) 5.497 12.136 ( 3.231 -7.888 4.175) 9.492 13.256 ( -0.861 8.068 1.005) 8.176 13.742 ( -1.101 -5.878 0.996) 6.062 13.974 ( 0.215 2.291 -6.102) 6.522 14.208 ( -2.656 -3.655 -4.779) 6.577 ======================= Grid point 221 (113/260) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.781 ( 8.679 22.592 22.527) 33.063 3.855 ( 17.764 22.241 16.577) 32.940 4.691 ( -5.078 5.836 6.515) 10.114 4.782 ( 6.618 7.634 -2.410) 10.387 4.981 ( 8.236 7.015 8.683) 13.872 5.150 ( 3.914 -1.985 3.974) 5.921 5.493 ( 9.164 20.902 8.724) 24.433 5.626 ( 4.010 -2.446 0.393) 4.714 5.745 ( -2.463 -5.810 -0.074) 6.311 6.020 ( 0.755 -3.741 -5.664) 6.829 6.195 ( -4.853 -0.630 -1.262) 5.054 6.431 ( -1.629 -2.278 -1.823) 3.342 7.095 ( -9.602 -10.909 -0.324) 14.536 7.302 ( 4.000 -9.229 2.253) 10.308 7.380 ( -5.705 4.632 2.932) 7.912 8.097 ( -7.161 -1.826 -5.454) 9.185 8.348 ( -3.124 1.020 0.630) 3.346 8.448 ( 0.502 -7.171 2.870) 7.741 8.698 ( 1.210 -2.107 0.363) 2.457 8.855 ( -3.633 -8.602 5.102) 10.641 9.016 ( 4.573 6.870 -2.953) 8.765 9.392 ( 4.568 -4.269 -1.720) 6.485 10.101 ( 3.843 5.616 0.702) 6.841 10.355 ( 2.820 -1.468 -3.176) 4.494 10.743 ( -1.936 3.221 -0.149) 3.761 10.813 ( -0.037 0.112 -0.645) 0.656 10.984 ( -1.314 5.347 0.266) 5.512 11.291 ( -2.757 5.782 -1.706) 6.629 11.341 ( -0.561 -4.304 4.063) 5.945 11.522 ( 3.568 0.200 -2.575) 4.404 11.717 ( 0.224 6.753 0.147) 6.759 12.192 ( 0.159 -8.310 2.437) 8.661 13.250 ( -0.812 7.398 1.708) 7.636 13.738 ( 0.462 -5.978 -0.982) 6.075 13.933 ( -0.391 1.458 -4.005) 4.280 14.135 ( -2.109 -3.085 -3.617) 5.201 ======================= Grid point 222 (114/260) ======================= q-point: ( 0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.087 ( 8.398 17.359 19.317) 27.295 4.239 ( 12.994 19.318 13.970) 27.151 4.563 ( -14.452 10.197 5.844) 18.628 4.840 ( 0.773 9.588 0.440) 9.629 5.144 ( 8.446 3.506 -4.657) 10.262 5.274 ( 7.418 0.985 1.574) 7.646 5.626 ( -2.034 2.862 -0.957) 3.639 5.721 ( 4.184 -4.806 3.978) 7.513 5.779 ( 6.352 -7.029 -3.523) 10.108 6.011 ( 0.741 -4.368 -3.189) 5.459 6.093 ( -3.093 2.444 1.575) 4.245 6.481 ( 7.472 6.505 5.407) 11.287 6.937 ( -6.919 -10.033 1.521) 12.281 7.326 ( -3.255 6.736 4.016) 8.491 7.387 ( 3.920 -9.910 0.705) 10.681 7.868 ( -13.763 8.797 -3.741) 16.757 8.286 ( -3.693 0.404 -1.000) 3.848 8.497 ( 2.089 -7.021 1.696) 7.519 8.721 ( 0.122 -5.018 3.270) 5.991 8.840 ( -2.837 -11.008 6.764) 13.228 9.087 ( 5.267 6.462 -2.405) 8.677 9.459 ( 3.826 -4.876 -1.547) 6.388 10.171 ( 4.394 4.960 -1.877) 6.887 10.368 ( 1.817 -1.293 -4.710) 5.211 10.685 ( -4.769 3.209 0.422) 5.764 10.802 ( -0.536 -0.105 -1.241) 1.356 10.963 ( -0.405 7.025 -1.866) 7.280 11.187 ( -4.460 4.337 -4.417) 7.629 11.366 ( -1.241 -1.490 4.528) 4.925 11.580 ( 4.171 -2.353 -1.975) 5.180 11.730 ( 1.371 7.817 0.662) 7.964 12.176 ( -2.921 -6.255 0.281) 6.910 13.252 ( -0.750 6.609 2.557) 7.126 13.737 ( 1.161 -5.247 -3.284) 6.298 13.917 ( 0.939 -0.969 -1.004) 1.682 14.081 ( -1.638 -3.255 -2.124) 4.218 ======================= Grid point 223 (115/260) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.280 ( -19.692 16.456 5.553) 26.256 4.342 ( 6.060 11.875 14.456) 19.665 4.525 ( 7.103 13.960 10.444) 18.826 4.792 ( -8.113 11.989 4.194) 15.071 5.253 ( 10.604 4.017 -11.420) 16.093 5.361 ( 2.011 -0.909 -5.033) 5.496 5.465 ( -10.556 -4.520 -7.628) 13.786 5.781 ( 4.990 -9.055 -3.017) 10.770 5.847 ( 1.783 -4.942 2.782) 5.945 5.997 ( 0.923 -3.579 0.042) 3.697 6.152 ( 5.133 -1.263 2.072) 5.677 6.664 ( 2.363 -0.757 5.582) 6.109 6.948 ( 5.542 0.483 5.583) 7.881 7.336 ( -0.791 10.821 7.960) 13.456 7.443 ( 1.713 -10.848 0.783) 11.010 7.609 ( -10.829 14.421 0.909) 18.057 8.216 ( -2.625 1.710 -2.015) 3.725 8.514 ( -0.462 -0.546 -1.639) 1.788 8.737 ( -2.515 -6.905 4.308) 8.518 8.859 ( -0.489 -15.753 7.769) 17.572 9.155 ( 3.814 5.737 -1.934) 7.156 9.500 ( 2.120 -4.535 -1.545) 5.239 10.216 ( 2.808 2.848 -5.185) 6.548 10.349 ( 0.112 -1.670 -5.076) 5.345 10.591 ( -5.004 3.949 -0.282) 6.381 10.775 ( -0.856 -0.209 -2.441) 2.596 10.949 ( 0.733 7.636 -2.577) 8.093 11.096 ( -2.011 3.995 -4.268) 6.182 11.365 ( -1.804 -0.820 2.879) 3.495 11.620 ( 1.839 -2.246 -1.942) 3.493 11.777 ( 2.600 6.136 1.286) 6.787 12.107 ( -4.183 -3.127 -0.723) 5.272 13.259 ( -0.702 6.247 2.999) 6.965 13.735 ( 1.899 -3.262 -4.169) 5.624 13.944 ( 1.350 -4.987 0.719) 5.216 14.054 ( 0.261 -3.376 -0.542) 3.429 ======================= Grid point 224 (116/260) ======================= q-point: (-0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.945 ( -21.666 19.459 5.120) 29.568 4.446 ( -19.398 15.810 0.241) 25.026 4.513 ( 0.878 8.104 11.246) 13.890 4.803 ( 5.466 9.182 7.008) 12.779 5.183 ( -6.422 -8.463 -11.763) 15.850 5.241 ( -9.174 -6.742 -7.797) 13.799 5.430 ( 10.546 2.540 -5.735) 12.270 5.844 ( 4.938 -7.769 -5.196) 10.571 5.916 ( 2.513 1.076 6.366) 6.928 6.055 ( 3.591 -1.002 1.767) 4.126 6.261 ( 5.484 -0.302 1.692) 5.747 6.633 ( -8.259 2.667 2.643) 9.073 7.063 ( 2.535 -1.338 6.077) 6.719 7.250 ( -12.081 10.511 6.483) 17.276 7.458 ( -0.912 -11.565 2.437) 11.854 7.728 ( 14.853 11.270 8.127) 20.339 8.173 ( -0.360 3.847 -2.108) 4.402 8.470 ( -1.538 2.764 -3.620) 4.808 8.689 ( -5.848 -8.200 4.518) 11.038 8.912 ( 0.099 -14.066 5.299) 15.031 9.180 ( 0.319 4.886 -1.895) 5.250 9.515 ( 0.796 -4.428 -1.492) 4.740 10.165 ( -2.618 0.485 -8.666) 9.066 10.316 ( -0.461 -3.133 -2.316) 3.923 10.543 ( 0.452 4.988 -0.853) 5.081 10.750 ( 0.682 -0.248 -3.144) 3.226 10.950 ( 1.181 7.412 -2.060) 7.784 11.055 ( 0.624 4.153 -3.805) 5.667 11.346 ( -2.045 -0.403 1.586) 2.619 11.620 ( 0.321 -3.002 -3.523) 4.640 11.817 ( 0.779 4.593 0.390) 4.675 12.037 ( -3.338 0.115 0.820) 3.439 13.269 ( -0.625 6.470 2.821) 7.086 13.752 ( 3.475 -1.202 -4.094) 5.503 13.946 ( -1.573 -6.785 0.863) 7.019 14.103 ( 4.670 -5.385 1.178) 7.224 ======================= Grid point 225 (117/260) ======================= q-point: (-0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.602 ( -21.780 23.131 6.813) 32.493 3.989 ( -27.710 18.827 -3.260) 33.659 4.582 ( -1.590 2.772 8.101) 8.708 4.906 ( -3.321 -2.739 -1.549) 4.575 4.988 ( -2.713 -4.870 -4.293) 7.036 5.053 ( -7.087 -5.062 -2.016) 8.939 5.554 ( 5.281 4.437 -2.238) 7.251 5.892 ( 4.472 -4.500 -4.807) 7.960 6.003 ( 1.764 3.013 6.148) 7.070 6.097 ( -0.234 3.962 -0.988) 4.090 6.367 ( 4.053 1.059 3.183) 5.261 6.459 ( -9.805 10.599 1.436) 14.510 7.108 ( -7.799 6.236 7.944) 12.760 7.191 ( 5.129 -6.368 6.495) 10.442 7.453 ( -2.364 -11.084 4.431) 12.169 7.980 ( 6.924 -1.553 0.863) 7.148 8.172 ( 0.500 7.334 -1.079) 7.430 8.463 ( 4.932 4.444 -1.647) 6.840 8.618 ( -5.450 -7.996 4.657) 10.739 8.922 ( -1.675 -9.938 1.391) 10.174 9.142 ( -2.660 4.842 -2.027) 5.885 9.501 ( -1.121 -4.449 -1.541) 4.840 10.042 ( -3.565 -0.216 -7.799) 8.578 10.302 ( 0.005 -5.775 -0.247) 5.780 10.581 ( 3.882 4.810 -0.620) 6.212 10.757 ( 2.563 -0.019 -3.245) 4.136 10.958 ( 0.757 7.112 -0.665) 7.183 11.059 ( 2.715 4.668 -3.631) 6.507 11.321 ( -1.661 -0.003 1.042) 1.961 11.575 ( -1.025 -4.476 -6.944) 8.325 11.813 ( -1.293 5.196 0.528) 5.380 12.000 ( -2.501 1.430 2.560) 3.854 13.277 ( -0.562 7.054 2.245) 7.424 13.799 ( 5.137 1.081 -4.122) 6.674 13.916 ( -2.484 -7.586 1.317) 8.091 14.211 ( 5.896 -8.044 1.505) 10.086 ======================= Grid point 226 (118/260) ======================= q-point: (-0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.272 ( -22.469 24.972 8.844) 34.738 3.494 ( -24.782 25.318 0.970) 35.441 4.583 ( -4.054 -0.924 6.808) 7.977 4.703 ( -9.508 -18.245 -4.624) 21.087 4.932 ( -5.865 2.744 0.440) 6.490 5.023 ( 0.028 3.739 2.858) 4.706 5.544 ( -6.972 14.051 2.880) 15.948 5.902 ( -1.739 0.461 -1.882) 2.603 6.040 ( -0.236 -2.084 0.370) 2.130 6.085 ( 1.814 8.166 0.665) 8.392 6.379 ( 1.099 4.258 -2.961) 5.301 6.436 ( 0.212 2.273 3.856) 4.481 7.053 ( -3.652 1.016 6.250) 7.310 7.352 ( 5.330 -6.701 8.092) 11.781 7.444 ( -2.122 -8.443 5.502) 10.298 8.029 ( 1.628 -7.899 -3.233) 8.689 8.151 ( 0.129 4.672 -2.638) 5.367 8.562 ( -1.360 -5.655 5.547) 8.037 8.601 ( 5.260 2.791 -1.189) 6.072 8.883 ( -2.417 -6.785 -1.612) 7.381 9.072 ( -3.364 5.345 -1.500) 6.491 9.463 ( -1.865 -4.217 -0.817) 4.683 9.948 ( -1.505 0.157 -4.834) 5.066 10.305 ( 0.262 -7.295 -0.556) 7.321 10.656 ( 4.412 3.724 0.320) 5.783 10.783 ( 2.773 0.178 -3.472) 4.447 10.968 ( 0.103 6.383 1.558) 6.571 11.097 ( 4.398 5.126 -2.973) 7.380 11.308 ( -0.773 0.430 1.618) 1.844 11.495 ( -1.192 -3.872 -8.655) 9.556 11.785 ( -2.359 5.636 0.960) 6.185 11.975 ( -2.600 1.060 2.756) 3.934 13.281 ( -0.585 7.683 1.602) 7.870 13.861 ( 2.658 3.882 -2.547) 5.350 13.888 ( 0.573 -9.170 -0.211) 9.190 14.317 ( 4.845 -9.824 0.479) 10.964 ======================= Grid point 227 (119/260) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( -21.344 27.621 11.716) 36.820 3.198 ( -13.934 32.249 10.915) 36.787 4.525 ( -7.155 -5.613 4.368) 10.088 4.576 ( -4.426 -17.363 5.511) 18.746 4.843 ( -5.290 11.677 2.852) 13.133 5.006 ( -3.657 6.348 1.771) 7.537 5.398 ( -10.671 18.557 4.991) 21.981 5.823 ( -5.509 0.835 -0.152) 5.574 6.049 ( 0.017 -4.527 0.055) 4.527 6.120 ( 2.677 6.267 -3.150) 7.507 6.405 ( 3.571 0.781 -3.254) 4.894 6.439 ( -1.259 0.296 0.516) 1.392 7.065 ( -0.673 -2.921 6.457) 7.119 7.395 ( -5.024 -6.414 8.290) 11.623 7.531 ( 5.687 -5.206 3.304) 8.388 8.026 ( 1.258 -11.956 -2.821) 12.348 8.180 ( 4.347 2.181 -0.618) 4.903 8.583 ( 0.635 -5.522 5.382) 7.737 8.663 ( 2.636 3.018 -2.935) 4.967 8.819 ( -2.623 -4.162 -3.593) 6.093 9.011 ( -2.483 5.810 -0.887) 6.380 9.433 ( -1.423 -3.985 0.727) 4.294 9.917 ( 0.496 0.406 -2.330) 2.417 10.298 ( 0.150 -6.873 -2.315) 7.254 10.730 ( 3.362 2.264 0.374) 4.070 10.796 ( 1.602 0.623 -3.740) 4.116 10.983 ( -0.379 4.941 3.122) 5.857 11.173 ( 5.667 4.490 -1.060) 7.307 11.303 ( -1.971 -0.284 1.413) 2.441 11.434 ( 1.308 -0.637 -5.978) 6.153 11.746 ( -2.564 5.477 0.536) 6.071 11.954 ( -1.756 0.181 2.971) 3.456 13.279 ( -0.674 8.142 1.096) 8.243 13.836 ( -2.943 -5.388 1.974) 6.449 13.946 ( 5.606 0.988 -5.193) 7.705 14.377 ( 2.051 -10.203 -1.650) 10.538 ======================= Grid point 228 (120/260) ======================= q-point: (-0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.781 ( -7.225 32.360 19.214) 38.321 3.129 ( -5.810 33.185 17.683) 38.049 4.463 ( -4.276 -2.517 7.889) 9.320 4.568 ( -2.914 -12.343 9.674) 15.951 4.798 ( -3.233 14.715 5.995) 16.215 4.940 ( -3.571 8.012 0.254) 8.776 5.278 ( -6.314 15.532 4.512) 17.363 5.721 ( -5.395 0.552 -0.439) 5.441 6.023 ( -3.304 -4.570 0.747) 5.688 6.129 ( 1.885 3.705 -5.734) 7.082 6.402 ( -2.494 -1.724 -0.548) 3.081 6.450 ( 4.075 -2.010 -4.444) 6.356 7.105 ( -0.203 -6.181 6.167) 8.734 7.357 ( -5.305 -3.832 7.235) 9.755 7.620 ( 2.218 -4.528 0.652) 5.084 8.051 ( 2.834 -14.962 -0.098) 15.229 8.264 ( 3.841 -0.049 1.607) 4.164 8.634 ( 0.298 1.603 -0.539) 1.717 8.697 ( 4.425 -2.129 0.672) 4.956 8.744 ( -2.268 -3.014 -3.441) 5.106 8.972 ( -0.913 6.698 -1.488) 6.922 9.417 ( -1.644 -4.150 1.380) 4.672 9.921 ( 1.188 1.314 -0.826) 1.954 10.285 ( 0.777 -5.333 -2.921) 6.130 10.771 ( 1.244 1.578 -1.349) 2.420 10.796 ( 1.565 0.720 -2.376) 2.935 11.004 ( -0.038 3.974 3.775) 5.481 11.235 ( -2.610 -3.325 1.867) 4.621 11.290 ( 4.935 5.101 -2.502) 7.526 11.453 ( 2.282 2.022 -0.170) 3.053 11.711 ( -1.391 5.054 0.159) 5.244 11.968 ( 0.771 -1.522 3.823) 4.186 13.273 ( -0.761 8.356 0.795) 8.428 13.798 ( -3.097 -6.180 2.363) 7.306 13.993 ( 4.243 2.368 -6.333) 7.982 14.364 ( -1.096 -8.562 -3.893) 9.469 ======================= Grid point 229 (121/260) ======================= q-point: ( 0.00 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.569 ( 6.484 29.121 19.792) 35.802 3.823 ( 1.025 24.772 13.261) 28.117 4.163 ( 5.775 -22.698 16.869) 28.863 4.343 ( 1.599 -19.443 11.030) 22.411 5.052 ( 2.836 6.599 -0.065) 7.183 5.069 ( 0.472 5.637 -2.423) 6.154 5.657 ( -3.681 2.486 -0.238) 4.449 5.756 ( -2.044 4.527 2.909) 5.756 5.814 ( -5.729 15.720 3.206) 17.036 6.180 ( -5.608 -4.254 -3.889) 8.042 6.222 ( 1.299 0.737 -4.868) 5.092 6.392 ( 3.031 -8.265 -4.578) 9.923 7.078 ( -3.773 2.095 7.334) 8.510 7.198 ( -6.620 -7.812 6.890) 12.343 7.605 ( -2.263 4.198 4.022) 6.239 7.789 ( 0.518 -14.171 5.890) 15.355 8.388 ( 2.992 6.050 -0.531) 6.771 8.549 ( 2.332 -8.624 -3.291) 9.520 8.690 ( -0.897 1.546 -1.772) 2.518 8.720 ( -0.558 -1.072 -0.862) 1.485 9.117 ( 1.200 8.178 -3.223) 8.872 9.271 ( -0.430 -6.914 -2.262) 7.288 10.063 ( 2.783 6.606 3.136) 7.824 10.193 ( 2.420 -6.032 1.454) 6.660 10.801 ( 1.079 1.302 -2.594) 3.097 10.816 ( 1.215 -0.220 -2.025) 2.372 11.092 ( -0.726 3.074 2.522) 4.042 11.150 ( -0.258 -2.870 1.967) 3.489 11.433 ( 2.007 3.857 -1.162) 4.501 11.493 ( 1.141 -1.702 0.565) 2.126 11.817 ( 0.228 6.214 1.660) 6.436 11.936 ( 1.058 -5.598 3.323) 6.596 13.444 ( -0.748 9.278 -0.040) 9.308 13.620 ( -1.363 -8.184 0.421) 8.307 14.071 ( 1.028 4.347 -5.542) 7.118 14.174 ( -0.520 -5.891 -4.903) 7.682 ======================= Grid point 230 (122/260) ======================= q-point: ( 0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.887 ( 12.537 22.576 17.792) 31.359 3.979 ( 5.141 20.232 14.056) 25.166 4.441 ( 10.991 -16.052 16.829) 25.723 4.493 ( 4.946 -14.607 13.785) 20.685 5.068 ( 1.716 8.448 -1.636) 8.774 5.112 ( 3.184 4.104 0.799) 5.255 5.606 ( -1.452 1.461 -0.868) 2.236 5.693 ( -4.022 -6.990 -2.745) 8.519 5.811 ( -0.073 20.321 4.023) 20.716 6.057 ( -3.981 -4.240 -5.623) 8.090 6.218 ( 2.013 5.788 -2.217) 6.516 6.413 ( 1.587 -6.416 -1.956) 6.893 7.065 ( -3.304 -2.218 4.105) 5.717 7.119 ( -5.828 -6.591 4.623) 9.938 7.572 ( -4.646 8.274 5.290) 10.864 7.830 ( -0.692 -16.971 6.228) 18.091 8.413 ( 0.640 4.651 -2.100) 5.143 8.510 ( -2.573 -2.552 -5.899) 6.923 8.669 ( -0.817 0.274 0.152) 0.875 8.720 ( -0.827 -4.714 3.186) 5.749 9.124 ( 2.498 7.486 -3.581) 8.667 9.259 ( 1.624 -5.803 -2.907) 6.691 10.142 ( 3.354 6.152 2.936) 7.597 10.253 ( 2.965 -4.641 1.051) 5.607 10.802 ( 0.803 1.432 -1.883) 2.498 10.819 ( 0.392 -0.271 -1.275) 1.361 11.096 ( -0.323 4.568 1.707) 4.887 11.187 ( 1.982 -4.433 2.788) 5.599 11.436 ( -0.493 4.000 -1.555) 4.320 11.500 ( -0.302 -1.891 -0.208) 1.926 11.842 ( 0.919 7.240 1.753) 7.506 11.987 ( 1.624 -7.292 3.346) 8.185 13.430 ( -0.707 9.089 -0.087) 9.117 13.603 ( -0.732 -7.988 -0.015) 8.021 14.033 ( -0.655 3.673 -5.330) 6.506 14.119 ( -1.486 -4.775 -4.909) 7.008 ======================= Grid point 231 (123/260) ======================= q-point: ( 0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.178 ( 6.468 15.822 14.919) 22.688 4.235 ( 12.613 12.909 11.248) 21.266 4.686 ( 4.356 -4.104 13.815) 15.056 4.757 ( 11.071 -8.771 11.770) 18.385 5.116 ( 4.080 7.848 1.452) 8.964 5.177 ( 3.083 3.139 3.194) 5.437 5.578 ( -2.160 -3.111 -1.765) 4.178 5.613 ( 0.254 -5.006 -5.895) 7.738 5.808 ( -1.281 8.893 -2.243) 9.261 5.966 ( -1.795 -5.556 -5.894) 8.296 6.255 ( -0.187 9.615 2.105) 9.845 6.419 ( 0.659 -3.064 1.008) 3.292 6.981 ( -5.482 2.218 1.484) 6.097 7.125 ( 2.235 -8.971 2.445) 9.563 7.538 ( -3.718 12.252 6.941) 14.564 7.865 ( -0.283 -18.251 6.087) 19.242 8.380 ( -1.960 1.465 -3.114) 3.960 8.398 ( -5.210 0.627 -4.359) 6.822 8.663 ( -1.162 -0.119 2.481) 2.743 8.719 ( -2.608 -5.198 4.476) 7.338 9.159 ( 4.010 7.170 -2.813) 8.684 9.291 ( 3.970 -5.938 -2.558) 7.587 10.215 ( 3.281 5.382 0.625) 6.335 10.305 ( 2.748 -3.528 -0.964) 4.575 10.792 ( -1.101 1.683 -0.967) 2.232 10.812 ( -0.171 -0.374 -1.298) 1.361 11.105 ( 0.233 6.516 0.532) 6.542 11.234 ( 0.483 -6.139 1.582) 6.358 11.404 ( -1.436 5.268 -0.951) 5.542 11.490 ( 0.325 -3.165 -1.403) 3.477 11.868 ( 0.691 8.112 1.561) 8.289 12.030 ( 0.511 -8.076 2.716) 8.536 13.418 ( -0.621 9.036 0.103) 9.058 13.594 ( -0.105 -8.262 -0.521) 8.279 13.979 ( -1.173 3.242 -4.331) 5.535 14.057 ( -1.637 -4.304 -4.188) 6.225 ======================= Grid point 232 (124/260) ======================= q-point: ( 0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.387 ( 5.726 11.819 12.151) 17.892 4.493 ( 7.785 3.344 8.523) 12.018 4.776 ( -3.724 11.223 7.762) 14.145 4.934 ( 1.912 -2.135 4.356) 5.214 5.245 ( 7.722 5.756 2.655) 9.991 5.295 ( 6.583 3.041 3.381) 8.001 5.538 ( 0.710 -7.555 -1.551) 7.746 5.595 ( 0.315 -9.874 -6.893) 12.046 5.734 ( -3.068 6.556 -4.543) 8.545 5.891 ( -2.199 -7.964 -5.337) 9.836 6.215 ( -3.754 9.968 3.502) 11.212 6.448 ( -1.065 -11.187 4.029) 11.938 6.983 ( 4.798 11.746 1.678) 12.799 7.197 ( 3.911 -9.558 0.404) 10.335 7.556 ( -0.358 16.886 9.334) 19.297 7.894 ( -1.653 -10.698 3.926) 11.515 8.290 ( -3.893 -0.443 -1.588) 4.227 8.320 ( -2.544 -4.185 0.305) 4.907 8.655 ( -2.119 -1.063 3.083) 3.889 8.692 ( -3.964 -4.610 4.428) 7.521 9.218 ( 4.372 6.754 -1.998) 8.290 9.349 ( 4.042 -6.156 -2.041) 7.642 10.264 ( 2.827 4.145 -2.299) 5.519 10.331 ( 1.797 -2.546 -3.382) 4.599 10.747 ( -3.113 2.785 -1.126) 4.326 10.789 ( -1.260 -1.381 -1.711) 2.534 11.101 ( -0.375 6.468 -1.484) 6.646 11.204 ( -2.715 -3.191 -2.401) 4.829 11.393 ( -0.229 4.747 1.310) 4.930 11.503 ( 2.171 -5.237 -1.618) 5.895 11.889 ( 0.437 7.981 1.636) 8.159 12.041 ( -1.068 -7.208 1.875) 7.524 13.412 ( -0.351 9.014 0.661) 9.045 13.593 ( 0.513 -8.683 -0.687) 8.725 13.937 ( -0.519 2.545 -3.090) 4.036 14.005 ( -1.083 -4.011 -3.205) 5.247 ======================= Grid point 233 (125/260) ======================= q-point: ( 0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.527 ( -2.387 7.592 6.188) 10.081 4.558 ( -5.200 6.083 7.665) 11.081 4.778 ( 2.488 12.149 5.317) 13.493 4.935 ( -3.983 -0.209 3.607) 5.377 5.297 ( -6.875 0.364 -7.668) 10.305 5.360 ( -5.892 -3.308 -5.917) 8.982 5.420 ( 1.690 6.111 -9.798) 11.670 5.594 ( 6.215 -9.311 -5.562) 12.500 5.778 ( 6.343 -0.127 5.064) 8.118 5.870 ( 3.182 -7.760 3.179) 8.969 6.232 ( 1.462 8.999 6.278) 11.069 6.463 ( -0.502 -13.111 6.597) 14.685 7.088 ( 4.227 8.055 -0.482) 9.109 7.248 ( 1.475 -8.613 0.003) 8.738 7.662 ( 1.363 18.771 11.229) 21.916 7.833 ( -5.426 5.099 1.478) 7.591 8.231 ( -1.475 0.002 -0.985) 1.774 8.352 ( 2.775 -13.571 6.643) 15.363 8.632 ( -3.286 -2.611 3.356) 5.374 8.647 ( -3.453 -4.281 2.840) 6.190 9.271 ( 2.707 6.130 -1.475) 6.861 9.394 ( 2.490 -5.941 -1.804) 6.690 10.272 ( 0.596 2.527 -5.291) 5.894 10.315 ( -0.261 -1.835 -5.039) 5.369 10.676 ( -2.863 4.220 -1.995) 5.476 10.746 ( -1.441 -2.576 -2.587) 3.925 11.081 ( -0.039 5.118 -2.250) 5.591 11.142 ( -1.332 -0.463 -3.454) 3.730 11.396 ( -0.653 4.812 0.799) 4.921 11.524 ( 1.457 -6.637 -2.579) 7.268 11.909 ( 0.305 6.627 1.974) 6.921 12.027 ( -1.784 -4.978 1.707) 5.557 13.417 ( 0.133 9.183 1.288) 9.274 13.605 ( 1.338 -9.001 -0.348) 9.106 13.916 ( 0.271 1.704 -2.253) 2.838 13.978 ( 0.468 -3.922 -2.235) 4.538 ======================= Grid point 234 (126/260) ======================= q-point: (-0.50 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.331 ( -15.269 17.741 2.590) 23.550 4.567 ( -5.303 -3.539 5.567) 8.464 4.773 ( -14.577 14.106 -0.811) 20.301 4.909 ( 1.123 1.242 3.248) 3.655 5.021 ( -7.572 -5.197 -7.674) 11.968 5.078 ( -13.589 -9.191 -8.741) 18.589 5.521 ( 10.311 6.535 -7.060) 14.102 5.676 ( 7.871 -8.565 -6.381) 13.268 5.939 ( 6.120 1.981 5.721) 8.609 6.006 ( 6.538 -4.009 4.337) 8.810 6.331 ( 3.282 7.720 7.900) 11.523 6.521 ( 0.355 -9.931 7.686) 12.563 7.119 ( 0.473 5.203 0.041) 5.224 7.254 ( -1.261 -8.517 1.910) 8.819 7.585 ( -13.211 19.205 6.710) 24.257 7.850 ( -0.040 -3.358 3.221) 4.653 8.264 ( 4.497 6.876 3.267) 8.842 8.427 ( -0.629 -6.869 4.247) 8.101 8.585 ( -2.920 -1.147 1.470) 3.465 8.656 ( 2.211 -9.495 3.342) 10.306 9.285 ( -0.116 5.897 -1.350) 6.051 9.408 ( 0.495 -6.113 -1.750) 6.377 10.199 ( -3.234 2.522 -7.237) 8.318 10.255 ( -2.148 -3.005 -4.862) 6.106 10.642 ( 1.025 4.688 -2.195) 5.277 10.719 ( 0.899 -2.806 -2.851) 4.100 11.073 ( 0.699 4.380 -1.557) 4.701 11.115 ( 0.987 0.680 -3.320) 3.530 11.378 ( -1.375 4.613 -0.630) 4.854 11.509 ( -0.169 -7.190 -4.643) 8.560 11.923 ( -0.486 5.371 1.993) 5.749 12.010 ( -1.796 -2.949 2.343) 4.173 13.434 ( 0.519 9.700 1.467) 9.824 13.634 ( 1.960 -9.638 0.123) 9.836 13.910 ( 0.865 2.626 -2.061) 3.448 13.995 ( 2.872 -5.266 -1.256) 6.128 ======================= Grid point 235 (127/260) ======================= q-point: (-0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.067 ( -16.579 22.686 2.637) 28.222 4.366 ( -21.718 17.945 -4.324) 28.502 4.467 ( -10.190 -15.100 1.352) 18.266 4.687 ( -16.453 -13.167 -6.103) 21.939 4.982 ( 0.130 0.282 -0.080) 0.321 5.007 ( 2.623 -0.314 2.002) 3.315 5.651 ( 8.318 5.566 -3.898) 10.741 5.774 ( 7.444 -6.539 -4.743) 10.985 6.057 ( 3.566 3.263 2.839) 5.606 6.121 ( 4.472 -2.079 -0.201) 4.935 6.437 ( 1.457 6.051 7.605) 9.827 6.547 ( -3.378 -2.745 4.805) 6.484 7.144 ( 1.172 1.885 3.841) 4.437 7.241 ( -3.771 -6.328 7.003) 10.164 7.416 ( -9.725 19.325 6.994) 22.736 7.811 ( -5.296 -16.153 2.576) 17.193 8.318 ( -1.545 6.683 -1.235) 6.970 8.430 ( -1.729 -5.010 3.863) 6.558 8.595 ( 4.482 4.672 0.092) 6.475 8.734 ( 3.212 -8.730 1.487) 9.420 9.252 ( -2.241 6.426 -1.346) 6.937 9.387 ( -1.294 -6.700 -1.695) 7.031 10.086 ( -3.427 4.093 -5.572) 7.717 10.186 ( -1.935 -5.663 -2.855) 6.630 10.672 ( 3.695 4.088 -2.159) 5.918 10.736 ( 3.055 -2.147 -2.890) 4.722 11.080 ( 0.752 4.654 -0.258) 4.722 11.124 ( 2.422 0.807 -2.616) 3.655 11.345 ( -1.125 3.589 -1.591) 4.084 11.459 ( -0.705 -6.653 -6.435) 9.283 11.918 ( -1.721 4.905 1.844) 5.515 11.992 ( -2.351 -2.247 2.587) 4.156 13.453 ( 0.488 10.243 1.115) 10.315 13.668 ( 1.303 -10.788 0.372) 10.873 13.924 ( 2.679 5.290 -2.173) 6.315 14.055 ( 4.424 -7.471 -0.812) 8.720 ======================= Grid point 236 (128/260) ======================= q-point: (-0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.772 ( -18.909 25.036 3.157) 31.533 4.005 ( -15.900 24.642 1.162) 29.349 4.258 ( -13.579 -23.211 0.008) 26.891 4.429 ( -10.357 -16.548 1.803) 19.605 4.988 ( 0.309 4.310 0.204) 4.326 5.056 ( 1.653 -1.287 0.884) 2.274 5.742 ( 3.461 6.454 -0.802) 7.367 5.856 ( 4.277 -5.052 -2.716) 7.154 6.096 ( -1.206 5.837 0.825) 6.017 6.172 ( 3.133 -0.395 -2.855) 4.257 6.463 ( -3.718 3.252 3.070) 5.816 6.486 ( -4.420 1.600 1.959) 5.093 7.160 ( -6.194 6.045 10.023) 13.243 7.252 ( -1.713 -4.717 10.457) 11.598 7.387 ( 1.325 8.918 5.173) 10.395 7.737 ( -4.775 -19.787 3.240) 20.612 8.268 ( -0.840 6.828 -2.901) 7.466 8.412 ( -0.962 -7.464 0.507) 7.542 8.687 ( 4.567 4.294 -1.164) 6.376 8.774 ( 1.362 -4.598 -1.430) 5.004 9.197 ( -2.659 7.267 -1.086) 7.814 9.346 ( -1.816 -7.177 -1.268) 7.511 10.013 ( -1.507 5.673 -2.485) 6.374 10.151 ( -0.747 -7.746 -0.722) 7.816 10.728 ( 4.073 3.120 -2.267) 5.609 10.773 ( 3.339 -1.338 -3.225) 4.831 11.091 ( -0.273 5.489 1.499) 5.696 11.158 ( 2.415 -0.241 -0.410) 2.462 11.324 ( 0.329 2.398 -1.942) 3.103 11.405 ( 0.679 -4.864 -7.009) 8.558 11.890 ( -2.734 4.684 1.592) 5.652 11.962 ( -3.010 -2.290 2.393) 4.475 13.465 ( 0.101 10.393 0.621) 10.412 13.680 ( -0.291 -10.872 0.460) 10.886 13.973 ( 4.542 6.736 -2.712) 8.565 14.129 ( 4.516 -8.849 -1.299) 10.019 ======================= Grid point 237 (129/260) ======================= q-point: (-0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.500 ( -15.007 28.598 9.102) 33.554 3.815 ( -9.267 28.554 6.482) 30.712 4.060 ( -9.920 -26.728 6.116) 29.158 4.312 ( -6.197 -19.863 5.118) 21.428 4.996 ( 0.658 6.472 -0.266) 6.510 5.079 ( 0.749 -0.720 -0.270) 1.073 5.757 ( -1.703 8.940 1.388) 9.206 5.868 ( -1.690 -1.731 -0.984) 2.612 6.030 ( -6.674 10.699 2.306) 12.819 6.203 ( 3.179 -0.752 -3.999) 5.164 6.404 ( -1.709 -0.813 -3.089) 3.622 6.414 ( -4.883 -2.125 0.192) 5.329 7.121 ( -6.340 7.977 11.265) 15.190 7.276 ( -4.553 -6.213 10.748) 13.223 7.488 ( 4.542 2.848 4.502) 7.000 7.705 ( -1.291 -17.275 3.284) 17.632 8.268 ( 2.860 6.583 -1.962) 7.441 8.427 ( 2.713 -8.736 -0.374) 9.155 8.725 ( 1.620 2.786 -2.655) 4.175 8.771 ( 0.308 -1.859 -2.936) 3.489 9.150 ( -1.694 8.058 -0.866) 8.279 9.313 ( -1.163 -7.658 -0.602) 7.770 9.992 ( 0.094 6.396 -0.305) 6.404 10.143 ( 0.064 -8.178 -0.079) 8.178 10.775 ( 3.104 1.926 -2.569) 4.466 10.799 ( 2.352 -0.455 -3.595) 4.320 11.089 ( -1.393 5.496 2.501) 6.197 11.185 ( -0.761 -3.403 2.080) 4.061 11.333 ( 3.048 3.662 -2.899) 5.577 11.402 ( 3.459 -2.718 -3.747) 5.778 11.849 ( -2.843 4.761 1.299) 5.696 11.927 ( -2.642 -2.810 2.371) 4.528 13.465 ( -0.370 10.128 0.273) 10.138 13.667 ( -1.350 -9.853 0.557) 9.961 14.034 ( 4.599 6.361 -3.755) 8.701 14.186 ( 3.210 -8.784 -2.583) 9.702 ======================= Grid point 238 (130/260) ======================= q-point: (-0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.414 ( -4.626 31.073 16.589) 35.526 3.761 ( -3.863 28.368 10.347) 30.442 4.019 ( -2.256 -27.036 13.057) 30.108 4.282 ( -2.382 -20.833 7.833) 22.384 5.013 ( 1.740 7.356 -0.558) 7.579 5.081 ( 0.128 1.879 -1.401) 2.348 5.719 ( -3.470 7.865 1.635) 8.751 5.798 ( -5.217 8.016 1.912) 9.754 5.919 ( -7.393 7.959 2.360) 11.117 6.223 ( 2.451 -1.008 -4.481) 5.206 6.303 ( -6.159 -4.428 -1.150) 7.673 6.384 ( 2.207 -5.412 -6.271) 8.572 7.096 ( -5.093 5.481 9.475) 12.073 7.252 ( -6.100 -7.447 9.246) 13.348 7.580 ( 1.994 1.773 3.764) 4.614 7.734 ( 0.943 -13.844 4.635) 14.630 8.326 ( 4.112 6.196 -0.544) 7.456 8.493 ( 4.679 -9.835 -0.862) 10.925 8.718 ( 0.000 2.336 -2.851) 3.686 8.746 ( -0.470 -0.365 -3.061) 3.119 9.125 ( -0.170 8.518 -1.650) 8.678 9.293 ( -0.668 -7.825 -0.887) 7.904 10.009 ( 1.402 6.626 1.409) 6.918 10.154 ( 1.151 -7.386 0.517) 7.493 10.799 ( 1.624 1.045 -2.670) 3.295 10.808 ( 1.702 0.192 -3.258) 3.681 11.086 ( -0.980 4.128 2.735) 5.048 11.165 ( -2.376 -3.756 1.761) 4.780 11.386 ( 4.045 4.347 -1.536) 6.133 11.452 ( 3.132 -1.950 -0.350) 3.706 11.817 ( -1.571 5.327 1.298) 5.703 11.912 ( -0.922 -3.942 2.788) 4.916 13.457 ( -0.679 9.671 0.080) 9.696 13.644 ( -1.662 -8.848 0.594) 9.022 14.072 ( 3.102 5.349 -4.890) 7.883 14.201 ( 1.227 -7.515 -4.019) 8.610 ======================= Grid point 279 (131/260) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.236 ( 11.196 0.000 35.154) 36.893 2.394 ( -7.765 0.000 37.432) 38.229 3.959 ( -4.575 0.000 58.644) 58.822 4.187 ( -4.907 0.000 -13.254) 14.133 4.331 ( 0.214 0.000 -6.683) 6.686 5.254 ( -5.245 0.000 0.326) 5.255 5.525 ( -5.486 0.000 0.896) 5.559 5.652 ( 7.200 0.000 4.364) 8.419 6.035 ( 0.502 0.000 8.401) 8.416 6.114 ( 1.351 0.000 -7.627) 7.746 6.366 ( -0.594 0.000 -1.301) 1.430 6.533 ( 1.772 0.000 -1.850) 2.562 7.424 ( -9.582 0.000 -1.393) 9.682 7.799 ( -4.754 0.000 -0.117) 4.755 8.097 ( 1.682 0.000 0.243) 1.700 8.249 ( 7.344 0.000 -13.127) 15.042 8.278 ( -7.604 0.000 -5.589) 9.437 8.285 ( 5.264 0.000 -0.125) 5.265 8.495 ( 4.547 0.000 1.349) 4.743 8.725 ( -3.274 0.000 5.152) 6.105 9.262 ( 4.054 0.000 5.628) 6.937 9.445 ( -4.712 0.000 2.278) 5.234 9.910 ( 1.254 0.000 -5.645) 5.783 10.202 ( 2.418 0.000 -5.163) 5.701 10.666 ( 1.734 0.000 -4.084) 4.437 10.697 ( -1.111 0.000 -0.366) 1.169 10.956 ( -1.108 0.000 1.417) 1.799 11.113 ( 3.986 0.000 -1.888) 4.411 11.365 ( -1.454 0.000 5.537) 5.724 11.462 ( -5.677 0.000 9.988) 11.489 11.664 ( -2.288 0.000 -2.997) 3.770 12.222 ( 23.393 0.000 -10.365) 25.586 13.184 ( 0.888 0.000 6.135) 6.199 13.718 ( 2.112 0.000 -6.165) 6.516 14.129 ( -1.848 0.000 1.401) 2.319 14.242 ( -15.456 0.000 -1.639) 15.543 ======================= Grid point 280 (132/260) ======================= q-point: ( 0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.646 ( 5.863 0.000 35.040) 35.527 2.845 ( 27.259 0.000 31.159) 41.399 4.113 ( 8.343 0.000 -15.296) 17.423 4.296 ( 6.206 0.000 0.643) 6.239 4.417 ( 5.407 0.000 45.151) 45.474 5.137 ( -8.351 0.000 0.829) 8.392 5.389 ( -12.144 0.000 3.687) 12.691 5.775 ( 3.127 0.000 4.193) 5.231 6.064 ( 1.059 0.000 -10.254) 10.308 6.111 ( 1.340 0.000 5.623) 5.780 6.324 ( -2.351 0.000 -2.107) 3.157 6.532 ( -0.259 0.000 -2.308) 2.323 7.280 ( -6.120 0.000 0.547) 6.144 7.666 ( -9.564 0.000 0.689) 9.589 8.014 ( -11.987 0.000 -6.505) 13.638 8.167 ( 0.829 0.000 0.228) 0.860 8.255 ( 5.745 0.000 -16.336) 17.316 8.393 ( 5.582 0.000 1.543) 5.792 8.542 ( -0.777 0.000 0.862) 1.160 8.752 ( 2.453 0.000 5.664) 6.172 9.384 ( -2.162 0.000 0.640) 2.255 9.408 ( 6.586 0.000 5.650) 8.678 9.893 ( 0.428 0.000 -2.767) 2.800 10.224 ( 4.005 0.000 -5.397) 6.721 10.671 ( -2.043 0.000 1.096) 2.319 10.673 ( 2.055 0.000 -3.331) 3.914 10.936 ( -0.584 0.000 -2.307) 2.380 11.186 ( 4.892 0.000 -0.679) 4.939 11.354 ( -12.335 0.000 6.003) 13.718 11.411 ( 1.137 0.000 6.518) 6.616 11.613 ( -1.201 0.000 -3.024) 3.253 12.409 ( 7.656 0.000 -13.327) 15.369 13.271 ( 3.358 0.000 4.186) 5.366 13.700 ( 1.494 0.000 -7.233) 7.386 14.035 ( -7.957 0.000 4.491) 9.137 14.125 ( -0.560 0.000 3.430) 3.476 ======================= Grid point 281 (133/260) ======================= q-point: ( 0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.074 ( 14.736 0.000 30.441) 33.820 3.547 ( 24.978 0.000 29.300) 38.502 4.242 ( 16.685 0.000 -13.724) 21.604 4.386 ( 8.455 0.000 -5.847) 10.279 4.953 ( 16.772 0.000 40.113) 43.478 4.977 ( -9.668 0.000 0.313) 9.673 5.153 ( -16.789 0.000 4.241) 17.317 5.825 ( -0.399 0.000 3.095) 3.120 6.024 ( 3.055 0.000 -10.407) 10.846 6.124 ( -1.784 0.000 -1.497) 2.330 6.269 ( -2.469 0.000 -0.868) 2.617 6.496 ( -1.237 0.000 -3.242) 3.470 7.205 ( -3.335 0.000 1.033) 3.491 7.509 ( -8.143 0.000 1.396) 8.262 7.685 ( -18.519 0.000 -6.977) 19.790 8.211 ( 1.438 0.000 3.695) 3.965 8.236 ( 4.694 0.000 -13.533) 14.325 8.475 ( -6.217 0.000 -0.497) 6.237 8.481 ( 2.690 0.000 1.314) 2.994 8.884 ( 7.244 0.000 5.049) 8.830 9.397 ( 2.750 0.000 0.921) 2.900 9.534 ( 2.799 0.000 3.691) 4.632 9.900 ( 2.639 0.000 -1.303) 2.943 10.253 ( 3.870 0.000 -6.374) 7.457 10.647 ( -1.765 0.000 2.005) 2.672 10.688 ( 1.939 0.000 -2.658) 3.290 10.906 ( 0.249 0.000 -5.191) 5.197 11.112 ( -15.739 0.000 2.695) 15.968 11.284 ( 4.127 0.000 -0.829) 4.210 11.484 ( 1.472 0.000 6.860) 7.016 11.582 ( 0.123 0.000 -1.701) 1.705 12.351 ( -2.359 0.000 -12.118) 12.345 13.321 ( -1.065 0.000 3.906) 4.049 13.671 ( 1.337 0.000 -7.340) 7.461 14.026 ( 2.138 0.000 4.720) 5.182 14.154 ( 0.153 0.000 5.252) 5.255 ======================= Grid point 282 (134/260) ======================= q-point: ( 0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.576 ( 18.313 0.000 25.478) 31.376 4.088 ( 13.018 0.000 24.924) 28.119 4.409 ( 4.379 0.000 -2.701) 5.145 4.457 ( -6.010 0.000 7.240) 9.410 4.850 ( 1.597 0.000 -8.392) 8.542 4.933 ( -2.287 0.000 -3.028) 3.795 5.534 ( 20.691 0.000 19.223) 28.243 5.798 ( -4.004 0.000 -0.140) 4.006 6.020 ( 3.762 0.000 -8.070) 8.904 6.063 ( -2.408 0.000 -2.324) 3.347 6.216 ( -2.069 0.000 -1.807) 2.747 6.463 ( 0.931 0.000 -2.020) 2.224 7.170 ( -1.994 0.000 2.213) 2.979 7.290 ( -21.019 0.000 -1.584) 21.078 7.415 ( -3.259 0.000 0.497) 3.297 8.225 ( -6.209 0.000 6.975) 9.338 8.232 ( 3.930 0.000 -8.950) 9.775 8.375 ( -0.776 0.000 -3.932) 4.008 8.493 ( -2.096 0.000 -0.070) 2.097 9.052 ( 7.145 0.000 4.301) 8.340 9.468 ( 3.464 0.000 1.666) 3.844 9.555 ( -1.704 0.000 1.498) 2.268 9.964 ( 5.110 0.000 -2.242) 5.580 10.266 ( 3.296 0.000 -7.697) 8.373 10.639 ( -0.848 0.000 2.233) 2.388 10.693 ( -0.062 0.000 -2.224) 2.225 10.855 ( -13.307 0.000 2.380) 13.518 10.870 ( 0.557 0.000 -6.607) 6.630 11.316 ( 0.927 0.000 -4.010) 4.116 11.556 ( 0.723 0.000 7.087) 7.124 11.614 ( 3.490 0.000 1.930) 3.988 12.186 ( -6.052 0.000 -11.299) 12.818 13.310 ( -3.094 0.000 4.706) 5.632 13.644 ( 1.394 0.000 -6.705) 6.848 14.136 ( 6.137 0.000 3.626) 7.128 14.200 ( 0.160 0.000 6.275) 6.277 ======================= Grid point 283 (135/260) ======================= q-point: (-0.60 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.042 ( 12.256 0.000 17.097) 21.036 4.184 ( -27.050 0.000 13.568) 30.262 4.303 ( -14.403 0.000 14.913) 20.733 4.396 ( 4.915 0.000 14.491) 15.302 4.934 ( 15.419 0.000 -19.898) 25.173 5.095 ( 16.053 0.000 1.249) 16.102 5.693 ( -6.116 0.000 -2.514) 6.612 5.787 ( -1.296 0.000 -3.220) 3.471 6.014 ( 0.892 0.000 -7.504) 7.557 6.025 ( -0.562 0.000 -0.246) 0.614 6.201 ( 1.875 0.000 -0.653) 1.986 6.495 ( -2.944 0.000 -0.181) 2.950 7.060 ( 0.241 0.000 6.051) 6.056 7.204 ( 3.647 0.000 8.716) 9.448 7.392 ( 1.153 0.000 -2.140) 2.431 8.115 ( -8.932 0.000 5.289) 10.381 8.227 ( -0.410 0.000 -3.645) 3.668 8.377 ( 1.372 0.000 -2.147) 2.548 8.412 ( -4.517 0.000 -3.729) 5.858 9.163 ( 1.758 0.000 1.703) 2.448 9.528 ( 1.461 0.000 2.256) 2.688 9.530 ( -1.844 0.000 2.178) 2.854 10.019 ( 4.526 0.000 -6.891) 8.245 10.260 ( 3.151 0.000 -9.760) 10.256 10.629 ( -5.315 0.000 3.987) 6.644 10.646 ( -0.267 0.000 2.276) 2.291 10.749 ( -1.405 0.000 0.168) 1.415 10.834 ( 0.523 0.000 -5.736) 5.760 11.273 ( -1.194 0.000 -5.690) 5.814 11.606 ( -0.766 0.000 6.466) 6.511 11.710 ( 4.286 0.000 3.649) 5.629 11.990 ( -6.741 0.000 -10.713) 12.658 13.289 ( -3.173 0.000 4.861) 5.805 13.626 ( 1.611 0.000 -5.768) 5.989 14.245 ( -0.335 0.000 6.254) 6.263 14.282 ( 7.420 0.000 3.265) 8.107 ======================= Grid point 284 (136/260) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.749 ( -31.796 0.000 13.897) 34.701 3.893 ( -26.579 0.000 12.730) 29.470 4.532 ( 11.449 0.000 20.122) 23.151 4.543 ( 1.682 0.000 9.978) 10.119 5.028 ( 11.800 0.000 -20.309) 23.489 5.367 ( 1.994 0.000 0.174) 2.002 5.519 ( -15.843 0.000 5.304) 16.707 5.568 ( -5.392 0.000 -2.981) 6.161 5.965 ( 0.847 0.000 -9.769) 9.806 6.037 ( 1.169 0.000 1.027) 1.556 6.262 ( 3.343 0.000 2.050) 3.921 6.335 ( -7.938 0.000 -3.839) 8.817 7.172 ( 5.962 0.000 0.474) 5.981 7.421 ( 4.866 0.000 -4.497) 6.626 7.576 ( 23.403 0.000 14.839) 27.711 8.026 ( -4.688 0.000 5.577) 7.285 8.126 ( -9.274 0.000 1.173) 9.348 8.335 ( 1.201 0.000 -8.685) 8.768 8.362 ( -1.816 0.000 -1.423) 2.307 9.125 ( -5.681 0.000 -0.765) 5.733 9.524 ( -1.780 0.000 3.489) 3.916 9.551 ( -0.902 0.000 2.852) 2.991 10.039 ( 5.523 0.000 -11.312) 12.589 10.236 ( 3.030 0.000 -11.953) 12.331 10.640 ( 0.833 0.000 10.049) 10.083 10.659 ( -0.311 0.000 2.594) 2.613 10.735 ( -0.282 0.000 -1.096) 1.132 10.812 ( 0.709 0.000 -2.950) 3.034 11.206 ( -1.439 0.000 -5.809) 5.984 11.608 ( -3.015 0.000 1.776) 3.499 11.799 ( 2.613 0.000 3.360) 4.257 11.809 ( -5.865 0.000 -6.829) 9.002 13.267 ( -3.203 0.000 4.774) 5.748 13.620 ( 2.096 0.000 -4.847) 5.280 14.275 ( -1.083 0.000 5.254) 5.364 14.444 ( 8.360 0.000 2.643) 8.768 ======================= Grid point 285 (137/260) ======================= q-point: (-0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( -33.387 0.000 15.990) 37.019 3.474 ( -32.325 0.000 17.841) 36.922 4.591 ( -6.865 0.000 11.534) 13.423 4.805 ( 4.785 0.000 13.468) 14.293 4.869 ( -36.715 0.000 8.209) 37.622 5.092 ( 10.243 0.000 -14.256) 17.554 5.468 ( -3.426 0.000 -2.810) 4.431 5.679 ( 6.859 0.000 4.816) 8.381 5.917 ( 3.805 0.000 -10.866) 11.513 6.063 ( 0.246 0.000 1.373) 1.395 6.225 ( -0.097 0.000 -5.553) 5.554 6.305 ( -1.369 0.000 3.582) 3.835 7.305 ( 8.360 0.000 1.846) 8.561 7.500 ( 7.952 0.000 -5.463) 9.648 7.926 ( 1.712 0.000 7.228) 7.428 7.991 ( -5.339 0.000 1.469) 5.538 8.169 ( 17.859 0.000 6.974) 19.173 8.297 ( -3.437 0.000 -0.876) 3.547 8.301 ( 1.534 0.000 -8.653) 8.788 8.991 ( -8.109 0.000 -0.037) 8.110 9.499 ( -4.102 0.000 3.516) 5.402 9.541 ( -2.659 0.000 3.472) 4.373 10.044 ( 5.348 0.000 -14.567) 15.517 10.199 ( 2.714 0.000 -11.667) 11.979 10.673 ( -0.244 0.000 2.687) 2.698 10.719 ( -0.176 0.000 -2.070) 2.077 10.788 ( 5.636 0.000 13.626) 14.745 10.821 ( 1.515 0.000 0.243) 1.534 11.144 ( -0.953 0.000 -5.263) 5.349 11.513 ( -4.298 0.000 -8.054) 9.129 11.699 ( -5.389 0.000 2.304) 5.860 11.845 ( 0.250 0.000 2.218) 2.232 13.242 ( -3.513 0.000 4.750) 5.908 13.630 ( 2.769 0.000 -4.166) 5.002 14.281 ( -1.888 0.000 3.645) 4.105 14.609 ( 8.552 0.000 0.541) 8.569 ======================= Grid point 286 (138/260) ======================= q-point: (-0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.801 ( -35.094 0.000 19.532) 40.164 3.030 ( -34.017 0.000 23.447) 41.315 4.196 ( -43.496 0.000 31.718) 53.832 4.621 ( -4.523 0.000 0.928) 4.618 4.891 ( -3.649 0.000 7.183) 8.057 5.178 ( 8.148 0.000 -7.858) 11.320 5.405 ( -1.732 0.000 -2.396) 2.957 5.701 ( -1.817 0.000 -3.676) 4.100 5.973 ( 6.470 0.000 -5.011) 8.184 6.045 ( -4.280 0.000 3.302) 5.406 6.269 ( 8.564 0.000 -4.294) 9.580 6.293 ( -0.920 0.000 2.294) 2.472 7.488 ( 10.614 0.000 0.824) 10.646 7.616 ( 8.979 0.000 -4.708) 10.139 7.983 ( 2.879 0.000 1.836) 3.415 7.989 ( 0.266 0.000 10.501) 10.504 8.183 ( -4.806 0.000 -2.714) 5.519 8.261 ( 0.527 0.000 -7.437) 7.456 8.510 ( 11.579 0.000 0.641) 11.597 8.862 ( -6.614 0.000 1.550) 6.793 9.426 ( -7.090 0.000 3.855) 8.071 9.515 ( -3.082 0.000 4.112) 5.139 10.016 ( 4.107 0.000 -16.020) 16.539 10.181 ( 3.620 0.000 -7.634) 8.449 10.691 ( 0.443 0.000 1.714) 1.770 10.700 ( 0.203 0.000 -3.128) 3.134 10.867 ( 2.175 0.000 2.861) 3.594 11.012 ( 7.529 0.000 13.860) 15.773 11.100 ( -0.163 0.000 -3.657) 3.661 11.393 ( -0.781 0.000 -8.817) 8.851 11.619 ( -6.771 0.000 4.240) 7.989 11.841 ( -1.777 0.000 0.806) 1.951 13.212 ( -3.834 0.000 4.896) 6.219 13.656 ( 3.304 0.000 -3.876) 5.093 14.261 ( -2.619 0.000 1.919) 3.247 14.734 ( 6.123 0.000 -3.952) 7.288 ======================= Grid point 287 (139/260) ======================= q-point: (-0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.331 ( -34.834 0.000 25.549) 43.199 2.637 ( -31.062 0.000 29.764) 43.021 3.789 ( -32.740 0.000 46.926) 57.219 4.527 ( -5.631 0.000 -1.834) 5.922 4.754 ( -14.115 0.000 -0.572) 14.127 5.288 ( 8.351 0.000 -1.579) 8.499 5.368 ( -0.460 0.000 -1.890) 1.945 5.639 ( -1.256 0.000 -4.563) 4.733 5.994 ( -4.213 0.000 5.768) 7.143 6.045 ( 5.307 0.000 -3.212) 6.203 6.320 ( 2.061 0.000 1.108) 2.340 6.406 ( 8.552 0.000 -3.662) 9.303 7.646 ( 6.534 0.000 -4.272) 7.807 7.737 ( 7.418 0.000 -2.889) 7.960 8.044 ( -5.401 0.000 9.212) 10.678 8.089 ( 7.017 0.000 0.323) 7.024 8.163 ( 8.135 0.000 -0.123) 8.136 8.219 ( 0.517 0.000 -5.856) 5.879 8.577 ( -2.398 0.000 -2.245) 3.285 8.786 ( -3.848 0.000 2.885) 4.809 9.313 ( -8.395 0.000 4.097) 9.341 9.498 ( -2.488 0.000 4.831) 5.434 9.969 ( 3.314 0.000 -14.376) 14.753 10.209 ( 3.644 0.000 -4.813) 6.036 10.682 ( 0.787 0.000 -4.045) 4.121 10.710 ( 0.828 0.000 -0.150) 0.841 10.920 ( 0.567 0.000 3.766) 3.809 11.072 ( 1.088 0.000 -4.161) 4.301 11.245 ( 5.841 0.000 14.504) 15.636 11.416 ( 7.558 0.000 -3.016) 8.138 11.535 ( -2.915 0.000 3.385) 4.467 11.799 ( -2.980 0.000 -0.551) 3.031 13.180 ( -3.773 0.000 5.256) 6.470 13.688 ( 3.391 0.000 -4.067) 5.295 14.218 ( -3.076 0.000 0.594) 3.133 14.735 ( -1.408 0.000 -9.314) 9.420 ======================= Grid point 288 (140/260) ======================= q-point: (-0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( -18.440 0.000 33.883) 38.576 2.395 ( -21.912 0.000 35.377) 41.613 3.726 ( -17.472 0.000 57.180) 59.790 4.412 ( -3.979 0.000 -5.178) 6.530 4.449 ( -14.532 0.000 -8.279) 16.725 5.320 ( -2.446 0.000 -0.175) 2.452 5.473 ( 9.441 0.000 2.626) 9.800 5.590 ( -1.833 0.000 -2.277) 2.923 5.989 ( -1.832 0.000 7.461) 7.683 6.107 ( 4.272 0.000 -4.362) 6.106 6.360 ( 1.543 0.000 0.131) 1.549 6.497 ( 4.440 0.000 -2.758) 5.227 7.605 ( -6.724 0.000 -4.382) 8.026 7.819 ( 2.862 0.000 -1.180) 3.096 8.049 ( 2.685 0.000 0.077) 2.686 8.202 ( 7.802 0.000 -7.321) 10.699 8.210 ( 2.091 0.000 -1.355) 2.492 8.342 ( 8.723 0.000 -0.339) 8.730 8.461 ( -7.926 0.000 1.444) 8.056 8.755 ( -3.119 0.000 4.066) 5.125 9.222 ( -4.077 0.000 4.509) 6.079 9.488 ( -2.971 0.000 4.678) 5.542 9.932 ( 2.515 0.000 -10.126) 10.434 10.213 ( 1.194 0.000 -5.404) 5.534 10.670 ( 1.311 0.000 -4.405) 4.596 10.712 ( 0.107 0.000 -1.307) 1.312 10.948 ( -0.365 0.000 4.065) 4.082 11.075 ( 2.361 0.000 -3.126) 3.917 11.395 ( -5.386 0.000 3.750) 6.563 11.413 ( 1.482 0.000 12.644) 12.731 11.733 ( -3.281 0.000 -1.818) 3.750 11.800 ( 25.919 0.000 -2.727) 26.062 13.160 ( -2.714 0.000 5.866) 6.463 13.712 ( 2.930 0.000 -4.849) 5.666 14.167 ( -2.890 0.000 0.272) 2.902 14.543 ( -11.971 0.000 -9.140) 15.062 ======================= Grid point 289 (141/260) ======================= q-point: ( 0.00 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 11.959 15.105 32.403) 37.698 2.675 ( -5.191 23.662 32.602) 40.617 4.107 ( -5.205 14.594 51.206) 53.498 4.247 ( -4.350 6.109 -10.866) 13.202 4.398 ( -0.444 6.590 -4.794) 8.161 5.256 ( -4.079 0.003 0.857) 4.168 5.436 ( -2.498 -5.940 3.252) 7.218 5.749 ( 4.885 6.107 2.507) 8.213 5.918 ( -0.727 -8.635 5.996) 10.537 6.128 ( 0.116 -0.756 -5.487) 5.540 6.360 ( -1.243 -0.605 -1.814) 2.281 6.515 ( 2.577 -1.854 -2.573) 4.087 7.417 ( -7.990 -0.239 0.591) 8.016 7.751 ( -2.856 -5.573 0.352) 6.272 7.811 ( 0.400 -16.026 0.446) 16.037 8.288 ( -4.156 0.589 -8.327) 9.325 8.309 ( 4.107 2.714 -5.845) 7.642 8.447 ( 7.281 4.750 -4.623) 9.846 8.543 ( 1.745 7.727 1.676) 8.097 8.712 ( -3.967 -1.199 4.684) 6.254 9.215 ( 3.841 -4.690 5.732) 8.343 9.445 ( -4.841 -0.163 0.857) 4.919 9.910 ( 1.232 0.163 -3.222) 3.453 10.202 ( 2.898 0.258 -5.557) 6.272 10.651 ( 0.846 -0.045 -3.004) 3.121 10.749 ( -0.185 3.375 -1.086) 3.550 10.983 ( -1.497 2.558 2.433) 3.834 11.155 ( 4.475 3.258 -2.666) 6.144 11.302 ( -3.248 -2.699 5.032) 6.569 11.531 ( -3.631 2.351 8.310) 9.368 11.622 ( 0.003 -2.061 -2.345) 3.122 12.197 ( 18.501 -2.109 -7.188) 19.960 13.176 ( -0.490 -0.247 6.152) 6.176 13.748 ( 2.619 2.537 -7.227) 8.094 14.053 ( -4.551 -5.499 2.764) 7.654 14.282 ( -9.776 1.729 -3.706) 10.597 ======================= Grid point 290 (142/260) ======================= q-point: ( 0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.898 ( 7.858 22.451 30.388) 38.591 2.972 ( 23.940 12.597 28.859) 39.556 4.164 ( 7.359 5.335 -14.761) 17.334 4.368 ( 5.651 6.834 -2.649) 9.255 4.529 ( 5.059 11.350 46.103) 47.749 5.161 ( -7.466 2.524 1.087) 7.956 5.350 ( -9.646 -3.515 3.763) 10.935 5.812 ( -0.565 2.588 3.967) 4.770 5.996 ( 5.368 -5.828 -0.369) 7.932 6.081 ( -0.954 -3.363 -2.261) 4.163 6.302 ( -3.075 -1.847 -3.211) 4.814 6.518 ( 0.020 -1.494 -3.102) 3.443 7.306 ( -5.214 2.401 1.158) 5.855 7.618 ( -9.757 -4.411 -0.076) 10.708 7.846 ( 1.727 -16.985 -0.525) 17.081 8.075 ( -11.656 2.730 -7.796) 14.286 8.373 ( 7.635 1.912 -7.238) 10.693 8.505 ( 1.945 6.441 -3.520) 7.594 8.569 ( -0.752 4.776 1.511) 5.065 8.736 ( 3.197 -1.295 4.797) 5.908 9.313 ( 0.025 -5.826 3.733) 6.919 9.412 ( 3.642 -0.776 1.825) 4.147 9.910 ( 0.625 1.723 -1.383) 2.296 10.227 ( 4.025 0.368 -5.538) 6.856 10.646 ( 0.116 0.150 -1.169) 1.184 10.737 ( -0.180 3.592 -0.737) 3.672 10.959 ( -1.553 2.065 -0.968) 2.759 11.228 ( 5.009 1.932 -1.604) 5.604 11.268 ( -6.009 -1.733 4.262) 7.568 11.499 ( -3.646 2.719 5.652) 7.255 11.599 ( -0.940 0.199 -1.574) 1.845 12.369 ( 7.569 -3.750 -10.853) 13.753 13.233 ( 1.404 -2.464 5.925) 6.569 13.726 ( 1.489 1.885 -8.617) 8.946 13.994 ( -4.317 -3.037 5.154) 7.378 14.163 ( -2.644 2.234 0.659) 3.524 ======================= Grid point 291 (143/260) ======================= q-point: ( 0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.282 ( 13.231 18.939 26.353) 35.046 3.631 ( 23.620 8.339 27.670) 37.324 4.270 ( 15.455 3.494 -14.131) 21.231 4.452 ( 6.565 6.088 -3.461) 9.599 4.979 ( -0.231 3.057 12.735) 13.099 5.062 ( 5.249 7.396 20.093) 22.045 5.171 ( -11.516 2.342 7.676) 14.036 5.818 ( -1.269 -1.106 3.276) 3.683 6.006 ( 1.587 -2.173 -8.976) 9.371 6.098 ( -0.069 -2.134 0.176) 2.143 6.226 ( -2.276 -3.898 -1.672) 4.814 6.474 ( -1.571 -2.104 -4.115) 4.881 7.241 ( -3.418 3.245 1.206) 4.865 7.451 ( -8.427 -4.878 0.751) 9.766 7.754 ( -15.923 5.280 -4.904) 17.478 7.882 ( 0.745 -16.481 -2.199) 16.643 8.451 ( -0.370 -1.476 -0.098) 1.524 8.489 ( 3.228 4.121 -6.421) 8.284 8.537 ( -1.858 10.138 0.513) 10.319 8.863 ( 6.713 -1.929 3.859) 7.980 9.336 ( 1.829 -5.729 2.389) 6.471 9.522 ( 4.034 -1.651 2.714) 5.134 9.922 ( 2.272 2.188 -1.279) 3.403 10.254 ( 3.816 0.129 -6.534) 7.568 10.637 ( -0.902 0.470 0.848) 1.324 10.736 ( 0.674 3.325 -1.053) 3.552 10.917 ( -1.554 0.760 -3.404) 3.819 11.103 ( -12.716 -0.395 1.126) 12.772 11.315 ( 4.616 3.421 -1.953) 6.068 11.519 ( 0.672 1.515 6.188) 6.406 11.577 ( -0.179 0.716 -0.643) 0.979 12.332 ( -1.674 -1.879 -10.875) 11.162 13.283 ( -0.794 -2.811 5.477) 6.208 13.686 ( 1.027 0.988 -8.069) 8.194 14.007 ( 1.703 -1.888 4.492) 5.161 14.161 ( -0.114 0.239 3.473) 3.483 ======================= Grid point 292 (144/260) ======================= q-point: ( 0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.726 ( 16.377 13.726 21.993) 30.665 4.140 ( 11.860 5.251 23.464) 26.810 4.432 ( -1.375 2.620 -0.112) 2.961 4.477 ( -0.105 2.446 3.223) 4.047 4.911 ( 0.312 5.561 -6.713) 8.723 4.971 ( -0.413 3.494 -3.856) 5.220 5.555 ( 14.583 1.626 12.012) 18.963 5.826 ( -0.125 3.115 6.279) 7.010 5.968 ( 1.512 -5.020 -7.833) 9.426 6.047 ( -2.296 -1.478 -2.722) 3.855 6.202 ( -0.174 -1.379 -1.292) 1.898 6.443 ( 2.076 -1.576 -1.168) 2.856 7.193 ( -3.771 2.033 2.691) 5.060 7.327 ( -8.929 0.960 0.001) 8.980 7.440 ( -12.546 4.841 0.959) 13.482 7.897 ( 1.497 -16.684 -0.876) 16.774 8.336 ( -7.753 -0.504 -1.172) 7.857 8.478 ( -4.773 1.914 3.016) 5.962 8.584 ( 7.212 12.465 -7.479) 16.227 9.009 ( 6.175 -4.094 3.787) 8.321 9.397 ( 1.949 -6.080 2.878) 7.003 9.571 ( 0.431 0.038 1.196) 1.272 9.975 ( 4.825 1.296 -2.787) 5.721 10.264 ( 3.167 -0.257 -8.076) 8.679 10.629 ( -1.201 0.110 1.855) 2.212 10.734 ( -0.920 3.134 -1.236) 3.492 10.825 ( -7.818 -1.624 -0.242) 7.988 10.919 ( -3.978 3.518 -3.979) 6.636 11.340 ( 0.789 2.195 -4.451) 5.025 11.584 ( -0.091 2.620 6.457) 6.969 11.610 ( 4.363 -0.232 2.245) 4.912 12.186 ( -5.526 -0.127 -10.378) 11.759 13.290 ( -2.533 -1.583 5.398) 6.170 13.651 ( 1.290 0.494 -7.107) 7.240 14.102 ( 5.297 -3.113 3.688) 7.166 14.192 ( 0.018 -1.166 4.842) 4.981 ======================= Grid point 293 (145/260) ======================= q-point: (-0.60 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.087 ( -7.409 2.617 11.744) 14.130 4.204 ( -7.302 6.181 18.725) 21.028 4.414 ( -11.276 6.719 12.907) 18.409 4.437 ( 2.966 5.625 9.689) 11.589 4.941 ( 13.012 0.967 -16.183) 20.788 5.123 ( 14.551 2.531 -2.548) 14.988 5.593 ( -6.693 -6.523 -3.676) 10.043 5.881 ( -0.649 5.270 -3.418) 6.315 5.958 ( 2.332 -4.354 -5.603) 7.469 6.023 ( -0.299 -0.807 0.253) 0.897 6.209 ( 2.005 0.673 -0.276) 2.133 6.518 ( -1.386 2.742 1.602) 3.465 7.146 ( -1.743 7.980 5.711) 9.966 7.213 ( 1.537 1.294 8.220) 8.463 7.395 ( 2.124 -0.194 1.494) 2.604 7.913 ( -0.083 -14.016 1.172) 14.065 8.205 ( -5.096 -1.926 -2.225) 5.884 8.373 ( -9.264 2.343 2.218) 9.809 8.631 ( 3.876 12.986 -7.025) 15.264 9.109 ( 1.862 -4.954 2.031) 5.669 9.425 ( -1.077 -6.327 2.813) 7.008 9.586 ( 0.488 1.105 1.680) 2.069 10.025 ( 4.325 0.695 -7.062) 8.310 10.251 ( 2.938 -0.729 -10.014) 10.461 10.608 ( -3.693 -1.286 3.948) 5.557 10.665 ( -3.174 1.675 2.558) 4.407 10.765 ( -0.140 1.193 -1.245) 1.730 10.863 ( -0.160 2.887 -4.205) 5.103 11.298 ( -0.940 2.208 -5.648) 6.137 11.620 ( -0.622 1.050 4.769) 4.923 11.713 ( 3.824 0.530 3.611) 5.286 12.008 ( -5.976 1.673 -9.114) 11.026 13.279 ( -2.892 -0.716 5.136) 5.938 13.629 ( 1.693 0.339 -6.081) 6.322 14.222 ( 0.092 -2.362 5.210) 5.721 14.240 ( 6.311 -4.131 3.237) 8.209 ======================= Grid point 294 (146/260) ======================= q-point: (-0.50 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.735 ( -29.661 0.968 15.273) 33.376 3.996 ( -27.460 8.338 8.628) 29.967 4.548 ( 3.139 2.416 14.030) 14.578 4.617 ( 9.115 6.045 12.114) 16.321 5.017 ( 10.040 -1.068 -19.435) 21.901 5.359 ( -1.300 -1.141 -1.341) 2.189 5.402 ( -1.374 -5.260 0.223) 5.441 5.754 ( -9.789 11.050 1.362) 14.826 5.943 ( 0.796 -1.907 -7.513) 7.792 6.034 ( 1.591 -0.461 0.255) 1.676 6.272 ( 2.993 1.354 2.991) 4.443 6.357 ( -9.769 2.590 -2.512) 10.414 7.161 ( 0.946 -0.326 1.548) 1.843 7.430 ( 7.541 -0.021 -0.639) 7.568 7.623 ( 20.431 4.205 14.002) 25.123 7.912 ( -1.052 -9.150 2.662) 9.587 8.127 ( -2.411 -6.105 -2.039) 6.873 8.204 ( -9.495 4.296 0.619) 10.440 8.620 ( 0.618 12.643 -6.851) 14.394 9.087 ( -4.550 -3.482 -0.539) 5.755 9.416 ( -2.487 -7.200 3.926) 8.570 9.600 ( -0.883 1.183 2.083) 2.553 10.029 ( 3.842 -1.092 -11.069) 11.767 10.228 ( 3.453 -0.188 -11.542) 12.049 10.621 ( 0.492 -1.929 9.105) 9.320 10.662 ( -0.160 0.757 2.777) 2.882 10.755 ( 0.062 1.727 -1.462) 2.263 10.844 ( 0.549 3.057 -1.986) 3.686 11.237 ( -1.091 2.838 -5.636) 6.404 11.611 ( -2.489 -0.148 -1.423) 2.871 11.762 ( -1.439 -0.643 1.079) 1.910 11.885 ( -1.740 4.649 -1.752) 5.264 13.262 ( -3.047 -0.308 4.819) 5.710 13.625 ( 2.345 0.476 -5.115) 5.648 14.241 ( -1.351 -3.447 4.454) 5.792 14.395 ( 8.081 -4.744 2.567) 9.716 ======================= Grid point 295 (147/260) ======================= q-point: (-0.40 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.318 ( -30.822 4.462 18.261) 36.102 3.521 ( -33.675 5.230 12.431) 36.275 4.619 ( -3.415 2.389 9.591) 10.457 4.832 ( 2.198 2.759 8.337) 9.052 4.987 ( -26.822 9.089 9.822) 29.975 5.063 ( 7.336 -2.723 -13.035) 15.203 5.457 ( -3.525 -0.424 -0.931) 3.671 5.737 ( 4.426 5.571 2.822) 7.654 5.904 ( 2.514 -0.829 -7.457) 7.912 6.063 ( 1.209 -0.207 -0.230) 1.248 6.214 ( -1.219 -0.174 -4.676) 4.836 6.340 ( -0.357 2.885 3.619) 4.642 7.221 ( 4.706 -5.428 1.823) 7.412 7.550 ( 7.277 1.674 -1.083) 7.546 7.890 ( -0.591 -4.204 5.659) 7.074 8.002 ( 1.645 1.324 2.436) 3.223 8.041 ( -2.186 -8.214 -1.735) 8.675 8.224 ( 14.241 2.951 4.244) 15.150 8.562 ( -1.298 12.236 -6.647) 13.985 8.975 ( -6.824 -1.481 -0.423) 6.996 9.388 ( -4.225 -7.970 4.605) 10.128 9.582 ( -2.761 1.012 2.166) 3.652 10.002 ( 2.815 -3.854 -12.222) 13.120 10.211 ( 4.112 1.495 -11.932) 12.709 10.672 ( 0.285 0.018 1.952) 1.973 10.744 ( -0.086 1.237 1.273) 1.778 10.761 ( 4.992 -1.370 8.259) 9.748 10.860 ( 1.799 3.329 1.714) 4.154 11.182 ( -0.772 3.600 -4.835) 6.077 11.510 ( -3.346 -0.632 -9.592) 10.178 11.715 ( -4.723 1.844 4.035) 6.480 11.884 ( -0.280 3.611 1.599) 3.959 13.240 ( -3.324 -0.065 4.619) 5.691 13.639 ( 3.149 0.864 -4.410) 5.487 14.238 ( -2.047 -4.241 3.102) 5.639 14.553 ( 8.085 -5.406 0.544) 9.741 ======================= Grid point 296 (148/260) ======================= q-point: (-0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.886 ( -34.149 8.383 17.712) 39.372 3.048 ( -31.619 3.903 23.671) 39.690 4.424 ( -35.913 19.193 26.979) 48.846 4.641 ( -5.579 2.458 0.938) 6.168 4.924 ( -2.913 3.017 5.820) 7.174 5.126 ( 6.185 -5.096 -6.110) 10.078 5.383 ( -3.213 -1.517 -0.779) 3.638 5.748 ( -0.656 3.892 -5.366) 6.661 5.957 ( 3.666 -0.822 -0.886) 3.860 6.064 ( -0.629 1.045 -0.314) 1.259 6.246 ( 8.020 -1.635 -4.738) 9.458 6.331 ( -1.747 3.523 2.479) 4.648 7.350 ( 8.041 -9.231 1.349) 12.316 7.666 ( 6.430 0.783 -1.331) 6.613 7.905 ( -4.411 -8.495 7.876) 12.396 7.990 ( 2.742 -0.052 -0.347) 2.764 8.056 ( 3.613 -1.162 -0.655) 3.851 8.469 ( 1.273 6.316 -3.481) 7.323 8.522 ( 7.461 5.610 -1.551) 9.463 8.862 ( -5.726 -0.060 0.730) 5.773 9.331 ( -6.048 -7.840 4.710) 10.965 9.543 ( -3.371 1.065 2.995) 4.634 9.966 ( 2.940 -4.167 -11.211) 12.316 10.203 ( 4.164 1.935 -10.046) 11.045 10.684 ( 0.587 0.189 -1.165) 1.318 10.742 ( 0.203 2.783 0.043) 2.791 10.888 ( 3.775 1.352 2.589) 4.772 10.969 ( 4.529 -3.095 9.298) 10.796 11.154 ( 0.898 5.273 -0.551) 5.377 11.399 ( -0.448 -0.073 -9.356) 9.367 11.651 ( -6.030 3.142 4.493) 8.149 11.877 ( -1.456 3.320 0.781) 3.708 13.212 ( -3.551 0.204 4.617) 5.828 13.670 ( 3.745 1.386 -4.128) 5.743 14.213 ( -2.664 -4.641 1.616) 5.590 14.669 ( 5.465 -6.209 -3.421) 8.951 ======================= Grid point 297 (149/260) ======================= q-point: (-0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( -33.233 9.272 23.458) 41.722 2.759 ( -24.312 11.534 31.117) 41.138 4.046 ( -30.997 23.416 39.303) 55.261 4.548 ( -5.474 2.204 -1.293) 6.041 4.804 ( -12.615 4.649 -0.767) 13.466 5.223 ( 7.649 -6.675 0.148) 10.153 5.334 ( -1.928 -2.432 -0.356) 3.124 5.698 ( 0.001 4.310 -5.608) 7.073 5.955 ( -3.750 -1.597 3.303) 5.247 6.083 ( 3.910 1.971 -2.223) 4.910 6.341 ( 1.230 2.222 1.585) 2.994 6.375 ( 8.641 -2.913 -4.765) 10.289 7.501 ( 7.724 -10.799 -0.172) 13.278 7.726 ( 0.141 -3.487 -1.567) 3.825 7.862 ( -4.014 -9.269 5.449) 11.477 8.090 ( 7.359 0.539 0.014) 7.379 8.172 ( 8.758 0.282 0.041) 8.763 8.423 ( -0.087 10.678 -3.952) 11.387 8.590 ( -0.525 2.062 -1.672) 2.706 8.788 ( -3.615 0.283 1.960) 4.122 9.244 ( -7.315 -6.695 4.516) 10.896 9.516 ( -2.571 1.240 4.215) 5.090 9.942 ( 2.962 -2.595 -10.598) 11.306 10.212 ( 3.392 0.458 -7.038) 7.826 10.676 ( 0.628 0.186 -3.510) 3.570 10.751 ( 0.721 2.767 -0.378) 2.884 10.951 ( 0.352 3.009 3.673) 4.761 11.061 ( 3.818 -2.359 -1.838) 4.849 11.255 ( 5.098 2.855 10.856) 12.329 11.383 ( 3.611 -2.673 -3.929) 5.968 11.583 ( -3.484 4.053 3.189) 6.223 11.856 ( -0.523 4.733 -0.081) 4.762 13.183 ( -3.460 0.508 4.859) 5.986 13.708 ( 3.859 1.913 -4.378) 6.141 14.169 ( -3.186 -4.786 0.529) 5.773 14.670 ( -1.243 -6.109 -7.886) 10.052 ======================= Grid point 298 (150/260) ======================= q-point: (-0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( -14.854 13.570 31.496) 37.373 2.630 ( -16.259 19.612 33.170) 41.823 3.934 ( -18.096 20.110 50.125) 56.960 4.430 ( -5.769 2.793 -5.143) 8.218 4.533 ( -11.635 7.186 -6.953) 15.341 5.302 ( -1.910 -2.348 0.296) 3.041 5.373 ( 5.822 -6.709 4.524) 9.969 5.680 ( 1.916 4.793 -2.703) 5.827 5.920 ( -3.326 -3.944 5.038) 7.211 6.132 ( 3.185 0.828 -3.538) 4.832 6.369 ( 0.852 0.792 -0.025) 1.164 6.468 ( 5.229 -2.736 -3.570) 6.897 7.550 ( -4.405 -4.615 -0.978) 6.454 7.708 ( 2.091 -12.178 1.357) 12.430 7.845 ( -1.792 -7.725 0.925) 7.984 8.223 ( 7.561 1.443 -2.167) 7.997 8.314 ( 8.876 -0.745 -6.212) 10.860 8.413 ( 0.373 6.772 -3.132) 7.471 8.532 ( -3.210 7.326 1.217) 8.091 8.754 ( -3.083 0.157 3.209) 4.453 9.168 ( -3.628 -5.404 4.950) 8.177 9.501 ( -3.014 1.027 3.688) 4.872 9.919 ( 2.025 -1.291 -7.482) 7.858 10.208 ( 1.736 -0.293 -6.355) 6.594 10.661 ( 0.817 0.030 -3.856) 3.942 10.755 ( 0.480 2.919 -1.381) 3.265 10.974 ( -0.562 2.521 4.284) 5.003 11.106 ( 3.561 2.179 -2.937) 5.105 11.340 ( -3.914 -1.366 4.646) 6.227 11.469 ( 3.376 -0.255 9.151) 9.757 11.613 ( 3.731 -3.087 -1.635) 5.111 11.921 ( 11.457 5.857 -1.496) 12.954 13.164 ( -2.693 0.617 5.417) 6.081 13.739 ( 3.455 2.374 -5.361) 6.805 14.112 ( -3.577 -5.049 0.612) 6.218 14.512 ( -9.235 -3.189 -8.257) 12.792 ======================= Grid point 299 (151/260) ======================= q-point: ( 0.00 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.802 ( 11.783 26.222 25.780) 38.614 3.197 ( -1.106 26.624 27.804) 38.512 4.394 ( -3.256 10.398 -8.048) 13.545 4.510 ( -1.797 17.914 13.733) 22.644 4.605 ( -3.778 16.690 18.511) 25.209 5.230 ( -1.144 -2.800 5.152) 5.974 5.335 ( -1.179 -3.947 6.962) 8.089 5.692 ( 1.160 -8.589 4.311) 9.679 5.906 ( -1.071 5.439 0.084) 5.544 6.068 ( -1.654 -5.270 -5.998) 8.154 6.332 ( -1.696 -2.668 -3.443) 4.674 6.468 ( 3.283 -2.275 -3.435) 5.268 7.422 ( -5.679 0.267 3.015) 6.435 7.479 ( 1.074 -13.736 4.520) 14.500 7.671 ( -6.021 -4.226 -0.146) 7.358 8.261 ( -0.031 -4.021 -7.928) 8.889 8.354 ( 5.378 1.137 -3.035) 6.279 8.492 ( 0.520 2.369 0.336) 2.448 8.661 ( 0.822 0.008 1.600) 1.799 8.740 ( -1.780 6.517 -2.674) 7.265 9.078 ( 3.852 -8.970 5.294) 11.105 9.423 ( -4.751 -2.467 -1.903) 5.682 9.931 ( 1.660 2.456 1.567) 3.353 10.216 ( 3.369 1.016 -5.563) 6.582 10.670 ( 1.140 1.687 -2.826) 3.483 10.803 ( 0.213 1.703 -0.325) 1.747 11.043 ( -2.684 2.828 4.138) 5.686 11.208 ( 3.002 2.950 -1.982) 4.653 11.294 ( 0.814 -0.471 0.346) 1.002 11.490 ( -0.266 -1.463 0.772) 1.676 11.669 ( -1.395 3.913 5.217) 6.669 12.150 ( 10.212 -2.611 -2.411) 10.813 13.197 ( -1.399 2.798 4.676) 5.626 13.798 ( 2.308 1.988 -9.157) 9.650 13.941 ( -3.259 -5.427 4.042) 7.511 14.276 ( -5.223 -2.442 -5.162) 7.738 ======================= Grid point 300 (152/260) ======================= q-point: ( 0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.302 ( 22.158 20.614 24.053) 38.658 3.424 ( 5.644 26.665 23.686) 36.109 4.329 ( 5.575 11.011 -13.355) 18.184 4.546 ( 4.388 10.475 -3.745) 11.958 4.847 ( 4.141 18.044 36.005) 40.485 5.241 ( -2.215 4.270 6.753) 8.292 5.279 ( -8.254 -0.660 3.234) 8.890 5.757 ( 0.191 -9.308 3.843) 10.072 5.924 ( 0.843 -1.902 6.210) 6.549 5.990 ( 0.433 -3.970 -8.238) 9.155 6.263 ( -3.244 -1.928 -3.829) 5.376 6.472 ( 0.088 -2.894 -4.162) 5.070 7.358 ( -3.902 1.739 2.412) 4.906 7.487 ( -5.240 -11.748 -1.544) 12.956 7.549 ( -4.398 -7.441 3.590) 9.359 8.137 ( -7.724 2.255 -6.746) 10.501 8.391 ( 2.827 0.115 -3.164) 4.245 8.533 ( 1.280 -0.849 0.687) 1.683 8.677 ( 0.328 0.953 2.076) 2.308 8.752 ( 5.094 5.137 -3.482) 8.029 9.159 ( -0.312 -9.478 5.048) 10.743 9.375 ( 2.519 -2.908 -1.206) 4.032 9.965 ( 1.076 3.982 0.919) 4.226 10.241 ( 3.628 1.018 -5.331) 6.528 10.674 ( 0.863 2.385 -1.264) 2.834 10.800 ( -0.229 2.335 -0.268) 2.361 11.000 ( -4.120 1.717 1.781) 4.805 11.218 ( -1.136 1.569 -1.739) 2.604 11.348 ( 4.494 3.949 0.230) 5.986 11.469 ( -1.442 -2.426 0.006) 2.823 11.662 ( -2.946 4.314 4.193) 6.699 12.276 ( 6.059 -5.247 -5.398) 9.663 13.218 ( -0.549 1.456 5.625) 5.836 13.751 ( 0.513 0.254 -9.283) 9.301 13.931 ( -1.471 -2.999 4.571) 5.661 14.178 ( -2.441 -1.008 -2.526) 3.654 ======================= Grid point 301 (153/260) ======================= q-point: ( 0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.720 ( 10.525 22.629 18.907) 31.310 3.867 ( 19.843 14.818 23.630) 34.230 4.398 ( 12.776 9.428 -13.486) 20.832 4.609 ( 2.447 9.406 0.262) 9.723 5.075 ( -2.035 6.196 5.106) 8.283 5.137 ( -7.683 0.166 2.468) 8.072 5.361 ( 8.524 15.745 20.903) 27.523 5.767 ( 0.299 -4.126 2.869) 5.034 5.900 ( -1.628 -8.666 -4.382) 9.846 6.066 ( 5.313 -2.817 3.821) 7.125 6.154 ( -5.820 -0.843 -4.160) 7.203 6.423 ( -1.241 -2.415 -4.023) 4.853 7.310 ( -4.440 -4.430 2.204) 6.648 7.330 ( -7.625 0.091 0.915) 7.680 7.558 ( 1.236 -12.923 0.832) 13.009 7.909 ( -13.593 7.708 -2.785) 15.873 8.403 ( -2.220 -2.963 1.060) 3.851 8.525 ( -0.237 0.673 -2.427) 2.530 8.730 ( 5.075 5.960 -1.257) 7.929 8.826 ( 4.841 -0.152 -1.545) 5.084 9.180 ( 0.006 -9.687 5.419) 11.100 9.460 ( 5.337 -4.437 0.312) 6.947 9.988 ( 1.905 4.448 -1.145) 4.973 10.260 ( 3.097 0.504 -6.229) 6.975 10.675 ( -0.537 2.943 0.268) 3.004 10.796 ( 0.192 2.205 -0.602) 2.294 10.927 ( -5.092 0.717 -0.156) 5.144 11.129 ( -6.178 3.123 -3.408) 7.716 11.404 ( 1.211 4.492 -2.120) 5.113 11.495 ( 4.533 -2.394 1.864) 5.455 11.643 ( -2.194 4.613 4.225) 6.630 12.277 ( -0.480 -3.686 -7.178) 8.083 13.251 ( -0.759 0.305 6.015) 6.071 13.697 ( 0.653 -0.065 -8.276) 8.302 13.955 ( 1.000 -3.042 3.662) 4.865 14.146 ( -0.678 -2.017 0.213) 2.138 ======================= Grid point 302 (154/260) ======================= q-point: ( 0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.048 ( 12.151 17.021 14.720) 25.574 4.296 ( 9.918 10.123 19.485) 24.093 4.530 ( -11.111 7.366 5.050) 14.255 4.569 ( 9.310 7.035 -3.975) 12.327 5.026 ( -7.302 4.556 1.091) 8.676 5.073 ( 8.128 7.199 -9.706) 14.564 5.571 ( 1.299 -0.369 -0.668) 1.507 5.827 ( 0.620 -8.618 -7.424) 11.392 5.900 ( 6.311 0.747 9.104) 11.103 6.023 ( -5.064 0.208 -1.767) 5.368 6.162 ( 3.010 -2.236 1.492) 4.035 6.446 ( 6.749 3.774 3.631) 8.542 7.205 ( -5.737 -5.671 3.758) 8.900 7.303 ( -1.252 2.300 5.369) 5.973 7.579 ( -2.666 -5.938 -2.036) 6.820 7.650 ( -10.873 5.695 3.262) 12.700 8.311 ( -7.554 -1.661 0.544) 7.754 8.502 ( -1.790 1.000 -1.249) 2.401 8.820 ( 6.711 10.201 -6.509) 13.837 8.903 ( 4.258 -6.256 2.352) 7.925 9.235 ( 0.641 -10.215 5.984) 11.856 9.532 ( 2.603 -3.822 0.003) 4.624 10.024 ( 3.856 3.601 -3.542) 6.355 10.258 ( 2.334 -0.195 -7.799) 8.143 10.653 ( -2.916 1.853 1.291) 3.688 10.791 ( -1.660 -0.685 -1.380) 2.265 10.815 ( -4.993 4.080 -0.775) 6.494 11.002 ( -3.792 4.644 -4.164) 7.300 11.387 ( -0.536 2.053 -3.152) 3.799 11.592 ( 3.890 -1.147 -0.124) 4.058 11.665 ( 0.933 4.880 6.802) 8.423 12.177 ( -4.138 -0.941 -7.515) 8.630 13.272 ( -1.671 0.393 5.755) 6.005 13.657 ( 1.286 0.030 -7.358) 7.469 14.022 ( 3.753 -4.707 3.166) 6.802 14.145 ( -0.645 -3.625 2.098) 4.238 ======================= Grid point 303 (155/260) ======================= q-point: (-0.60 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.177 ( -18.874 7.562 9.416) 22.407 4.400 ( 2.005 11.425 15.049) 19.000 4.529 ( 1.942 7.017 10.537) 12.808 4.621 ( -4.928 10.539 2.487) 11.897 4.975 ( 7.262 2.298 -11.542) 13.829 5.177 ( 10.291 2.442 -7.543) 12.991 5.462 ( -8.269 -6.524 -4.445) 11.432 5.825 ( 5.524 -7.470 -8.562) 12.634 5.961 ( -1.300 -0.640 1.625) 2.178 6.007 ( 1.459 0.788 0.110) 1.661 6.216 ( 2.897 -0.041 1.230) 3.147 6.623 ( 1.680 7.527 3.756) 8.578 7.217 ( 3.808 -3.957 7.650) 9.416 7.327 ( -8.625 7.977 6.775) 13.562 7.426 ( 1.456 7.797 8.821) 11.862 7.666 ( 2.881 -9.611 1.032) 10.086 8.181 ( -6.564 -0.211 -0.513) 6.587 8.426 ( -5.649 2.714 -1.413) 6.425 8.842 ( 1.702 5.735 -6.566) 8.883 9.001 ( 3.994 -3.528 0.868) 5.399 9.266 ( -1.845 -9.787 5.034) 11.159 9.565 ( 1.361 -3.070 0.352) 3.377 10.050 ( 2.463 1.895 -6.901) 7.569 10.239 ( 3.012 -0.324 -9.170) 9.657 10.587 ( -5.270 -0.747 3.441) 6.338 10.709 ( -2.619 2.046 -0.416) 3.350 10.800 ( 0.848 3.135 -1.972) 3.799 10.939 ( -0.968 4.381 -2.514) 5.143 11.347 ( -0.985 2.349 -3.893) 4.653 11.622 ( 0.449 -1.354 -1.092) 1.797 11.747 ( 1.913 3.223 5.321) 6.508 12.049 ( -4.058 2.169 -5.508) 7.177 13.276 ( -2.264 0.897 5.175) 5.719 13.637 ( 2.049 0.375 -6.380) 6.711 14.125 ( 3.779 -7.151 3.073) 8.652 14.153 ( 0.864 -4.494 2.652) 5.289 ======================= Grid point 304 (156/260) ======================= q-point: (-0.50 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.834 ( -26.034 9.216 13.399) 30.696 4.193 ( -26.815 11.312 3.722) 29.340 4.623 ( 0.815 4.864 11.895) 12.876 4.756 ( 9.074 7.260 6.003) 13.080 4.985 ( 5.147 -2.331 -17.509) 18.398 5.282 ( -8.962 -5.479 -1.522) 10.614 5.350 ( 11.573 -1.255 -2.220) 11.851 5.842 ( 3.172 -4.156 -8.598) 10.063 5.971 ( -1.804 5.166 3.176) 6.327 6.017 ( 1.992 -0.897 -1.605) 2.711 6.302 ( 4.650 1.504 3.889) 6.246 6.487 ( -14.780 10.471 1.667) 18.190 7.201 ( -6.741 5.339 5.329) 10.117 7.366 ( 5.153 -6.903 6.348) 10.700 7.715 ( 3.667 -5.027 5.554) 8.341 7.744 ( 15.358 3.281 8.932) 18.067 8.084 ( -3.740 1.423 -0.190) 4.006 8.300 ( -5.471 5.003 -3.008) 8.001 8.801 ( -1.100 3.347 -5.548) 6.572 9.023 ( -0.956 -0.987 -2.327) 2.703 9.248 ( -3.801 -9.503 4.698) 11.261 9.583 ( -0.220 -2.848 0.824) 2.973 10.003 ( -0.522 -0.948 -9.215) 9.279 10.241 ( 4.865 1.163 -10.244) 11.400 10.572 ( -0.506 -2.534 7.734) 8.154 10.686 ( 0.024 1.202 -0.416) 1.273 10.805 ( 1.169 3.549 -1.660) 4.088 10.922 ( 0.337 4.465 -0.788) 4.547 11.301 ( -0.891 3.140 -3.737) 4.961 11.583 ( -1.766 -2.748 -6.842) 7.582 11.786 ( -1.458 2.920 4.506) 5.564 11.980 ( -1.212 4.565 -0.693) 4.774 13.268 ( -2.544 1.318 4.531) 5.361 13.639 ( 3.059 1.020 -5.478) 6.357 14.136 ( -1.884 -7.105 2.883) 7.895 14.271 ( 7.193 -7.288 1.942) 10.423 ======================= Grid point 305 (157/260) ======================= q-point: (-0.40 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.481 ( -25.949 12.203 17.247) 33.463 3.692 ( -32.236 11.831 6.160) 34.886 4.681 ( -2.232 3.827 8.358) 9.459 4.884 ( 1.563 0.305 -1.898) 2.478 4.978 ( 5.037 -3.623 -5.865) 8.538 5.114 ( -11.001 1.106 4.257) 11.847 5.476 ( 0.893 2.071 0.480) 2.306 5.833 ( 2.769 0.152 -7.420) 7.922 5.940 ( -1.897 6.531 2.358) 7.198 6.051 ( 1.943 -0.902 -1.233) 2.471 6.265 ( -7.175 6.764 -2.002) 10.062 6.404 ( 1.725 3.465 5.298) 6.561 7.162 ( -1.992 0.632 5.099) 5.510 7.499 ( 4.660 -6.293 6.434) 10.135 7.746 ( -1.419 -8.705 4.104) 9.728 7.978 ( 2.460 0.604 -0.831) 2.666 8.066 ( -0.873 4.346 2.521) 5.099 8.310 ( 10.684 5.464 0.793) 12.026 8.734 ( -1.968 3.290 -4.586) 5.977 8.956 ( -3.447 0.712 -3.357) 4.864 9.204 ( -5.178 -10.039 5.029) 12.365 9.567 ( -2.116 -2.442 1.156) 3.432 9.927 ( -0.345 -2.640 -7.944) 8.378 10.250 ( 4.586 1.791 -11.185) 12.220 10.655 ( 1.724 -2.788 7.578) 8.256 10.703 ( 2.251 -0.954 0.565) 2.510 10.820 ( 2.200 4.383 -1.423) 5.106 10.942 ( 1.581 4.673 1.780) 5.245 11.266 ( -0.302 4.142 -2.645) 4.923 11.478 ( -2.208 -2.524 -10.406) 10.933 11.774 ( -3.522 3.870 4.795) 7.097 11.969 ( -0.891 4.294 0.909) 4.478 13.253 ( -2.670 1.739 3.990) 5.106 13.666 ( 4.085 1.852 -4.866) 6.618 14.116 ( -2.318 -7.815 2.102) 8.418 14.408 ( 7.016 -8.743 0.206) 11.212 ======================= Grid point 306 (158/260) ======================= q-point: (-0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.125 ( -30.490 15.437 14.148) 36.988 3.242 ( -24.496 15.560 20.909) 35.768 4.667 ( -5.609 4.332 6.760) 9.794 4.820 ( -13.266 9.909 6.215) 17.686 4.947 ( 0.181 -5.968 -0.741) 6.016 5.037 ( -3.868 1.783 4.062) 5.885 5.400 ( -8.412 5.933 4.135) 11.093 5.813 ( 0.573 1.776 -7.313) 7.548 5.968 ( 2.069 2.315 0.769) 3.198 6.066 ( 1.433 -0.963 -1.248) 2.130 6.229 ( 5.254 0.919 -6.507) 8.413 6.424 ( -2.489 5.280 3.645) 6.882 7.204 ( 2.363 -4.158 5.041) 6.949 7.614 ( 3.614 -5.292 3.234) 7.178 7.728 ( -4.843 -8.148 7.114) 11.852 8.009 ( 4.111 1.178 -1.566) 4.554 8.073 ( 2.104 1.685 0.348) 2.718 8.504 ( 6.961 1.867 0.005) 7.207 8.680 ( -0.417 4.345 -3.261) 5.449 8.872 ( -3.245 1.599 -2.745) 4.541 9.140 ( -6.084 -10.539 5.150) 13.214 9.537 ( -2.257 -1.742 2.158) 3.576 9.889 ( 1.427 -2.721 -5.562) 6.354 10.242 ( 3.499 1.407 -10.551) 11.205 10.694 ( 1.201 0.624 -1.562) 2.067 10.758 ( 0.487 -2.524 3.751) 4.547 10.891 ( 6.594 1.989 -0.120) 6.889 10.993 ( 0.913 4.339 4.334) 6.200 11.270 ( 1.996 5.438 1.046) 5.886 11.378 ( -0.675 -1.893 -9.216) 9.432 11.732 ( -4.763 4.602 3.978) 7.726 11.954 ( -1.226 3.841 0.653) 4.084 13.233 ( -2.665 2.258 3.657) 5.057 13.710 ( 4.677 2.624 -4.686) 7.121 14.084 ( -2.605 -8.057 1.111) 8.540 14.505 ( 4.458 -9.766 -2.701) 11.069 ======================= Grid point 307 (159/260) ======================= q-point: (-0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.724 ( -25.371 21.577 19.477) 38.583 3.073 ( -16.179 19.558 28.721) 38.330 4.561 ( -18.247 19.688 21.113) 34.151 4.627 ( -7.303 9.006 0.930) 11.632 4.921 ( -9.711 6.236 -0.190) 11.542 5.033 ( 4.966 -12.017 5.182) 13.997 5.301 ( -5.589 1.373 4.021) 7.021 5.757 ( -1.399 1.385 -5.389) 5.737 5.972 ( -1.435 3.099 -0.746) 3.495 6.094 ( 2.643 -1.299 -1.787) 3.445 6.306 ( 8.123 -3.181 -7.797) 11.700 6.407 ( -1.182 4.072 2.064) 4.716 7.302 ( 4.080 -7.808 4.945) 10.103 7.622 ( -4.963 -5.699 1.738) 7.754 7.722 ( -0.955 -5.435 5.937) 8.105 8.096 ( 5.999 -0.814 0.076) 6.054 8.164 ( 7.684 -0.734 -0.878) 7.768 8.543 ( 0.220 3.100 -2.602) 4.054 8.672 ( 0.302 3.694 -1.316) 3.933 8.812 ( -1.375 2.228 -1.955) 3.268 9.065 ( -6.470 -10.225 5.337) 13.225 9.523 ( -1.587 -1.078 2.955) 3.524 9.886 ( 1.990 -2.055 -4.308) 5.172 10.225 ( 2.527 0.451 -8.756) 9.125 10.691 ( 0.831 1.098 -3.797) 4.039 10.781 ( 0.489 -0.466 1.170) 1.351 10.998 ( 1.721 -0.037 2.930) 3.398 11.051 ( 5.681 4.740 0.974) 7.462 11.321 ( 0.722 -1.800 -3.293) 3.821 11.354 ( 3.167 4.099 3.740) 6.389 11.674 ( -4.023 4.847 2.946) 6.954 11.948 ( 0.611 3.820 0.414) 3.891 13.213 ( -2.501 2.797 3.602) 5.201 13.758 ( 4.637 3.110 -5.033) 7.517 14.040 ( -3.014 -7.824 0.434) 8.396 14.512 ( -0.385 -9.301 -5.708) 10.920 ======================= Grid point 308 (160/260) ======================= q-point: (-0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.577 ( -8.170 26.887 25.089) 37.671 3.070 ( -8.608 23.596 30.435) 39.461 4.445 ( -14.328 26.524 30.686) 43.017 4.525 ( -4.282 7.053 -3.290) 8.883 4.711 ( -10.189 9.909 -3.733) 14.695 5.177 ( 3.773 -10.194 7.960) 13.472 5.271 ( -1.102 -2.486 5.976) 6.566 5.698 ( -1.974 -1.564 -1.716) 3.048 5.934 ( -1.398 4.699 -1.542) 5.139 6.111 ( 0.796 -3.349 -3.337) 4.794 6.363 ( 2.386 -3.049 -5.031) 6.348 6.422 ( 3.042 -0.008 -1.332) 3.321 7.404 ( 3.054 -10.104 5.007) 11.683 7.521 ( -7.533 -3.972 3.443) 9.186 7.732 ( -1.581 -4.523 1.462) 5.010 8.220 ( 7.295 -3.774 0.020) 8.214 8.275 ( 6.080 -1.149 -4.871) 7.874 8.515 ( -0.870 4.350 -2.700) 5.193 8.655 ( -0.871 3.001 -0.336) 3.143 8.790 ( -0.867 4.027 -1.431) 4.361 9.014 ( -2.400 -9.709 5.577) 11.451 9.503 ( -3.049 -1.655 0.939) 3.594 9.897 ( 1.736 -0.037 -1.227) 2.127 10.210 ( 2.452 0.383 -7.009) 7.436 10.677 ( 0.849 1.330 -3.833) 4.145 10.796 ( 0.723 0.715 -0.088) 1.021 11.032 ( -0.298 2.612 4.878) 5.542 11.153 ( 5.039 3.506 -1.967) 6.446 11.305 ( -0.795 -3.907 -1.146) 4.149 11.446 ( 2.804 2.113 4.709) 5.874 11.651 ( -1.090 3.979 3.572) 5.457 12.004 ( 6.080 2.369 -0.119) 6.526 13.198 ( -2.122 3.125 3.910) 5.437 13.796 ( 4.029 3.170 -6.411) 8.209 13.986 ( -3.592 -7.235 1.156) 8.160 14.416 ( -4.841 -6.305 -6.686) 10.388 ======================= Grid point 309 (161/260) ======================= q-point: ( 0.00 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.362 ( 9.392 28.863 20.271) 36.499 3.702 ( 0.688 23.947 24.018) 33.923 4.577 ( 0.751 5.502 -2.664) 6.159 4.754 ( -2.538 6.239 -1.516) 6.904 4.851 ( 2.023 1.956 9.472) 9.881 5.131 ( 3.512 -8.538 14.147) 16.893 5.455 ( -3.497 22.610 16.054) 27.950 5.610 ( -2.998 0.186 -1.400) 3.314 5.918 ( -4.172 -8.928 -4.142) 10.690 5.995 ( -0.747 2.901 -4.066) 5.050 6.244 ( -0.328 -5.736 -6.436) 8.628 6.432 ( 1.904 -2.067 -2.682) 3.885 7.270 ( -2.588 -6.613 6.977) 9.956 7.398 ( -5.092 -3.553 2.082) 6.549 7.641 ( -6.204 1.894 4.956) 8.163 8.126 ( 1.791 -9.068 -0.844) 9.281 8.353 ( 3.702 -0.531 0.403) 3.762 8.544 ( -3.368 1.849 -0.690) 3.904 8.647 ( 0.539 -0.797 -1.664) 1.922 8.863 ( 3.664 -3.972 -0.028) 5.404 8.888 ( 1.420 0.705 -0.863) 1.805 9.341 ( -2.888 -5.699 -3.870) 7.470 10.012 ( 2.252 5.315 3.719) 6.867 10.230 ( 3.169 -0.029 -3.713) 4.882 10.711 ( 1.615 2.266 -2.392) 3.670 10.814 ( 0.955 -0.476 0.342) 1.120 11.084 ( -2.225 1.501 1.819) 3.242 11.230 ( 3.492 -4.352 -1.779) 5.857 11.307 ( 1.271 6.556 0.536) 6.699 11.526 ( -0.919 2.707 1.555) 3.255 11.746 ( -0.913 4.214 4.241) 6.048 12.085 ( 4.716 -4.139 0.332) 6.283 13.291 ( -1.055 6.538 2.259) 6.997 13.767 ( -1.301 -5.984 -4.181) 7.415 13.896 ( 1.164 1.936 -1.601) 2.769 14.193 ( -2.294 -5.459 -5.345) 7.977 ======================= Grid point 310 (162/260) ======================= q-point: ( 0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.747 ( 16.801 23.038 18.491) 33.984 3.910 ( 4.677 21.665 19.762) 29.695 4.579 ( 4.841 12.809 -9.090) 16.436 4.750 ( 3.216 8.450 -1.184) 9.119 4.994 ( 3.796 -3.586 11.498) 12.628 5.246 ( -1.936 -1.624 10.543) 10.842 5.551 ( 0.814 21.287 15.278) 26.215 5.587 ( 1.309 -3.837 1.581) 4.351 5.791 ( -5.725 -9.061 -4.763) 11.729 5.956 ( -0.148 -2.092 -3.761) 4.306 6.216 ( 0.948 -3.119 -2.820) 4.311 6.428 ( -0.425 -0.942 -2.562) 2.763 7.243 ( -6.083 -9.310 1.597) 11.235 7.323 ( -3.158 -5.524 3.084) 7.070 7.550 ( -7.670 5.337 5.945) 11.075 8.120 ( -1.254 -4.649 -2.703) 5.523 8.388 ( -0.444 -0.448 -0.661) 0.914 8.498 ( -1.982 -2.109 3.029) 4.190 8.666 ( 2.322 -0.878 -0.095) 2.484 8.880 ( 3.785 6.611 -5.420) 9.349 8.954 ( 0.443 -9.857 4.543) 10.862 9.298 ( 2.123 -4.773 -3.624) 6.358 10.065 ( 1.560 5.652 1.398) 6.028 10.257 ( 2.895 0.249 -4.113) 5.036 10.727 ( 1.446 2.711 -1.063) 3.251 10.823 ( -0.206 0.046 0.318) 0.381 11.036 ( -3.479 2.317 0.502) 4.211 11.271 ( 1.691 -0.531 -6.594) 6.828 11.344 ( 2.378 1.420 5.058) 5.766 11.506 ( -1.743 3.338 0.438) 3.791 11.751 ( -1.657 5.023 3.625) 6.412 12.163 ( 3.737 -6.144 -1.121) 7.278 13.293 ( -0.886 5.868 3.086) 6.689 13.715 ( -0.656 -4.253 -5.175) 6.730 13.899 ( 0.060 0.285 -0.190) 0.348 14.123 ( -1.587 -4.227 -4.074) 6.081 ======================= Grid point 311 (163/260) ======================= q-point: ( 0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.131 ( 8.996 18.208 13.322) 24.289 4.185 ( 14.127 15.897 17.853) 27.767 4.633 ( 9.392 13.410 -10.571) 19.488 4.807 ( 0.165 9.454 2.652) 9.821 5.095 ( -0.492 -2.499 5.757) 6.295 5.230 ( -2.492 7.103 2.643) 7.978 5.617 ( -0.440 1.497 -4.291) 4.566 5.680 ( 3.730 -7.324 4.303) 9.277 5.714 ( 0.015 -0.490 3.627) 3.660 5.946 ( 1.652 -7.464 -2.361) 8.001 6.207 ( -2.576 3.888 1.576) 4.923 6.427 ( 3.351 3.868 2.281) 5.603 7.101 ( -8.904 -10.289 1.645) 13.706 7.336 ( 1.745 -7.386 1.101) 7.669 7.475 ( -5.977 7.837 7.692) 12.502 8.034 ( -7.304 3.423 -0.221) 8.069 8.351 ( -3.051 -1.691 0.444) 3.516 8.500 ( -0.314 -3.711 1.644) 4.071 8.719 ( 2.927 -3.012 0.803) 4.276 8.919 ( 3.997 3.936 -4.449) 7.160 8.979 ( 0.058 -7.088 4.936) 8.638 9.355 ( 5.572 -5.932 -2.337) 8.468 10.092 ( 1.765 5.575 -1.581) 6.058 10.269 ( 2.141 0.068 -5.248) 5.669 10.734 ( -0.503 2.565 -0.591) 2.680 10.810 ( -1.318 -0.479 -0.305) 1.435 10.977 ( -2.882 4.325 -1.118) 5.316 11.200 ( -3.575 2.732 -6.087) 7.570 11.420 ( 0.653 -1.547 2.890) 3.342 11.500 ( 2.100 1.733 0.194) 2.730 11.751 ( -0.772 6.509 3.375) 7.372 12.186 ( 0.277 -5.509 -2.833) 6.201 13.304 ( -0.799 4.927 3.968) 6.377 13.672 ( 0.388 -2.801 -5.899) 6.542 13.902 ( 0.216 -1.634 1.057) 1.958 14.079 ( -0.945 -4.492 -2.280) 5.125 ======================= Grid point 312 (164/260) ======================= q-point: ( 0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.361 ( 7.739 13.798 9.615) 18.513 4.515 ( 9.279 10.686 12.688) 19.008 4.707 ( -14.416 9.858 9.280) 19.777 4.758 ( 11.378 11.607 -9.227) 18.690 5.095 ( -2.107 2.605 1.188) 3.555 5.228 ( 2.481 7.453 -7.130) 10.609 5.550 ( -5.262 -1.573 -5.832) 8.010 5.631 ( -0.543 -10.641 -8.691) 13.750 5.819 ( 4.256 -6.714 4.138) 8.962 5.964 ( 1.912 -7.191 -1.932) 7.687 6.188 ( -1.101 4.879 5.815) 7.671 6.602 ( 10.241 8.041 6.027) 14.348 7.007 ( -3.699 -9.285 6.074) 11.696 7.388 ( 3.575 -8.238 -0.198) 8.983 7.463 ( -2.314 11.549 11.125) 16.202 7.868 ( -12.343 10.291 3.746) 16.501 8.281 ( -5.176 -1.089 0.620) 5.326 8.505 ( 0.123 -1.499 -0.883) 1.744 8.770 ( 1.898 -6.702 0.590) 6.990 8.949 ( 1.450 -4.378 0.573) 4.648 9.044 ( 3.694 -0.595 1.843) 4.171 9.430 ( 4.158 -6.089 -1.724) 7.573 10.110 ( 2.476 4.663 -4.053) 6.656 10.255 ( 1.290 -0.207 -6.656) 6.783 10.686 ( -4.599 1.481 -0.431) 4.850 10.770 ( -1.925 -1.036 -2.384) 3.234 10.926 ( -1.323 6.330 -2.019) 6.775 11.090 ( -3.523 3.625 -4.786) 6.962 11.413 ( -1.556 0.701 0.427) 1.759 11.556 ( 2.753 -2.449 -0.610) 3.734 11.782 ( 1.112 6.755 4.319) 8.094 12.141 ( -2.247 -2.892 -3.551) 5.101 13.319 ( -1.041 4.390 4.383) 6.290 13.646 ( 1.453 -1.581 -5.912) 6.290 13.928 ( 1.578 -4.145 1.813) 4.791 14.053 ( -0.781 -5.308 -0.778) 5.421 ======================= Grid point 313 (165/260) ======================= q-point: (-0.60 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.383 ( -16.662 12.257 6.045) 21.550 4.609 ( 0.478 8.755 11.608) 14.547 4.699 ( 3.090 9.584 6.564) 12.021 4.841 ( -3.106 11.031 -1.386) 11.543 5.024 ( 0.041 2.399 -10.988) 11.247 5.206 ( 4.650 0.421 -8.559) 9.750 5.334 ( -9.674 -6.365 -5.539) 12.837 5.655 ( 6.709 -9.546 -7.761) 14.014 5.906 ( 3.553 -3.241 2.200) 5.289 6.001 ( 3.148 -2.940 -0.757) 4.374 6.249 ( 2.364 4.573 7.074) 8.749 6.740 ( 0.309 0.860 2.074) 2.266 7.074 ( 4.033 -5.378 8.047) 10.485 7.434 ( 0.878 -6.595 0.040) 6.654 7.587 ( 1.575 14.569 16.523) 22.085 7.692 ( -7.088 11.873 7.124) 15.555 8.195 ( -3.965 1.497 -0.417) 4.259 8.473 ( -2.456 1.730 -2.568) 3.952 8.779 ( -0.814 -7.300 -0.870) 7.397 8.980 ( 0.126 -10.551 2.754) 10.905 9.113 ( 3.017 2.508 -0.127) 3.926 9.475 ( 2.329 -5.630 -1.331) 6.237 10.099 ( -0.335 2.909 -6.369) 7.010 10.234 ( 2.514 -0.546 -6.918) 7.381 10.588 ( -5.074 1.152 0.287) 5.211 10.720 ( -1.172 -0.772 -2.961) 3.277 10.902 ( 0.482 6.320 -2.921) 6.979 11.022 ( -1.130 3.616 -2.486) 4.532 11.383 ( -1.628 1.325 -0.667) 2.202 11.567 ( 0.105 -3.919 -3.676) 5.374 11.837 ( 0.883 5.484 4.420) 7.099 12.078 ( -1.958 0.262 -2.020) 2.826 13.328 ( -1.410 4.510 4.132) 6.277 13.641 ( 2.674 -0.332 -5.431) 6.063 13.974 ( 0.920 -7.297 2.294) 7.704 14.048 ( 1.479 -5.737 -0.153) 5.927 ======================= Grid point 314 (166/260) ======================= q-point: (-0.50 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.085 ( -21.112 15.178 8.948) 27.498 4.439 ( -24.311 13.070 -0.405) 27.605 4.721 ( -1.843 3.715 10.302) 11.105 4.883 ( 5.691 4.654 -0.202) 7.355 4.920 ( -0.945 -3.615 -14.374) 14.852 5.163 ( -7.156 -6.402 0.347) 9.608 5.336 ( 12.134 0.410 -4.162) 12.835 5.716 ( 6.425 -7.784 -7.299) 12.456 5.985 ( 4.054 -0.934 -0.021) 4.161 6.039 ( 2.228 0.238 -2.770) 3.563 6.363 ( 3.809 5.250 8.028) 10.321 6.670 ( -8.642 5.195 1.130) 10.146 7.210 ( 4.115 -6.492 9.142) 11.944 7.380 ( -8.520 9.155 5.271) 13.571 7.565 ( -4.498 -3.916 9.882) 11.542 7.891 ( 8.560 6.674 8.657) 13.883 8.162 ( 0.876 6.423 1.107) 6.576 8.396 ( -2.233 4.394 -4.207) 6.480 8.739 ( -2.820 -6.804 -0.435) 7.378 8.971 ( -2.390 -11.128 0.143) 11.383 9.136 ( -0.128 3.097 -0.843) 3.212 9.495 ( 0.695 -5.650 -0.907) 5.765 10.013 ( -3.072 2.130 -6.591) 7.577 10.243 ( 3.253 -1.754 -6.058) 7.096 10.549 ( -0.059 0.861 2.337) 2.491 10.694 ( 0.473 -0.606 -2.481) 2.597 10.899 ( 1.943 5.611 -3.670) 6.980 11.007 ( 0.654 3.678 -0.910) 3.845 11.350 ( -1.439 1.611 -0.723) 2.278 11.509 ( -1.797 -4.420 -7.363) 8.774 11.866 ( -0.986 4.890 4.064) 6.434 12.049 ( -0.912 1.881 0.228) 2.103 13.329 ( -1.573 4.997 3.446) 6.271 13.663 ( 4.091 1.008 -4.993) 6.533 13.973 ( -2.040 -8.335 1.873) 8.783 14.118 ( 5.472 -7.817 0.192) 9.544 ======================= Grid point 315 (167/260) ======================= q-point: (-0.40 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.786 ( -21.052 17.480 11.644) 29.737 3.982 ( -26.393 16.858 3.357) 31.497 4.727 ( -3.083 -5.866 2.591) 7.115 4.778 ( -5.178 -3.461 -2.068) 6.563 4.966 ( 1.802 -0.658 -2.807) 3.400 5.083 ( -3.425 -1.834 4.571) 5.999 5.514 ( 9.465 1.892 -2.400) 9.946 5.780 ( 6.378 -4.461 -6.797) 10.333 6.030 ( 1.857 0.484 -3.741) 4.205 6.048 ( 1.689 1.659 -2.517) 3.455 6.455 ( -4.772 7.775 4.230) 10.055 6.502 ( -5.325 7.970 3.928) 10.358 7.267 ( -7.639 8.189 8.600) 14.120 7.365 ( 4.167 -4.168 9.444) 11.132 7.574 ( -2.863 -8.133 8.672) 12.229 7.984 ( 0.779 -1.166 0.545) 1.505 8.171 ( -3.534 6.089 0.936) 7.102 8.433 ( 8.721 6.600 -1.329) 11.017 8.688 ( -2.936 -6.511 1.238) 7.249 8.908 ( -3.340 -9.354 -2.684) 10.289 9.102 ( -2.745 3.062 -0.607) 4.157 9.486 ( -1.001 -5.604 -0.410) 5.708 9.925 ( -2.015 2.578 -3.996) 5.165 10.249 ( 2.272 -2.591 -6.164) 7.062 10.607 ( 3.277 -0.601 3.877) 5.112 10.698 ( 1.947 -0.372 -2.796) 3.427 10.919 ( 3.380 5.337 -3.716) 7.330 11.032 ( 2.160 3.957 0.916) 4.600 11.327 ( -0.516 1.754 -0.180) 1.837 11.416 ( -1.879 -3.530 -8.371) 9.277 11.862 ( -2.606 4.859 3.689) 6.634 12.034 ( -1.467 1.777 0.811) 2.443 13.324 ( -1.509 5.598 2.671) 6.383 13.711 ( 5.313 2.265 -5.000) 7.640 13.944 ( -2.513 -8.577 1.597) 9.079 14.220 ( 5.758 -9.831 -0.770) 11.419 ======================= Grid point 316 (168/260) ======================= q-point: (-0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.482 ( -23.235 19.821 12.363) 32.948 3.637 ( -18.064 22.973 14.184) 32.485 4.659 ( -3.832 -14.114 0.214) 14.626 4.727 ( -4.142 -3.538 7.886) 9.584 4.928 ( -2.884 0.214 -0.999) 3.059 5.075 ( -2.127 1.363 2.532) 3.577 5.597 ( -0.538 8.810 1.644) 8.979 5.824 ( 2.846 -0.552 -6.126) 6.778 6.012 ( -0.205 1.221 -2.529) 2.815 6.060 ( 1.744 1.441 -2.741) 3.554 6.316 ( -4.155 7.816 -3.040) 9.360 6.517 ( -2.528 3.653 4.368) 6.230 7.219 ( -4.736 5.755 9.190) 11.832 7.497 ( 3.531 -5.533 4.320) 7.858 7.586 ( -3.102 -5.795 10.966) 12.785 7.996 ( 0.586 -3.610 0.871) 3.759 8.120 ( -0.661 3.669 -0.119) 3.730 8.561 ( 5.659 3.553 -1.964) 6.965 8.662 ( -1.376 -6.081 2.689) 6.790 8.826 ( -3.128 -7.774 -3.591) 9.117 9.044 ( -3.242 3.528 -0.250) 4.798 9.465 ( -1.108 -5.615 0.392) 5.736 9.889 ( -0.028 3.053 -1.355) 3.341 10.234 ( 1.366 -2.656 -6.491) 7.145 10.690 ( 2.763 -1.345 2.481) 3.949 10.713 ( 2.164 -0.355 -3.474) 4.108 10.969 ( 4.764 4.819 -2.711) 7.298 11.089 ( 2.450 4.683 3.004) 6.080 11.327 ( 0.386 -2.269 -7.838) 8.169 11.349 ( 0.600 1.568 2.662) 3.147 11.828 ( -3.901 4.981 2.903) 6.960 12.009 ( -1.806 1.227 0.766) 2.313 13.315 ( -1.370 6.167 2.057) 6.644 13.773 ( 5.786 3.064 -5.605) 8.619 13.909 ( -2.603 -8.472 1.432) 8.978 14.297 ( 3.988 -10.792 -2.623) 11.801 ======================= Grid point 317 (169/260) ======================= q-point: (-0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.217 ( -16.964 26.625 17.032) 35.871 3.517 ( -10.787 24.384 21.603) 34.316 4.608 ( -4.149 -9.634 4.802) 11.536 4.739 ( -2.100 -10.823 9.679) 14.670 4.885 ( -1.417 3.314 2.330) 4.292 5.019 ( -4.917 4.450 -0.750) 6.674 5.534 ( -9.120 18.834 8.440) 22.564 5.779 ( -2.788 1.531 -4.494) 5.506 6.008 ( 1.475 -2.909 -3.304) 4.643 6.063 ( 0.362 2.064 -2.661) 3.387 6.278 ( 3.685 0.456 -8.278) 9.072 6.476 ( -4.071 1.877 2.156) 4.974 7.227 ( -2.037 0.804 8.691) 8.963 7.513 ( -2.729 -5.129 1.574) 6.019 7.642 ( -0.526 -2.284 9.826) 10.102 8.021 ( 0.792 -6.979 3.419) 7.812 8.170 ( 5.666 1.782 -0.324) 5.949 8.604 ( 1.731 3.084 -3.093) 4.699 8.681 ( 1.185 -5.079 2.959) 5.997 8.748 ( -2.793 -7.456 -3.012) 8.513 8.987 ( -2.962 4.345 -0.596) 5.292 9.451 ( -0.959 -6.197 0.161) 6.273 9.898 ( 1.202 3.506 0.729) 3.778 10.212 ( 1.413 -2.193 -5.921) 6.470 10.712 ( 1.501 0.918 -4.093) 4.455 10.748 ( 2.173 -1.846 0.607) 2.915 11.029 ( 2.793 2.964 -0.037) 4.072 11.167 ( 4.262 5.557 2.093) 7.309 11.271 ( -0.929 -1.980 -4.342) 4.862 11.425 ( 3.470 1.712 4.334) 5.810 11.774 ( -3.922 5.193 2.242) 6.883 11.991 ( -0.478 0.365 0.906) 1.088 13.305 ( -1.252 6.583 1.746) 6.925 13.826 ( 5.007 1.557 -7.137) 8.856 13.875 ( -2.412 -6.302 2.008) 7.040 14.315 ( 0.985 -10.173 -4.559) 11.191 ======================= Grid point 318 (170/260) ======================= q-point: (-0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.162 ( -4.061 30.501 20.304) 36.865 3.554 ( -4.533 24.723 25.143) 35.553 4.583 ( -2.054 -3.505 3.537) 5.386 4.763 ( -2.712 -5.496 9.664) 11.444 4.883 ( -5.058 10.336 -2.709) 11.822 4.971 ( 2.878 -5.434 9.190) 11.057 5.452 ( -8.137 22.652 13.498) 27.596 5.689 ( -3.816 0.755 -2.978) 4.899 5.991 ( -0.600 -7.088 -4.397) 8.363 6.035 ( -0.713 3.732 -3.424) 5.115 6.287 ( 2.844 -3.652 -8.613) 9.778 6.429 ( -1.295 -0.992 -0.147) 1.638 7.255 ( -2.063 -3.621 8.384) 9.363 7.462 ( -4.224 -3.193 2.255) 5.755 7.677 ( -2.402 -0.483 6.259) 6.722 8.077 ( 2.486 -9.502 2.766) 10.204 8.272 ( 5.389 0.606 -0.245) 5.428 8.594 ( -0.462 3.400 -2.635) 4.326 8.673 ( -1.575 -1.168 -3.135) 3.697 8.761 ( 3.892 -10.261 3.456) 11.506 8.928 ( -2.372 5.464 -2.346) 6.402 9.417 ( -2.486 -6.776 -2.116) 7.521 9.943 ( 2.207 4.538 3.295) 6.027 10.208 ( 2.484 -1.052 -4.553) 5.292 10.707 ( 1.315 1.622 -3.723) 4.269 10.786 ( 1.831 -1.262 0.237) 2.237 11.072 ( 1.373 1.775 1.904) 2.943 11.223 ( 0.014 -3.347 -2.413) 4.126 11.262 ( 2.981 6.481 0.871) 7.187 11.504 ( 1.546 1.900 3.769) 4.495 11.738 ( -1.856 4.878 2.962) 6.001 12.014 ( 2.374 -1.353 1.001) 2.910 13.297 ( -1.158 6.740 1.802) 7.072 13.817 ( -0.712 -7.005 -4.174) 8.185 13.879 ( 1.951 2.680 -1.596) 3.679 14.271 ( -1.565 -7.963 -5.592) 9.855 ======================= Grid point 319 (171/260) ======================= q-point: ( 0.00 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.910 ( 6.019 25.007 15.935) 30.257 4.119 ( 0.133 14.105 16.037) 21.358 4.478 ( 6.139 -11.058 15.818) 20.252 4.601 ( 2.214 -14.299 14.388) 20.406 4.999 ( 0.497 7.793 -4.722) 9.126 5.065 ( 3.780 0.636 2.230) 4.434 5.635 ( -2.614 1.988 -2.569) 4.170 5.729 ( -3.030 -7.835 -3.573) 9.129 5.933 ( -6.392 16.999 6.259) 19.209 6.068 ( -4.076 4.552 -5.955) 8.532 6.135 ( 2.300 -1.894 -4.769) 5.623 6.333 ( 3.734 -9.205 -1.755) 10.087 7.221 ( -5.930 1.507 6.773) 9.128 7.300 ( -6.795 -5.359 3.404) 9.299 7.738 ( -4.505 7.487 9.859) 13.173 7.924 ( -0.953 -10.531 7.840) 13.164 8.375 ( 1.821 3.569 -0.096) 4.008 8.493 ( -1.181 -6.838 -1.599) 7.121 8.658 ( 1.268 2.190 -1.677) 3.035 8.719 ( 3.058 -4.361 0.339) 5.338 9.038 ( 0.906 8.438 -5.281) 9.996 9.203 ( -0.455 -7.871 -4.958) 9.314 10.122 ( 2.600 5.198 2.538) 6.342 10.203 ( 2.817 -2.773 -0.474) 3.981 10.755 ( 1.879 2.125 -1.510) 3.213 10.792 ( 1.707 -1.536 -0.322) 2.319 11.113 ( -0.393 1.639 -0.653) 1.808 11.156 ( 1.834 -2.880 -1.660) 3.797 11.441 ( 0.179 6.204 2.518) 6.698 11.532 ( -0.573 -2.465 3.124) 4.020 11.853 ( 0.268 6.434 2.080) 6.767 11.982 ( 1.865 -6.107 1.346) 6.526 13.446 ( -0.784 8.567 0.342) 8.610 13.618 ( -1.060 -8.404 -0.966) 8.525 13.966 ( 0.866 4.679 -4.834) 6.783 14.075 ( -0.437 -6.030 -5.246) 8.004 ======================= Grid point 320 (172/260) ======================= q-point: ( 0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.169 ( 10.465 17.349 13.091) 24.122 4.257 ( 3.446 10.736 13.149) 17.321 4.711 ( 8.133 -1.726 9.476) 12.607 4.760 ( 4.933 -7.020 11.777) 14.571 5.007 ( 3.979 8.873 -2.497) 10.040 5.167 ( 4.442 -4.973 5.150) 8.426 5.590 ( -0.473 1.079 -1.949) 2.277 5.633 ( -5.290 -4.904 -2.718) 7.708 5.839 ( -5.998 5.011 -0.641) 7.842 5.926 ( -4.280 -2.273 -7.899) 9.267 6.229 ( 6.519 8.354 2.793) 10.958 6.394 ( 3.498 -4.598 -0.420) 5.793 7.141 ( -8.151 -0.554 3.617) 8.935 7.203 ( -5.820 -5.641 4.040) 9.056 7.716 ( -5.402 10.919 9.631) 15.529 7.953 ( -1.262 -11.464 6.350) 13.166 8.385 ( -0.628 1.209 0.000) 1.363 8.443 ( -3.239 -3.705 -0.125) 4.923 8.679 ( 1.481 2.773 0.210) 3.151 8.773 ( 1.375 -6.701 2.257) 7.203 9.037 ( 3.617 7.826 -5.667) 10.317 9.184 ( 2.772 -6.671 -5.111) 8.849 10.172 ( 1.915 4.667 0.055) 5.045 10.240 ( 2.265 -2.105 -2.067) 3.720 10.776 ( 1.008 2.094 -0.543) 2.386 10.809 ( 0.135 -1.244 0.087) 1.254 11.099 ( -0.112 3.926 -1.564) 4.227 11.189 ( 2.914 -4.950 -3.018) 6.489 11.443 ( -1.734 5.494 2.859) 6.431 11.523 ( -2.414 -1.927 2.310) 3.857 11.876 ( 0.631 7.419 1.802) 7.661 12.028 ( 2.067 -7.414 0.793) 7.738 13.436 ( -0.745 7.994 0.785) 8.067 13.594 ( -0.710 -7.444 -1.244) 7.580 13.939 ( -0.181 3.467 -3.905) 5.225 14.027 ( -0.848 -5.020 -4.562) 6.836 ======================= Grid point 321 (173/260) ======================= q-point: ( 0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.420 ( 5.941 9.575 9.758) 14.906 4.443 ( 9.457 7.871 10.516) 16.185 4.863 ( 5.720 6.636 0.409) 8.771 4.919 ( 3.807 0.537 6.089) 7.202 5.097 ( 5.080 6.193 0.958) 8.067 5.282 ( 4.167 -5.767 3.760) 8.047 5.508 ( -5.642 -0.535 -2.142) 6.059 5.600 ( 1.656 -3.187 2.049) 4.135 5.723 ( -5.091 0.003 -5.126) 7.224 5.818 ( -0.586 -6.005 -9.580) 11.322 6.325 ( -0.215 8.245 4.052) 9.189 6.469 ( 4.312 -3.515 3.548) 6.598 7.021 ( -5.978 3.813 3.111) 7.743 7.170 ( -0.579 -8.816 2.315) 9.133 7.708 ( -3.262 14.580 10.952) 18.525 7.980 ( -0.990 -9.749 6.332) 11.667 8.346 ( -3.607 0.969 0.101) 3.736 8.396 ( -3.091 -4.677 3.609) 6.667 8.700 ( 0.119 1.924 0.683) 2.045 8.790 ( -1.560 -6.736 2.979) 7.529 9.084 ( 5.855 7.504 -5.101) 10.798 9.228 ( 5.542 -6.845 -4.245) 9.777 10.193 ( 1.612 4.228 -2.613) 5.225 10.253 ( 1.623 -1.817 -3.910) 4.607 10.773 ( -1.017 1.408 -1.125) 2.070 10.795 ( -1.495 -0.913 -0.904) 1.972 11.081 ( -0.278 5.741 -2.881) 6.429 11.186 ( -0.262 -3.991 -5.417) 6.734 11.438 ( -1.320 3.109 3.648) 4.972 11.497 ( -1.642 -1.982 1.898) 3.197 11.900 ( 0.663 8.084 1.587) 8.265 12.057 ( 0.729 -7.364 -0.026) 7.400 13.432 ( -0.546 7.397 1.430) 7.554 13.577 ( -0.035 -6.549 -1.479) 6.714 13.909 ( -0.436 2.294 -2.605) 3.498 13.983 ( -0.816 -4.712 -3.455) 5.900 ======================= Grid point 322 (174/260) ======================= q-point: ( 0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.581 ( 4.669 7.854 7.673) 11.931 4.651 ( 5.762 1.583 7.463) 9.561 4.910 ( -5.845 9.244 5.987) 12.468 4.969 ( 3.907 6.015 -2.861) 7.722 5.152 ( 2.608 5.290 -3.964) 7.106 5.314 ( 0.634 -3.758 -7.796) 8.677 5.435 ( -0.968 -2.356 -4.730) 5.373 5.514 ( -11.888 -4.415 -6.991) 14.481 5.717 ( 6.834 -0.650 3.344) 7.636 5.805 ( 4.616 -7.537 -1.981) 9.057 6.332 ( -1.722 9.647 7.595) 12.397 6.552 ( 0.700 -10.890 6.277) 12.589 7.020 ( 2.834 8.367 2.758) 9.254 7.206 ( 2.726 -9.516 0.836) 9.934 7.772 ( 0.850 16.809 12.829) 21.163 7.984 ( -4.662 -1.254 6.256) 7.902 8.282 ( -3.762 1.998 1.534) 4.527 8.397 ( 0.060 -8.716 5.287) 10.194 8.687 ( -1.635 -0.045 -0.157) 1.643 8.766 ( -3.653 -7.528 3.407) 9.034 9.160 ( 6.069 7.069 -4.084) 10.172 9.300 ( 5.182 -6.880 -3.273) 9.215 10.193 ( 1.260 3.401 -4.614) 5.869 10.241 ( 0.814 -1.446 -5.455) 5.702 10.716 ( -3.787 1.582 -2.201) 4.657 10.747 ( -2.213 -1.387 -2.923) 3.920 11.048 ( -0.536 5.439 -3.643) 6.568 11.120 ( -1.902 -1.164 -5.197) 5.655 11.436 ( -1.615 2.141 2.280) 3.520 11.496 ( -0.137 -3.410 0.696) 3.483 11.925 ( 0.794 7.265 1.942) 7.561 12.056 ( -0.401 -5.580 -0.332) 5.604 13.438 ( -0.257 7.060 2.069) 7.361 13.574 ( 0.947 -5.781 -1.418) 6.027 13.890 ( 0.005 0.789 -1.478) 1.675 13.949 ( -0.425 -4.617 -2.499) 5.268 ======================= Grid point 323 (175/260) ======================= q-point: (-0.60 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.617 ( -9.523 9.776 4.000) 14.222 4.716 ( -2.324 0.717 7.170) 7.571 4.881 ( 1.377 7.983 4.920) 9.478 4.981 ( -1.500 -0.150 -2.534) 2.948 5.085 ( -12.059 4.879 -10.301) 16.593 5.206 ( -11.573 -6.400 -8.019) 15.466 5.254 ( 6.107 6.762 -7.329) 11.693 5.449 ( 6.757 -10.864 -7.537) 14.849 5.868 ( 6.830 0.094 2.528) 7.283 5.916 ( 6.606 -4.306 0.765) 7.923 6.396 ( 1.525 9.673 9.807) 13.858 6.610 ( 0.292 -10.837 7.750) 13.326 7.103 ( 3.348 6.292 2.767) 7.645 7.262 ( 2.376 -9.000 1.657) 9.455 7.892 ( -5.589 10.343 12.143) 16.902 7.900 ( -2.959 7.494 5.815) 9.936 8.262 ( 0.545 7.368 3.842) 8.327 8.460 ( 1.762 -5.794 3.733) 7.115 8.650 ( -1.414 -3.793 -1.626) 4.362 8.715 ( -4.952 -10.612 4.392) 12.507 9.224 ( 3.890 6.354 -3.478) 8.222 9.353 ( 3.135 -6.466 -2.753) 7.695 10.159 ( -1.168 2.907 -5.818) 6.608 10.209 ( 0.291 -1.983 -5.588) 5.937 10.631 ( -2.927 2.859 -2.511) 4.800 10.687 ( -1.374 -2.424 -3.401) 4.396 11.019 ( 0.563 4.688 -4.333) 6.409 11.065 ( -0.336 0.193 -3.845) 3.865 11.412 ( -2.183 2.135 0.610) 3.114 11.480 ( -1.414 -4.402 -2.001) 5.038 11.953 ( 0.418 5.781 2.397) 6.273 12.048 ( -0.431 -3.329 0.449) 3.387 13.451 ( -0.081 7.398 2.271) 7.739 13.591 ( 2.034 -5.415 -1.174) 5.903 13.885 ( 0.090 -0.527 -0.835) 0.992 13.938 ( 1.235 -4.852 -1.917) 5.361 ======================= Grid point 324 (176/260) ======================= q-point: (-0.50 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.400 ( -15.684 15.455 3.874) 22.357 4.659 ( -8.834 -6.794 2.470) 11.415 4.701 ( -20.329 8.609 -5.367) 22.720 4.860 ( -9.436 -3.542 -6.340) 11.908 4.955 ( 2.910 2.976 0.646) 4.212 5.039 ( -3.306 -5.466 3.834) 7.450 5.395 ( 12.445 5.803 -5.991) 14.981 5.548 ( 9.540 -8.699 -6.672) 14.533 5.981 ( 5.301 0.796 -1.136) 5.480 6.013 ( 4.917 -2.037 -2.682) 5.960 6.503 ( 2.085 8.183 8.979) 12.326 6.655 ( -1.456 -5.807 5.567) 8.175 7.180 ( 2.168 3.682 6.179) 7.513 7.313 ( 1.278 -8.379 3.796) 9.287 7.753 ( -12.683 13.483 10.734) 21.398 7.932 ( -3.590 -3.481 5.521) 7.449 8.354 ( 2.020 12.198 5.898) 13.699 8.473 ( 0.679 3.134 -0.514) 3.248 8.600 ( -4.316 -5.877 -0.240) 7.295 8.695 ( 0.638 -14.166 1.686) 14.281 9.241 ( 0.755 6.151 -3.211) 6.980 9.370 ( 0.947 -6.634 -2.431) 7.129 10.081 ( -2.676 4.384 -4.493) 6.824 10.174 ( -0.349 -4.578 -3.472) 5.757 10.599 ( 1.164 3.426 -1.989) 4.129 10.662 ( 1.109 -2.559 -2.887) 4.014 11.007 ( 2.221 4.503 -5.496) 7.445 11.052 ( 1.649 0.283 -3.330) 3.726 11.373 ( -2.307 1.264 0.162) 2.635 11.422 ( -2.364 -3.796 -3.762) 5.844 11.969 ( -0.759 4.969 2.473) 5.602 12.045 ( -0.800 -2.262 1.202) 2.684 13.465 ( -0.092 8.287 1.843) 8.490 13.626 ( 2.642 -6.202 -1.055) 6.823 13.879 ( 0.246 0.831 -0.977) 1.306 13.969 ( 3.490 -6.744 -1.516) 7.743 ======================= Grid point 325 (177/260) ======================= q-point: (-0.40 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.142 ( -16.775 17.665 4.643) 24.799 4.336 ( -18.230 17.286 2.438) 25.241 4.479 ( -10.986 -14.656 -0.839) 18.335 4.656 ( -11.109 -12.391 3.235) 16.953 4.989 ( 0.623 3.557 0.479) 3.643 5.054 ( 0.471 -2.213 2.770) 3.577 5.572 ( 11.196 4.174 -4.643) 12.819 5.674 ( 9.418 -5.703 -5.838) 12.462 6.039 ( 3.412 0.870 -3.990) 5.322 6.058 ( 3.627 -0.623 -5.199) 6.370 6.572 ( -1.299 4.898 6.035) 7.880 6.619 ( -5.908 1.427 2.838) 6.708 7.278 ( 2.521 0.897 8.423) 8.838 7.365 ( 1.029 -6.281 4.603) 7.855 7.624 ( -11.484 14.976 14.624) 23.875 7.888 ( -5.363 -9.338 5.808) 12.235 8.311 ( -5.843 8.324 0.694) 10.194 8.506 ( -5.705 -10.683 3.420) 12.585 8.568 ( 6.403 6.954 -2.137) 9.692 8.717 ( 1.646 -8.359 -2.606) 8.910 9.212 ( -1.280 6.749 -2.712) 7.385 9.354 ( -0.722 -7.232 -1.931) 7.520 10.018 ( -1.776 6.214 -1.512) 6.638 10.151 ( -0.327 -6.527 -1.492) 6.703 10.633 ( 3.601 2.388 -1.586) 4.603 10.677 ( 2.748 -1.764 -3.006) 4.439 11.023 ( 4.190 4.665 -5.670) 8.454 11.077 ( 3.809 -0.123 -2.909) 4.794 11.339 ( -1.612 -0.022 -0.096) 1.615 11.356 ( -2.237 -2.011 -2.119) 3.680 11.960 ( -2.187 4.605 2.242) 5.569 12.030 ( -1.943 -2.094 1.273) 3.127 13.473 ( -0.196 9.094 1.090) 9.161 13.661 ( 1.977 -8.494 -1.103) 8.790 13.887 ( 1.786 4.399 -1.590) 5.007 14.030 ( 4.422 -8.873 -1.865) 10.088 ======================= Grid point 326 (178/260) ======================= q-point: (-0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.894 ( -15.952 21.070 9.625) 28.125 4.105 ( -12.710 22.481 8.922) 27.323 4.309 ( -9.283 -19.163 5.698) 22.042 4.516 ( -8.669 -16.895 6.699) 20.136 4.993 ( -0.194 5.030 0.134) 5.035 5.073 ( 0.067 -2.200 0.776) 2.334 5.704 ( 6.693 3.706 -3.567) 8.442 5.779 ( 6.551 -3.597 -5.598) 9.338 6.050 ( 1.588 2.249 -4.798) 5.532 6.079 ( 3.515 -0.286 -5.799) 6.787 6.483 ( -9.060 6.967 1.043) 11.476 6.555 ( -5.594 -0.360 3.645) 6.687 7.348 ( -2.357 3.606 6.942) 8.170 7.409 ( 0.830 -3.720 3.096) 4.910 7.588 ( -5.104 9.465 17.016) 20.129 7.841 ( -5.525 -11.861 8.756) 15.744 8.235 ( -1.993 8.096 -0.081) 8.338 8.444 ( -2.991 -12.388 2.570) 13.001 8.642 ( 3.682 3.758 -3.038) 6.075 8.716 ( 1.070 -3.860 -4.053) 5.699 9.166 ( -1.743 7.572 -2.070) 8.041 9.325 ( -1.102 -7.955 -1.326) 8.140 9.995 ( -0.476 6.895 0.360) 6.921 10.136 ( -0.142 -6.661 -1.304) 6.789 10.686 ( 3.522 0.826 -1.919) 4.095 10.705 ( 2.885 -0.770 -3.697) 4.752 11.068 ( 4.441 4.828 -4.316) 7.852 11.138 ( 4.562 -1.042 -2.172) 5.160 11.303 ( -0.889 1.137 -1.138) 1.838 11.346 ( 0.546 -1.841 3.239) 3.766 11.925 ( -3.271 4.556 1.826) 5.899 11.997 ( -2.644 -2.331 1.165) 3.712 13.474 ( -0.340 9.461 0.445) 9.478 13.675 ( 0.466 -10.155 -1.075) 10.223 13.918 ( 3.339 6.912 -2.747) 8.153 14.088 ( 3.908 -9.801 -2.942) 10.954 ======================= Grid point 327 (179/260) ======================= q-point: (-0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.746 ( -10.570 25.961 15.595) 32.076 4.008 ( -7.537 23.313 13.680) 28.062 4.245 ( -5.355 -21.874 12.641) 25.825 4.453 ( -4.898 -18.706 9.593) 21.585 4.991 ( 0.228 5.920 -0.302) 5.932 5.067 ( -0.581 -0.783 -1.200) 1.546 5.750 ( 0.990 3.702 -2.609) 4.635 5.814 ( 1.688 -1.858 -4.675) 5.306 6.029 ( -0.796 6.684 -2.917) 7.336 6.101 ( 3.561 0.018 -5.657) 6.684 6.331 ( -6.898 5.369 -2.070) 8.983 6.451 ( -8.028 -4.553 2.209) 9.490 7.316 ( -5.357 6.383 6.509) 10.574 7.421 ( -2.006 -4.328 2.283) 5.288 7.655 ( -1.326 4.683 14.184) 14.996 7.832 ( -3.459 -11.106 11.204) 16.150 8.251 ( 3.157 6.754 0.368) 7.465 8.445 ( 0.989 -12.459 2.120) 12.677 8.662 ( 1.675 2.462 -3.757) 4.794 8.701 ( 0.640 -1.461 -4.015) 4.321 9.121 ( -1.615 8.245 -2.297) 8.710 9.296 ( -1.120 -8.813 -1.743) 9.053 10.006 ( 0.934 6.558 1.679) 6.834 10.132 ( 0.869 -5.595 -1.075) 5.763 10.724 ( 2.407 0.227 -3.947) 4.628 10.727 ( 2.920 -0.334 -2.296) 3.730 11.100 ( 1.770 3.916 -1.978) 4.731 11.176 ( 1.354 -3.340 -2.949) 4.656 11.323 ( 2.511 5.483 2.749) 6.628 11.412 ( 3.174 -2.894 4.220) 6.022 11.878 ( -3.153 5.031 1.536) 6.132 11.962 ( -1.966 -3.128 1.245) 3.899 13.468 ( -0.533 9.408 0.114) 9.423 13.665 ( -0.585 -10.075 -0.961) 10.137 13.956 ( 3.390 7.005 -4.051) 8.773 14.119 ( 2.383 -9.254 -4.242) 10.455 ======================= Grid point 328 (180/260) ======================= q-point: (-0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.752 ( -2.244 28.031 17.448) 33.094 4.026 ( -3.341 19.916 16.918) 26.344 4.302 ( 0.361 -19.079 15.607) 24.652 4.486 ( -0.955 -18.322 13.500) 22.779 5.006 ( 1.798 4.921 0.113) 5.241 5.036 ( -0.792 3.112 -3.378) 4.661 5.708 ( -2.859 2.481 -2.843) 4.734 5.789 ( -1.119 -3.606 -2.883) 4.750 5.984 ( -4.237 16.865 3.674) 17.773 6.108 ( 1.600 2.868 -6.099) 6.926 6.224 ( -2.306 -2.132 -6.922) 7.601 6.333 ( -4.693 -9.128 0.569) 10.279 7.270 ( -5.481 4.414 7.221) 10.083 7.378 ( -4.629 -5.252 2.852) 7.560 7.720 ( -2.119 4.927 11.408) 12.606 7.873 ( -1.022 -9.940 10.111) 14.216 8.323 ( 3.776 5.173 0.498) 6.424 8.489 ( 1.989 -11.115 0.578) 11.306 8.657 ( 1.023 2.149 -3.392) 4.144 8.688 ( 1.175 -1.019 -2.774) 3.180 9.075 ( -1.050 8.614 -3.872) 9.502 9.255 ( -1.408 -9.027 -3.545) 9.800 10.054 ( 2.392 5.902 3.050) 7.061 10.157 ( 2.381 -4.074 -0.232) 4.724 10.737 ( 2.082 1.292 -3.125) 3.971 10.760 ( 2.515 -1.183 -1.553) 3.184 11.111 ( 0.784 2.225 -0.614) 2.438 11.161 ( -0.405 -2.760 -1.888) 3.368 11.396 ( 2.550 6.291 2.922) 7.391 11.493 ( 2.034 -2.991 4.055) 5.433 11.847 ( -1.413 5.814 1.751) 6.234 11.954 ( 0.026 -4.509 1.458) 4.739 13.458 ( -0.706 9.063 0.106) 9.091 13.644 ( -1.045 -9.328 -0.881) 9.427 13.974 ( 2.278 5.973 -4.887) 8.047 14.112 ( 0.701 -7.691 -5.139) 9.276 ======================= Grid point 369 (181/260) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.863 ( 9.408 0.000 30.495) 31.913 3.056 ( -6.209 0.000 31.448) 32.055 3.875 ( -6.104 0.000 -19.022) 19.977 4.067 ( 2.787 0.000 -17.374) 17.596 4.997 ( -2.772 0.000 45.395) 45.480 5.303 ( -6.140 0.000 4.600) 7.672 5.512 ( 1.010 0.000 -3.093) 3.254 5.714 ( 7.581 0.000 1.236) 7.681 6.001 ( -3.859 0.000 -3.055) 4.922 6.141 ( 0.362 0.000 0.364) 0.513 6.350 ( -1.574 0.000 0.984) 1.856 6.490 ( 2.214 0.000 -2.990) 3.721 7.432 ( -9.193 0.000 2.874) 9.632 7.809 ( -1.417 0.000 -1.086) 1.785 7.920 ( 4.979 0.000 -16.131) 16.882 8.035 ( 3.329 0.000 -6.469) 7.275 8.213 ( -8.176 0.000 0.230) 8.179 8.286 ( 6.451 0.000 -0.997) 6.528 8.578 ( 0.251 0.000 5.915) 5.921 8.761 ( -0.011 0.000 -1.441) 1.441 9.361 ( 5.033 0.000 4.634) 6.841 9.463 ( -5.949 0.000 -0.375) 5.961 9.893 ( -0.068 0.000 3.102) 3.102 10.098 ( 2.679 0.000 -5.655) 6.258 10.616 ( 1.059 0.000 -0.940) 1.416 10.671 ( 0.746 0.000 -2.159) 2.285 10.992 ( -5.084 0.000 2.098) 5.500 11.074 ( 5.504 0.000 -2.174) 5.918 11.462 ( 0.458 0.000 4.646) 4.669 11.605 ( -1.964 0.000 -2.966) 3.557 11.646 ( -9.884 0.000 9.325) 13.589 12.022 ( 17.707 0.000 -10.453) 20.563 13.308 ( -0.045 0.000 6.917) 6.917 13.588 ( 1.360 0.000 -7.313) 7.438 14.156 ( 0.409 0.000 1.445) 1.502 14.211 ( -8.331 0.000 -1.530) 8.471 ======================= Grid point 370 (182/260) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.258 ( 4.565 0.000 27.441) 27.818 3.386 ( 24.464 0.000 25.100) 35.050 3.768 ( 9.804 0.000 -19.291) 21.639 4.053 ( 10.178 0.000 -17.333) 20.101 5.204 ( -9.297 0.000 5.789) 10.952 5.275 ( 0.336 0.000 32.507) 32.509 5.466 ( -6.307 0.000 3.160) 7.054 5.805 ( 3.452 0.000 -3.535) 4.941 5.915 ( -2.221 0.000 -1.818) 2.871 6.117 ( -0.908 0.000 -4.320) 4.414 6.323 ( -3.154 0.000 2.150) 3.817 6.476 ( -0.767 0.000 -3.782) 3.859 7.319 ( -6.402 0.000 4.892) 8.057 7.713 ( -10.180 0.000 3.976) 10.929 7.896 ( -12.086 0.000 -4.579) 12.924 7.920 ( 9.001 0.000 -16.536) 18.828 8.186 ( 2.567 0.000 1.170) 2.821 8.418 ( 7.518 0.000 0.435) 7.531 8.596 ( -3.556 0.000 4.288) 5.571 8.779 ( 4.243 0.000 -2.754) 5.059 9.384 ( -1.415 0.000 -0.640) 1.553 9.503 ( 6.052 0.000 4.197) 7.365 9.903 ( -1.026 0.000 3.222) 3.381 10.107 ( 3.105 0.000 -6.857) 7.528 10.633 ( 1.452 0.000 -0.846) 1.681 10.668 ( 0.554 0.000 -1.755) 1.841 10.911 ( -4.637 0.000 0.276) 4.645 11.164 ( 5.672 0.000 -1.657) 5.909 11.459 ( -15.322 0.000 4.746) 16.040 11.524 ( 2.038 0.000 5.233) 5.616 11.567 ( -1.402 0.000 -1.381) 1.968 12.155 ( 7.025 0.000 -13.142) 14.902 13.367 ( 0.836 0.000 5.761) 5.821 13.557 ( 1.468 0.000 -7.651) 7.790 14.103 ( -3.900 0.000 2.814) 4.809 14.196 ( 1.625 0.000 4.062) 4.375 ======================= Grid point 371 (183/260) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.595 ( 13.448 0.000 20.443) 24.470 3.918 ( 20.143 0.000 -16.234) 25.871 3.954 ( 20.656 0.000 6.097) 21.537 4.230 ( 21.420 0.000 -1.697) 21.487 5.060 ( -12.285 0.000 7.423) 14.354 5.230 ( -16.889 0.000 4.828) 17.566 5.532 ( 4.872 0.000 9.816) 10.958 5.786 ( 0.752 0.000 -10.535) 10.562 5.935 ( 1.883 0.000 6.757) 7.014 6.077 ( -1.177 0.000 -0.810) 1.429 6.254 ( -5.134 0.000 -0.816) 5.199 6.430 ( -0.559 0.000 -3.222) 3.270 7.278 ( -3.745 0.000 8.472) 9.263 7.549 ( -9.727 0.000 1.822) 9.896 7.617 ( -16.717 0.000 -0.589) 16.727 7.986 ( 8.748 0.000 -9.837) 13.165 8.256 ( 4.016 0.000 0.771) 4.089 8.503 ( -9.516 0.000 3.931) 10.296 8.521 ( 2.440 0.000 1.983) 3.145 8.874 ( 9.693 0.000 -6.035) 11.418 9.413 ( 4.026 0.000 0.698) 4.086 9.597 ( 1.198 0.000 2.783) 3.030 9.920 ( 0.538 0.000 3.120) 3.166 10.102 ( 2.753 0.000 -9.368) 9.764 10.652 ( 1.363 0.000 -1.126) 1.768 10.667 ( 0.654 0.000 -1.225) 1.388 10.841 ( -3.259 0.000 -0.050) 3.260 11.161 ( -14.085 0.000 2.130) 14.245 11.250 ( -0.873 0.000 -2.248) 2.412 11.571 ( 2.709 0.000 0.351) 2.732 11.600 ( 2.157 0.000 5.025) 5.468 12.105 ( -1.018 0.000 -13.345) 13.384 13.402 ( -1.286 0.000 4.733) 4.905 13.533 ( 1.904 0.000 -7.094) 7.345 14.115 ( 1.875 0.000 4.271) 4.665 14.263 ( 1.432 0.000 6.239) 6.401 ======================= Grid point 372 (184/260) ======================= q-point: ( 0.30 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.005 ( 17.345 0.000 15.153) 23.032 4.180 ( 20.401 0.000 -15.267) 25.481 4.219 ( 15.906 0.000 -10.005) 18.791 4.631 ( 4.763 0.000 12.222) 13.117 4.884 ( -13.988 0.000 9.550) 16.937 4.978 ( -6.612 0.000 5.213) 8.420 5.647 ( 6.583 0.000 -5.841) 8.801 5.716 ( 0.032 0.000 -9.124) 9.124 6.005 ( -0.893 0.000 4.608) 4.694 6.052 ( -2.363 0.000 1.399) 2.746 6.158 ( -2.197 0.000 -4.186) 4.727 6.456 ( 4.783 0.000 0.782) 4.846 7.294 ( -9.869 0.000 7.201) 12.217 7.336 ( -8.287 0.000 10.035) 13.014 7.413 ( -5.794 0.000 -0.896) 5.863 8.070 ( 6.703 0.000 -6.023) 9.012 8.295 ( -2.087 0.000 -4.205) 4.695 8.384 ( -5.172 0.000 10.020) 11.277 8.518 ( -4.430 0.000 1.472) 4.668 9.003 ( 9.998 0.000 -9.526) 13.810 9.502 ( 4.232 0.000 1.822) 4.608 9.604 ( -1.695 0.000 3.138) 3.567 9.943 ( -0.324 0.000 0.272) 0.423 10.070 ( 2.545 0.000 -12.079) 12.344 10.663 ( 0.781 0.000 -0.865) 1.166 10.675 ( 0.969 0.000 -0.760) 1.231 10.800 ( -1.790 0.000 1.277) 2.198 10.923 ( -12.361 0.000 4.982) 13.327 11.220 ( -0.552 0.000 -5.851) 5.877 11.660 ( 0.758 0.000 2.884) 2.982 11.660 ( 5.414 0.000 2.480) 5.955 11.959 ( -4.285 0.000 -11.522) 12.293 13.397 ( -2.764 0.000 4.604) 5.370 13.522 ( 2.183 0.000 -6.158) 6.533 14.210 ( 5.159 0.000 3.674) 6.333 14.328 ( 0.172 0.000 7.131) 7.133 ======================= Grid point 373 (185/260) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.299 ( -1.888 0.000 9.561) 9.746 4.393 ( -15.330 0.000 6.433) 16.625 4.425 ( 22.912 0.000 -15.229) 27.512 4.429 ( 3.269 0.000 -5.511) 6.408 4.756 ( -6.822 0.000 14.227) 15.778 5.186 ( 13.177 0.000 4.912) 14.063 5.642 ( -4.253 0.000 -2.737) 5.058 5.674 ( 1.804 0.000 -8.417) 8.608 5.965 ( -5.344 0.000 2.460) 5.882 6.034 ( 0.037 0.000 1.129) 1.130 6.155 ( 5.993 0.000 -4.779) 7.665 6.490 ( -5.962 0.000 -0.478) 5.981 7.124 ( -3.576 0.000 3.191) 4.792 7.334 ( -1.369 0.000 -3.517) 3.774 7.494 ( 8.270 0.000 17.847) 19.670 8.127 ( 4.039 0.000 -4.880) 6.334 8.180 ( -6.175 0.000 0.097) 6.175 8.386 ( -10.443 0.000 -0.639) 10.462 8.418 ( -1.556 0.000 8.480) 8.621 9.060 ( 5.045 0.000 -12.082) 13.093 9.575 ( 1.985 0.000 2.556) 3.236 9.608 ( -1.146 0.000 4.792) 4.927 9.902 ( -1.932 0.000 -4.380) 4.788 10.026 ( 3.060 0.000 -13.246) 13.595 10.681 ( 1.561 0.000 0.781) 1.746 10.688 ( 0.890 0.000 -0.253) 0.925 10.796 ( -0.509 0.000 3.153) 3.194 10.822 ( -4.802 0.000 8.097) 9.413 11.157 ( -1.197 0.000 -6.347) 6.459 11.625 ( -3.706 0.000 -7.852) 8.683 11.772 ( 4.602 0.000 2.563) 5.268 11.841 ( -2.472 0.000 -1.577) 2.932 13.378 ( -3.054 0.000 4.607) 5.528 13.521 ( 2.382 0.000 -5.236) 5.753 14.338 ( 6.609 0.000 2.218) 6.971 14.366 ( -1.431 0.000 6.405) 6.563 ======================= Grid point 374 (186/260) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.997 ( -28.254 0.000 12.910) 31.064 4.149 ( -20.940 0.000 13.581) 24.958 4.574 ( 8.752 0.000 -5.094) 10.127 4.635 ( 16.367 0.000 -20.069) 25.897 4.904 ( 5.818 0.000 18.380) 19.279 5.348 ( -0.360 0.000 -2.867) 2.890 5.533 ( -5.932 0.000 -0.637) 5.966 5.627 ( 1.050 0.000 -1.302) 1.673 5.872 ( -7.973 0.000 4.836) 9.325 6.050 ( 1.000 0.000 0.089) 1.004 6.275 ( -12.308 0.000 -2.119) 12.489 6.287 ( 8.709 0.000 0.189) 8.711 7.183 ( 5.996 0.000 0.666) 6.033 7.315 ( 3.294 0.000 -6.216) 7.035 7.846 ( 16.141 0.000 12.712) 20.546 8.112 ( -1.416 0.000 2.187) 2.606 8.132 ( -4.137 0.000 -0.545) 4.172 8.182 ( -4.937 0.000 -7.072) 8.624 8.429 ( -4.897 0.000 10.369) 11.467 9.017 ( 0.044 0.000 -11.106) 11.106 9.609 ( -0.391 0.000 3.108) 3.132 9.614 ( -2.774 0.000 5.426) 6.093 9.842 ( 0.517 0.000 -7.934) 7.951 9.996 ( 4.013 0.000 -11.847) 12.508 10.698 ( 0.227 0.000 0.109) 0.252 10.704 ( 0.259 0.000 -0.909) 0.945 10.825 ( 0.633 0.000 4.604) 4.648 10.871 ( 2.045 0.000 12.212) 12.382 11.096 ( -0.733 0.000 -5.041) 5.094 11.458 ( -4.802 0.000 -13.509) 14.337 11.813 ( -2.781 0.000 3.302) 4.317 11.849 ( 2.215 0.000 1.688) 2.785 13.356 ( -3.129 0.000 4.611) 5.573 13.531 ( 2.696 0.000 -4.580) 5.314 14.368 ( -2.716 0.000 4.479) 5.238 14.469 ( 7.141 0.000 -0.139) 7.142 ======================= Grid point 375 (187/260) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.600 ( -29.419 0.000 18.604) 34.808 3.830 ( -27.255 0.000 18.872) 33.151 4.639 ( 1.668 0.000 -3.988) 4.322 4.788 ( 14.670 0.000 -12.269) 19.125 5.085 ( 1.064 0.000 10.337) 10.392 5.117 ( -23.745 0.000 11.161) 26.237 5.442 ( -3.949 0.000 0.471) 3.977 5.640 ( -2.278 0.000 -8.089) 8.403 5.842 ( 4.229 0.000 5.019) 6.564 6.070 ( 1.295 0.000 -0.696) 1.470 6.136 ( -0.346 0.000 -3.929) 3.944 6.387 ( -0.555 0.000 4.618) 4.651 7.309 ( 8.236 0.000 -1.282) 8.336 7.371 ( 9.081 0.000 -7.838) 11.995 7.980 ( -4.723 0.000 -4.442) 6.484 8.039 ( 0.905 0.000 2.728) 2.875 8.160 ( 2.002 0.000 -4.211) 4.663 8.288 ( 14.087 0.000 5.151) 14.999 8.403 ( -6.942 0.000 13.870) 15.510 8.921 ( -2.360 0.000 -8.661) 8.977 9.586 ( -4.832 0.000 5.341) 7.203 9.608 ( -2.154 0.000 3.378) 4.006 9.801 ( 1.698 0.000 -9.094) 9.251 10.005 ( 5.400 0.000 -8.294) 9.897 10.684 ( -1.163 0.000 -1.407) 1.825 10.698 ( -0.240 0.000 -0.211) 0.320 10.884 ( 1.807 0.000 5.744) 6.021 10.996 ( 2.724 0.000 -0.703) 2.814 11.106 ( 3.588 0.000 10.046) 10.667 11.292 ( -2.545 0.000 -12.992) 13.238 11.769 ( -4.943 0.000 3.048) 5.807 11.872 ( -0.431 0.000 0.565) 0.710 13.333 ( -3.338 0.000 4.768) 5.820 13.550 ( 3.118 0.000 -4.322) 5.329 14.337 ( -3.451 0.000 2.162) 4.072 14.577 ( 6.170 0.000 -3.593) 7.140 ======================= Grid point 376 (188/260) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.217 ( -31.413 0.000 24.108) 39.598 3.485 ( -28.324 0.000 23.691) 36.926 4.553 ( -7.176 0.000 -5.865) 9.268 4.814 ( -23.971 0.000 28.165) 36.985 4.938 ( 1.523 0.000 -3.001) 3.365 5.090 ( 2.214 0.000 -1.403) 2.621 5.400 ( -2.427 0.000 2.594) 3.552 5.528 ( -0.004 0.000 -11.701) 11.701 5.965 ( 4.287 0.000 2.883) 5.166 6.078 ( -0.205 0.000 0.318) 0.378 6.193 ( 8.885 0.000 -3.930) 9.715 6.364 ( -3.758 0.000 4.723) 6.036 7.448 ( 9.146 0.000 -3.546) 9.810 7.515 ( 12.004 0.000 -5.810) 13.336 7.923 ( 3.270 0.000 -9.961) 10.484 8.055 ( 0.427 0.000 -2.413) 2.451 8.175 ( 1.410 0.000 0.079) 1.412 8.359 ( -7.832 0.000 18.548) 20.134 8.527 ( 6.629 0.000 1.126) 6.724 8.824 ( -1.773 0.000 -7.071) 7.290 9.511 ( -7.588 0.000 4.191) 8.668 9.591 ( -2.258 0.000 3.566) 4.221 9.781 ( 2.615 0.000 -5.977) 6.524 10.063 ( 6.070 0.000 -5.109) 7.934 10.651 ( -1.131 0.000 -1.763) 2.094 10.689 ( -0.090 0.000 -1.358) 1.361 10.966 ( 1.822 0.000 6.694) 6.937 10.991 ( 1.416 0.000 -5.541) 5.719 11.213 ( 4.272 0.000 -9.477) 10.395 11.310 ( 6.400 0.000 15.119) 16.418 11.683 ( -6.722 0.000 2.032) 7.023 11.846 ( -2.498 0.000 -0.325) 2.519 13.308 ( -3.521 0.000 5.179) 6.262 13.576 ( 3.363 0.000 -4.474) 5.597 14.281 ( -3.670 0.000 0.170) 3.674 14.620 ( 2.645 0.000 -7.381) 7.840 ======================= Grid point 377 (189/260) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.856 ( -29.295 0.000 28.563) 40.915 3.195 ( -24.879 0.000 28.164) 37.579 4.365 ( -7.508 0.000 -7.265) 10.447 4.670 ( -20.113 0.000 -8.338) 21.773 4.687 ( -17.206 0.000 37.870) 41.595 5.282 ( 13.868 0.000 0.472) 13.876 5.382 ( -2.244 0.000 3.410) 4.082 5.486 ( 3.902 0.000 -10.303) 11.017 6.037 ( 2.220 0.000 1.729) 2.814 6.081 ( -0.456 0.000 3.145) 3.178 6.334 ( 9.113 0.000 -3.936) 9.927 6.356 ( -0.416 0.000 2.347) 2.383 7.566 ( 5.988 0.000 -3.004) 6.699 7.684 ( 9.862 0.000 -2.713) 10.229 7.918 ( 6.312 0.000 -15.949) 17.153 8.006 ( -1.803 0.000 -5.484) 5.773 8.207 ( 0.806 0.000 2.225) 2.366 8.384 ( -4.103 0.000 15.136) 15.682 8.564 ( -1.887 0.000 0.345) 1.918 8.770 ( 1.001 0.000 -5.369) 5.461 9.390 ( -8.307 0.000 3.182) 8.896 9.583 ( -1.920 0.000 3.654) 4.128 9.808 ( 2.881 0.000 -0.923) 3.026 10.112 ( 3.117 0.000 -5.422) 6.254 10.623 ( -0.419 0.000 -1.803) 1.851 10.677 ( 0.404 0.000 -2.242) 2.278 10.986 ( 2.381 0.000 -4.790) 5.349 11.025 ( -0.396 0.000 6.291) 6.304 11.345 ( 15.193 0.000 -4.307) 15.792 11.511 ( 4.198 0.000 12.937) 13.601 11.577 ( -5.276 0.000 1.106) 5.391 11.787 ( -3.699 0.000 -0.265) 3.708 13.286 ( -3.328 0.000 5.851) 6.731 13.600 ( 3.059 0.000 -5.055) 5.909 14.216 ( -3.200 0.000 -0.921) 3.330 14.555 ( -3.105 0.000 -9.130) 9.643 ======================= Grid point 378 (190/260) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.673 ( -13.803 0.000 31.776) 34.645 3.034 ( -16.966 0.000 31.288) 35.592 4.189 ( -3.253 0.000 -14.057) 14.428 4.226 ( -18.267 0.000 -14.901) 23.574 4.762 ( -9.226 0.000 46.466) 47.374 5.357 ( -3.528 0.000 3.890) 5.251 5.499 ( 4.088 0.000 -7.091) 8.185 5.527 ( 11.624 0.000 2.488) 11.887 6.059 ( -0.587 0.000 -0.849) 1.032 6.110 ( 0.489 0.000 4.311) 4.339 6.363 ( -0.213 0.000 0.237) 0.318 6.441 ( 5.774 0.000 -3.239) 6.620 7.566 ( -5.567 0.000 0.721) 5.613 7.798 ( 4.509 0.000 -2.736) 5.274 7.923 ( 7.624 0.000 -16.429) 18.112 7.982 ( 4.947 0.000 -6.444) 8.124 8.227 ( 1.144 0.000 -0.031) 1.145 8.361 ( -6.984 0.000 2.291) 7.350 8.539 ( -1.744 0.000 6.198) 6.439 8.770 ( 1.315 0.000 -2.616) 2.928 9.305 ( -2.869 0.000 3.792) 4.755 9.555 ( -4.219 0.000 1.999) 4.668 9.857 ( 1.795 0.000 2.200) 2.839 10.104 ( 1.447 0.000 -5.952) 6.125 10.611 ( 0.408 0.000 -1.407) 1.465 10.673 ( 0.832 0.000 -2.274) 2.422 11.010 ( 3.897 0.000 -3.554) 5.274 11.041 ( -2.794 0.000 4.867) 5.612 11.455 ( -2.421 0.000 2.599) 3.551 11.622 ( -0.045 0.000 6.071) 6.071 11.713 ( 21.498 0.000 -5.703) 22.241 11.720 ( -4.997 0.000 3.722) 6.231 13.280 ( -2.266 0.000 6.655) 7.030 13.607 ( 2.132 0.000 -6.141) 6.501 14.165 ( -1.669 0.000 -0.525) 1.750 14.393 ( -7.942 0.000 -6.700) 10.391 ======================= Grid point 379 (191/260) ======================= q-point: ( 0.00 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.965 ( 10.077 10.897 29.172) 32.731 3.255 ( -5.176 17.721 27.538) 33.154 3.944 ( -6.200 6.985 -18.144) 20.406 4.159 ( 2.596 8.710 -15.423) 17.902 5.065 ( -2.421 6.150 39.214) 39.768 5.325 ( -5.564 2.664 7.628) 9.810 5.471 ( -0.287 -3.177 -0.720) 3.270 5.760 ( 8.901 3.498 -1.315) 9.654 5.955 ( -3.869 -4.474 -0.526) 5.938 6.112 ( -0.493 -3.124 1.088) 3.345 6.321 ( -2.639 -2.441 -1.265) 3.811 6.456 ( 3.105 -3.237 -3.879) 5.930 7.445 ( -7.861 1.182 2.847) 8.443 7.736 ( 0.938 -9.297 -7.466) 11.961 7.790 ( -1.202 -5.991 2.553) 6.622 8.070 ( 2.921 1.627 -12.201) 12.651 8.241 ( -4.945 2.776 -0.094) 5.672 8.370 ( 7.034 5.862 -3.959) 9.976 8.611 ( -0.099 2.873 4.658) 5.473 8.752 ( -0.692 -1.058 -0.706) 1.448 9.316 ( 4.550 -4.560 4.776) 8.019 9.437 ( -5.500 -2.561 -1.520) 6.255 9.920 ( -0.127 2.545 3.387) 4.239 10.102 ( 2.914 0.498 -5.083) 5.880 10.618 ( 0.815 0.690 -0.046) 1.069 10.710 ( 0.983 3.191 -2.914) 4.431 11.030 ( -4.848 3.559 2.312) 6.444 11.108 ( 5.310 2.803 -2.233) 6.406 11.394 ( -1.788 -4.421 4.539) 6.584 11.544 ( -0.554 -5.276 -3.324) 6.260 11.715 ( -5.772 4.972 8.563) 11.461 12.043 ( 13.678 1.639 -8.571) 16.225 13.301 ( -0.572 -0.466 7.035) 7.074 13.598 ( 1.536 0.912 -8.196) 8.388 14.108 ( -1.475 -3.844 2.903) 5.038 14.218 ( -5.284 -0.303 -3.069) 6.118 ======================= Grid point 380 (192/260) ======================= q-point: ( 0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.428 ( 4.516 15.630 22.262) 27.573 3.478 ( 23.394 9.109 23.918) 34.675 3.833 ( 8.355 6.966 -17.121) 20.285 4.153 ( 9.757 9.398 -15.551) 20.624 5.204 ( -6.973 0.598 8.594) 11.083 5.344 ( -3.342 5.865 24.089) 25.017 5.434 ( -4.117 -2.215 4.580) 6.545 5.861 ( 2.166 4.213 -0.492) 4.763 5.885 ( -0.555 -2.693 -1.682) 3.223 6.093 ( -0.938 -2.527 -3.645) 4.533 6.265 ( -3.289 -5.223 1.029) 6.258 6.448 ( -0.458 -2.653 -4.324) 5.093 7.349 ( -5.646 2.789 4.608) 7.803 7.646 ( -9.598 -6.010 2.864) 11.681 7.770 ( 2.623 -10.047 -7.002) 12.524 7.965 ( -8.787 4.395 -3.637) 10.476 8.243 ( 6.722 3.752 -3.816) 8.593 8.462 ( 4.899 3.350 -1.957) 6.249 8.624 ( -2.651 2.686 3.622) 5.231 8.764 ( 3.616 -1.552 -1.893) 4.367 9.341 ( -1.533 -4.005 -0.274) 4.297 9.468 ( 6.268 -3.611 3.449) 8.014 9.927 ( -1.229 2.340 2.737) 3.805 10.115 ( 2.957 0.890 -6.187) 6.915 10.635 ( 0.829 0.939 0.431) 1.325 10.705 ( 0.970 2.883 -3.151) 4.380 10.948 ( -4.920 3.371 0.483) 5.984 11.199 ( 5.862 2.521 -1.547) 6.566 11.345 ( -8.937 -5.095 3.683) 10.927 11.520 ( 0.745 -3.140 -1.453) 3.539 11.654 ( -4.978 6.512 5.413) 9.823 12.153 ( 6.292 -0.231 -11.446) 13.064 13.351 ( 0.190 -1.218 6.496) 6.612 13.564 ( 1.539 0.558 -8.308) 8.468 14.080 ( -3.223 -2.249 3.476) 5.247 14.188 ( 1.226 -1.079 2.270) 2.796 ======================= Grid point 381 (193/260) ======================= q-point: ( 0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.707 ( 13.607 9.787 10.446) 19.750 3.961 ( 15.998 6.734 -6.892) 18.676 4.048 ( 21.304 7.509 7.176) 23.701 4.314 ( 19.197 8.024 -4.573) 21.303 5.074 ( -12.765 1.612 7.013) 14.653 5.233 ( -14.610 0.347 4.591) 15.318 5.521 ( 3.532 -0.508 3.593) 5.064 5.868 ( 0.874 6.754 -6.765) 9.599 5.913 ( 0.941 -2.059 8.105) 8.416 6.050 ( -1.050 -2.629 -1.035) 3.015 6.209 ( -3.437 -4.225 -0.820) 5.508 6.406 ( 0.016 -1.846 -2.218) 2.886 7.317 ( -3.300 3.630 8.383) 9.713 7.481 ( -9.926 -4.308 1.747) 10.961 7.708 ( -11.411 3.906 -1.304) 12.132 7.833 ( 1.357 -8.522 -0.752) 8.662 8.345 ( 6.815 4.959 -6.027) 10.362 8.484 ( -3.246 -1.414 2.562) 4.370 8.579 ( -3.108 5.114 2.561) 6.509 8.853 ( 8.798 -2.233 -5.093) 10.408 9.369 ( 3.654 -4.106 1.188) 5.623 9.572 ( 2.531 -2.950 2.148) 4.441 9.930 ( -0.101 1.256 2.150) 2.492 10.110 ( 2.324 0.875 -8.548) 8.901 10.650 ( 0.371 0.794 0.574) 1.048 10.700 ( 1.211 2.326 -3.501) 4.374 10.874 ( -3.776 2.874 0.457) 4.768 11.141 ( -14.820 -2.711 2.753) 15.316 11.263 ( 2.605 2.831 -3.681) 5.324 11.552 ( 3.399 -1.674 0.272) 3.798 11.652 ( 0.071 4.330 5.083) 6.678 12.111 ( -0.849 0.494 -11.944) 11.984 13.386 ( -1.277 -1.246 5.486) 5.769 13.537 ( 1.827 0.252 -7.405) 7.631 14.089 ( 1.376 -2.462 3.799) 4.731 14.243 ( 1.342 -2.133 5.268) 5.839 ======================= Grid point 382 (194/260) ======================= q-point: ( 0.30 0.11 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.045 ( 19.651 3.343 -0.252) 19.935 4.208 ( 13.705 5.764 -0.966) 14.899 4.329 ( 15.607 8.059 -10.140) 20.282 4.655 ( 1.833 2.461 11.597) 11.996 4.895 ( -8.046 1.652 7.404) 11.058 5.014 ( -9.508 3.133 4.613) 11.022 5.576 ( 3.765 -3.832 -5.455) 7.656 5.802 ( -1.667 2.866 -7.681) 8.367 5.949 ( -0.987 -2.603 1.138) 3.007 6.048 ( -0.848 -1.239 2.310) 2.755 6.156 ( 0.007 -0.334 -3.230) 3.247 6.469 ( 6.456 1.809 2.598) 7.191 7.326 ( -8.099 -0.507 2.922) 8.624 7.362 ( -1.421 5.266 11.819) 13.017 7.476 ( -12.138 6.407 2.152) 13.893 7.891 ( 3.447 -12.610 1.321) 13.139 8.302 ( -5.964 0.060 -3.784) 7.064 8.483 ( 0.519 1.715 0.210) 1.805 8.548 ( -2.710 7.084 2.848) 8.102 8.974 ( 9.129 -3.007 -7.819) 12.390 9.450 ( 2.927 -4.451 2.821) 6.028 9.598 ( 0.152 -1.541 1.233) 1.979 9.943 ( -0.115 0.295 -0.280) 0.423 10.074 ( 1.863 0.507 -11.246) 11.410 10.657 ( 0.002 0.105 0.639) 0.648 10.699 ( 1.323 1.928 -2.851) 3.687 10.816 ( -4.033 0.822 1.964) 4.560 10.932 ( -9.659 1.279 4.125) 10.580 11.243 ( -0.397 2.417 -5.658) 6.165 11.622 ( 2.762 -2.044 -0.235) 3.444 11.712 ( 2.545 3.275 4.703) 6.271 11.982 ( -3.686 2.073 -9.992) 10.850 13.388 ( -2.584 -0.699 5.031) 5.699 13.522 ( 2.104 0.005 -6.349) 6.688 14.172 ( 4.683 -3.634 3.289) 6.779 14.299 ( -0.008 -3.007 6.305) 6.985 ======================= Grid point 383 (195/260) ======================= q-point: ( 0.40 0.11 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.298 ( -8.784 0.775 10.233) 13.509 4.379 ( 19.157 -0.045 -14.160) 23.822 4.463 ( -17.915 5.317 7.399) 20.099 4.521 ( 14.264 5.690 -10.552) 18.633 4.796 ( -7.411 3.643 12.942) 15.352 5.165 ( 12.136 -1.696 3.368) 12.708 5.541 ( -5.289 -5.760 -1.718) 8.006 5.730 ( 0.745 0.052 -8.756) 8.787 5.956 ( -0.232 1.062 2.420) 2.653 6.034 ( -1.169 -0.890 0.593) 1.584 6.181 ( 6.263 2.177 -2.976) 7.267 6.539 ( -4.247 4.740 0.217) 6.368 7.212 ( -4.640 8.152 3.145) 9.894 7.336 ( -1.847 0.883 -0.140) 2.052 7.544 ( 8.436 4.542 15.684) 18.379 7.954 ( 1.695 -11.970 3.025) 12.462 8.173 ( -5.401 -0.890 -1.672) 5.724 8.388 ( -9.461 0.155 -0.940) 9.509 8.559 ( 0.323 9.583 1.505) 9.706 9.033 ( 4.454 -2.857 -10.123) 11.422 9.498 ( -0.348 -5.416 4.765) 7.223 9.622 ( 1.283 -0.887 1.362) 2.071 9.907 ( -1.769 0.725 -4.274) 4.682 10.024 ( 2.639 0.092 -12.639) 12.912 10.670 ( 0.923 -0.691 1.416) 1.826 10.704 ( 0.599 1.528 -0.809) 1.830 10.779 ( -1.961 -1.607 5.740) 6.275 10.864 ( -2.885 3.663 4.347) 6.375 11.187 ( -0.882 2.974 -5.814) 6.590 11.593 ( -2.914 -2.696 -8.184) 9.096 11.797 ( 2.587 2.290 4.136) 5.389 11.884 ( -1.311 3.783 -2.534) 4.738 13.373 ( -3.019 -0.336 4.824) 5.701 13.520 ( 2.463 -0.089 -5.441) 5.973 14.291 ( 6.322 -4.458 2.018) 7.994 14.328 ( -1.601 -3.866 5.721) 7.088 ======================= Grid point 384 (196/260) ======================= q-point: (-0.50 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.014 ( -25.844 2.055 14.093) 29.508 4.181 ( -23.352 3.468 11.044) 26.064 4.587 ( 10.882 1.502 -6.379) 12.703 4.643 ( 13.453 0.749 -18.695) 23.044 4.916 ( 4.363 1.025 16.395) 16.996 5.321 ( 0.162 -2.455 -3.463) 4.248 5.445 ( -1.074 -5.054 3.429) 6.201 5.680 ( 1.058 1.457 -8.651) 8.837 5.933 ( -4.982 4.518 5.005) 8.383 6.036 ( 0.948 -1.443 -0.413) 1.775 6.323 ( 5.923 3.114 1.764) 6.920 6.333 ( -12.968 6.486 0.477) 14.508 7.201 ( -0.224 2.600 2.618) 3.697 7.370 ( 6.890 4.540 -5.080) 9.690 7.874 ( 14.426 2.292 11.032) 18.305 7.996 ( -0.182 -9.026 5.218) 10.427 8.105 ( -0.730 -1.968 -0.220) 2.110 8.185 ( -9.754 1.742 -3.281) 10.437 8.556 ( -2.457 8.649 2.767) 9.408 8.994 ( -0.177 -2.299 -9.662) 9.933 9.513 ( -2.451 -6.311 5.934) 9.003 9.643 ( -0.642 -0.522 1.813) 1.993 9.844 ( -0.176 0.360 -7.126) 7.137 9.995 ( 4.102 0.343 -11.623) 12.330 10.688 ( -0.401 -0.663 0.580) 0.968 10.715 ( 1.534 0.869 -1.198) 2.132 10.846 ( 1.337 -2.417 11.067) 11.407 10.866 ( 0.480 3.535 3.887) 5.276 11.138 ( -0.330 3.990 -4.108) 5.736 11.440 ( -4.310 -1.659 -12.917) 13.718 11.830 ( -2.159 1.805 4.018) 4.906 11.889 ( 1.392 3.562 0.610) 3.873 13.352 ( -3.168 -0.273 4.664) 5.645 13.531 ( 2.945 0.079 -4.780) 5.615 14.323 ( -2.870 -4.505 4.050) 6.703 14.418 ( 6.969 -4.962 -0.202) 8.558 ======================= Grid point 385 (197/260) ======================= q-point: (-0.40 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.652 ( -28.272 5.148 17.789) 33.797 3.828 ( -27.199 0.873 18.691) 33.014 4.656 ( 1.965 1.800 -4.405) 5.149 4.781 ( 13.562 -0.637 -10.468) 17.144 5.052 ( -2.666 -1.760 8.633) 9.205 5.176 ( -11.528 2.924 5.967) 13.306 5.461 ( -2.232 1.398 0.679) 2.720 5.661 ( 0.454 1.452 -6.905) 7.071 5.894 ( -1.018 5.166 5.426) 7.561 6.051 ( 1.198 -1.543 -1.320) 2.357 6.136 ( -3.341 0.997 -3.154) 4.702 6.429 ( -0.425 3.766 5.060) 6.322 7.240 ( 3.906 -2.488 0.099) 4.632 7.479 ( 9.372 6.271 -5.536) 12.562 7.987 ( -4.520 -0.098 -2.575) 5.203 8.015 ( 0.274 -4.954 1.375) 5.149 8.045 ( -0.239 -3.647 2.916) 4.676 8.308 ( 14.553 1.227 3.977) 15.136 8.519 ( -4.802 8.186 5.558) 10.998 8.907 ( -2.101 -1.373 -7.627) 8.029 9.494 ( -4.658 -6.841 6.287) 10.394 9.627 ( -2.387 -0.381 2.030) 3.156 9.802 ( 1.408 0.131 -7.491) 7.623 10.006 ( 5.421 0.548 -8.615) 10.194 10.674 ( -0.982 -0.434 -0.784) 1.329 10.728 ( 0.792 2.313 -1.183) 2.716 10.891 ( 0.892 -0.628 4.842) 4.963 10.981 ( 3.213 -0.492 3.847) 5.037 11.147 ( 2.766 4.172 5.436) 7.390 11.287 ( -1.905 -0.482 -12.321) 12.477 11.796 ( -4.592 2.528 3.356) 6.224 11.903 ( -0.421 2.823 0.149) 2.858 13.328 ( -3.322 -0.307 4.690) 5.755 13.554 ( 3.466 0.452 -4.542) 5.731 14.288 ( -3.495 -4.852 1.970) 6.296 14.523 ( 5.979 -5.252 -3.371) 8.643 ======================= Grid point 386 (198/260) ======================= q-point: (-0.30 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.261 ( -31.543 4.834 22.026) 38.775 3.530 ( -24.191 5.166 25.495) 35.523 4.590 ( -5.020 3.223 -5.986) 8.451 4.887 ( -15.411 4.360 14.801) 21.808 4.959 ( 2.819 2.347 0.888) 3.774 5.091 ( -3.015 0.640 2.417) 3.917 5.414 ( -4.555 2.186 4.668) 6.879 5.578 ( -0.288 4.508 -9.710) 10.709 5.972 ( 3.738 0.728 2.372) 4.487 6.051 ( 0.426 -2.297 -1.957) 3.047 6.160 ( 7.292 -2.947 -3.648) 8.670 6.404 ( -4.385 3.831 4.506) 7.362 7.343 ( 7.894 -5.539 -1.289) 9.730 7.606 ( 8.322 4.004 -4.155) 10.127 7.914 ( -0.241 -1.503 -6.695) 6.866 8.032 ( 2.577 -1.540 -2.577) 3.956 8.092 ( 1.086 -4.075 6.110) 7.424 8.477 ( -5.394 7.211 8.773) 12.573 8.522 ( 7.112 0.374 0.367) 7.131 8.821 ( -1.771 -0.419 -6.175) 6.438 9.436 ( -6.939 -6.637 5.715) 11.174 9.597 ( -2.195 -0.318 1.637) 2.757 9.791 ( 2.422 0.876 -4.393) 5.093 10.057 ( 5.618 -0.232 -5.577) 7.920 10.646 ( -0.948 -0.063 -1.653) 1.907 10.726 ( 0.246 3.140 -1.764) 3.610 10.957 ( 3.634 -2.461 0.317) 4.400 11.011 ( 0.287 2.712 2.008) 3.387 11.209 ( 3.140 0.414 -8.090) 8.687 11.316 ( 5.737 0.653 11.676) 13.026 11.720 ( -6.053 3.432 2.578) 7.421 11.880 ( -1.787 3.091 -0.478) 3.602 13.303 ( -3.398 -0.263 5.004) 6.054 13.585 ( 3.732 0.865 -4.795) 6.137 14.232 ( -3.597 -4.827 0.220) 6.024 14.566 ( 2.596 -5.218 -6.762) 8.927 ======================= Grid point 387 (199/260) ======================= q-point: (-0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.902 ( -27.301 6.257 27.189) 39.035 3.330 ( -20.524 11.897 28.343) 36.960 4.427 ( -6.495 5.497 -8.369) 11.935 4.682 ( -17.751 3.339 0.093) 18.063 4.825 ( -16.284 10.579 25.027) 31.677 5.251 ( 12.027 -3.234 2.339) 12.672 5.378 ( -3.335 0.982 5.365) 6.393 5.542 ( 3.949 4.497 -9.690) 11.389 6.006 ( -1.185 -3.234 2.064) 4.016 6.073 ( 2.482 -0.304 0.663) 2.587 6.285 ( 8.908 -4.777 -4.566) 11.091 6.379 ( -1.225 2.342 2.006) 3.318 7.482 ( 7.970 -6.168 -0.940) 10.121 7.690 ( 3.164 -1.459 -2.050) 4.043 7.853 ( -1.201 -3.583 -6.838) 7.813 8.065 ( 5.856 3.424 -8.968) 11.245 8.164 ( 2.339 -2.006 4.620) 5.553 8.451 ( -4.791 3.920 6.870) 9.248 8.582 ( 0.270 2.225 1.004) 2.456 8.767 ( 0.564 -0.283 -4.702) 4.744 9.336 ( -7.873 -5.408 4.258) 10.458 9.578 ( -1.687 -0.748 1.598) 2.441 9.824 ( 2.733 1.597 0.440) 3.196 10.097 ( 2.990 -1.129 -5.430) 6.301 10.621 ( -0.408 0.165 -1.644) 1.702 10.716 ( 0.576 3.188 -2.517) 4.102 10.995 ( 3.044 0.491 -3.750) 4.855 11.057 ( 0.258 2.930 6.232) 6.891 11.295 ( 11.247 -3.811 -4.629) 12.746 11.466 ( 1.230 -1.905 8.696) 8.987 11.648 ( -3.195 4.876 4.232) 7.203 11.847 ( -0.911 4.891 -0.379) 4.989 13.283 ( -3.152 -0.129 5.620) 6.445 13.612 ( 3.401 1.150 -5.576) 6.632 14.169 ( -3.118 -4.486 -0.560) 5.492 14.511 ( -2.568 -4.377 -8.377) 9.795 ======================= Grid point 388 (200/260) ======================= q-point: (-0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.755 ( -11.272 9.565 30.464) 33.862 3.224 ( -14.255 16.595 28.887) 36.237 4.252 ( -7.302 5.458 -12.600) 15.553 4.298 ( -13.054 7.584 -14.016) 20.600 4.860 ( -8.494 9.087 40.784) 42.639 5.354 ( -2.992 -0.252 5.444) 6.217 5.444 ( 4.552 -2.501 1.339) 5.363 5.598 ( 9.558 4.045 -4.544) 11.330 5.997 ( -1.836 -5.320 2.361) 6.103 6.107 ( 0.475 -0.852 0.857) 1.299 6.360 ( -0.234 -1.106 -1.078) 1.562 6.400 ( 5.669 -3.063 -3.606) 7.384 7.548 ( -2.977 -1.885 1.101) 3.691 7.719 ( 3.454 -9.511 -0.646) 10.139 7.793 ( 0.725 -3.192 -7.292) 7.993 8.094 ( 4.348 4.226 -10.413) 12.049 8.240 ( 4.850 1.154 -0.547) 5.015 8.382 ( -5.507 2.335 0.137) 5.983 8.587 ( -1.164 3.795 4.296) 5.849 8.766 ( 0.984 -0.460 -2.140) 2.400 9.259 ( -2.809 -4.617 4.175) 6.829 9.537 ( -4.224 -1.797 0.224) 4.596 9.880 ( 1.707 2.216 3.199) 4.249 10.096 ( 1.956 -0.500 -5.429) 5.792 10.611 ( 0.324 0.366 -0.913) 1.036 10.712 ( 1.018 3.265 -2.681) 4.345 11.030 ( 3.275 1.931 -1.907) 4.253 11.085 ( -1.530 3.760 3.702) 5.494 11.397 ( -0.698 -4.728 1.645) 5.054 11.538 ( 4.945 -6.799 -2.064) 8.657 11.689 ( 0.945 4.223 8.984) 9.972 11.875 ( 6.575 6.738 -2.393) 9.714 13.277 ( -2.256 -0.072 6.456) 6.839 13.619 ( 2.404 1.173 -6.926) 7.425 14.122 ( -1.864 -4.013 0.313) 4.436 14.370 ( -6.527 -2.520 -6.664) 9.662 ======================= Grid point 389 (201/260) ======================= q-point: ( 0.00 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.287 ( 10.131 20.550 24.676) 33.673 3.672 ( -2.998 22.339 21.199) 30.942 4.148 ( -5.522 13.191 -15.005) 20.728 4.384 ( 1.980 13.147 -11.449) 17.546 5.158 ( 0.385 0.491 17.374) 17.385 5.406 ( -1.514 -0.640 4.917) 5.185 5.473 ( -5.552 11.312 17.321) 21.420 5.760 ( 5.470 -7.076 1.505) 9.069 5.881 ( 0.774 -0.088 -1.219) 1.446 6.019 ( -3.148 -5.580 1.162) 6.512 6.253 ( -2.138 -5.116 -4.290) 7.010 6.388 ( 3.135 -2.435 -5.563) 6.834 7.460 ( -4.063 -0.664 1.135) 4.270 7.523 ( -1.139 -9.915 -0.673) 10.003 7.720 ( -5.815 -0.869 5.878) 8.314 8.093 ( 1.789 0.692 -10.244) 10.422 8.306 ( 0.137 3.252 0.194) 3.261 8.475 ( 4.552 4.611 -3.536) 7.381 8.661 ( 1.463 0.861 0.653) 1.819 8.725 ( -2.233 -0.633 -0.459) 2.366 9.181 ( 3.746 -8.854 5.414) 11.034 9.363 ( -4.358 -4.874 -3.986) 7.658 9.987 ( -0.105 4.097 3.617) 5.466 10.125 ( 3.141 1.806 -4.074) 5.452 10.649 ( 1.054 2.230 0.968) 2.650 10.775 ( 0.839 2.826 -2.860) 4.107 11.101 ( -2.924 1.738 1.845) 3.870 11.154 ( 2.242 1.892 -2.515) 3.864 11.338 ( 1.343 -1.078 3.468) 3.872 11.465 ( -0.668 -0.490 -2.475) 2.610 11.802 ( -3.713 3.458 7.715) 9.234 12.069 ( 8.237 0.582 -5.683) 10.024 13.304 ( -1.169 1.138 6.530) 6.731 13.617 ( 1.524 0.840 -9.488) 9.647 14.021 ( -1.290 -4.767 4.212) 6.490 14.184 ( -2.951 -3.229 -4.551) 6.312 ======================= Grid point 390 (202/260) ======================= q-point: ( 0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.729 ( 17.647 15.847 19.207) 30.520 3.802 ( 6.494 19.661 10.942) 23.419 4.056 ( 5.642 15.271 -8.860) 18.535 4.392 ( 8.431 13.773 -11.746) 19.969 5.230 ( -3.577 1.403 7.700) 8.605 5.355 ( -6.454 -2.658 3.146) 7.656 5.530 ( -3.044 9.074 12.099) 15.427 5.806 ( -0.464 -4.021 6.714) 7.839 5.903 ( 0.538 -3.798 -0.302) 3.848 6.027 ( 2.681 -3.139 2.716) 4.941 6.162 ( -3.361 -3.345 -5.998) 7.646 6.390 ( 0.905 -2.365 -4.243) 4.941 7.404 ( -3.474 1.269 2.991) 4.756 7.467 ( -4.619 -10.712 0.179) 11.667 7.636 ( -7.049 -1.814 5.252) 8.976 8.051 ( -3.215 3.764 -2.758) 5.667 8.319 ( 4.373 3.827 -2.825) 6.461 8.516 ( 1.217 1.963 -3.032) 3.811 8.688 ( 0.598 3.415 -0.134) 3.470 8.715 ( 2.680 -3.299 -0.969) 4.359 9.231 ( -1.266 -7.139 1.495) 7.403 9.362 ( 5.990 -6.771 0.695) 9.067 9.991 ( -1.355 3.972 1.673) 4.518 10.144 ( 2.490 1.883 -4.888) 5.800 10.674 ( 0.628 2.666 1.239) 3.007 10.765 ( 0.783 2.810 -3.693) 4.707 11.017 ( -5.544 2.388 0.338) 6.046 11.186 ( -0.465 -2.157 -0.536) 2.270 11.367 ( -0.192 5.736 0.197) 5.743 11.450 ( 1.758 -2.912 -0.615) 3.457 11.765 ( -4.903 4.448 5.641) 8.698 12.143 ( 4.818 -0.991 -8.004) 9.395 13.338 ( -0.710 0.361 6.928) 6.974 13.574 ( 1.397 0.424 -8.987) 9.105 14.019 ( -2.224 -3.766 3.999) 5.926 14.145 ( 0.728 -3.343 -0.656) 3.483 ======================= Grid point 391 (203/260) ======================= q-point: ( 0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.936 ( 13.017 13.153 -6.670) 19.670 4.190 ( 10.447 14.380 2.506) 17.950 4.237 ( 17.939 11.409 12.127) 24.475 4.524 ( 14.545 12.406 -6.508) 20.194 5.131 ( -12.226 4.051 4.394) 13.608 5.239 ( -9.616 0.077 4.984) 10.831 5.518 ( 0.468 -0.188 -4.037) 4.068 5.825 ( -4.021 -6.638 0.842) 7.806 5.946 ( 1.542 -3.306 8.369) 9.129 6.047 ( -1.972 3.520 -7.830) 8.809 6.103 ( 2.694 -4.330 -0.318) 5.109 6.401 ( 3.091 2.565 2.463) 4.712 7.364 ( -6.063 -7.425 3.479) 10.198 7.404 ( -2.069 2.391 6.572) 7.293 7.584 ( -2.045 -5.233 3.132) 6.432 7.921 ( -10.907 9.182 3.492) 14.679 8.414 ( 7.150 1.460 -4.161) 8.400 8.451 ( -6.289 -0.918 -0.474) 6.373 8.695 ( 1.118 5.744 -1.583) 6.062 8.786 ( 6.728 -4.340 -3.674) 8.809 9.259 ( 2.844 -6.927 2.498) 7.893 9.470 ( 4.469 -7.161 0.737) 8.473 9.976 ( -0.739 3.361 0.182) 3.446 10.137 ( 1.337 1.719 -6.795) 7.135 10.681 ( -0.355 1.863 -0.203) 1.908 10.752 ( 0.801 2.698 -3.467) 4.465 10.923 ( -5.529 1.304 0.364) 5.693 11.097 ( -8.044 -0.320 0.667) 8.078 11.350 ( -0.078 4.933 -3.753) 6.199 11.518 ( 4.482 -1.209 1.055) 4.761 11.743 ( -1.492 4.443 5.099) 6.926 12.118 ( -0.325 0.046 -8.849) 8.855 13.370 ( -1.309 0.051 6.403) 6.535 13.541 ( 1.681 0.198 -7.679) 7.864 14.023 ( 0.425 -4.022 2.795) 4.916 14.174 ( 0.909 -4.805 3.021) 5.748 ======================= Grid point 392 (204/260) ======================= q-point: ( 0.30 0.22 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.155 ( 18.860 8.362 -11.702) 23.719 4.385 ( 6.623 10.718 4.712) 13.452 4.508 ( 12.288 9.418 -6.399) 16.753 4.734 ( -1.900 5.511 9.797) 11.400 4.956 ( -2.920 4.092 1.738) 5.319 5.085 ( -10.555 3.789 3.207) 11.664 5.512 ( 0.757 -2.755 -3.741) 4.707 5.704 ( -5.460 -9.712 -4.259) 11.928 5.980 ( -0.723 -0.522 -1.445) 1.698 6.005 ( 0.518 -1.462 1.485) 2.147 6.151 ( 4.213 1.480 -2.460) 5.098 6.549 ( 8.753 6.197 4.232) 11.530 7.291 ( -3.806 -4.167 3.550) 6.667 7.468 ( 2.401 3.967 9.143) 10.252 7.579 ( -4.006 -1.246 5.530) 6.941 7.761 ( -9.303 7.211 7.934) 14.194 8.302 ( -7.672 -0.003 -2.824) 8.175 8.471 ( -0.204 -0.977 -0.966) 1.389 8.710 ( 2.580 6.672 -3.851) 8.124 8.886 ( 7.458 -5.194 -4.633) 10.201 9.335 ( 1.865 -7.284 4.470) 8.748 9.524 ( 2.352 -5.846 -1.229) 6.420 9.970 ( 0.236 2.635 -1.509) 3.045 10.093 ( 0.542 1.427 -9.297) 9.421 10.662 ( -1.006 0.159 -0.858) 1.332 10.745 ( 0.652 1.586 -1.891) 2.553 10.815 ( -6.690 0.458 0.897) 6.766 10.986 ( -4.869 3.620 2.422) 6.533 11.311 ( -0.720 4.002 -4.675) 6.196 11.580 ( 1.707 -2.072 -1.842) 3.255 11.786 ( 1.723 4.045 5.280) 6.871 12.029 ( -2.233 2.323 -7.176) 7.866 13.381 ( -2.259 0.404 5.666) 6.113 13.523 ( 2.066 0.172 -6.499) 6.821 14.077 ( 3.524 -5.601 2.216) 6.978 14.206 ( -0.528 -6.188 4.426) 7.626 ======================= Grid point 393 (205/260) ======================= q-point: ( 0.40 0.22 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.355 ( -10.601 5.182 8.142) 14.336 4.428 ( 15.255 5.193 -13.069) 20.748 4.591 ( -6.689 6.984 -3.260) 10.206 4.648 ( 3.242 7.080 -4.817) 9.156 4.878 ( -8.765 4.148 10.438) 14.247 5.132 ( 9.966 -1.605 0.297) 10.099 5.429 ( -7.598 -5.459 1.606) 9.492 5.660 ( 3.910 -6.072 -8.307) 11.008 5.983 ( 0.920 -1.269 0.395) 1.616 6.006 ( -0.756 -0.632 -0.183) 1.002 6.244 ( 7.037 4.818 1.603) 8.678 6.655 ( -0.943 5.958 -0.417) 6.046 7.315 ( 4.280 -0.555 2.256) 4.870 7.439 ( -10.269 7.663 3.829) 13.372 7.668 ( 6.982 8.449 15.030) 18.602 7.762 ( 0.892 -4.024 9.058) 9.951 8.160 ( -5.800 0.002 -2.177) 6.195 8.394 ( -6.813 0.593 -1.951) 7.111 8.716 ( 1.290 4.971 -4.435) 6.786 8.954 ( 4.081 -4.185 -6.586) 8.806 9.371 ( -1.962 -7.505 6.159) 9.905 9.559 ( 2.905 -5.272 -1.839) 6.294 9.940 ( -1.912 2.587 -3.724) 4.921 10.041 ( 2.472 1.842 -10.909) 11.337 10.650 ( -0.063 -1.613 1.551) 2.239 10.726 ( -3.665 -1.945 2.819) 5.016 10.762 ( 1.494 2.843 -0.497) 3.250 10.946 ( -2.228 4.030 2.685) 5.330 11.266 ( -0.470 4.488 -4.379) 6.288 11.534 ( -2.747 -2.942 -7.644) 8.639 11.854 ( 0.986 3.247 4.965) 6.014 11.969 ( -0.068 4.301 -2.747) 5.104 13.374 ( -2.897 0.754 5.100) 5.914 13.521 ( 2.741 0.375 -5.677) 6.316 14.172 ( 5.483 -7.201 1.301) 9.144 14.215 ( -1.999 -7.266 4.226) 8.640 ======================= Grid point 394 (206/260) ======================= q-point: (-0.50 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.095 ( -21.982 6.348 13.567) 26.600 4.290 ( -24.805 7.378 7.109) 26.838 4.633 ( 13.925 1.960 -12.599) 18.881 4.672 ( 6.935 3.323 -11.364) 13.721 4.935 ( 1.418 0.637 12.216) 12.314 5.262 ( 1.233 -3.166 -3.404) 4.810 5.361 ( 1.865 -3.548 4.752) 6.217 5.665 ( 3.860 -2.851 -9.540) 10.679 5.983 ( -1.164 -0.306 -0.455) 1.287 6.003 ( 1.384 -1.080 -0.891) 1.968 6.400 ( 6.128 4.719 5.645) 9.575 6.513 ( -13.013 9.816 0.454) 16.306 7.310 ( -7.357 8.173 5.572) 12.328 7.436 ( 7.081 0.424 0.405) 7.105 7.810 ( 1.040 -5.728 7.543) 9.528 7.962 ( 6.515 3.777 8.998) 11.733 8.098 ( 2.415 2.342 1.869) 3.848 8.233 ( -6.865 3.087 -4.365) 8.701 8.693 ( -0.832 3.934 -2.898) 4.957 8.935 ( 0.046 -3.012 -7.513) 8.094 9.365 ( -4.116 -8.276 7.350) 11.809 9.586 ( 1.182 -4.987 -1.390) 5.310 9.867 ( -2.246 2.184 -4.144) 5.195 10.026 ( 4.595 2.935 -11.012) 12.288 10.675 ( 0.304 -0.882 0.682) 1.155 10.711 ( 1.199 -2.429 1.432) 3.064 10.807 ( 0.752 0.005 5.570) 5.620 10.943 ( 0.508 3.596 1.902) 4.099 11.236 ( 0.195 5.327 -2.623) 5.941 11.402 ( -3.705 -1.889 -10.627) 11.411 11.880 ( -1.763 3.043 4.469) 5.687 11.972 ( 0.856 4.255 -0.645) 4.388 13.355 ( -3.136 0.873 4.592) 5.629 13.538 ( 3.557 0.830 -5.111) 6.282 14.195 ( -3.123 -8.114 3.226) 9.274 14.283 ( 6.385 -8.200 -0.591) 10.409 ======================= Grid point 395 (207/260) ======================= q-point: (-0.40 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.799 ( -24.966 9.348 15.420) 30.797 3.910 ( -24.733 8.015 16.968) 31.046 4.702 ( 4.267 1.227 -7.519) 8.731 4.769 ( 8.162 0.769 -3.650) 8.974 5.012 ( -1.267 -2.559 5.224) 5.954 5.200 ( -4.928 -0.410 2.799) 5.682 5.470 ( 5.119 -0.841 -1.347) 5.360 5.673 ( 4.583 -0.583 -8.223) 9.432 5.967 ( -0.545 0.538 0.732) 1.060 6.022 ( 1.644 -1.435 -1.443) 2.617 6.255 ( -13.569 11.368 0.590) 17.711 6.516 ( 0.373 4.572 5.878) 7.456 7.256 ( -2.731 4.433 4.056) 6.600 7.551 ( 5.751 -0.205 -0.870) 5.820 7.862 ( -1.380 -6.608 6.897) 9.651 7.989 ( -1.376 0.778 2.151) 2.669 8.081 ( -2.191 4.565 -2.651) 5.716 8.346 ( 12.173 2.749 2.522) 12.731 8.652 ( -2.128 4.174 -0.687) 4.735 8.869 ( -1.305 -2.188 -6.430) 6.917 9.330 ( -5.995 -9.213 7.801) 13.479 9.580 ( -0.641 -4.412 -0.971) 4.563 9.819 ( -0.236 2.092 -2.674) 3.403 10.040 ( 5.166 2.894 -9.279) 11.007 10.666 ( -0.458 -0.403 -1.039) 1.205 10.772 ( 4.748 0.447 -1.719) 5.069 10.829 ( -2.319 -3.116 4.724) 6.116 11.013 ( 3.926 2.523 4.013) 6.155 11.244 ( 1.535 3.929 0.304) 4.229 11.282 ( -0.951 1.200 -7.764) 7.914 11.859 ( -3.884 3.589 3.736) 6.475 11.971 ( -0.449 3.667 -0.671) 3.755 13.331 ( -3.117 0.951 4.303) 5.397 13.571 ( 4.242 1.396 -5.033) 6.728 14.153 ( -3.467 -8.273 1.725) 9.134 14.379 ( 5.496 -8.940 -3.051) 10.929 ======================= Grid point 396 (208/260) ======================= q-point: (-0.30 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.432 ( -27.813 12.634 18.606) 35.768 3.701 ( -17.746 11.804 25.383) 33.145 4.669 ( -2.960 4.398 -4.273) 6.809 4.911 ( 4.959 -1.732 1.584) 5.487 4.971 ( -2.069 -1.662 2.818) 3.871 5.124 ( -7.404 0.983 3.931) 8.441 5.499 ( -1.917 5.069 3.036) 6.212 5.675 ( -0.254 3.684 -4.564) 5.871 5.977 ( 0.504 -0.714 0.212) 0.900 6.035 ( 1.248 0.640 -2.238) 2.642 6.111 ( 0.344 1.057 -4.256) 4.399 6.503 ( -4.897 5.490 4.228) 8.485 7.280 ( 2.681 -0.233 2.703) 3.814 7.615 ( 2.453 -3.235 -2.187) 4.611 7.852 ( -3.165 -3.830 2.932) 5.769 8.025 ( 4.072 0.877 1.816) 4.544 8.087 ( 2.422 3.446 1.018) 4.334 8.508 ( 3.784 0.073 0.652) 3.840 8.619 ( -0.275 4.556 -0.261) 4.572 8.803 ( -1.350 -1.361 -5.111) 5.458 9.269 ( -7.209 -9.623 7.519) 14.181 9.559 ( -0.649 -3.830 -1.280) 4.091 9.821 ( 1.527 2.541 0.088) 2.966 10.069 ( 4.317 1.521 -6.759) 8.163 10.648 ( -0.266 0.135 -2.022) 2.044 10.789 ( -0.910 1.753 -1.080) 2.251 10.879 ( 6.148 -3.378 -0.889) 7.071 11.087 ( 1.114 4.230 4.280) 6.120 11.218 ( 1.754 -0.111 -6.858) 7.079 11.354 ( 4.604 3.303 7.345) 9.277 11.801 ( -5.187 4.330 3.172) 7.464 11.951 ( -0.890 3.623 -0.840) 3.825 13.308 ( -2.942 1.135 4.356) 5.378 13.612 ( 4.480 1.835 -5.585) 7.391 14.101 ( -3.290 -7.905 0.580) 8.582 14.422 ( 2.629 -8.942 -5.577) 10.861 ======================= Grid point 397 (209/260) ======================= q-point: (-0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.141 ( -21.008 17.499 23.437) 36.012 3.618 ( -13.654 16.440 27.539) 34.858 4.555 ( -5.209 6.884 -6.093) 10.566 4.785 ( -11.970 6.200 -4.131) 14.099 5.005 ( -8.289 4.004 11.748) 14.925 5.156 ( 9.418 -6.174 7.079) 13.302 5.468 ( -6.960 8.796 12.429) 16.742 5.633 ( 1.135 4.001 -6.156) 7.430 5.943 ( -2.028 -1.557 -2.423) 3.523 6.065 ( 2.207 -1.171 -1.373) 2.851 6.164 ( 7.850 -6.200 -6.039) 11.685 6.446 ( -3.521 4.029 1.681) 5.608 7.375 ( 5.236 -3.806 2.737) 7.028 7.606 ( -1.130 -6.209 -2.851) 6.925 7.810 ( -3.038 -0.710 0.910) 3.250 8.118 ( 5.638 2.038 -3.630) 7.008 8.161 ( 3.177 1.229 5.439) 6.417 8.499 ( -2.420 1.621 -1.141) 3.128 8.643 ( 1.615 2.822 -0.425) 3.279 8.756 ( 0.290 -0.955 -4.195) 4.312 9.185 ( -7.509 -9.162 6.167) 13.355 9.536 ( -1.099 -4.009 -1.933) 4.584 9.870 ( 2.312 3.174 3.580) 5.314 10.088 ( 2.821 0.466 -5.468) 6.170 10.632 ( 0.091 0.774 -1.798) 1.959 10.774 ( 0.404 1.638 -1.563) 2.300 10.982 ( 6.138 -1.315 -2.255) 6.670 11.139 ( 0.749 5.110 5.770) 7.744 11.233 ( 4.422 -2.211 -4.248) 6.518 11.466 ( 1.596 1.827 5.291) 5.821 11.745 ( -3.231 4.634 4.506) 7.226 11.942 ( 0.797 4.025 -0.628) 4.150 13.292 ( -2.592 1.387 4.787) 5.618 13.643 ( 3.965 1.903 -6.819) 8.114 14.050 ( -2.678 -7.022 0.497) 7.531 14.388 ( -1.256 -7.736 -6.903) 10.444 ======================= Grid point 398 (210/260) ======================= q-point: (-0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.067 ( -6.542 21.121 25.804) 33.981 3.609 ( -9.008 20.717 25.556) 34.109 4.395 ( -8.185 8.780 -9.685) 15.423 4.506 ( -8.476 12.302 -11.521) 18.865 5.028 ( -2.820 3.512 20.535) 21.023 5.343 ( 3.220 -2.192 9.140) 9.936 5.460 ( -4.642 7.432 13.834) 16.376 5.647 ( 5.107 -0.245 -3.122) 5.991 5.899 ( -1.269 -2.392 -1.374) 3.036 6.065 ( -1.024 -3.723 -1.460) 4.128 6.256 ( 5.944 -7.278 -5.249) 10.763 6.399 ( -1.554 1.380 -1.960) 2.857 7.476 ( 2.972 -5.420 2.048) 6.511 7.549 ( -3.122 -6.544 -0.689) 7.283 7.764 ( -2.775 0.605 0.978) 3.004 8.143 ( 1.584 0.906 -7.898) 8.107 8.258 ( 3.473 0.806 3.517) 5.008 8.455 ( 0.231 4.569 -3.557) 5.795 8.648 ( -0.449 1.547 0.671) 1.745 8.754 ( 0.988 -0.384 -2.600) 2.808 9.123 ( -2.826 -8.789 5.403) 10.697 9.474 ( -4.020 -4.887 -3.169) 7.077 9.941 ( 1.681 3.792 4.906) 6.424 10.100 ( 2.878 1.151 -4.434) 5.410 10.630 ( 0.705 1.451 -0.478) 1.683 10.776 ( 0.985 2.448 -1.964) 3.290 11.059 ( 4.520 0.304 -1.694) 4.837 11.175 ( -1.276 4.899 3.402) 6.100 11.288 ( 2.883 -4.843 -0.115) 5.637 11.485 ( -0.534 1.361 -0.024) 1.462 11.770 ( 0.161 3.555 7.641) 8.429 11.978 ( 4.471 3.462 -2.083) 6.026 13.288 ( -1.995 1.497 5.587) 6.118 13.647 ( 2.654 1.462 -8.524) 9.047 14.020 ( -1.585 -5.788 1.984) 6.320 14.290 ( -3.867 -5.417 -6.320) 9.178 ======================= Grid point 399 (211/260) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.741 ( 8.105 23.955 19.308) 31.817 4.093 ( -1.665 18.951 15.217) 24.361 4.446 ( -2.977 15.800 -8.878) 18.367 4.646 ( 1.040 12.033 -7.633) 14.287 5.074 ( 3.277 -7.758 11.963) 14.630 5.368 ( 0.780 -5.030 6.618) 8.349 5.578 ( 0.205 -7.074 0.700) 7.112 5.779 ( -3.728 16.050 13.691) 21.423 5.825 ( -2.405 -7.279 -4.693) 8.988 5.957 ( -1.129 0.007 0.753) 1.357 6.124 ( 1.443 -6.346 -4.555) 7.943 6.361 ( 1.544 -1.346 -5.467) 5.839 7.367 ( -3.860 -5.456 2.461) 7.122 7.406 ( -2.225 -4.083 -0.472) 4.674 7.782 ( -7.255 6.660 9.421) 13.628 8.096 ( 0.074 -0.576 -3.021) 3.076 8.360 ( 2.043 2.167 1.809) 3.485 8.555 ( 0.684 3.372 -0.503) 3.477 8.617 ( 0.423 -3.891 -0.413) 3.936 8.764 ( 1.588 3.501 -6.163) 7.264 8.975 ( 2.634 -10.909 6.193) 12.818 9.241 ( -2.248 -7.323 -6.384) 9.972 10.075 ( 0.283 4.467 2.678) 5.216 10.164 ( 2.721 1.803 -2.961) 4.407 10.701 ( 1.597 2.873 1.609) 3.659 10.810 ( 0.822 0.612 -1.184) 1.566 11.092 ( -0.916 -1.187 -0.387) 1.549 11.151 ( 1.992 -2.587 -4.284) 5.387 11.385 ( 0.646 5.878 5.310) 7.948 11.527 ( -1.006 4.723 -1.408) 5.030 11.852 ( -2.396 1.756 6.337) 6.999 12.055 ( 4.616 -2.133 -3.278) 6.050 13.356 ( -1.092 4.172 4.643) 6.337 13.624 ( 0.856 -0.479 -8.676) 8.732 13.931 ( -0.395 -3.616 3.477) 5.032 14.095 ( -1.306 -5.425 -4.939) 7.452 ======================= Grid point 400 (212/260) ======================= q-point: ( 0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.076 ( 13.180 18.022 14.877) 26.829 4.170 ( 4.611 16.839 2.129) 17.588 4.405 ( 3.463 18.460 -2.177) 18.908 4.667 ( 7.111 12.765 -7.161) 16.272 5.202 ( 1.174 -4.448 10.021) 11.026 5.337 ( -3.929 -0.110 -3.226) 5.085 5.603 ( -2.600 -3.467 1.569) 4.609 5.732 ( -4.289 -9.019 2.740) 10.356 5.794 ( -0.969 0.945 0.824) 1.585 5.940 ( -2.585 -4.894 5.025) 7.476 6.161 ( 4.540 2.789 -2.832) 6.034 6.382 ( 4.343 1.164 -2.211) 5.011 7.275 ( -7.499 -7.094 2.570) 10.638 7.368 ( -2.429 -4.518 1.671) 5.395 7.714 ( -8.009 8.558 10.710) 15.877 8.100 ( 0.932 0.860 0.119) 1.274 8.382 ( -0.326 2.205 1.126) 2.497 8.548 ( -2.188 1.124 0.644) 2.543 8.641 ( 3.491 -3.372 -2.831) 5.619 8.764 ( 3.631 4.450 -5.603) 8.024 9.052 ( 0.238 -10.486 5.057) 11.644 9.215 ( 4.827 -7.642 -4.537) 10.113 10.078 ( -0.921 4.495 0.297) 4.598 10.181 ( 1.748 1.512 -3.665) 4.333 10.730 ( 0.176 2.724 0.906) 2.876 10.807 ( 0.313 1.137 -2.313) 2.596 11.029 ( -4.157 0.007 -0.947) 4.264 11.163 ( 0.855 -1.471 -3.728) 4.098 11.436 ( 1.006 2.576 4.140) 4.978 11.497 ( -0.786 5.730 -1.324) 5.933 11.836 ( -3.293 3.003 4.731) 6.499 12.104 ( 3.488 -3.118 -4.704) 6.634 13.375 ( -0.953 3.446 5.525) 6.581 13.579 ( 0.860 -0.151 -7.787) 7.836 13.940 ( -1.349 -3.652 3.157) 5.012 14.057 ( 0.267 -5.251 -2.638) 5.883 ======================= Grid point 401 (213/260) ======================= q-point: ( 0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.231 ( 9.896 15.922 -8.741) 20.685 4.447 ( 14.061 10.909 6.746) 19.032 4.505 ( 5.334 14.518 5.231) 16.327 4.782 ( 9.776 12.650 -4.759) 16.680 5.204 ( -9.490 1.235 0.190) 9.572 5.235 ( -2.654 -0.232 1.022) 2.854 5.503 ( -4.024 -0.759 -2.514) 4.805 5.670 ( -5.850 -7.489 -3.833) 10.247 5.825 ( 2.270 -8.447 4.750) 9.953 5.927 ( -1.156 -8.467 0.740) 8.578 6.206 ( 3.099 7.757 -2.239) 8.648 6.501 ( 7.968 5.439 3.783) 10.362 7.177 ( -6.401 -8.512 6.214) 12.330 7.356 ( 0.077 -5.684 1.428) 5.861 7.676 ( -5.146 11.161 12.516) 17.541 8.088 ( -5.217 6.423 5.082) 9.711 8.382 ( -2.208 -2.172 2.848) 4.208 8.488 ( -2.065 2.474 -3.172) 4.522 8.687 ( 4.265 -4.751 -4.750) 7.957 8.803 ( 5.166 4.864 -5.613) 9.047 9.094 ( 1.238 -9.336 5.184) 10.750 9.303 ( 6.409 -9.002 -2.502) 11.330 10.058 ( -0.618 4.490 -1.446) 4.757 10.170 ( 0.467 1.319 -5.041) 5.231 10.713 ( -1.299 1.337 -2.335) 2.988 10.784 ( -1.547 -0.111 -1.907) 2.458 10.950 ( -3.645 2.626 -1.301) 4.676 11.114 ( -3.419 0.608 -1.909) 3.963 11.434 ( -1.585 3.387 -1.472) 4.019 11.522 ( 2.084 1.429 1.805) 3.105 11.828 ( -0.700 4.343 4.100) 6.013 12.101 ( 0.480 -2.064 -5.528) 5.920 13.399 ( -1.154 2.907 5.807) 6.595 13.546 ( 1.344 0.230 -6.594) 6.734 13.939 ( -0.345 -4.029 1.673) 4.376 14.057 ( 0.224 -6.564 0.580) 6.594 ======================= Grid point 402 (214/260) ======================= q-point: ( 0.30 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.376 ( 14.516 13.180 -11.673) 22.819 4.605 ( 1.832 10.967 2.600) 11.419 4.678 ( 9.275 6.985 -3.529) 12.136 4.872 ( -3.182 8.000 5.839) 10.403 5.035 ( -2.719 3.145 -5.331) 6.760 5.156 ( -7.497 2.858 0.064) 8.024 5.459 ( -3.271 -2.750 -2.212) 4.812 5.488 ( -5.079 -10.927 -4.454) 12.846 5.893 ( 1.197 -5.553 3.467) 6.655 5.937 ( 2.567 -5.876 -0.801) 6.462 6.266 ( 4.025 8.662 2.293) 9.823 6.672 ( 7.696 4.292 1.138) 8.885 7.155 ( -1.758 -7.384 8.524) 11.414 7.392 ( 2.619 -6.781 1.097) 7.352 7.729 ( 0.443 13.172 14.367) 19.497 7.996 ( -10.220 12.229 9.077) 18.341 8.295 ( -7.141 -0.725 -0.020) 7.178 8.472 ( 0.299 1.434 -1.995) 2.475 8.711 ( 2.813 -6.363 -6.274) 9.368 8.865 ( 6.323 2.803 -5.833) 9.047 9.163 ( 0.907 -9.129 6.959) 11.515 9.381 ( 4.729 -8.028 -3.489) 9.949 10.041 ( 0.183 4.070 -2.518) 4.789 10.126 ( -0.249 1.556 -6.887) 7.065 10.661 ( -2.459 -0.202 -2.423) 3.458 10.725 ( -3.055 -2.233 -1.416) 4.040 10.885 ( -2.366 5.100 -1.848) 5.918 11.045 ( -3.146 1.791 0.161) 3.624 11.390 ( -1.457 3.801 -2.583) 4.821 11.543 ( -0.521 -1.618 -1.254) 2.112 11.870 ( 1.508 4.352 4.297) 6.300 12.059 ( -0.466 0.304 -4.518) 4.552 13.414 ( -1.766 2.980 5.459) 6.465 13.532 ( 2.069 0.731 -5.597) 6.012 13.962 ( 1.910 -5.595 1.000) 5.996 14.062 ( -0.978 -7.856 2.162) 8.207 ======================= Grid point 403 (215/260) ======================= q-point: ( 0.40 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.496 ( -10.303 8.406 4.454) 14.023 4.576 ( 10.911 9.091 -12.617) 18.997 4.718 ( 1.346 5.018 -10.818) 12.001 4.797 ( -6.797 7.383 -1.087) 10.093 4.958 ( -11.493 4.265 8.763) 15.069 5.098 ( 8.707 -1.658 -3.454) 9.513 5.324 ( -7.413 -5.121 4.811) 10.214 5.512 ( 5.994 -8.569 -7.028) 12.600 5.929 ( 1.520 -2.950 0.584) 3.369 5.973 ( 1.925 -3.022 -1.830) 4.023 6.381 ( 5.124 8.433 6.114) 11.608 6.744 ( 0.185 2.303 -1.338) 2.670 7.239 ( 3.770 -5.258 8.205) 10.449 7.442 ( 1.344 -5.019 1.174) 5.326 7.852 ( -4.094 9.572 8.892) 13.692 7.927 ( -0.474 15.518 17.006) 23.027 8.181 ( -3.970 2.283 -1.656) 4.869 8.423 ( -4.027 2.774 -2.582) 5.530 8.701 ( 1.241 -6.015 -5.662) 8.353 8.916 ( 3.738 -0.876 -7.048) 8.025 9.208 ( -1.807 -7.592 7.520) 10.837 9.429 ( 3.922 -7.349 -4.034) 9.256 10.003 ( -2.489 3.615 -3.074) 5.358 10.092 ( 2.803 2.610 -7.639) 8.545 10.608 ( -2.158 -2.030 1.414) 3.283 10.680 ( -1.240 -2.332 -0.559) 2.700 10.843 ( -0.356 4.621 -2.371) 5.206 11.005 ( -1.646 1.467 -0.101) 2.207 11.351 ( -0.754 3.817 -2.444) 4.595 11.483 ( -3.382 -2.144 -4.919) 6.343 11.923 ( 0.578 3.630 4.199) 5.580 12.037 ( 0.765 2.106 -2.194) 3.136 13.414 ( -2.434 3.397 4.781) 6.350 13.539 ( 3.102 1.428 -5.032) 6.082 14.017 ( 2.870 -7.940 1.206) 8.529 14.054 ( -1.065 -8.410 1.618) 8.630 ======================= Grid point 404 (216/260) ======================= q-point: (-0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.260 ( -17.832 9.498 8.704) 21.999 4.468 ( -21.804 10.139 4.442) 24.452 4.636 ( 4.239 -1.189 -13.024) 13.748 4.786 ( 9.361 6.443 -7.866) 13.821 4.939 ( -3.189 0.182 9.766) 10.275 5.201 ( 0.423 -2.978 -0.698) 3.088 5.298 ( 4.684 -2.576 2.670) 5.975 5.571 ( 6.688 -6.400 -7.946) 12.200 5.952 ( 1.514 -1.620 -1.874) 2.903 5.982 ( 1.460 -1.621 -2.978) 3.692 6.513 ( 3.797 6.489 7.065) 10.317 6.671 ( -6.920 5.549 -1.163) 8.946 7.372 ( 4.287 -5.053 6.597) 9.350 7.439 ( -2.534 1.201 1.539) 3.199 7.805 ( -7.234 6.387 13.700) 16.758 8.034 ( -1.914 2.955 5.289) 6.354 8.217 ( 7.107 9.243 3.853) 12.279 8.313 ( -3.713 4.922 -4.401) 7.575 8.681 ( 0.256 -4.509 -3.174) 5.520 8.888 ( -0.347 -3.070 -7.741) 8.335 9.208 ( -4.154 -6.060 7.109) 10.223 9.458 ( 2.320 -7.413 -3.512) 8.525 9.935 ( -2.821 4.567 -1.320) 5.529 10.096 ( 3.832 3.210 -8.342) 9.725 10.622 ( 1.375 -3.824 3.910) 5.639 10.662 ( -0.425 -1.781 -0.705) 1.962 10.843 ( 1.274 2.774 -0.812) 3.159 10.987 ( 1.171 0.531 -2.374) 2.700 11.331 ( -0.266 3.764 -1.048) 3.916 11.377 ( -3.338 -0.375 -5.458) 6.408 11.945 ( -1.322 3.379 3.842) 5.284 12.041 ( 0.533 2.278 -1.117) 2.592 13.400 ( -2.650 3.818 3.948) 6.098 13.568 ( 4.152 2.129 -4.865) 6.741 14.016 ( -3.011 -9.205 2.608) 10.030 14.107 ( 5.212 -9.186 -1.417) 10.656 ======================= Grid point 405 (217/260) ======================= q-point: (-0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.013 ( -19.256 11.805 12.206) 25.673 4.143 ( -19.989 14.703 13.152) 28.084 4.641 ( 3.839 -6.092 -3.936) 8.206 4.861 ( 2.061 6.734 -1.295) 7.161 4.932 ( -3.063 -6.092 3.909) 7.860 5.171 ( -3.577 -2.293 3.789) 5.693 5.444 ( 10.433 -0.869 -4.801) 11.518 5.632 ( 6.895 -3.460 -8.617) 11.566 5.958 ( 1.302 -0.660 -2.608) 2.988 5.990 ( 1.895 -1.598 -2.962) 3.863 6.491 ( -11.424 10.522 0.291) 15.534 6.606 ( -0.041 4.368 5.540) 7.055 7.375 ( -4.433 4.753 1.908) 6.774 7.484 ( 3.090 -5.084 2.543) 6.470 7.794 ( -5.173 1.504 13.327) 14.375 8.025 ( -1.384 2.103 3.466) 4.284 8.198 ( -3.664 6.510 0.864) 7.520 8.415 ( 8.815 4.062 -0.735) 9.734 8.665 ( -0.416 -2.624 -1.245) 2.935 8.816 ( -1.410 -4.295 -6.549) 7.958 9.167 ( -5.902 -5.347 6.737) 10.432 9.460 ( 0.659 -7.342 -3.042) 7.974 9.895 ( -1.328 5.464 0.860) 5.688 10.103 ( 3.385 2.613 -7.649) 8.764 10.653 ( 0.407 -1.081 -1.936) 2.255 10.689 ( 2.412 -5.154 3.072) 6.467 10.858 ( 1.802 3.085 -1.879) 4.037 11.036 ( 5.726 -0.792 -1.717) 6.030 11.283 ( -2.567 2.327 -2.123) 4.063 11.352 ( 1.539 3.237 1.001) 3.721 11.931 ( -3.158 3.523 3.298) 5.767 12.031 ( -0.732 1.930 -1.024) 2.305 13.380 ( -2.445 4.173 3.281) 5.845 13.612 ( 4.842 2.540 -5.315) 7.625 13.977 ( -3.092 -8.779 1.795) 9.479 14.183 ( 4.823 -10.354 -2.973) 11.803 ======================= Grid point 406 (218/260) ======================= q-point: (-0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.751 ( -20.349 18.513 15.945) 31.797 3.985 ( -12.652 16.240 21.003) 29.410 4.695 ( 0.959 -5.561 2.295) 6.092 4.866 ( -1.765 -2.015 6.185) 6.740 4.908 ( -0.123 -2.721 -0.126) 2.727 5.117 ( -5.534 -0.960 1.727) 5.876 5.567 ( 7.045 1.842 -4.870) 8.760 5.686 ( 5.659 -1.708 -7.905) 9.871 5.961 ( 0.811 -0.843 -2.285) 2.567 6.005 ( 2.115 -1.767 -2.849) 3.964 6.284 ( -10.862 12.411 -0.284) 16.495 6.597 ( -4.736 3.384 3.864) 6.987 7.326 ( -1.840 3.484 1.407) 4.184 7.513 ( 0.211 -5.838 -2.158) 6.228 7.812 ( -3.084 1.264 11.043) 11.535 8.064 ( 2.962 2.466 4.489) 5.916 8.170 ( -2.683 3.901 5.461) 7.228 8.520 ( 4.130 1.134 -2.442) 4.930 8.651 ( 0.789 -1.547 -2.267) 2.855 8.751 ( -1.605 -4.845 -4.137) 6.569 9.104 ( -6.390 -4.657 6.055) 9.959 9.444 ( 0.126 -7.477 -3.248) 8.153 9.901 ( 0.540 5.394 2.850) 6.125 10.104 ( 2.407 1.418 -5.920) 6.546 10.647 ( 0.879 -0.268 -2.640) 2.795 10.730 ( 0.985 -4.780 0.763) 4.939 10.908 ( 5.657 3.833 -2.867) 7.410 11.125 ( 4.920 -1.412 -1.810) 5.429 11.248 ( -0.984 4.340 1.683) 4.757 11.418 ( 3.515 2.272 4.287) 5.992 11.884 ( -4.476 3.894 2.862) 6.587 12.006 ( -1.023 1.535 -0.886) 2.046 13.362 ( -2.076 4.467 2.970) 5.752 13.657 ( 4.765 2.295 -6.448) 8.340 13.937 ( -2.552 -7.675 1.436) 8.215 14.225 ( 2.860 -10.459 -4.634) 11.792 ======================= Grid point 407 (219/260) ======================= q-point: (-0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.565 ( -14.102 24.010 19.165) 33.803 3.968 ( -8.453 18.259 24.279) 31.533 4.666 ( -4.167 1.894 0.056) 4.577 4.862 ( -1.536 -2.694 1.308) 3.365 4.988 ( -8.025 -0.932 2.101) 8.348 5.017 ( 5.415 -5.934 9.318) 12.303 5.627 ( 2.929 3.420 -3.096) 5.465 5.704 ( 0.054 3.628 -0.244) 3.637 5.946 ( -0.593 -2.413 -3.114) 3.984 6.014 ( 0.162 -0.112 -2.318) 2.326 6.140 ( -2.093 5.417 -4.717) 7.481 6.514 ( -6.312 1.969 1.787) 6.849 7.336 ( 1.182 -0.570 2.097) 2.474 7.482 ( -0.599 -5.461 -4.000) 6.795 7.830 ( -2.882 3.219 8.133) 9.209 8.162 ( -2.979 0.451 5.348) 6.138 8.178 ( 4.669 2.160 5.911) 7.836 8.537 ( 1.443 2.160 -4.016) 4.782 8.665 ( 1.116 -0.651 -2.025) 2.402 8.706 ( 0.813 -5.654 -3.181) 6.538 9.025 ( -6.766 -4.323 4.362) 9.137 9.411 ( -1.054 -8.218 -4.273) 9.322 9.954 ( 1.995 4.991 4.854) 7.243 10.109 ( 2.439 1.145 -4.142) 4.941 10.648 ( 1.202 0.787 -2.052) 2.505 10.757 ( 1.770 -2.823 0.259) 3.342 10.989 ( 5.386 2.133 -2.888) 6.473 11.172 ( 2.453 -2.467 -3.078) 4.645 11.275 ( 0.873 6.648 5.273) 8.531 11.511 ( 2.672 1.688 3.640) 4.821 11.830 ( -3.589 3.933 3.580) 6.416 11.992 ( 0.255 0.841 -0.532) 1.027 13.350 ( -1.696 4.648 3.103) 5.840 13.680 ( 3.580 1.085 -7.972) 8.806 13.912 ( -1.475 -5.766 1.857) 6.234 14.215 ( 0.295 -9.299 -5.646) 10.883 ======================= Grid point 408 (220/260) ======================= q-point: (-0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.551 ( -3.308 26.202 20.362) 33.348 4.017 ( -5.202 19.693 21.963) 29.954 4.574 ( -4.601 7.722 -4.172) 9.910 4.755 ( -6.024 11.923 -8.965) 16.088 4.951 ( 0.351 -9.304 10.564) 14.082 5.220 ( 5.695 -9.474 13.879) 17.743 5.612 ( -0.870 -1.205 -4.577) 4.812 5.728 ( -2.170 14.579 12.426) 19.278 5.895 ( -1.592 -4.018 -4.805) 6.463 5.976 ( -1.185 0.480 -2.150) 2.502 6.132 ( 3.494 -4.408 -6.820) 8.840 6.414 ( -4.541 -0.639 -1.443) 4.807 7.374 ( 0.255 -3.978 3.005) 4.992 7.446 ( -0.714 -4.133 -3.005) 5.160 7.823 ( -4.372 5.260 7.548) 10.186 8.134 ( -2.724 -1.596 0.911) 3.286 8.288 ( 3.492 2.421 3.958) 5.807 8.541 ( 2.282 3.585 -3.580) 5.557 8.635 ( -2.112 -2.576 0.119) 3.333 8.750 ( 5.119 -1.841 -4.933) 7.344 8.946 ( -4.564 -6.278 4.551) 8.998 9.338 ( -2.990 -8.488 -5.623) 10.612 10.027 ( 1.886 4.656 4.783) 6.936 10.133 ( 2.990 1.678 -2.925) 4.507 10.665 ( 1.665 1.940 -0.184) 2.563 10.791 ( 1.680 -0.923 0.160) 1.923 11.055 ( 4.415 0.041 -2.525) 5.087 11.174 ( -0.098 -3.274 -2.380) 4.049 11.333 ( 0.938 7.194 5.372) 9.027 11.545 ( -0.170 3.289 0.229) 3.302 11.828 ( -0.768 2.451 5.933) 6.466 12.009 ( 2.304 -0.376 -1.266) 2.656 13.348 ( -1.361 4.592 3.701) 6.053 13.666 ( 1.820 -0.244 -8.869) 9.057 13.913 ( -0.337 -4.008 2.647) 4.815 14.161 ( -1.447 -7.254 -5.684) 9.329 ======================= Grid point 409 (221/260) ======================= q-point: ( 0.00 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.191 ( 4.513 19.427 13.485) 24.075 4.367 ( -0.937 5.293 8.901) 10.398 4.698 ( 2.017 6.682 4.042) 8.066 4.787 ( 0.358 -1.849 1.499) 2.407 4.965 ( 3.699 4.557 7.198) 9.288 5.179 ( 3.123 -11.836 8.798) 15.075 5.537 ( -1.065 2.160 -6.850) 7.261 5.653 ( -1.311 -8.472 -4.789) 9.820 5.956 ( -5.124 1.046 -3.063) 6.061 5.982 ( -6.255 -0.665 -3.452) 7.175 6.129 ( 5.159 9.694 4.698) 11.944 6.297 ( 3.022 -5.717 -2.584) 6.964 7.306 ( -4.500 -0.672 2.126) 5.022 7.332 ( -3.434 -2.884 0.329) 4.497 7.944 ( -5.781 8.245 10.300) 14.405 8.061 ( -2.806 -3.311 5.442) 6.961 8.408 ( -0.001 3.539 4.023) 5.358 8.513 ( -2.151 -5.928 3.144) 7.046 8.625 ( 2.649 3.452 -1.418) 4.576 8.728 ( 4.867 -7.330 0.348) 8.805 8.917 ( 0.772 6.588 -6.295) 9.145 9.079 ( 0.117 -8.629 -8.013) 11.777 10.151 ( 0.971 2.887 0.728) 3.132 10.183 ( 1.858 -0.204 -1.356) 2.309 10.757 ( 1.856 2.645 1.634) 3.621 10.800 ( 1.417 -1.493 0.720) 2.180 11.079 ( 0.009 0.080 -2.321) 2.322 11.099 ( 1.567 -1.973 -3.511) 4.321 11.515 ( -0.765 6.003 4.402) 7.484 11.585 ( -0.934 -0.198 1.699) 1.949 11.897 ( -0.292 3.467 2.575) 4.329 11.985 ( 2.109 -4.611 -1.028) 5.173 13.463 ( -0.689 6.136 1.611) 6.382 13.577 ( -0.174 -4.539 -3.254) 5.588 13.907 ( 0.271 1.633 -1.091) 1.983 13.983 ( -0.215 -5.302 -4.217) 6.778 ======================= Grid point 410 (222/260) ======================= q-point: ( 0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.391 ( 7.553 11.435 9.309) 16.567 4.433 ( 3.563 7.598 3.711) 9.176 4.738 ( 2.940 12.911 -2.943) 13.565 4.837 ( 6.127 2.639 -1.570) 6.853 5.118 ( 3.543 -1.020 10.980) 11.583 5.246 ( 0.504 -9.604 -2.245) 9.876 5.520 ( 3.383 0.087 -0.517) 3.423 5.614 ( -0.036 -5.812 -2.535) 6.341 5.771 ( -9.884 1.285 -4.746) 11.040 5.855 ( -8.393 -4.929 2.107) 9.958 6.274 ( 7.172 7.096 0.780) 10.119 6.380 ( 7.297 -2.593 -1.253) 7.844 7.207 ( -8.141 0.416 3.726) 8.963 7.269 ( -4.803 -4.825 2.939) 7.415 7.918 ( -5.122 10.375 10.538) 15.650 8.070 ( -0.590 -4.346 5.747) 7.230 8.419 ( -2.120 2.470 3.713) 4.938 8.500 ( -2.641 -5.021 4.302) 7.120 8.661 ( 2.518 5.013 -2.151) 6.008 8.797 ( 3.041 -6.669 -1.633) 7.509 8.922 ( 3.875 3.969 -3.776) 6.710 9.061 ( 4.666 -7.811 -7.580) 11.842 10.156 ( -0.089 3.064 -1.147) 3.273 10.193 ( 0.844 -0.531 -2.459) 2.654 10.777 ( -0.657 1.965 0.010) 2.072 10.807 ( -0.678 -0.946 -0.813) 1.420 11.052 ( -0.486 2.356 -2.573) 3.522 11.111 ( 1.791 -3.248 -3.661) 5.212 11.517 ( -2.125 4.341 3.892) 6.205 11.565 ( -2.308 0.379 1.564) 2.813 11.908 ( 0.033 4.776 1.491) 5.003 12.017 ( 2.271 -5.446 -1.879) 6.192 13.465 ( -0.640 5.114 2.421) 5.694 13.552 ( 0.009 -2.952 -2.901) 4.139 13.900 ( -0.567 0.235 -0.251) 0.663 13.953 ( -0.144 -4.585 -2.961) 5.459 ======================= Grid point 411 (223/260) ======================= q-point: ( 0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.517 ( 6.855 10.821 -2.091) 12.979 4.598 ( 8.292 2.852 4.510) 9.860 4.784 ( 4.490 13.173 -3.062) 14.250 4.956 ( 6.956 0.776 -0.669) 7.031 5.176 ( -1.398 -2.866 -11.100) 11.549 5.187 ( -2.047 -2.069 2.085) 3.580 5.536 ( -9.124 2.506 0.302) 9.467 5.583 ( -4.418 -0.499 -7.868) 9.037 5.658 ( 5.669 -4.829 4.957) 8.946 5.754 ( -2.794 -8.592 5.149) 10.399 6.375 ( 4.170 8.820 0.886) 9.796 6.521 ( 7.654 -4.362 1.415) 8.922 7.111 ( -5.824 2.525 6.286) 8.933 7.224 ( -2.359 -7.123 3.551) 8.301 7.931 ( -2.006 12.785 11.184) 17.104 8.117 ( -0.285 -4.486 7.774) 8.980 8.385 ( -4.343 3.015 3.032) 6.095 8.476 ( -2.944 -4.583 3.580) 6.518 8.671 ( 0.920 4.826 -3.997) 6.334 8.816 ( 0.978 -6.944 -2.264) 7.369 8.993 ( 6.094 3.603 -1.789) 7.302 9.129 ( 7.547 -8.276 -5.524) 12.488 10.138 ( -0.289 3.235 -2.554) 4.132 10.178 ( -0.011 -0.704 -3.618) 3.686 10.737 ( -2.329 1.159 -3.011) 3.979 10.762 ( -2.903 -1.410 -2.446) 4.049 11.023 ( -0.901 4.085 -2.392) 4.819 11.094 ( -0.962 -2.609 -3.110) 4.172 11.498 ( -2.454 3.076 1.879) 4.361 11.539 ( -1.996 -0.534 1.955) 2.845 11.925 ( 0.987 5.425 1.027) 5.609 12.032 ( 1.210 -4.780 -2.389) 5.479 13.475 ( -0.513 4.218 3.108) 5.264 13.538 ( 0.583 -1.576 -2.360) 2.897 13.886 ( -0.648 -0.504 -0.164) 0.837 13.935 ( -0.367 -5.026 -1.137) 5.166 ======================= Grid point 412 (224/260) ======================= q-point: ( 0.30 0.44 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.632 ( 8.632 10.696 -4.962) 14.612 4.744 ( 4.957 -0.226 0.820) 5.030 4.825 ( 2.453 10.388 -6.397) 12.444 4.996 ( -5.019 -1.394 -0.688) 5.254 5.063 ( 1.041 2.896 -11.506) 11.910 5.154 ( 1.436 -3.752 -3.016) 5.024 5.353 ( -11.277 -0.405 -1.195) 11.348 5.400 ( -8.531 -3.185 -1.646) 9.253 5.801 ( 4.617 -2.524 4.751) 7.090 5.822 ( 4.930 -4.437 2.604) 7.126 6.458 ( 3.249 10.208 4.915) 11.787 6.645 ( 4.362 -7.130 2.656) 8.771 7.111 ( 0.376 3.842 6.932) 7.935 7.244 ( 1.611 -7.883 3.403) 8.736 7.999 ( 0.235 12.004 9.690) 15.429 8.142 ( -4.501 -0.787 9.716) 10.736 8.324 ( -3.437 6.230 1.499) 7.271 8.474 ( 0.544 -5.301 2.769) 6.005 8.636 ( -1.132 3.876 -5.071) 6.482 8.808 ( -0.543 -9.533 -0.848) 9.586 9.093 ( 5.729 3.743 -1.051) 6.924 9.220 ( 6.442 -7.786 -4.756) 11.169 10.113 ( -0.234 2.758 -3.262) 4.278 10.142 ( -0.404 -0.172 -4.618) 4.638 10.662 ( -3.249 0.535 -3.253) 4.628 10.684 ( -2.979 -1.650 -2.981) 4.526 10.983 ( -1.561 4.338 -2.724) 5.355 11.046 ( -1.895 -1.748 -2.253) 3.423 11.459 ( -2.594 3.053 -0.143) 4.009 11.509 ( -2.615 -1.986 0.165) 3.288 11.958 ( 1.603 4.411 1.477) 4.920 12.034 ( 0.998 -2.782 -1.774) 3.447 13.491 ( -0.515 4.030 3.404) 5.301 13.540 ( 1.469 -0.559 -1.897) 2.464 13.879 ( 0.123 -1.740 -0.167) 1.752 13.920 ( -0.850 -5.506 -0.087) 5.572 ======================= Grid point 413 (225/260) ======================= q-point: ( 0.40 0.44 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.658 ( -8.731 7.003 -1.213) 11.258 4.740 ( -2.899 1.766 -14.386) 14.781 4.774 ( 4.582 4.984 -3.627) 7.681 4.879 ( -4.035 -1.484 -5.594) 7.055 5.059 ( -7.663 5.734 5.510) 11.043 5.116 ( 4.569 4.015 -4.170) 7.374 5.225 ( -5.147 -3.681 5.683) 8.505 5.327 ( 4.320 -9.478 -4.577) 11.377 5.889 ( 3.444 -0.630 0.454) 3.531 5.910 ( 3.725 -2.605 -0.776) 4.611 6.558 ( 3.025 8.969 6.507) 11.486 6.713 ( 1.199 -5.595 2.677) 6.318 7.201 ( 3.359 2.641 6.919) 8.132 7.313 ( 2.762 -7.137 3.490) 8.411 8.029 ( -4.476 7.109 7.274) 11.112 8.107 ( -6.625 0.145 9.110) 11.265 8.332 ( 3.500 12.454 1.488) 13.022 8.515 ( -0.206 1.346 3.989) 4.215 8.563 ( -1.235 -0.885 -7.112) 7.273 8.784 ( -2.257 -12.380 0.727) 12.605 9.166 ( 3.171 3.472 -1.095) 4.828 9.281 ( 4.311 -7.127 -4.718) 9.573 10.075 ( -1.486 3.260 -2.611) 4.433 10.117 ( 1.137 -0.526 -3.893) 4.089 10.594 ( -2.094 0.816 -1.113) 2.508 10.631 ( -0.926 -2.475 -2.029) 3.332 10.934 ( -0.985 4.191 -3.910) 5.816 10.999 ( -1.152 -2.022 -3.316) 4.051 11.412 ( -2.116 2.290 -0.731) 3.202 11.448 ( -3.466 -1.540 -1.456) 4.063 11.994 ( 0.869 3.375 1.866) 3.954 12.045 ( 1.099 -1.303 -0.691) 1.839 13.503 ( -0.835 4.898 3.111) 5.862 13.562 ( 2.387 -0.195 -1.765) 2.975 13.886 ( -0.072 -3.797 0.695) 3.861 13.908 ( 0.527 -5.349 -0.942) 5.456 ======================= Grid point 414 (226/260) ======================= q-point: (-0.50 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.443 ( -12.666 8.304 0.594) 15.157 4.573 ( -5.609 -4.360 -7.223) 10.132 4.681 ( -13.637 9.345 2.744) 16.758 4.822 ( -0.767 -3.828 -1.002) 4.031 5.004 ( -2.891 6.196 4.787) 8.347 5.123 ( -3.033 -5.269 3.748) 7.142 5.298 ( 10.522 3.557 -3.687) 11.703 5.423 ( 9.443 -7.834 -6.409) 13.843 5.933 ( 2.683 -0.123 -2.729) 3.829 5.948 ( 2.557 -1.469 -3.369) 4.477 6.644 ( 1.231 5.995 5.542) 8.257 6.721 ( -2.253 -0.915 1.435) 2.824 7.310 ( 3.216 0.148 6.084) 6.883 7.375 ( 1.659 -5.124 2.190) 5.814 7.975 ( -8.376 7.486 11.715) 16.231 8.058 ( -5.123 -1.045 7.150) 8.857 8.417 ( 3.836 6.701 -4.234) 8.806 8.450 ( -3.610 11.199 0.051) 11.767 8.567 ( 1.248 -5.056 1.044) 5.311 8.734 ( -3.789 -11.994 0.671) 12.596 9.188 ( 0.346 3.684 -1.207) 3.892 9.307 ( 2.300 -7.391 -4.249) 8.830 10.038 ( -1.458 5.260 -0.177) 5.462 10.116 ( 1.236 -1.787 -2.907) 3.629 10.582 ( 1.026 0.308 0.398) 1.143 10.618 ( 0.725 -2.505 -1.513) 3.015 10.904 ( 1.321 3.270 -4.268) 5.537 10.965 ( 1.444 -2.465 -5.488) 6.187 11.378 ( -2.262 1.079 0.057) 2.507 11.383 ( -1.785 0.483 -0.375) 1.887 12.011 ( -0.650 3.008 1.859) 3.595 12.053 ( 0.058 -0.972 -0.249) 1.005 13.505 ( -1.163 6.238 2.313) 6.753 13.595 ( 2.805 -1.094 -2.050) 3.643 13.876 ( -1.038 -2.741 0.673) 3.008 13.937 ( 3.298 -7.135 -1.866) 8.079 ======================= Grid point 415 (227/260) ======================= q-point: (-0.40 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.254 ( -11.889 11.986 7.908) 18.642 4.445 ( -10.921 7.585 7.165) 15.104 4.493 ( -7.098 -1.486 4.135) 8.348 4.750 ( -7.810 -12.120 5.157) 15.313 5.000 ( -0.469 6.490 0.952) 6.577 5.107 ( -1.852 -4.252 2.654) 5.343 5.462 ( 11.693 2.837 -7.044) 13.943 5.545 ( 9.641 -4.853 -7.851) 13.347 5.951 ( 2.295 0.079 -4.004) 4.616 5.963 ( 2.431 -1.055 -4.191) 4.958 6.646 ( -6.268 4.749 1.251) 7.963 6.674 ( -2.662 1.698 3.391) 4.633 7.387 ( 1.146 -1.350 1.388) 2.250 7.400 ( 1.133 -2.720 -0.124) 2.949 7.925 ( -7.761 8.546 15.394) 19.242 8.036 ( -3.638 -2.009 8.954) 9.872 8.338 ( -5.437 8.251 1.326) 9.970 8.479 ( 2.827 -0.910 -4.327) 5.248 8.588 ( -0.477 -1.879 2.688) 3.314 8.676 ( -2.135 -7.870 -0.811) 8.194 9.168 ( -1.358 4.683 -1.204) 5.023 9.303 ( 0.629 -7.953 -3.690) 8.789 10.018 ( -1.161 6.224 1.159) 6.437 10.111 ( 0.464 -2.322 -2.634) 3.542 10.619 ( 2.366 -1.210 -0.248) 2.669 10.627 ( 1.671 -1.431 -2.030) 2.993 10.923 ( 4.149 3.430 -3.867) 6.629 10.991 ( 5.652 -3.200 -4.754) 8.049 11.342 ( -1.714 2.997 1.811) 3.899 11.381 ( 0.179 -0.468 2.133) 2.192 11.997 ( -2.299 2.953 1.629) 4.081 12.040 ( -1.395 -1.053 -0.207) 1.760 13.497 ( -1.190 7.195 1.425) 7.430 13.625 ( 2.278 -3.540 -2.618) 4.957 13.869 ( 0.149 0.624 -0.188) 0.668 13.985 ( 3.750 -8.930 -2.744) 10.067 ======================= Grid point 416 (228/260) ======================= q-point: (-0.30 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.129 ( -11.738 18.609 14.491) 26.345 4.326 ( -9.143 16.633 13.793) 23.462 4.476 ( -3.290 -13.874 11.484) 18.308 4.662 ( -6.382 -14.574 8.076) 17.842 4.992 ( -0.595 5.833 -0.029) 5.863 5.083 ( -2.201 -2.958 0.270) 3.697 5.596 ( 9.151 1.650 -7.602) 12.010 5.640 ( 7.733 -2.562 -8.712) 11.927 5.955 ( 1.383 0.460 -4.508) 4.738 5.976 ( 2.696 -1.353 -4.876) 5.734 6.507 ( -9.704 8.864 1.130) 13.191 6.616 ( -6.500 -1.979 2.726) 7.321 7.368 ( -0.589 1.208 -3.548) 3.794 7.414 ( 0.488 -3.761 -2.543) 4.566 7.927 ( -5.375 8.711 16.301) 19.249 8.066 ( -2.257 -3.712 12.807) 13.524 8.273 ( -3.655 8.014 3.669) 9.542 8.478 ( -0.237 -9.840 -0.240) 9.846 8.595 ( 0.770 0.907 -1.136) 1.645 8.649 ( -0.281 -3.718 -1.607) 4.060 9.126 ( -2.166 5.715 -1.804) 6.372 9.278 ( -0.372 -8.624 -3.922) 9.481 10.017 ( 0.045 5.626 1.900) 5.938 10.101 ( 0.546 -2.237 -2.019) 3.062 10.641 ( 2.097 -0.103 -2.640) 3.373 10.658 ( 2.430 -2.152 -1.079) 3.420 10.988 ( 5.387 4.077 -3.213) 7.481 11.067 ( 5.369 -3.751 -3.560) 7.455 11.351 ( 0.351 5.008 4.300) 6.610 11.424 ( 2.128 -1.885 4.219) 5.088 11.956 ( -3.402 3.267 1.423) 4.927 12.006 ( -2.057 -1.483 -0.104) 2.538 13.485 ( -1.000 7.564 0.806) 7.672 13.635 ( 1.174 -5.983 -3.089) 6.835 13.879 ( 1.388 3.614 -1.218) 4.058 14.022 ( 2.989 -9.397 -3.792) 10.565 ======================= Grid point 417 (229/260) ======================= q-point: (-0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.051 ( -8.841 23.683 15.788) 29.804 4.316 ( -5.813 13.747 17.170) 22.750 4.510 ( -3.139 -13.661 14.730) 20.333 4.670 ( -1.514 -13.757 12.214) 18.459 4.992 ( 0.685 3.313 1.371) 3.650 5.030 ( -2.817 0.663 -2.669) 3.937 5.656 ( 2.783 1.269 -6.671) 7.339 5.703 ( 5.762 -3.047 -6.548) 9.239 5.935 ( 1.169 2.471 -6.180) 6.757 5.993 ( 3.988 -2.543 -5.971) 7.618 6.333 ( -10.666 10.583 1.543) 15.104 6.492 ( -9.089 -4.679 1.992) 10.414 7.342 ( 0.470 1.419 -2.855) 3.222 7.395 ( 0.461 -3.606 -3.842) 5.290 7.951 ( -4.634 8.221 14.016) 16.897 8.099 ( -5.825 -5.611 14.096) 16.252 8.286 ( 2.398 7.866 3.435) 8.912 8.490 ( 1.034 -11.267 1.783) 11.454 8.598 ( 0.861 1.253 -1.960) 2.481 8.636 ( 0.283 -1.980 -2.081) 2.886 9.061 ( -2.941 6.488 -3.841) 8.093 9.229 ( -1.485 -9.490 -5.400) 11.019 10.052 ( 1.757 4.372 3.003) 5.588 10.111 ( 1.871 -1.337 -0.775) 2.427 10.665 ( 2.454 1.084 -1.698) 3.175 10.699 ( 2.911 -2.436 -0.450) 3.823 11.046 ( 3.459 3.262 -2.847) 5.541 11.112 ( 2.433 -3.299 -2.951) 5.051 11.411 ( 2.009 6.310 5.228) 8.437 11.504 ( 2.803 -2.650 4.433) 5.876 11.907 ( -2.954 3.873 1.647) 5.142 11.974 ( -1.313 -2.468 0.171) 2.800 13.474 ( -0.811 7.452 0.639) 7.523 13.625 ( 0.369 -6.690 -3.325) 7.480 13.895 ( 1.648 4.365 -1.961) 5.061 14.033 ( 1.594 -8.560 -4.541) 9.820 ======================= Grid point 418 (230/260) ======================= q-point: (-0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.063 ( -2.243 23.906 15.326) 28.485 4.335 ( -4.411 6.521 13.429) 15.567 4.601 ( 0.679 -3.355 14.812) 15.203 4.740 ( -0.567 -10.133 10.753) 14.786 4.954 ( -1.870 7.420 -4.657) 8.958 5.057 ( 3.027 -4.992 7.201) 9.270 5.614 ( -1.355 1.831 -6.582) 6.965 5.713 ( -0.468 -8.110 -4.762) 9.416 5.949 ( 6.210 5.745 -6.758) 10.828 6.031 ( 3.970 -2.521 -4.716) 6.660 6.163 ( -9.858 10.246 2.633) 14.460 6.346 ( -7.316 -6.576 0.639) 9.858 7.336 ( -0.338 0.358 -0.172) 0.522 7.375 ( -0.588 -3.036 -2.210) 3.801 7.960 ( -4.768 7.591 11.340) 14.455 8.081 ( -5.093 -4.067 9.152) 11.236 8.363 ( 1.839 5.624 4.506) 7.438 8.521 ( -0.246 -8.706 2.432) 9.043 8.600 ( 1.137 1.800 -1.554) 2.636 8.650 ( 3.397 -4.071 -1.189) 5.434 8.977 ( -2.110 7.058 -5.891) 9.432 9.152 ( -1.758 -9.709 -7.068) 12.137 10.111 ( 2.113 3.317 2.597) 4.713 10.149 ( 2.516 -0.428 -0.433) 2.589 10.706 ( 2.716 2.227 0.295) 3.525 10.753 ( 2.878 -2.429 0.834) 3.857 11.072 ( 2.053 1.617 -2.782) 3.817 11.115 ( 0.217 -2.569 -2.475) 3.574 11.478 ( 1.172 6.594 4.729) 8.199 11.568 ( 1.099 -1.787 2.882) 3.565 11.886 ( -1.017 3.786 2.470) 4.634 11.966 ( 0.352 -3.599 -0.020) 3.616 13.466 ( -0.714 6.954 0.948) 7.054 13.603 ( -0.036 -5.971 -3.379) 6.861 13.906 ( 1.110 3.358 -1.925) 4.026 14.016 ( 0.345 -6.929 -4.699) 8.379 ======================= Grid point 459 (231/260) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.365 ( -7.371 0.000 -17.413) 18.909 3.365 ( 7.371 0.000 17.413) 18.909 3.687 ( 4.779 0.000 -17.544) 18.183 3.687 ( -4.779 0.000 17.544) 18.183 5.413 ( 5.517 0.000 -6.268) 8.350 5.413 ( -5.517 0.000 6.268) 8.350 5.613 ( 4.485 0.000 -16.483) 17.082 5.613 ( -4.485 0.000 16.483) 17.082 6.034 ( 2.861 0.000 -7.033) 7.593 6.034 ( -2.861 0.000 7.033) 7.593 6.417 ( 1.974 0.000 -4.522) 4.934 6.417 ( -1.974 0.000 4.522) 4.934 7.569 ( 9.951 0.000 -12.354) 15.863 7.569 ( -9.951 0.000 12.354) 15.863 7.912 ( 4.107 0.000 -5.404) 6.788 7.912 ( -4.107 0.000 5.404) 6.788 8.249 ( -7.651 0.000 2.536) 8.060 8.249 ( 7.651 0.000 -2.536) 8.060 8.690 ( 0.978 0.000 -5.376) 5.464 8.690 ( -0.978 0.000 5.376) 5.464 9.432 ( -5.896 0.000 -2.764) 6.512 9.432 ( 5.896 0.000 2.764) 6.512 9.987 ( 1.974 0.000 -5.901) 6.222 9.987 ( -1.974 0.000 5.901) 6.222 10.628 ( 0.254 0.000 -1.878) 1.895 10.628 ( -0.254 0.000 1.878) 1.895 11.032 ( 6.298 0.000 -2.131) 6.648 11.032 ( -6.298 0.000 2.131) 6.648 11.542 ( -1.804 0.000 -3.693) 4.110 11.542 ( 1.804 0.000 3.693) 4.110 11.829 ( 13.417 0.000 -9.838) 16.638 11.829 ( -13.417 0.000 9.838) 16.638 13.446 ( 0.726 0.000 -7.461) 7.496 13.446 ( -0.726 0.000 7.461) 7.496 14.183 ( -3.656 0.000 -1.411) 3.919 14.183 ( 3.656 0.000 1.411) 3.919 ======================= Grid point 461 (232/260) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.230 ( 11.417 0.000 -25.742) 28.160 3.555 ( 13.962 0.000 -20.096) 24.470 3.835 ( 3.751 0.000 21.600) 21.923 3.909 ( 20.865 0.000 15.258) 25.849 5.339 ( -8.676 0.000 7.300) 11.339 5.447 ( 2.156 0.000 -4.244) 4.760 5.507 ( 4.146 0.000 -27.960) 28.266 5.543 ( -9.695 0.000 1.690) 9.841 6.060 ( 2.158 0.000 -0.944) 2.356 6.071 ( -1.207 0.000 10.059) 10.131 6.377 ( -5.741 0.000 3.262) 6.603 6.396 ( -0.053 0.000 -3.776) 3.776 7.523 ( -6.948 0.000 16.753) 18.137 7.651 ( 4.299 0.000 -8.445) 9.477 7.841 ( -8.574 0.000 -1.354) 8.680 7.844 ( -4.329 0.000 6.923) 8.165 8.211 ( 0.985 0.000 1.335) 1.659 8.405 ( 10.236 0.000 -1.732) 10.381 8.674 ( 2.676 0.000 -7.240) 7.718 8.688 ( -4.343 0.000 5.074) 6.679 9.359 ( 0.583 0.000 -1.979) 2.063 9.559 ( 5.439 0.000 1.490) 5.639 9.966 ( 0.979 0.000 -7.601) 7.664 9.992 ( -1.806 0.000 5.628) 5.911 10.621 ( 0.663 0.000 -2.185) 2.283 10.638 ( 0.038 0.000 1.203) 1.204 10.946 ( -5.224 0.000 2.963) 6.006 11.119 ( 4.825 0.000 -3.194) 5.787 11.493 ( -3.317 0.000 -1.161) 3.514 11.604 ( -14.954 0.000 5.164) 15.821 11.607 ( 2.409 0.000 3.469) 4.224 11.912 ( 5.232 0.000 -12.314) 13.379 13.413 ( 1.803 0.000 -7.340) 7.558 13.485 ( -0.910 0.000 6.485) 6.548 14.145 ( -0.600 0.000 1.585) 1.695 14.282 ( 4.410 0.000 5.073) 6.722 ======================= Grid point 462 (233/260) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.385 ( 25.665 0.000 -26.047) 36.567 3.689 ( 19.566 0.000 -23.024) 30.214 4.095 ( 8.415 0.000 18.408) 20.240 4.449 ( 24.636 0.000 14.309) 28.490 5.208 ( -9.167 0.000 2.074) 9.399 5.285 ( -16.315 0.000 0.905) 16.341 5.427 ( 7.329 0.000 -20.463) 21.736 5.483 ( 3.451 0.000 -6.564) 7.416 6.073 ( 0.025 0.000 -1.151) 1.151 6.093 ( -1.992 0.000 3.248) 3.810 6.266 ( -8.890 0.000 2.573) 9.255 6.391 ( 1.959 0.000 -1.257) 2.328 7.550 ( -8.451 0.000 -0.895) 8.498 7.558 ( -4.069 0.000 19.046) 19.475 7.639 ( -14.049 0.000 2.603) 14.288 7.920 ( 5.880 0.000 2.218) 6.285 8.246 ( 1.633 0.000 -1.556) 2.255 8.544 ( 4.663 0.000 -0.016) 4.663 8.623 ( -6.842 0.000 8.180) 10.664 8.683 ( 6.796 0.000 -12.737) 14.437 9.420 ( 6.064 0.000 -0.266) 6.069 9.623 ( 1.518 0.000 -0.343) 1.556 9.912 ( 0.119 0.000 -9.564) 9.564 10.006 ( -1.722 0.000 5.484) 5.748 10.623 ( 1.304 0.000 -1.821) 2.240 10.647 ( 0.308 0.000 0.707) 0.771 10.895 ( -3.557 0.000 4.471) 5.713 11.135 ( 0.200 0.000 -4.763) 4.768 11.264 ( -16.824 0.000 3.696) 17.225 11.582 ( 4.917 0.000 0.434) 4.936 11.658 ( 0.876 0.000 -0.290) 0.922 11.864 ( 0.224 0.000 -10.494) 10.496 13.403 ( 2.648 0.000 -6.506) 7.025 13.499 ( -2.277 0.000 5.387) 5.848 14.182 ( 2.690 0.000 2.672) 3.792 14.395 ( 2.610 0.000 7.667) 8.099 ======================= Grid point 463 (234/260) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.695 ( 28.510 0.000 -25.222) 38.065 3.909 ( 22.512 0.000 -20.285) 30.303 4.365 ( 7.976 0.000 13.406) 15.600 4.828 ( -2.995 0.000 8.001) 8.543 5.057 ( 0.229 0.000 2.798) 2.808 5.083 ( -7.324 0.000 6.050) 9.500 5.478 ( 11.441 0.000 -12.145) 16.686 5.502 ( 4.164 0.000 -7.440) 8.526 6.044 ( -1.092 0.000 -4.528) 4.658 6.065 ( -2.647 0.000 1.688) 3.139 6.122 ( -8.163 0.000 2.874) 8.654 6.443 ( 4.898 0.000 -2.760) 5.622 7.400 ( -15.648 0.000 5.937) 16.736 7.402 ( -7.677 0.000 0.643) 7.704 7.646 ( -0.810 0.000 17.635) 17.654 8.021 ( 3.975 0.000 0.357) 3.991 8.220 ( -2.125 0.000 -3.559) 4.145 8.532 ( -5.547 0.000 -0.114) 5.548 8.611 ( -3.248 0.000 13.191) 13.585 8.729 ( 9.721 0.000 -17.868) 20.341 9.533 ( 5.680 0.000 1.190) 5.803 9.634 ( 0.832 0.000 -0.490) 0.966 9.843 ( 0.619 0.000 -10.204) 10.223 9.980 ( -5.240 0.000 3.465) 6.281 10.642 ( 1.938 0.000 -1.021) 2.191 10.663 ( 0.946 0.000 0.896) 1.303 10.882 ( -2.116 0.000 5.644) 6.028 11.045 ( -9.644 0.000 7.708) 12.346 11.099 ( -0.935 0.000 -6.729) 6.794 11.579 ( -4.576 0.000 -11.807) 12.663 11.694 ( 6.360 0.000 0.766) 6.406 11.838 ( 1.415 0.000 -0.581) 1.530 13.410 ( 2.947 0.000 -5.597) 6.325 13.487 ( -3.074 0.000 4.821) 5.717 14.265 ( 4.504 0.000 1.906) 4.891 14.471 ( -0.586 0.000 7.866) 7.887 ======================= Grid point 464 (235/260) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.995 ( 24.756 0.000 -22.452) 33.421 4.171 ( 21.209 0.000 -16.347) 26.778 4.509 ( -2.650 0.000 8.934) 9.319 4.576 ( -21.620 0.000 9.699) 23.696 5.077 ( -0.639 0.000 13.930) 13.945 5.215 ( 7.095 0.000 -2.325) 7.467 5.512 ( 3.137 0.000 -7.109) 7.771 5.591 ( 3.557 0.000 -2.217) 4.191 6.001 ( 4.345 0.000 -9.474) 10.423 6.033 ( -2.820 0.000 3.183) 4.253 6.076 ( 2.005 0.000 2.061) 2.876 6.462 ( -3.222 0.000 -2.823) 4.284 7.221 ( -8.124 0.000 7.082) 10.778 7.291 ( -5.053 0.000 -0.380) 5.067 7.800 ( 6.145 0.000 13.399) 14.741 8.067 ( 2.003 0.000 -1.600) 2.564 8.152 ( -2.675 0.000 -1.683) 3.161 8.359 ( -12.606 0.000 -2.479) 12.847 8.669 ( -2.734 0.000 15.707) 15.943 8.748 ( 7.564 0.000 -19.288) 20.718 9.623 ( 2.847 0.000 2.236) 3.620 9.654 ( 1.559 0.000 -0.643) 1.686 9.801 ( 2.661 0.000 -9.031) 9.415 9.889 ( -6.852 0.000 3.351) 7.628 10.672 ( 1.799 0.000 -0.322) 1.828 10.688 ( 0.946 0.000 0.448) 1.046 10.898 ( -0.996 0.000 6.154) 6.234 10.980 ( -2.889 0.000 1.037) 3.070 11.075 ( 0.427 0.000 4.483) 4.503 11.380 ( -5.761 0.000 -15.067) 16.131 11.798 ( 4.773 0.000 0.026) 4.773 11.863 ( 0.289 0.000 1.479) 1.507 13.425 ( 2.975 0.000 -4.910) 5.741 13.465 ( -3.138 0.000 4.569) 5.543 14.359 ( 5.158 0.000 -0.057) 5.158 14.484 ( -3.432 0.000 5.820) 6.757 ======================= Grid point 465 (236/260) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.265 ( 20.597 0.000 -14.234) 25.037 4.265 ( -20.597 0.000 14.234) 25.037 4.413 ( 13.245 0.000 -9.368) 16.223 4.413 ( -13.245 0.000 9.368) 16.223 5.206 ( -1.356 0.000 -12.449) 12.522 5.206 ( 1.356 0.000 12.449) 12.522 5.550 ( 5.405 0.000 -2.840) 6.106 5.550 ( -5.405 0.000 2.840) 6.106 6.013 ( 2.777 0.000 -5.139) 5.842 6.013 ( -2.777 0.000 5.139) 5.842 6.268 ( -15.528 0.000 1.293) 15.581 6.268 ( 15.528 0.000 -1.293) 15.581 7.216 ( -1.608 0.000 -3.439) 3.796 7.216 ( 1.608 0.000 3.439) 3.796 8.040 ( -7.811 0.000 -7.927) 11.129 8.040 ( 7.811 0.000 7.927) 11.129 8.127 ( -3.851 0.000 -0.446) 3.877 8.127 ( 3.851 0.000 0.446) 3.877 8.724 ( 5.014 0.000 -17.920) 18.608 8.724 ( -5.014 0.000 17.920) 18.608 9.663 ( 0.040 0.000 -1.871) 1.872 9.663 ( -0.040 0.000 1.871) 1.872 9.814 ( 5.124 0.000 -6.205) 8.047 9.814 ( -5.124 0.000 6.205) 8.047 10.694 ( -0.550 0.000 -0.006) 0.550 10.694 ( 0.550 0.000 0.006) 0.550 10.934 ( -0.230 0.000 -5.452) 5.456 10.934 ( 0.230 0.000 5.452) 5.456 11.186 ( -3.741 0.000 -13.925) 14.419 11.186 ( 3.741 0.000 13.925) 14.419 11.857 ( 2.190 0.000 -0.966) 2.394 11.857 ( -2.190 0.000 0.966) 2.394 13.444 ( 3.011 0.000 -4.570) 5.473 13.444 ( -3.011 0.000 4.570) 5.473 14.440 ( 4.920 0.000 -2.825) 5.674 14.440 ( -4.920 0.000 2.825) 5.674 ======================= Grid point 471 (237/260) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.457 ( -8.045 9.170 -19.510) 23.010 3.457 ( 8.045 9.170 19.510) 23.010 3.815 ( 4.202 12.058 -17.606) 21.750 3.815 ( -4.202 12.058 17.606) 21.750 5.394 ( 3.297 -1.572 -6.553) 7.502 5.394 ( -3.297 -1.572 6.553) 7.502 5.662 ( 6.283 4.284 -13.153) 15.193 5.662 ( -6.283 4.284 13.153) 15.193 6.016 ( 1.821 -1.771 -8.068) 8.459 6.016 ( -1.821 -1.771 8.068) 8.459 6.367 ( 3.093 -4.659 -4.938) 7.461 6.367 ( -3.093 -4.659 4.938) 7.461 7.552 ( 6.752 -1.926 -8.782) 11.244 7.552 ( -6.752 -1.926 8.782) 11.244 7.884 ( -0.646 -1.798 -6.484) 6.759 7.884 ( 0.646 -1.798 6.484) 6.759 8.290 ( 4.511 3.613 -3.526) 6.770 8.290 ( -4.511 3.613 3.526) 6.770 8.699 ( 0.477 0.569 -4.199) 4.264 8.699 ( -0.477 0.569 4.199) 4.264 9.392 ( -5.657 -3.981 -3.125) 7.591 9.392 ( 5.657 -3.981 3.125) 7.591 10.005 ( 2.019 1.797 -5.028) 5.708 10.005 ( -2.019 1.797 5.028) 5.708 10.650 ( 0.331 2.037 -2.947) 3.597 10.650 ( -0.331 2.037 2.947) 3.597 11.069 ( -2.973 3.250 0.295) 4.415 11.069 ( 2.973 3.250 -0.295) 4.415 11.475 ( -0.050 -5.079 -3.864) 6.382 11.475 ( 0.050 -5.079 3.864) 6.382 11.879 ( 8.509 3.795 -8.410) 12.551 11.879 ( -8.509 3.795 8.410) 12.551 13.444 ( 0.920 -0.132 -7.902) 7.956 13.444 ( -0.920 -0.132 7.902) 7.956 14.163 ( -2.557 -2.097 -2.704) 4.272 14.163 ( 2.557 -2.097 2.704) 4.272 ======================= Grid point 473 (238/260) ======================= q-point: ( 0.10 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.296 ( 9.333 7.371 -25.481) 28.120 3.694 ( 13.371 12.451 -16.118) 24.364 3.952 ( 3.758 10.782 18.836) 22.026 3.987 ( 19.365 8.073 13.190) 24.782 5.323 ( -6.197 -1.923 0.822) 6.540 5.404 ( -0.227 -1.160 -2.653) 2.905 5.553 ( -9.669 1.134 0.450) 9.746 5.625 ( 4.553 8.462 -20.466) 22.610 6.017 ( 0.971 -3.872 0.093) 3.993 6.071 ( -0.147 -0.713 7.372) 7.408 6.318 ( -5.987 -5.627 3.576) 8.961 6.371 ( 1.156 -1.993 -2.446) 3.360 7.516 ( -4.777 -1.237 11.082) 12.131 7.640 ( 5.617 -1.642 -3.434) 6.786 7.710 ( -10.316 -5.475 2.748) 11.998 7.953 ( -3.044 4.627 3.185) 6.389 8.227 ( -0.108 2.136 0.897) 2.319 8.417 ( 8.596 0.964 -2.741) 9.074 8.680 ( 0.856 0.555 -3.421) 3.570 8.704 ( -2.432 0.909 2.048) 3.307 9.318 ( 0.641 -4.000 -2.066) 4.547 9.521 ( 5.584 -3.794 1.867) 7.004 9.985 ( -0.142 1.710 -4.575) 4.886 10.003 ( -1.214 1.395 2.279) 2.935 10.634 ( 0.470 1.210 -2.998) 3.268 10.664 ( -0.137 2.552 2.062) 3.284 10.980 ( -5.259 2.909 2.511) 6.514 11.158 ( 4.759 3.443 -3.033) 6.611 11.400 ( -7.737 -6.996 1.570) 10.549 11.506 ( 1.037 -3.442 0.495) 3.628 11.746 ( -6.958 6.379 3.465) 10.055 11.944 ( 4.189 2.658 -9.886) 11.061 13.410 ( 1.636 -0.257 -7.208) 7.396 13.484 ( -0.923 -0.003 6.851) 6.913 14.119 ( -0.805 -2.525 0.811) 2.772 14.258 ( 4.048 -2.490 4.980) 6.884 ======================= Grid point 474 (239/260) ======================= q-point: ( 0.20 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.410 ( 23.179 4.134 -25.279) 34.545 3.819 ( 17.658 11.355 -22.327) 30.647 4.186 ( 7.687 8.464 16.005) 19.670 4.494 ( 22.952 4.460 13.466) 26.982 5.191 ( -8.512 -1.227 -0.803) 8.638 5.281 ( -13.050 -0.192 0.556) 13.064 5.440 ( 0.815 1.221 -4.023) 4.282 5.585 ( 6.725 9.124 -17.347) 20.722 6.023 ( -1.076 -5.139 1.022) 5.349 6.081 ( -2.106 -1.252 0.757) 2.565 6.216 ( -7.263 -4.687 2.171) 8.913 6.399 ( 3.093 1.214 0.187) 3.328 7.476 ( -7.954 -4.029 0.653) 8.940 7.584 ( -4.988 1.227 13.599) 14.537 7.694 ( -3.711 1.011 2.049) 4.358 7.902 ( -2.915 1.244 6.860) 7.557 8.249 ( 1.846 0.532 -4.375) 4.778 8.528 ( 3.468 -1.383 0.656) 3.791 8.651 ( -4.203 2.227 5.685) 7.412 8.694 ( 5.625 0.593 -10.107) 11.582 9.379 ( 6.140 -3.988 -0.434) 7.335 9.592 ( 1.687 -3.200 -0.095) 3.618 9.932 ( -0.498 1.880 -8.346) 8.570 10.003 ( -1.744 -0.040 4.035) 4.396 10.627 ( 1.030 0.390 -2.300) 2.550 10.675 ( 0.021 2.677 1.521) 3.079 10.922 ( -3.946 2.085 3.677) 5.783 11.173 ( 0.401 3.477 -5.288) 6.341 11.209 ( -13.687 -4.281 3.927) 14.869 11.551 ( 3.810 -2.138 -1.114) 4.509 11.713 ( 0.357 4.443 0.272) 4.465 11.904 ( -0.123 3.306 -8.289) 8.925 13.398 ( 2.476 -0.427 -6.316) 6.797 13.502 ( -2.300 0.230 5.742) 6.190 14.145 ( 2.336 -3.520 2.040) 4.692 14.362 ( 2.282 -3.352 7.144) 8.214 ======================= Grid point 475 (240/260) ======================= q-point: ( 0.30 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.700 ( 27.899 1.867 -23.127) 36.287 3.990 ( 19.335 7.197 -22.086) 30.223 4.422 ( 6.472 5.218 11.488) 14.181 4.843 ( -3.095 1.455 7.374) 8.128 5.024 ( -0.886 -1.426 2.010) 2.619 5.118 ( -6.176 1.866 5.325) 8.365 5.467 ( 4.010 0.047 -3.517) 5.334 5.613 ( 7.611 8.116 -11.344) 15.890 5.988 ( -3.775 -5.314 3.290) 7.301 6.038 ( -0.572 -0.733 -3.385) 3.511 6.121 ( -4.082 -1.258 0.502) 4.301 6.476 ( 5.794 3.312 -2.225) 7.035 7.329 ( -7.420 -2.031 -0.062) 7.693 7.529 ( -10.800 6.045 3.623) 12.896 7.682 ( -1.449 4.227 16.857) 17.439 7.950 ( 1.886 -5.606 4.232) 7.273 8.202 ( -2.370 -1.386 -5.663) 6.293 8.518 ( -5.327 -1.078 1.264) 5.580 8.654 ( -1.696 3.192 8.841) 9.551 8.741 ( 8.922 0.694 -15.189) 17.629 9.492 ( 5.845 -4.031 0.724) 7.137 9.602 ( 0.471 -3.252 -0.513) 3.326 9.859 ( -0.019 1.651 -9.327) 9.472 9.976 ( -4.568 -0.186 2.941) 5.436 10.639 ( 1.649 -0.180 -1.048) 1.962 10.691 ( 0.597 2.585 1.488) 3.042 10.887 ( -3.151 -0.363 4.564) 5.558 11.041 ( -8.331 0.039 6.512) 10.574 11.130 ( -0.369 3.231 -5.572) 6.451 11.538 ( -2.688 -2.687 -9.309) 10.055 11.751 ( 4.486 4.403 -0.529) 6.308 11.872 ( 0.674 3.029 -0.869) 3.222 13.403 ( 2.869 -0.509 -5.406) 6.142 13.490 ( -3.181 0.312 4.971) 5.910 14.219 ( 4.262 -4.400 1.564) 6.322 14.429 ( -0.769 -4.192 7.267) 8.425 ======================= Grid point 476 (241/260) ======================= q-point: ( 0.40 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.020 ( 25.085 2.584 -20.524) 32.514 4.185 ( 19.407 2.056 -17.993) 26.545 4.509 ( -8.023 0.534 9.544) 12.479 4.616 ( -16.773 3.381 7.364) 18.628 5.088 ( -0.642 0.831 11.875) 11.922 5.181 ( 5.889 -2.719 -1.422) 6.640 5.493 ( 2.075 -0.886 -3.589) 4.239 5.618 ( -2.909 -0.091 -1.980) 3.520 6.010 ( 0.551 -0.680 2.818) 2.950 6.016 ( 1.624 0.466 -4.482) 4.790 6.114 ( 7.681 3.991 -1.834) 8.848 6.512 ( -1.876 4.487 -3.148) 5.793 7.241 ( -1.530 2.250 -0.209) 2.729 7.369 ( -9.573 7.141 4.962) 12.933 7.829 ( 6.021 2.957 12.657) 14.325 8.003 ( 1.693 -5.475 1.678) 5.972 8.119 ( -2.508 -2.748 -3.810) 5.325 8.360 ( -11.931 0.262 -1.798) 12.068 8.701 ( -1.885 2.421 11.717) 12.112 8.764 ( 6.564 1.186 -16.272) 17.586 9.581 ( 3.063 -4.075 1.499) 5.314 9.614 ( 1.161 -3.907 -0.531) 4.110 9.812 ( 2.087 1.337 -8.005) 8.380 9.895 ( -6.181 0.734 2.846) 6.844 10.667 ( 1.913 -0.394 -0.334) 1.982 10.707 ( -0.186 1.665 0.864) 1.885 10.895 ( 0.343 -1.368 4.852) 5.053 10.985 ( -3.615 1.135 4.184) 5.644 11.109 ( 0.553 3.334 1.336) 3.634 11.369 ( -5.454 -0.848 -13.534) 14.616 11.833 ( 4.281 3.178 -0.413) 5.348 11.888 ( 0.150 2.336 1.489) 2.774 13.419 ( 3.024 -0.421 -4.742) 5.639 13.466 ( -3.309 0.134 4.547) 5.625 14.309 ( 5.072 -4.869 -0.158) 7.033 14.437 ( -3.510 -4.736 5.419) 8.007 ======================= Grid point 477 (242/260) ======================= q-point: ( 0.50 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.287 ( 18.794 2.237 -13.916) 23.492 4.287 ( -18.794 2.237 13.916) 23.492 4.420 ( 13.034 1.056 -9.278) 16.034 4.420 ( -13.034 1.056 9.278) 16.034 5.186 ( 0.131 -1.856 -11.110) 11.264 5.186 ( -0.131 -1.856 11.110) 11.264 5.531 ( 1.087 -1.549 -5.833) 6.132 5.531 ( -1.087 -1.549 5.833) 6.132 6.011 ( 1.303 -0.625 -2.496) 2.884 6.011 ( -1.303 -0.625 2.496) 2.884 6.343 ( -14.284 6.669 0.314) 15.767 6.343 ( 14.284 6.669 -0.314) 15.767 7.269 ( 2.998 5.251 -4.519) 7.549 7.269 ( -2.998 5.251 4.519) 7.549 8.026 ( -1.557 -2.352 -4.347) 5.182 8.026 ( 1.557 -2.352 4.347) 5.182 8.114 ( -9.825 0.209 -1.756) 9.983 8.114 ( 9.825 0.209 1.756) 9.983 8.745 ( 4.014 1.571 -14.490) 15.117 8.745 ( -4.014 1.571 14.490) 15.117 9.620 ( 1.584 -4.157 -4.502) 6.329 9.620 ( -1.584 -4.157 4.502) 6.329 9.824 ( 4.617 1.180 -5.337) 7.155 9.824 ( -4.617 1.180 5.337) 7.155 10.696 ( -0.144 0.115 -0.408) 0.447 10.696 ( 0.144 0.115 0.408) 0.447 10.946 ( -0.742 0.678 -2.595) 2.783 10.946 ( 0.742 0.678 2.595) 2.783 11.191 ( -3.474 0.974 -11.373) 11.932 11.191 ( 3.474 0.974 11.373) 11.932 11.883 ( 1.433 2.492 -1.392) 3.194 11.883 ( -1.433 2.492 1.392) 3.194 13.441 ( 3.170 -0.170 -4.669) 5.646 13.441 ( -3.170 -0.170 4.669) 5.646 14.389 ( 4.895 -4.959 -2.687) 7.468 14.389 ( -4.895 -4.959 2.687) 7.468 ======================= Grid point 483 (243/260) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.717 ( -8.085 16.391 -18.963) 26.337 3.717 ( 8.085 16.391 18.963) 26.337 4.121 ( 3.011 17.559 -14.864) 23.202 4.121 ( -3.011 17.559 14.864) 23.202 5.357 ( -0.372 -2.279 -6.793) 7.174 5.357 ( 0.372 -2.279 6.793) 7.174 5.746 ( 7.376 2.779 -4.452) 9.052 5.746 ( -7.376 2.779 4.452) 9.052 5.967 ( 0.129 -2.920 -9.360) 9.806 5.967 ( -0.129 -2.920 9.360) 9.806 6.259 ( 3.234 -5.095 -5.982) 8.497 6.259 ( -3.234 -5.095 5.982) 8.497 7.485 ( 0.182 -4.595 -1.943) 4.992 7.485 ( -0.182 -4.595 1.943) 4.992 7.884 ( 1.242 2.322 -10.083) 10.422 7.884 ( -1.242 2.322 10.083) 10.422 8.374 ( 3.848 4.451 -5.578) 8.108 8.374 ( -3.848 4.451 5.578) 8.108 8.697 ( -0.485 -0.997 -2.252) 2.510 8.697 ( 0.485 -0.997 2.252) 2.510 9.279 ( -4.588 -7.274 -4.718) 9.809 9.279 ( 4.588 -7.274 4.718) 9.809 10.055 ( 1.955 3.040 -3.459) 5.003 10.055 ( -1.955 3.040 3.459) 5.003 10.702 ( -0.006 3.014 -4.069) 5.064 10.702 ( 0.006 3.014 4.069) 5.064 11.123 ( -4.767 0.861 -0.267) 4.852 11.123 ( 4.767 0.861 0.267) 4.852 11.407 ( -1.777 -0.138 -3.402) 3.840 11.407 ( 1.777 -0.138 3.402) 3.840 11.945 ( 4.753 2.458 -6.916) 8.744 11.945 ( -4.753 2.458 6.916) 8.744 13.446 ( 1.171 0.528 -8.324) 8.423 13.446 ( -1.171 0.528 8.324) 8.423 14.101 ( -1.457 -4.083 -4.114) 5.976 14.101 ( 1.457 -4.083 4.114) 5.976 ======================= Grid point 485 (244/260) ======================= q-point: ( 0.10 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.538 ( 5.691 16.574 -22.873) 28.814 3.988 ( 11.771 15.870 -6.934) 20.940 4.192 ( 10.463 13.781 5.579) 18.181 4.250 ( 7.816 16.286 13.527) 22.568 5.268 ( -3.207 -3.593 -6.296) 7.927 5.392 ( -1.834 -0.718 2.976) 3.569 5.588 ( -10.610 2.241 0.622) 10.862 5.800 ( 5.040 6.077 -12.311) 14.625 5.916 ( 0.632 -3.624 -5.580) 6.683 6.024 ( 0.149 -4.878 5.061) 7.031 6.175 ( -6.448 -7.833 3.824) 10.842 6.350 ( 4.933 0.501 1.507) 5.182 7.468 ( -1.858 -3.207 2.643) 4.552 7.505 ( -1.227 -8.863 3.292) 9.533 7.738 ( -7.007 5.625 4.291) 9.957 8.027 ( 3.952 3.196 1.868) 5.415 8.309 ( -2.578 5.855 0.308) 6.405 8.436 ( 4.633 0.903 -3.489) 5.870 8.682 ( 0.816 -0.781 -2.292) 2.555 8.706 ( -1.763 -0.709 1.953) 2.725 9.207 ( 1.125 -6.991 -3.250) 7.791 9.408 ( 5.317 -7.545 3.428) 9.846 10.026 ( -2.417 2.533 0.568) 3.547 10.054 ( 0.209 3.269 -3.309) 4.656 10.666 ( -0.541 1.876 -3.640) 4.131 10.729 ( 0.102 3.552 2.300) 4.233 11.029 ( -5.436 1.060 1.118) 5.650 11.195 ( 1.022 -1.800 0.838) 2.233 11.328 ( -3.528 2.249 -3.420) 5.404 11.467 ( 2.760 0.226 1.537) 3.167 11.849 ( -5.569 3.929 1.909) 7.078 11.995 ( 2.929 1.955 -6.216) 7.144 13.411 ( 1.349 0.591 -6.852) 7.009 13.488 ( -1.027 0.459 7.560) 7.643 14.050 ( -1.164 -4.227 -0.715) 4.442 14.183 ( 3.043 -5.039 4.582) 7.460 ======================= Grid point 486 (245/260) ======================= q-point: ( 0.20 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.587 ( 17.870 13.644 -22.708) 31.956 4.087 ( 13.159 14.768 -20.457) 28.456 4.392 ( 6.088 11.259 10.707) 16.687 4.621 ( 17.514 7.996 11.071) 22.209 5.165 ( -4.692 -1.910 -3.456) 6.132 5.267 ( -10.939 -1.405 -3.149) 11.470 5.480 ( -2.868 2.666 3.488) 5.244 5.769 ( 0.887 3.528 -10.719) 11.320 5.906 ( 1.388 -1.313 -1.443) 2.395 6.038 ( -1.447 -3.506 1.979) 4.278 6.098 ( -3.154 -6.033 0.991) 6.879 6.454 ( 5.683 4.202 1.332) 7.192 7.404 ( -5.924 -3.600 0.014) 6.932 7.525 ( 0.226 -7.399 5.415) 9.172 7.722 ( -1.306 4.984 9.185) 10.531 8.016 ( -6.997 8.027 5.947) 12.197 8.281 ( 0.013 3.117 -6.920) 7.589 8.492 ( 2.076 -2.271 1.510) 3.427 8.675 ( 0.456 -1.280 -1.857) 2.300 8.701 ( 2.135 1.013 -1.772) 2.954 9.266 ( 6.579 -7.146 -1.943) 9.906 9.493 ( 1.797 -6.888 1.795) 7.342 9.979 ( -1.608 2.700 -4.207) 5.251 10.022 ( -1.673 2.257 -0.683) 2.891 10.638 ( 0.059 0.636 -2.486) 2.567 10.740 ( -0.247 3.175 1.518) 3.528 10.943 ( -5.797 -0.453 1.621) 6.036 11.143 ( -6.994 -1.587 3.508) 7.983 11.262 ( -0.652 5.116 -5.299) 7.395 11.525 ( 2.538 -0.090 -0.922) 2.701 11.805 ( -0.129 4.347 0.309) 4.360 11.970 ( -0.225 2.873 -5.328) 6.057 13.396 ( 2.137 0.501 -5.892) 6.287 13.510 ( -2.359 0.717 6.676) 7.117 14.052 ( 1.469 -5.461 0.482) 5.676 14.263 ( 1.375 -6.495 5.963) 8.924 ======================= Grid point 487 (246/260) ======================= q-point: ( 0.30 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.811 ( 24.037 9.625 -20.354) 32.935 4.171 ( 13.984 10.573 -22.875) 28.821 4.549 ( 2.842 7.119 7.846) 10.969 4.884 ( -2.325 2.576 4.922) 6.022 5.006 ( -2.760 -0.878 -0.327) 2.915 5.144 ( -3.119 0.650 2.497) 4.048 5.475 ( -0.121 0.450 0.895) 1.009 5.670 ( -6.770 -5.102 -0.629) 8.501 5.958 ( 3.279 1.668 0.467) 3.709 6.023 ( -0.416 -1.217 -0.021) 1.286 6.095 ( 4.484 2.479 -2.171) 5.565 6.567 ( 6.629 5.310 -1.913) 8.706 7.313 ( -2.996 -0.073 -0.782) 3.097 7.556 ( -1.459 -3.800 3.496) 5.366 7.794 ( 1.655 4.097 9.498) 10.476 7.930 ( -7.379 7.572 9.176) 13.999 8.188 ( -3.585 0.678 -7.599) 8.430 8.492 ( -4.257 -1.461 2.180) 5.000 8.694 ( 1.577 -0.532 0.534) 1.748 8.745 ( 5.810 0.215 -6.944) 9.057 9.377 ( 6.839 -7.389 -1.985) 10.262 9.508 ( -0.683 -6.126 1.479) 6.339 9.911 ( -0.681 3.478 -7.800) 8.567 9.986 ( -3.307 1.502 1.956) 4.126 10.634 ( 0.837 -0.357 -0.754) 1.181 10.754 ( 0.656 2.764 1.889) 3.412 10.846 ( -5.920 -2.729 2.135) 6.860 11.064 ( -5.155 1.629 5.097) 7.430 11.215 ( -0.190 5.005 -4.946) 7.039 11.500 ( -2.657 -0.963 -6.625) 7.203 11.843 ( 3.723 4.504 -0.174) 5.846 11.941 ( 0.037 3.451 -1.160) 3.641 13.400 ( 2.724 0.427 -5.077) 5.777 13.502 ( -3.428 1.000 5.610) 6.650 14.103 ( 3.552 -6.935 0.517) 7.809 14.308 ( -1.261 -7.766 5.995) 9.891 ======================= Grid point 488 (247/260) ======================= q-point: ( 0.40 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.107 ( 23.488 6.498 -17.221) 29.841 4.270 ( 15.457 6.424 -19.356) 25.590 4.540 ( -11.359 2.530 8.625) 14.485 4.697 ( -13.013 4.688 3.719) 14.323 5.087 ( 3.862 -1.813 1.222) 4.438 5.139 ( -1.336 -0.520 6.255) 6.417 5.478 ( 0.351 -1.144 -0.677) 1.375 5.556 ( -5.797 -5.330 1.482) 8.013 5.978 ( 0.281 -1.936 -0.589) 2.043 6.006 ( -1.572 -2.017 0.298) 2.574 6.264 ( 13.028 10.020 0.200) 16.437 6.612 ( -0.506 4.937 -3.901) 6.313 7.312 ( 3.988 4.182 -1.892) 6.080 7.504 ( -6.694 3.656 3.320) 8.319 7.909 ( 1.955 -1.936 4.218) 5.036 7.933 ( 3.002 8.119 11.154) 14.119 8.076 ( -2.764 -0.647 -6.194) 6.814 8.370 ( -9.986 0.743 -0.396) 10.021 8.728 ( 0.282 -0.658 4.148) 4.209 8.776 ( 3.917 -0.013 -9.071) 9.881 9.465 ( 5.088 -7.396 -3.335) 9.577 9.509 ( -1.076 -6.378 3.344) 7.282 9.861 ( 1.491 3.708 -6.851) 7.931 9.928 ( -4.837 2.811 2.543) 6.145 10.655 ( 1.623 -0.978 0.125) 1.899 10.744 ( -3.487 1.305 0.724) 3.793 10.837 ( 2.988 -3.371 4.048) 6.056 11.016 ( -4.613 0.934 3.764) 6.026 11.196 ( 1.080 5.101 -1.773) 5.507 11.365 ( -4.909 0.781 -8.925) 10.216 11.908 ( 3.441 3.963 -0.667) 5.290 11.946 ( 0.067 3.217 1.183) 3.429 13.417 ( 3.160 0.504 -4.570) 5.579 13.475 ( -3.715 0.972 4.835) 6.174 14.177 ( 4.691 -7.984 -0.622) 9.281 14.303 ( -3.630 -8.446 4.620) 10.289 ======================= Grid point 489 (248/260) ======================= q-point: ( 0.50 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.349 ( 16.449 3.731 -13.304) 21.483 4.349 ( -16.449 3.731 13.304) 21.483 4.474 ( 14.704 4.789 -9.865) 18.343 4.474 ( -14.704 4.789 9.865) 18.343 5.143 ( 3.066 -2.183 -8.916) 9.677 5.143 ( -3.066 -2.183 8.916) 9.677 5.492 ( 2.884 -2.612 -8.270) 9.140 5.492 ( -2.884 -2.612 8.270) 9.140 5.984 ( 0.930 -1.930 -0.665) 2.243 5.984 ( -0.930 -1.930 0.665) 2.243 6.489 ( -9.583 7.232 -3.088) 12.397 6.489 ( 9.583 7.232 3.088) 12.397 7.399 ( 7.361 6.192 -3.636) 10.284 7.399 ( -7.361 6.192 3.636) 10.284 7.971 ( -0.046 -1.180 -7.044) 7.142 7.971 ( 0.046 -1.180 7.044) 7.142 8.156 ( -11.523 3.636 -3.075) 12.468 8.156 ( 11.523 3.636 3.075) 12.468 8.761 ( 2.266 -0.457 -8.917) 9.212 8.761 ( -2.266 -0.457 8.917) 9.212 9.506 ( 3.363 -6.981 -6.644) 10.207 9.506 ( -3.363 -6.981 6.644) 10.207 9.870 ( 3.975 3.654 -4.535) 7.051 9.870 ( -3.975 3.654 4.535) 7.051 10.692 ( -0.844 -0.763 -1.099) 1.582 10.692 ( 0.844 -0.763 1.099) 1.582 10.938 ( -2.061 -1.529 -3.747) 4.542 10.938 ( 2.061 -1.529 3.747) 4.542 11.239 ( -2.956 3.775 -4.497) 6.573 11.239 ( 2.956 3.775 4.497) 6.573 11.945 ( 1.362 3.386 -2.288) 4.308 11.945 ( -1.362 3.386 2.288) 4.308 13.444 ( 3.500 0.732 -4.786) 5.974 13.444 ( -3.500 0.732 4.786) 5.974 14.252 ( 4.799 -8.493 -2.541) 10.081 14.252 ( -4.799 -8.493 2.541) 10.081 ======================= Grid point 495 (249/260) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.077 ( -6.196 18.658 -14.687) 24.540 4.077 ( 6.196 18.658 14.687) 24.540 4.472 ( 2.134 16.641 -10.035) 19.550 4.472 ( -2.134 16.641 10.035) 19.550 5.290 ( -2.371 -4.630 -10.093) 11.354 5.290 ( 2.371 -4.630 10.093) 11.354 5.704 ( -0.314 -7.538 -8.183) 11.130 5.704 ( 0.314 -7.538 8.183) 11.130 5.927 ( 1.019 -0.455 -4.413) 4.552 5.927 ( -1.019 -0.455 4.413) 4.552 6.209 ( -1.185 0.149 -9.676) 9.749 6.209 ( 1.185 0.149 9.676) 9.749 7.390 ( 1.757 -4.415 -0.913) 4.838 7.390 ( -1.757 -4.415 0.913) 4.838 7.973 ( 2.657 6.035 -9.102) 11.240 7.973 ( -2.657 6.035 9.102) 11.240 8.458 ( 2.868 3.837 -7.285) 8.719 8.458 ( -2.868 3.837 7.285) 8.719 8.666 ( 1.666 -1.632 -3.994) 4.625 8.666 ( -1.666 -1.632 3.994) 4.625 9.107 ( -2.432 -9.701 -7.291) 12.377 9.107 ( 2.432 -9.701 7.291) 12.377 10.118 ( 1.372 2.982 -2.050) 3.870 10.118 ( -1.372 2.982 2.050) 3.870 10.760 ( -0.598 2.516 -3.690) 4.506 10.760 ( 0.598 2.516 3.690) 4.506 11.096 ( -2.637 -2.527 -1.000) 3.787 11.096 ( 2.637 -2.527 1.000) 3.787 11.476 ( -0.764 5.692 -3.904) 6.944 11.476 ( 0.764 5.692 3.904) 6.944 11.969 ( 2.799 -0.161 -5.431) 6.112 11.969 ( -2.799 -0.161 5.431) 6.112 13.470 ( 1.051 1.879 -7.221) 7.535 13.470 ( -1.051 1.879 7.221) 7.535 14.006 ( -0.683 -5.058 -4.250) 6.642 14.006 ( 0.683 -5.058 4.250) 6.642 ======================= Grid point 497 (250/260) ======================= q-point: ( 0.10 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.924 ( 3.194 21.212 -18.285) 28.187 4.293 ( 9.355 13.983 -0.236) 16.826 4.491 ( 5.095 14.966 -0.076) 15.809 4.577 ( 6.831 15.869 7.351) 18.776 5.164 ( -2.236 -7.260 -11.359) 13.665 5.357 ( -2.148 -3.330 3.269) 5.137 5.603 ( -4.170 -3.635 -5.588) 7.863 5.739 ( -3.708 -1.775 5.101) 6.551 5.847 ( -1.460 -11.154 3.725) 11.850 6.029 ( 2.225 -0.879 1.893) 3.050 6.068 ( -2.291 5.181 -6.508) 8.628 6.377 ( 8.784 1.149 1.871) 9.054 7.349 ( -4.550 -6.030 4.516) 8.801 7.398 ( -1.063 -3.752 1.515) 4.183 7.888 ( -4.453 8.841 4.001) 10.677 8.097 ( 6.292 3.810 0.889) 7.409 8.438 ( 0.643 6.111 -5.769) 8.429 8.453 ( -1.600 1.433 1.411) 2.570 8.642 ( -2.715 -2.701 2.620) 4.640 8.687 ( 2.157 -0.979 -2.371) 3.351 9.050 ( 2.474 -8.272 -5.336) 10.150 9.223 ( 4.205 -10.759 5.638) 12.854 10.086 ( -2.438 3.269 0.237) 4.085 10.118 ( -0.017 2.828 -2.745) 3.941 10.705 ( -1.863 1.997 -3.652) 4.560 10.785 ( -0.189 1.495 0.730) 1.675 11.020 ( -4.584 -0.764 0.595) 4.686 11.140 ( 0.306 -2.885 0.814) 3.013 11.429 ( -1.200 6.289 -4.092) 7.598 11.519 ( 1.281 4.166 2.653) 5.103 11.903 ( -3.475 1.519 0.722) 3.860 12.010 ( 2.316 -0.622 -3.616) 4.339 13.440 ( 1.067 2.393 -5.717) 6.289 13.506 ( -1.039 1.375 7.359) 7.559 13.960 ( -1.232 -4.447 -1.774) 4.944 14.064 ( 1.605 -6.521 3.917) 7.775 ======================= Grid point 498 (251/260) ======================= q-point: ( 0.20 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.931 ( 12.389 19.972 -18.735) 30.056 4.381 ( 8.967 13.938 -16.673) 23.509 4.609 ( 4.605 10.030 5.139) 12.174 4.792 ( 9.007 8.551 6.162) 13.865 5.081 ( 1.415 -7.196 -7.551) 10.526 5.221 ( -9.239 -3.648 -7.736) 12.590 5.529 ( -4.249 1.608 4.247) 6.219 5.657 ( -8.429 -6.320 3.875) 11.225 5.895 ( 2.320 -7.454 2.720) 8.267 5.965 ( -3.941 -3.590 2.848) 6.044 6.138 ( 8.081 11.121 -3.571) 14.203 6.535 ( 8.176 2.786 -0.079) 8.638 7.303 ( -4.435 -5.893 5.474) 9.185 7.399 ( -0.129 -4.673 3.425) 5.795 7.872 ( -1.331 9.532 5.336) 11.005 8.168 ( -0.155 6.762 1.566) 6.942 8.371 ( -2.532 3.403 -8.583) 9.574 8.456 ( -0.049 1.028 4.106) 4.233 8.615 ( -0.973 -4.192 0.389) 4.321 8.713 ( 3.358 -0.099 -3.786) 5.061 9.111 ( 7.011 -7.674 -3.428) 10.945 9.318 ( 2.109 -10.310 4.322) 11.376 10.042 ( -1.865 3.535 -1.628) 4.316 10.079 ( -1.700 2.875 -3.060) 4.530 10.652 ( -1.359 0.795 -2.547) 2.994 10.763 ( -2.058 -1.390 -0.530) 2.539 10.946 ( -4.573 2.019 1.192) 5.139 11.121 ( -3.072 -1.480 1.941) 3.923 11.374 ( -1.372 6.080 -4.492) 7.683 11.545 ( -0.208 1.535 0.041) 1.550 11.879 ( 0.750 3.066 0.138) 3.160 12.004 ( 0.412 0.398 -3.281) 3.330 13.426 ( 1.689 2.669 -4.774) 5.725 13.533 ( -2.064 1.462 7.156) 7.590 13.942 ( 0.439 -5.139 -1.081) 5.269 14.113 ( 0.153 -8.194 4.706) 9.451 ======================= Grid point 499 (252/260) ======================= q-point: ( 0.30 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.074 ( 17.848 16.110 -17.421) 29.692 4.396 ( 8.699 11.587 -20.855) 25.394 4.687 ( -0.869 5.856 3.307) 6.781 4.929 ( 4.500 0.112 0.085) 4.502 4.967 ( -8.608 -2.216 -5.100) 10.247 5.139 ( 3.218 -1.344 -0.816) 3.581 5.466 ( -6.603 -1.881 3.772) 7.834 5.535 ( -8.302 -5.237 7.165) 12.152 5.933 ( 0.288 -2.925 0.744) 3.032 5.953 ( -0.465 -4.113 2.672) 4.927 6.286 ( 9.795 12.240 0.114) 15.677 6.658 ( 6.057 2.995 -2.261) 7.126 7.290 ( -0.618 -2.664 4.788) 5.514 7.442 ( 1.366 -5.861 4.099) 7.281 7.910 ( 1.926 8.418 2.830) 9.087 8.132 ( -3.382 9.510 0.652) 10.115 8.252 ( -5.415 5.131 -3.174) 8.107 8.469 ( -2.459 -0.044 2.218) 3.312 8.624 ( 2.063 -5.526 -0.734) 5.944 8.749 ( 4.036 -0.496 -5.060) 6.492 9.218 ( 7.335 -7.757 -3.727) 11.308 9.358 ( -0.596 -8.692 3.764) 9.490 9.993 ( -0.554 4.428 -6.018) 7.492 10.034 ( -2.283 2.889 1.186) 3.869 10.624 ( -0.541 -0.600 -0.490) 0.945 10.724 ( -1.938 -4.163 0.818) 4.665 10.873 ( -4.285 4.103 0.668) 5.970 11.073 ( -4.065 -1.014 2.398) 4.827 11.322 ( -0.606 5.585 -4.315) 7.084 11.497 ( -3.461 0.324 -3.548) 4.967 11.922 ( 3.333 3.347 0.150) 4.726 11.995 ( 0.528 1.700 -1.108) 2.097 13.430 ( 2.388 2.803 -4.165) 5.560 13.534 ( -3.219 2.149 6.204) 7.312 13.960 ( 2.363 -6.795 -0.865) 7.246 14.132 ( -1.847 -9.467 4.709) 10.733 ======================= Grid point 500 (253/260) ======================= q-point: ( 0.40 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.275 ( 16.515 9.667 -15.292) 24.496 4.432 ( 12.305 9.608 -16.147) 22.460 4.588 ( -10.853 1.428 2.682) 11.270 4.800 ( -9.429 5.208 2.175) 10.989 5.029 ( 7.027 -2.990 -4.151) 8.692 5.151 ( -4.514 1.033 7.462) 8.781 5.405 ( 0.340 -6.243 -2.815) 6.857 5.464 ( -6.786 -3.403 8.624) 11.489 5.936 ( 0.002 -2.141 0.190) 2.149 5.954 ( -0.831 -2.781 0.554) 2.955 6.468 ( 8.870 9.829 2.872) 13.548 6.695 ( 0.337 3.191 -3.730) 4.920 7.354 ( 3.801 -0.730 3.664) 5.330 7.479 ( -0.527 -4.471 2.100) 4.968 7.966 ( 3.056 6.816 -0.291) 7.475 8.105 ( 0.859 4.477 -5.232) 6.939 8.156 ( -3.557 11.457 5.560) 13.222 8.392 ( -6.936 1.701 0.568) 7.164 8.668 ( 1.993 -4.622 2.552) 5.644 8.764 ( 1.944 -1.414 -6.571) 6.997 9.305 ( 6.097 -7.992 -5.397) 11.410 9.365 ( -2.071 -7.833 5.133) 9.591 9.955 ( 1.193 5.309 -4.928) 7.342 10.003 ( -2.818 4.335 2.008) 5.546 10.626 ( 0.593 -1.856 0.882) 2.139 10.700 ( -2.405 -4.668 1.291) 5.407 10.834 ( 0.330 2.406 1.171) 2.696 11.003 ( -5.174 -1.989 0.355) 5.555 11.300 ( 0.981 5.008 -2.604) 5.729 11.397 ( -4.059 1.930 -3.640) 5.784 11.978 ( 2.639 2.882 -0.198) 3.912 12.004 ( 0.481 2.250 0.371) 2.330 13.450 ( 3.067 2.906 -3.990) 5.811 13.512 ( -3.755 2.739 5.097) 6.898 14.008 ( 3.780 -8.450 -1.371) 9.358 14.115 ( -3.551 -9.945 3.845) 11.238 ======================= Grid point 501 (254/260) ======================= q-point: ( 0.50 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.422 ( 11.946 3.250 -9.312) 15.492 4.422 ( -11.946 3.250 9.312) 15.492 4.611 ( 14.823 8.438 -9.235) 19.396 4.611 ( -14.823 8.438 9.235) 19.396 5.109 ( 6.111 -1.032 -7.461) 9.699 5.109 ( -6.111 -1.032 7.461) 9.699 5.418 ( 4.974 -4.911 -7.857) 10.517 5.418 ( -4.974 -4.911 7.857) 10.517 5.941 ( 0.314 -2.160 -0.883) 2.354 5.941 ( -0.314 -2.160 0.883) 2.354 6.621 ( -5.062 5.974 -4.122) 8.849 6.621 ( 5.062 5.974 4.122) 8.849 7.444 ( -3.422 -1.871 -1.253) 4.096 7.444 ( 3.422 -1.871 1.253) 4.096 8.029 ( 1.287 6.222 -7.328) 9.699 8.029 ( -1.287 6.222 7.328) 9.699 8.252 ( -7.829 5.954 -1.033) 9.890 8.252 ( 7.829 5.954 1.033) 9.890 8.726 ( 0.542 -2.714 -7.632) 8.118 8.726 ( -0.542 -2.714 7.632) 8.118 9.354 ( 4.228 -7.921 -7.222) 11.522 9.354 ( -4.228 -7.921 7.222) 11.522 9.966 ( 2.748 5.558 -4.519) 7.672 9.966 ( -2.748 5.558 4.519) 7.672 10.657 ( -2.099 -2.751 -0.591) 3.510 10.657 ( 2.099 -2.751 0.591) 3.510 10.901 ( -1.513 -1.679 -5.427) 5.879 10.901 ( 1.513 -1.679 5.427) 5.879 11.322 ( -2.334 3.990 -0.549) 4.655 11.322 ( 2.334 3.990 0.549) 4.655 12.006 ( 1.104 2.496 -2.502) 3.703 12.006 ( -1.104 2.496 2.502) 3.703 13.479 ( 3.580 2.943 -4.437) 6.416 13.479 ( -3.580 2.943 4.437) 6.416 14.067 ( 4.075 -9.563 -2.531) 10.698 14.067 ( -4.075 -9.563 2.531) 10.698 ======================= Grid point 507 (255/260) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.397 ( -2.510 10.999 -6.486) 13.013 4.397 ( 2.510 10.999 6.486) 13.013 4.732 ( -0.016 7.649 -3.075) 8.244 4.732 ( 0.016 7.649 3.075) 8.244 5.191 ( -2.733 -3.770 -10.224) 11.235 5.191 ( 2.733 -3.770 10.224) 11.235 5.526 ( -0.635 -7.285 -7.102) 10.193 5.526 ( 0.635 -7.285 7.102) 10.193 5.933 ( -3.639 0.480 -0.133) 3.673 5.933 ( 3.639 0.480 0.133) 3.673 6.227 ( -0.789 0.814 -4.496) 4.637 6.227 ( 0.789 0.814 4.496) 4.637 7.326 ( 0.039 -1.712 -0.383) 1.754 7.326 ( -0.039 -1.712 0.383) 1.754 8.083 ( 0.960 3.710 -3.384) 5.113 8.083 ( -0.960 3.710 3.384) 5.113 8.513 ( 1.876 1.253 -4.603) 5.126 8.513 ( -1.876 1.253 4.603) 5.126 8.663 ( 2.456 1.689 -5.891) 6.602 8.663 ( -2.456 1.689 5.891) 6.602 8.922 ( -0.062 -7.333 -6.957) 10.108 8.922 ( 0.062 -7.333 6.957) 10.108 10.162 ( 0.480 1.242 -0.688) 1.499 10.162 ( -0.480 1.242 0.688) 1.499 10.796 ( -0.488 1.001 -1.527) 1.890 10.796 ( 0.488 1.001 1.527) 1.890 11.055 ( -1.279 -1.229 -0.349) 1.808 11.055 ( 1.279 -1.229 0.349) 1.808 11.581 ( 0.009 3.647 -2.068) 4.193 11.581 ( -0.009 3.647 2.068) 4.193 11.948 ( 1.072 -1.234 -2.530) 3.012 11.948 ( -1.072 -1.234 2.530) 3.012 13.510 ( 0.441 1.573 -3.267) 3.652 13.510 ( -0.441 1.573 3.267) 3.652 13.920 ( -0.172 -2.814 -2.180) 3.564 13.920 ( 0.172 -2.814 2.180) 3.564 ======================= Grid point 509 (256/260) ======================= q-point: ( 0.10 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.328 ( 2.773 17.402 -11.707) 21.156 4.490 ( 5.592 3.189 -1.561) 6.624 4.730 ( 1.805 8.176 -0.240) 8.376 4.823 ( 6.350 3.147 2.072) 7.383 5.039 ( -3.075 1.685 -14.858) 15.266 5.229 ( -1.734 -10.009 -4.194) 10.989 5.514 ( 2.006 -0.852 0.212) 2.189 5.611 ( 2.265 -9.623 5.742) 11.433 5.813 ( -9.357 5.399 6.537) 12.627 5.928 ( -6.104 -5.752 5.094) 9.813 6.241 ( 6.834 7.946 -3.859) 11.168 6.359 ( 9.418 -3.496 -0.789) 10.077 7.286 ( -4.709 -0.219 4.167) 6.292 7.324 ( -2.343 -3.374 2.897) 5.026 8.060 ( -1.097 7.390 2.285) 7.813 8.144 ( 3.758 -0.485 1.391) 4.037 8.483 ( -2.577 2.518 -1.462) 3.888 8.527 ( 1.083 -0.183 -1.799) 2.107 8.624 ( -3.047 2.671 0.591) 4.095 8.674 ( 3.317 -0.807 -7.029) 7.814 8.920 ( 3.837 -2.663 -1.742) 4.985 9.007 ( 3.117 -9.726 6.622) 12.172 10.141 ( -1.620 1.932 -0.484) 2.568 10.155 ( -0.678 0.673 -1.529) 1.803 10.745 ( -2.674 2.022 -3.040) 4.526 10.782 ( -2.113 -1.433 -1.648) 3.039 11.032 ( -1.293 1.885 0.852) 2.440 11.082 ( 0.597 -2.886 0.555) 2.999 11.547 ( -1.934 4.743 -1.760) 5.416 11.585 ( -1.047 1.274 0.865) 1.862 11.926 ( -0.474 1.465 -0.393) 1.589 11.972 ( 1.673 -2.743 -1.763) 3.665 13.498 ( 0.523 2.889 -2.334) 3.751 13.528 ( -0.443 0.168 3.887) 3.916 13.898 ( -0.870 -0.884 -0.656) 1.403 13.943 ( 0.106 -4.958 2.508) 5.557 ======================= Grid point 510 (257/260) ======================= q-point: ( 0.20 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.336 ( 8.469 19.273 -13.760) 25.150 4.571 ( 7.218 0.863 -7.898) 10.735 4.765 ( 3.065 5.312 -4.862) 7.826 4.869 ( -0.826 -6.674 -13.973) 15.506 4.975 ( 5.354 5.221 2.020) 7.746 5.111 ( -3.747 -6.973 -10.195) 12.907 5.535 ( -3.117 0.676 4.503) 5.518 5.585 ( -9.305 -3.230 4.983) 11.039 5.804 ( 1.714 0.256 7.609) 7.804 5.873 ( -3.487 -5.002 6.555) 8.953 6.366 ( 8.727 10.409 -1.462) 13.662 6.522 ( 9.266 -4.602 -1.041) 10.398 7.242 ( -4.003 0.599 6.817) 7.928 7.306 ( -2.135 -4.694 4.898) 7.112 8.075 ( 0.805 9.974 2.059) 10.216 8.228 ( 3.949 -3.614 1.751) 5.632 8.393 ( -4.647 4.280 -4.454) 7.730 8.507 ( -1.812 -5.217 -1.470) 5.715 8.588 ( -0.676 6.808 -0.796) 6.888 8.690 ( 4.298 -2.773 -7.804) 9.331 9.010 ( 5.935 -0.698 0.676) 6.014 9.110 ( 3.181 -9.405 5.453) 11.328 10.104 ( -1.615 2.204 -1.518) 3.126 10.119 ( -1.599 0.768 -2.374) 2.964 10.673 ( -2.745 1.514 -2.569) 4.053 10.715 ( -3.354 -2.597 -2.059) 4.715 11.008 ( -2.338 3.549 0.822) 4.329 11.075 ( -1.895 -2.988 0.796) 3.627 11.491 ( -2.494 5.070 -2.650) 6.241 11.555 ( -2.474 -1.133 -0.685) 2.806 11.934 ( 1.804 2.686 -0.498) 3.274 11.985 ( 1.429 -2.136 -1.688) 3.075 13.496 ( 0.932 3.843 -1.678) 4.296 13.549 ( -0.630 -0.714 4.211) 4.317 13.881 ( -0.728 0.094 -0.179) 0.755 13.957 ( -0.901 -6.741 3.103) 7.475 ======================= Grid point 511 (258/260) ======================= q-point: ( 0.30 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.415 ( 11.062 16.966 -14.661) 25.003 4.602 ( 4.647 6.703 -13.597) 15.856 4.721 ( -1.327 -3.670 -12.341) 12.943 4.797 ( 2.283 -8.460 -6.451) 10.881 5.010 ( 0.070 3.946 -2.121) 4.480 5.088 ( 5.007 -3.491 -1.147) 6.211 5.439 ( -11.487 0.528 7.977) 13.995 5.474 ( -7.973 -2.287 7.713) 11.327 5.881 ( 1.417 -1.449 3.500) 4.044 5.889 ( -0.149 -2.140 4.415) 4.909 6.512 ( 7.645 9.866 0.939) 12.517 6.655 ( 6.257 -3.821 -1.124) 7.417 7.257 ( -0.109 1.000 7.449) 7.517 7.331 ( 0.592 -5.379 5.245) 7.536 8.103 ( 1.308 9.803 -0.503) 9.902 8.253 ( -2.937 -3.313 -3.647) 5.736 8.317 ( 0.768 7.011 0.133) 7.054 8.470 ( -0.523 -6.426 -2.567) 6.939 8.580 ( -0.118 6.788 1.005) 6.863 8.707 ( 3.652 -4.267 -7.090) 9.045 9.114 ( 5.214 -1.230 -0.243) 5.363 9.186 ( 1.431 -7.488 4.010) 8.614 10.067 ( -0.538 2.508 -3.240) 4.132 10.080 ( -1.131 1.180 -0.250) 1.653 10.619 ( -2.033 0.398 -0.626) 2.164 10.650 ( -2.595 -2.814 -0.532) 3.865 10.956 ( -3.812 4.044 0.075) 5.557 11.029 ( -3.788 -3.141 0.446) 4.941 11.427 ( -2.045 4.530 -3.144) 5.881 11.489 ( -3.394 -1.608 -2.361) 4.436 11.976 ( 2.810 2.100 -0.113) 3.509 12.004 ( 1.700 -0.646 -0.661) 1.935 13.506 ( 1.525 4.350 -1.457) 4.835 13.564 ( -1.067 -0.335 4.034) 4.186 13.872 ( -0.055 -0.620 -0.297) 0.690 13.954 ( -2.014 -7.707 3.120) 8.555 ======================= Grid point 512 (259/260) ======================= q-point: ( 0.40 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.456 ( 4.858 7.801 -13.146) 16.039 4.568 ( -4.384 -2.982 -6.970) 8.757 4.644 ( 9.059 10.368 -9.068) 16.486 4.817 ( 0.919 -5.332 -1.926) 5.743 5.039 ( 4.646 4.929 -3.204) 7.493 5.143 ( 1.056 -3.411 -0.140) 3.574 5.320 ( -6.840 -0.089 6.257) 9.271 5.383 ( -8.524 -4.573 8.581) 12.931 5.904 ( -0.081 -0.842 1.286) 1.540 5.909 ( -0.204 -1.415 1.266) 1.910 6.638 ( 5.114 6.884 2.073) 8.822 6.722 ( 2.262 -1.166 -1.347) 2.880 7.328 ( 1.970 -0.039 5.558) 5.897 7.380 ( 0.787 -4.664 2.905) 5.551 8.115 ( 1.234 6.503 -1.317) 6.749 8.177 ( -1.549 1.034 -3.749) 4.186 8.337 ( 0.595 6.334 0.989) 6.439 8.430 ( -2.125 -0.904 -2.827) 3.650 8.613 ( 1.854 2.307 3.616) 4.672 8.711 ( 1.826 -4.339 -6.149) 7.744 9.185 ( 3.807 -2.761 -2.138) 5.166 9.221 ( -0.465 -5.690 3.405) 6.647 10.050 ( 0.775 3.555 -1.639) 3.990 10.071 ( -0.355 1.638 0.480) 1.743 10.594 ( -0.905 -0.713 1.029) 1.545 10.617 ( -1.263 -3.055 0.235) 3.314 10.890 ( -2.805 3.016 -0.369) 4.135 10.951 ( -4.547 -3.020 -0.919) 5.535 11.384 ( -0.467 3.202 -2.099) 3.857 11.418 ( -2.537 -0.172 -1.741) 3.082 12.020 ( 1.947 1.299 -0.008) 2.340 12.030 ( 1.194 0.339 -0.026) 1.242 13.527 ( 2.074 4.267 -1.753) 5.058 13.566 ( -1.772 1.411 3.376) 4.066 13.877 ( 1.230 -3.064 -0.884) 3.418 13.932 ( -2.672 -7.473 2.572) 8.343 ======================= Grid point 513 (260/260) ======================= q-point: ( 0.50 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.24e-05 8.24e-05 8.24e-05 8.24e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.469 ( 4.280 1.279 -3.174) 5.480 4.469 ( -4.280 1.279 3.174) 5.480 4.763 ( 7.445 5.111 -4.560) 10.117 4.763 ( -7.445 5.111 4.560) 10.117 5.110 ( 5.963 1.098 -4.977) 7.845 5.110 ( -5.963 1.098 4.977) 7.845 5.311 ( 4.532 -4.711 -4.802) 8.111 5.311 ( -4.532 -4.711 4.802) 8.111 5.908 ( 0.119 -0.958 -0.421) 1.054 5.908 ( -0.119 -0.958 0.421) 1.054 6.715 ( -1.629 2.865 -1.993) 3.852 6.715 ( 1.629 2.865 1.993) 3.852 7.383 ( -0.974 -2.509 -1.547) 3.105 7.383 ( 0.974 -2.509 1.547) 3.105 8.137 ( -0.164 3.226 -2.175) 3.894 8.137 ( 0.164 3.226 2.175) 3.894 8.369 ( -1.420 4.288 -2.076) 4.971 8.369 ( 1.420 4.288 2.076) 4.971 8.676 ( -0.109 -1.623 -6.273) 6.481 8.676 ( 0.109 -1.623 6.273) 6.481 9.220 ( 2.387 -4.351 -4.098) 6.436 9.220 ( -2.387 -4.351 4.098) 6.436 10.063 ( 1.043 3.182 -2.399) 4.119 10.063 ( -1.043 3.182 2.399) 4.119 10.599 ( -0.488 -2.160 -0.874) 2.381 10.599 ( 0.488 -2.160 0.874) 2.381 10.880 ( -0.577 -0.495 -2.075) 2.210 10.880 ( 0.577 -0.495 2.075) 2.210 11.381 ( -0.949 1.629 0.174) 1.893 11.381 ( 0.949 1.629 -0.174) 1.893 12.039 ( 0.465 0.814 -1.158) 1.490 12.039 ( -0.465 0.814 1.158) 1.490 13.551 ( 2.226 3.299 -2.492) 4.696 13.551 ( -2.226 3.299 2.492) 4.696 13.901 ( 2.317 -5.822 -1.744) 6.505 13.901 ( -2.317 -5.822 1.744) 6.505 =================== 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 17593.831 8776.321 16417.448 0.000 3499.038 0.000 3/32400 20.0 10019.805 7225.748 9272.156 0.000 280.720 0.000 3/32400 30.0 3898.928 3432.252 3790.825 0.000 -93.244 0.000 3/32400 40.0 1731.544 1675.279 1699.315 0.000 -68.094 0.000 3/32400 50.0 913.467 915.881 896.772 0.000 -42.461 0.000 3/32400 60.0 550.463 559.018 540.175 0.000 -27.380 0.000 3/32400 70.0 366.413 373.948 359.257 0.000 -18.753 0.000 3/32400 80.0 262.844 268.890 257.378 0.000 -13.629 0.000 3/32400 90.0 199.605 204.534 195.151 0.000 -10.420 0.000 3/32400 100.0 158.399 162.555 154.612 0.000 -8.302 0.000 3/32400 110.0 130.098 133.715 126.790 0.000 -6.839 0.000 3/32400 120.0 109.800 113.030 106.858 0.000 -5.787 0.000 3/32400 130.0 94.708 97.647 92.057 0.000 -5.003 0.000 3/32400 140.0 83.142 85.854 80.731 0.000 -4.403 0.000 3/32400 150.0 74.047 76.576 71.839 0.000 -3.932 0.000 3/32400 160.0 66.736 69.113 64.701 0.000 -3.553 0.000 3/32400 170.0 60.748 62.996 58.863 0.000 -3.243 0.000 3/32400 180.0 55.762 57.898 54.008 0.000 -2.984 0.000 3/32400 190.0 51.551 53.588 49.912 0.000 -2.766 0.000 3/32400 200.0 47.950 49.899 46.413 0.000 -2.579 0.000 3/32400 210.0 44.836 46.706 43.391 0.000 -2.418 0.000 3/32400 220.0 42.117 43.915 40.754 0.000 -2.277 0.000 3/32400 230.0 39.723 41.455 38.434 0.000 -2.152 0.000 3/32400 240.0 37.599 39.270 36.376 0.000 -2.041 0.000 3/32400 250.0 35.700 37.315 34.538 0.000 -1.942 0.000 3/32400 260.0 33.993 35.556 32.886 0.000 -1.853 0.000 3/32400 270.0 32.450 33.964 31.393 0.000 -1.772 0.000 3/32400 280.0 31.047 32.516 30.037 0.000 -1.699 0.000 3/32400 290.0 29.767 31.192 28.799 0.000 -1.632 0.000 3/32400 300.0 28.593 29.978 27.664 0.000 -1.570 0.000 3/32400 310.0 27.512 28.859 26.620 0.000 -1.513 0.000 3/32400 320.0 26.514 27.826 25.656 0.000 -1.460 0.000 3/32400 330.0 25.589 26.867 24.762 0.000 -1.411 0.000 3/32400 340.0 24.730 25.975 23.932 0.000 -1.365 0.000 3/32400 350.0 23.928 25.143 23.158 0.000 -1.323 0.000 3/32400 360.0 23.180 24.365 22.435 0.000 -1.283 0.000 3/32400 370.0 22.478 23.636 21.757 0.000 -1.245 0.000 3/32400 380.0 21.820 22.952 21.121 0.000 -1.210 0.000 3/32400 390.0 21.201 22.307 20.523 0.000 -1.177 0.000 3/32400 400.0 20.617 21.699 19.959 0.000 -1.146 0.000 3/32400 410.0 20.065 21.125 19.427 0.000 -1.116 0.000 3/32400 420.0 19.544 20.581 18.923 0.000 -1.088 0.000 3/32400 430.0 19.050 20.066 18.446 0.000 -1.061 0.000 3/32400 440.0 18.581 19.577 17.993 0.000 -1.036 0.000 3/32400 450.0 18.135 19.112 17.562 0.000 -1.012 0.000 3/32400 460.0 17.711 18.669 17.153 0.000 -0.989 0.000 3/32400 470.0 17.307 18.247 16.763 0.000 -0.967 0.000 3/32400 480.0 16.922 17.844 16.390 0.000 -0.946 0.000 3/32400 490.0 16.554 17.459 16.035 0.000 -0.926 0.000 3/32400 500.0 16.202 17.091 15.694 0.000 -0.907 0.000 3/32400 510.0 15.865 16.738 15.369 0.000 -0.889 0.000 3/32400 520.0 15.542 16.401 15.057 0.000 -0.871 0.000 3/32400 530.0 15.233 16.076 14.758 0.000 -0.854 0.000 3/32400 540.0 14.935 15.765 14.471 0.000 -0.838 0.000 3/32400 550.0 14.650 15.466 14.195 0.000 -0.822 0.000 3/32400 560.0 14.375 15.178 13.929 0.000 -0.807 0.000 3/32400 570.0 14.111 14.902 13.674 0.000 -0.793 0.000 3/32400 580.0 13.857 14.635 13.428 0.000 -0.779 0.000 3/32400 590.0 13.612 14.378 13.191 0.000 -0.766 0.000 3/32400 600.0 13.375 14.130 12.962 0.000 -0.753 0.000 3/32400 610.0 13.147 13.890 12.742 0.000 -0.740 0.000 3/32400 620.0 12.926 13.659 12.529 0.000 -0.728 0.000 3/32400 630.0 12.714 13.435 12.323 0.000 -0.716 0.000 3/32400 640.0 12.508 13.219 12.124 0.000 -0.705 0.000 3/32400 650.0 12.308 13.010 11.931 0.000 -0.694 0.000 3/32400 660.0 12.115 12.807 11.744 0.000 -0.683 0.000 3/32400 670.0 11.929 12.611 11.564 0.000 -0.673 0.000 3/32400 680.0 11.748 12.421 11.389 0.000 -0.663 0.000 3/32400 690.0 11.572 12.236 11.219 0.000 -0.653 0.000 3/32400 700.0 11.402 12.057 11.054 0.000 -0.644 0.000 3/32400 710.0 11.237 11.883 10.894 0.000 -0.635 0.000 3/32400 720.0 11.076 11.715 10.739 0.000 -0.626 0.000 3/32400 730.0 10.920 11.551 10.588 0.000 -0.617 0.000 3/32400 740.0 10.769 11.391 10.442 0.000 -0.609 0.000 3/32400 750.0 10.621 11.236 10.299 0.000 -0.600 0.000 3/32400 760.0 10.478 11.086 10.161 0.000 -0.593 0.000 3/32400 770.0 10.339 10.939 10.026 0.000 -0.585 0.000 3/32400 780.0 10.203 10.796 9.894 0.000 -0.577 0.000 3/32400 790.0 10.071 10.657 9.767 0.000 -0.570 0.000 3/32400 800.0 9.942 10.522 9.642 0.000 -0.563 0.000 3/32400 810.0 9.817 10.389 9.521 0.000 -0.556 0.000 3/32400 820.0 9.695 10.261 9.402 0.000 -0.549 0.000 3/32400 830.0 9.576 10.135 9.287 0.000 -0.542 0.000 3/32400 840.0 9.459 10.013 9.174 0.000 -0.536 0.000 3/32400 850.0 9.346 9.893 9.065 0.000 -0.530 0.000 3/32400 860.0 9.235 9.777 8.958 0.000 -0.523 0.000 3/32400 870.0 9.127 9.663 8.853 0.000 -0.517 0.000 3/32400 880.0 9.022 9.551 8.751 0.000 -0.511 0.000 3/32400 890.0 8.919 9.443 8.651 0.000 -0.506 0.000 3/32400 900.0 8.818 9.337 8.553 0.000 -0.500 0.000 3/32400 910.0 8.719 9.233 8.458 0.000 -0.495 0.000 3/32400 920.0 8.623 9.131 8.365 0.000 -0.489 0.000 3/32400 930.0 8.529 9.032 8.274 0.000 -0.484 0.000 3/32400 940.0 8.437 8.935 8.184 0.000 -0.479 0.000 3/32400 950.0 8.347 8.840 8.097 0.000 -0.474 0.000 3/32400 960.0 8.258 8.747 8.012 0.000 -0.469 0.000 3/32400 970.0 8.172 8.656 7.928 0.000 -0.464 0.000 3/32400 980.0 8.088 8.566 7.846 0.000 -0.459 0.000 3/32400 990.0 8.005 8.479 7.766 0.000 -0.455 0.000 3/32400 1000.0 7.924 8.393 7.688 0.000 -0.450 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 17:21:30]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|