----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 08:34:19]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 3 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 24 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.306298534647102 -2.621404560000000 0.000000000000000 b 5.306298534647102 2.621404560000000 0.000000000000000 c -4.276793360051092 0.000000000000000 11.660561190399964 Atomic positions (fractional): *1 Li 0.11262155783512 0.14467623284654 0.43345510308445 6.941 2 Li 0.85532376715346 0.88737844216488 0.06654489691555 6.941 3 Li 0.88737844216488 0.85532376715346 0.56654489691555 6.941 4 Li 0.14467623284654 0.11262155783512 0.93345510308445 6.941 *5 B 0.58819495385703 0.69215101119743 0.20667362865792 10.811 6 B 0.30784898880257 0.41180504614297 0.29332637134208 10.811 7 B 0.41180504614297 0.30784898880257 0.79332637134207 10.811 8 B 0.69215101119743 0.58819495385703 0.70667362865793 10.811 *9 Se 0.75821960688527 0.24178039311473 0.75000000000000 78.960 10 Se 0.24178039311473 0.75821960688527 0.25000000000000 78.960 *11 Se 0.92299550223978 0.57191352070330 0.34090942815561 78.960 12 Se 0.42808647929670 0.07700449776022 0.15909057184439 78.960 13 Se 0.07700449776022 0.42808647929670 0.65909057184439 78.960 14 Se 0.57191352070330 0.92299550223978 0.84090942815561 78.960 *15 Se 0.73433615573650 0.39634044186770 0.06065385434137 78.960 16 Se 0.60365955813230 0.26566384426350 0.43934614565863 78.960 17 Se 0.26566384426350 0.60365955813230 0.93934614565862 78.960 18 Se 0.39634044186770 0.73433615573650 0.56065385434138 78.960 -------------------------------- unit cell --------------------------------- Lattice vectors: a 10.612597069294203 0.000000000000000 0.000000000000000 b 0.000000000000000 5.242809120000000 0.000000000000000 c -4.276793360051092 0.000000000000000 11.660561190399964 Atomic positions (fractional): *1 Li 0.12864889534083 0.01602733750571 0.43345510308445 6.941 > 1 2 Li 0.87135110465917 0.01602733750571 0.06654489691555 6.941 > 2 3 Li 0.87135110465917 0.98397266249429 0.56654489691555 6.941 > 3 4 Li 0.12864889534083 0.98397266249429 0.93345510308445 6.941 > 4 5 Li 0.62864889534083 0.51602733750571 0.43345510308445 6.941 > 1 6 Li 0.37135110465917 0.51602733750571 0.06654489691555 6.941 > 2 7 Li 0.37135110465917 0.48397266249429 0.56654489691555 6.941 > 3 8 Li 0.62864889534083 0.48397266249429 0.93345510308445 6.941 > 4 *9 B 0.64017298252723 0.05197802867020 0.20667362865792 10.811 > 5 10 B 0.85982701747277 0.55197802867020 0.29332637134208 10.811 > 6 11 B 0.35982701747277 0.94802197132980 0.79332637134207 10.811 > 7 12 B 0.14017298252723 0.44802197132980 0.70667362865793 10.811 > 8 13 B 0.14017298252723 0.55197802867020 0.20667362865792 10.811 > 5 14 B 0.35982701747277 0.05197802867020 0.29332637134208 10.811 > 6 15 B 0.85982701747277 0.44802197132980 0.79332637134207 10.811 > 7 16 B 0.64017298252723 0.94802197132980 0.70667362865793 10.811 > 8 *17 Se 0.00000000000000 0.24178039311473 0.75000000000000 78.960 > 9 18 Se 0.00000000000000 0.75821960688527 0.25000000000000 78.960 > 10 *19 Se 0.74745451147154 0.82445900923176 0.34090942815561 78.960 > 11 20 Se 0.75254548852846 0.32445900923176 0.15909057184439 78.960 > 12 21 Se 0.25254548852846 0.17554099076824 0.65909057184439 78.960 > 13 22 Se 0.24745451147154 0.67554099076824 0.84090942815561 78.960 > 14 *23 Se 0.56533829880210 0.83100214306560 0.06065385434137 78.960 > 15 24 Se 0.93466170119790 0.33100214306560 0.43934614565863 78.960 > 16 25 Se 0.43466170119790 0.16899785693440 0.93934614565862 78.960 > 17 26 Se 0.06533829880210 0.66899785693440 0.56065385434138 78.960 > 18 27 Se 0.50000000000000 0.74178039311473 0.75000000000000 78.960 > 9 28 Se 0.50000000000000 0.25821960688527 0.25000000000000 78.960 > 10 29 Se 0.24745451147154 0.32445900923176 0.34090942815561 78.960 > 11 30 Se 0.25254548852846 0.82445900923176 0.15909057184439 78.960 > 12 31 Se 0.75254548852846 0.67554099076824 0.65909057184439 78.960 > 13 32 Se 0.74745451147154 0.17554099076824 0.84090942815561 78.960 > 14 33 Se 0.06533829880210 0.33100214306560 0.06065385434137 78.960 > 15 34 Se 0.43466170119790 0.83100214306560 0.43934614565863 78.960 > 16 35 Se 0.93466170119790 0.66899785693440 0.93934614565862 78.960 > 17 36 Se 0.56533829880210 0.16899785693440 0.56065385434138 78.960 > 18 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.612597069294203 0.000000000000000 0.000000000000000 b 0.000000000000000 15.728427360000001 0.000000000000000 c -4.276793360051092 0.000000000000000 11.660561190399964 Atomic positions (fractional): *1 Li 0.12864889534083 0.00534244583524 0.43345510308445 6.941 > 1 2 Li 0.12864889534083 0.33867577916857 0.43345510308445 6.941 > 1 3 Li 0.12864889534083 0.67200911250190 0.43345510308445 6.941 > 1 4 Li 0.87135110465917 0.00534244583524 0.06654489691555 6.941 > 2 5 Li 0.87135110465917 0.33867577916857 0.06654489691555 6.941 > 2 6 Li 0.87135110465917 0.67200911250190 0.06654489691555 6.941 > 2 7 Li 0.87135110465917 0.32799088749810 0.56654489691555 6.941 > 3 8 Li 0.87135110465917 0.66132422083143 0.56654489691555 6.941 > 3 9 Li 0.87135110465917 0.99465755416476 0.56654489691555 6.941 > 3 10 Li 0.12864889534083 0.32799088749810 0.93345510308445 6.941 > 4 11 Li 0.12864889534083 0.66132422083143 0.93345510308445 6.941 > 4 12 Li 0.12864889534083 0.99465755416476 0.93345510308445 6.941 > 4 13 Li 0.62864889534083 0.17200911250190 0.43345510308445 6.941 > 1 14 Li 0.62864889534083 0.50534244583524 0.43345510308445 6.941 > 1 15 Li 0.62864889534083 0.83867577916857 0.43345510308445 6.941 > 1 16 Li 0.37135110465917 0.17200911250190 0.06654489691555 6.941 > 2 17 Li 0.37135110465917 0.50534244583524 0.06654489691555 6.941 > 2 18 Li 0.37135110465917 0.83867577916857 0.06654489691555 6.941 > 2 19 Li 0.37135110465917 0.16132422083143 0.56654489691555 6.941 > 3 20 Li 0.37135110465917 0.49465755416476 0.56654489691555 6.941 > 3 21 Li 0.37135110465917 0.82799088749810 0.56654489691555 6.941 > 3 22 Li 0.62864889534083 0.16132422083143 0.93345510308445 6.941 > 4 23 Li 0.62864889534083 0.49465755416476 0.93345510308445 6.941 > 4 24 Li 0.62864889534083 0.82799088749810 0.93345510308445 6.941 > 4 *25 B 0.64017298252723 0.01732600955673 0.20667362865792 10.811 > 5 26 B 0.64017298252723 0.35065934289007 0.20667362865792 10.811 > 5 27 B 0.64017298252723 0.68399267622340 0.20667362865792 10.811 > 5 28 B 0.85982701747277 0.18399267622340 0.29332637134208 10.811 > 6 29 B 0.85982701747277 0.51732600955673 0.29332637134208 10.811 > 6 30 B 0.85982701747277 0.85065934289007 0.29332637134208 10.811 > 6 31 B 0.35982701747277 0.31600732377660 0.79332637134207 10.811 > 7 32 B 0.35982701747277 0.64934065710993 0.79332637134207 10.811 > 7 33 B 0.35982701747277 0.98267399044327 0.79332637134207 10.811 > 7 34 B 0.14017298252723 0.14934065710993 0.70667362865793 10.811 > 8 35 B 0.14017298252723 0.48267399044327 0.70667362865793 10.811 > 8 36 B 0.14017298252723 0.81600732377660 0.70667362865793 10.811 > 8 37 B 0.14017298252723 0.18399267622340 0.20667362865792 10.811 > 5 38 B 0.14017298252723 0.51732600955673 0.20667362865792 10.811 > 5 39 B 0.14017298252723 0.85065934289007 0.20667362865792 10.811 > 5 40 B 0.35982701747277 0.01732600955673 0.29332637134208 10.811 > 6 41 B 0.35982701747277 0.35065934289007 0.29332637134208 10.811 > 6 42 B 0.35982701747277 0.68399267622340 0.29332637134208 10.811 > 6 43 B 0.85982701747277 0.14934065710993 0.79332637134207 10.811 > 7 44 B 0.85982701747277 0.48267399044327 0.79332637134207 10.811 > 7 45 B 0.85982701747277 0.81600732377660 0.79332637134207 10.811 > 7 46 B 0.64017298252723 0.31600732377660 0.70667362865793 10.811 > 8 47 B 0.64017298252723 0.64934065710993 0.70667362865793 10.811 > 8 48 B 0.64017298252723 0.98267399044327 0.70667362865793 10.811 > 8 *49 Se 0.00000000000000 0.08059346437158 0.75000000000000 78.960 > 9 50 Se 0.00000000000000 0.41392679770491 0.75000000000000 78.960 > 9 51 Se 0.00000000000000 0.74726013103824 0.75000000000000 78.960 > 9 52 Se 0.00000000000000 0.25273986896176 0.25000000000000 78.960 > 10 53 Se 0.00000000000000 0.58607320229509 0.25000000000000 78.960 > 10 54 Se 0.00000000000000 0.91940653562842 0.25000000000000 78.960 > 10 *55 Se 0.74745451147154 0.27481966974392 0.34090942815561 78.960 > 11 56 Se 0.74745451147154 0.60815300307725 0.34090942815561 78.960 > 11 57 Se 0.74745451147154 0.94148633641059 0.34090942815561 78.960 > 11 58 Se 0.75254548852846 0.10815300307725 0.15909057184439 78.960 > 12 59 Se 0.75254548852846 0.44148633641059 0.15909057184439 78.960 > 12 60 Se 0.75254548852846 0.77481966974392 0.15909057184439 78.960 > 12 61 Se 0.25254548852846 0.05851366358941 0.65909057184439 78.960 > 13 62 Se 0.25254548852846 0.39184699692275 0.65909057184439 78.960 > 13 63 Se 0.25254548852846 0.72518033025608 0.65909057184439 78.960 > 13 64 Se 0.24745451147154 0.22518033025608 0.84090942815561 78.960 > 14 65 Se 0.24745451147154 0.55851366358941 0.84090942815561 78.960 > 14 66 Se 0.24745451147154 0.89184699692275 0.84090942815561 78.960 > 14 *67 Se 0.56533829880210 0.27700071435520 0.06065385434137 78.960 > 15 68 Se 0.56533829880210 0.61033404768853 0.06065385434137 78.960 > 15 69 Se 0.56533829880210 0.94366738102187 0.06065385434137 78.960 > 15 70 Se 0.93466170119790 0.11033404768853 0.43934614565863 78.960 > 16 71 Se 0.93466170119790 0.44366738102187 0.43934614565863 78.960 > 16 72 Se 0.93466170119790 0.77700071435520 0.43934614565863 78.960 > 16 73 Se 0.43466170119790 0.05633261897813 0.93934614565862 78.960 > 17 74 Se 0.43466170119790 0.38966595231147 0.93934614565862 78.960 > 17 75 Se 0.43466170119790 0.72299928564480 0.93934614565862 78.960 > 17 76 Se 0.06533829880210 0.22299928564480 0.56065385434138 78.960 > 18 77 Se 0.06533829880210 0.55633261897813 0.56065385434138 78.960 > 18 78 Se 0.06533829880210 0.88966595231147 0.56065385434138 78.960 > 18 79 Se 0.50000000000000 0.24726013103824 0.75000000000000 78.960 > 9 80 Se 0.50000000000000 0.58059346437158 0.75000000000000 78.960 > 9 81 Se 0.50000000000000 0.91392679770491 0.75000000000000 78.960 > 9 82 Se 0.50000000000000 0.08607320229509 0.25000000000000 78.960 > 10 83 Se 0.50000000000000 0.41940653562842 0.25000000000000 78.960 > 10 84 Se 0.50000000000000 0.75273986896176 0.25000000000000 78.960 > 10 85 Se 0.24745451147154 0.10815300307725 0.34090942815561 78.960 > 11 86 Se 0.24745451147154 0.44148633641059 0.34090942815561 78.960 > 11 87 Se 0.24745451147154 0.77481966974392 0.34090942815561 78.960 > 11 88 Se 0.25254548852846 0.27481966974392 0.15909057184439 78.960 > 12 89 Se 0.25254548852846 0.60815300307725 0.15909057184439 78.960 > 12 90 Se 0.25254548852846 0.94148633641059 0.15909057184439 78.960 > 12 91 Se 0.75254548852846 0.22518033025608 0.65909057184439 78.960 > 13 92 Se 0.75254548852846 0.55851366358941 0.65909057184439 78.960 > 13 93 Se 0.75254548852846 0.89184699692275 0.65909057184439 78.960 > 13 94 Se 0.74745451147154 0.05851366358941 0.84090942815561 78.960 > 14 95 Se 0.74745451147154 0.39184699692275 0.84090942815561 78.960 > 14 96 Se 0.74745451147154 0.72518033025608 0.84090942815561 78.960 > 14 97 Se 0.06533829880210 0.11033404768853 0.06065385434137 78.960 > 15 98 Se 0.06533829880210 0.44366738102187 0.06065385434137 78.960 > 15 99 Se 0.06533829880210 0.77700071435520 0.06065385434137 78.960 > 15 100 Se 0.43466170119790 0.27700071435520 0.43934614565863 78.960 > 16 101 Se 0.43466170119790 0.61033404768853 0.43934614565863 78.960 > 16 102 Se 0.43466170119790 0.94366738102187 0.43934614565863 78.960 > 16 103 Se 0.93466170119790 0.22299928564480 0.93934614565862 78.960 > 17 104 Se 0.93466170119790 0.55633261897813 0.93934614565862 78.960 > 17 105 Se 0.93466170119790 0.88966595231147 0.93934614565862 78.960 > 17 106 Se 0.56533829880210 0.05633261897813 0.56065385434138 78.960 > 18 107 Se 0.56533829880210 0.38966595231147 0.56065385434138 78.960 > 18 108 Se 0.56533829880210 0.72299928564480 0.56065385434138 78.960 > 18 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 6.8275083 0.0000000 0.9805175 0.0000000 8.3714125 0.0000000 0.9805184 0.0000000 7.9509172 -------------------------- Born effective charges -------------------------- 1 Li 1.1247049 0.1141950 -0.2178526 0.1894966 1.3218655 -0.2946322 -0.1164941 -0.0119723 1.2404845 2 Li 1.1247049 -0.1141950 -0.2178526 -0.1894966 1.3218655 0.2946322 -0.1164941 0.0119723 1.2404845 3 Li 1.1247049 0.1141950 -0.2178526 0.1894966 1.3218655 -0.2946322 -0.1164941 -0.0119723 1.2404845 4 Li 1.1247049 -0.1141950 -0.2178526 -0.1894966 1.3218655 0.2946322 -0.1164941 0.0119723 1.2404845 5 B 1.2276975 -0.2574853 0.1756418 0.3415734 1.4369992 -0.1626447 -0.0880458 0.1703441 1.5755228 6 B 1.2276975 0.2574853 0.1756418 -0.3415734 1.4369992 0.1626447 -0.0880458 -0.1703441 1.5755228 7 B 1.2276975 -0.2574853 0.1756418 0.3415734 1.4369992 -0.1626447 -0.0880458 0.1703441 1.5755228 8 B 1.2276975 0.2574853 0.1756418 -0.3415734 1.4369992 0.1626447 -0.0880458 -0.1703441 1.5755228 9 Se -1.3066461 0.0000000 0.0163271 0.0000000 -1.0449029 0.0000000 0.1696506 0.0000000 -1.2768008 10 Se -1.3066461 0.0000000 0.0163271 0.0000000 -1.0449029 0.0000000 0.1696506 0.0000000 -1.2768008 11 Se -1.1069020 -0.1100347 -0.0917907 -0.2255971 -1.8827934 0.1562638 -0.1213993 -0.2941059 -1.4880523 12 Se -1.1069020 0.1100347 -0.0917907 0.2255971 -1.8827934 -0.1562638 -0.1213993 0.2941059 -1.4880523 13 Se -1.1069020 -0.1100347 -0.0917907 -0.2255971 -1.8827934 0.1562638 -0.1213993 -0.2941059 -1.4880523 14 Se -1.1069020 0.1100347 -0.0917907 0.2255971 -1.8827934 -0.1562638 -0.1213993 0.2941059 -1.4880523 15 Se -0.5921773 -0.4345407 0.1258380 -0.4606159 -0.3536198 -0.6230824 0.2411139 -0.9748603 -0.6895546 16 Se -0.5921773 0.4345407 0.1258380 0.4606159 -0.3536198 0.6230824 0.2411139 0.9748603 -0.6895546 17 Se -0.5921773 -0.4345407 0.1258380 -0.4606159 -0.3536198 -0.6230824 0.2411139 -0.9748603 -0.6895546 18 Se -0.5921773 0.4345407 0.1258380 0.4606159 -0.3536198 0.6230824 0.2411139 0.9748603 -0.6895546 ---------------------------------------------------------------------------- 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: 324/324 Permutation basis: 10665/10665 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2298 Number of blocks in projector: 2298 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: 492 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 282 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 282 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 282 Use standard eigh solver. Tree of FC basis block matrices: - (2298, 2258), data: False |-- (282, 277), data: True |-- (282, 277), data: True |-- (282, 277), data: True |-- (480, 472), data: True |-- (480, 472), data: True |-- (492, 483), data: True ----- Solver_atoms: 1 -- 108 / 108 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 560 - Time: 0.513 Solver_block: 200 / 560 - Time: 0.459 Solver_block: 300 / 560 - Time: 0.464 Solver_block: 400 / 560 - Time: 0.470 Solver_block: 500 / 560 - Time: 0.465 Solver_block: 560 / 560 - Time: 0.316 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.761 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 324/324 Permutation basis: 10665/10665 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2298 Number of blocks in projector: 2298 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: 492 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 480 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 282 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 282 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 282 Use standard eigh solver. Tree of FC basis block matrices: - (2298, 2258), data: False |-- (282, 277), data: True |-- (282, 277), data: True |-- (282, 277), data: True |-- (480, 472), data: True |-- (480, 472), data: True |-- (492, 483), 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 08:34:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:34:40]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 3 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.306298534647102 -2.621404560000000 0.000000000000000 b 5.306298534647102 2.621404560000000 0.000000000000000 c -4.276793360051092 0.000000000000000 11.660561190399964 Atomic positions (fractional): 1 Li 0.11262155783512 0.14467623284654 0.43345510308445 6.941 2 Li 0.85532376715346 0.88737844216488 0.06654489691555 6.941 3 Li 0.88737844216488 0.85532376715346 0.56654489691555 6.941 4 Li 0.14467623284654 0.11262155783512 0.93345510308445 6.941 5 B 0.58819495385703 0.69215101119743 0.20667362865792 10.811 6 B 0.30784898880257 0.41180504614297 0.29332637134208 10.811 7 B 0.41180504614297 0.30784898880257 0.79332637134207 10.811 8 B 0.69215101119743 0.58819495385703 0.70667362865793 10.811 9 Se 0.75821960688527 0.24178039311473 0.75000000000000 78.960 10 Se 0.24178039311473 0.75821960688527 0.25000000000000 78.960 11 Se 0.92299550223978 0.57191352070330 0.34090942815561 78.960 12 Se 0.42808647929670 0.07700449776022 0.15909057184439 78.960 13 Se 0.07700449776022 0.42808647929670 0.65909057184439 78.960 14 Se 0.57191352070330 0.92299550223978 0.84090942815561 78.960 15 Se 0.73433615573650 0.39634044186770 0.06065385434137 78.960 16 Se 0.60365955813230 0.26566384426350 0.43934614565863 78.960 17 Se 0.26566384426350 0.60365955813230 0.93934614565862 78.960 18 Se 0.39634044186770 0.73433615573650 0.56065385434138 78.960 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.612597069294203 0.000000000000000 0.000000000000000 b 0.000000000000000 15.728427360000001 0.000000000000000 c -4.276793360051092 0.000000000000000 11.660561190399964 Atomic positions (fractional): 1 Li 0.12864889534083 0.00534244583524 0.43345510308445 6.941 > 1 2 Li 0.12864889534083 0.33867577916857 0.43345510308445 6.941 > 1 3 Li 0.12864889534083 0.67200911250190 0.43345510308445 6.941 > 1 4 Li 0.87135110465917 0.00534244583524 0.06654489691555 6.941 > 4 5 Li 0.87135110465917 0.33867577916857 0.06654489691555 6.941 > 4 6 Li 0.87135110465917 0.67200911250190 0.06654489691555 6.941 > 4 7 Li 0.87135110465917 0.32799088749810 0.56654489691555 6.941 > 7 8 Li 0.87135110465917 0.66132422083143 0.56654489691555 6.941 > 7 9 Li 0.87135110465917 0.99465755416476 0.56654489691555 6.941 > 7 10 Li 0.12864889534083 0.32799088749810 0.93345510308445 6.941 > 10 11 Li 0.12864889534083 0.66132422083143 0.93345510308445 6.941 > 10 12 Li 0.12864889534083 0.99465755416476 0.93345510308445 6.941 > 10 13 Li 0.62864889534083 0.17200911250190 0.43345510308445 6.941 > 1 14 Li 0.62864889534083 0.50534244583524 0.43345510308445 6.941 > 1 15 Li 0.62864889534083 0.83867577916857 0.43345510308445 6.941 > 1 16 Li 0.37135110465917 0.17200911250190 0.06654489691555 6.941 > 4 17 Li 0.37135110465917 0.50534244583524 0.06654489691555 6.941 > 4 18 Li 0.37135110465917 0.83867577916857 0.06654489691555 6.941 > 4 19 Li 0.37135110465917 0.16132422083143 0.56654489691555 6.941 > 7 20 Li 0.37135110465917 0.49465755416476 0.56654489691555 6.941 > 7 21 Li 0.37135110465917 0.82799088749810 0.56654489691555 6.941 > 7 22 Li 0.62864889534083 0.16132422083143 0.93345510308445 6.941 > 10 23 Li 0.62864889534083 0.49465755416476 0.93345510308445 6.941 > 10 24 Li 0.62864889534083 0.82799088749810 0.93345510308445 6.941 > 10 25 B 0.64017298252723 0.01732600955673 0.20667362865792 10.811 > 25 26 B 0.64017298252723 0.35065934289007 0.20667362865792 10.811 > 25 27 B 0.64017298252723 0.68399267622340 0.20667362865792 10.811 > 25 28 B 0.85982701747277 0.18399267622340 0.29332637134208 10.811 > 28 29 B 0.85982701747277 0.51732600955673 0.29332637134208 10.811 > 28 30 B 0.85982701747277 0.85065934289007 0.29332637134208 10.811 > 28 31 B 0.35982701747277 0.31600732377660 0.79332637134207 10.811 > 31 32 B 0.35982701747277 0.64934065710993 0.79332637134207 10.811 > 31 33 B 0.35982701747277 0.98267399044327 0.79332637134207 10.811 > 31 34 B 0.14017298252723 0.14934065710993 0.70667362865793 10.811 > 34 35 B 0.14017298252723 0.48267399044327 0.70667362865793 10.811 > 34 36 B 0.14017298252723 0.81600732377660 0.70667362865793 10.811 > 34 37 B 0.14017298252723 0.18399267622340 0.20667362865792 10.811 > 25 38 B 0.14017298252723 0.51732600955673 0.20667362865792 10.811 > 25 39 B 0.14017298252723 0.85065934289007 0.20667362865792 10.811 > 25 40 B 0.35982701747277 0.01732600955673 0.29332637134208 10.811 > 28 41 B 0.35982701747277 0.35065934289007 0.29332637134208 10.811 > 28 42 B 0.35982701747277 0.68399267622340 0.29332637134208 10.811 > 28 43 B 0.85982701747277 0.14934065710993 0.79332637134207 10.811 > 31 44 B 0.85982701747277 0.48267399044327 0.79332637134207 10.811 > 31 45 B 0.85982701747277 0.81600732377660 0.79332637134207 10.811 > 31 46 B 0.64017298252723 0.31600732377660 0.70667362865793 10.811 > 34 47 B 0.64017298252723 0.64934065710993 0.70667362865793 10.811 > 34 48 B 0.64017298252723 0.98267399044327 0.70667362865793 10.811 > 34 49 Se 0.00000000000000 0.08059346437158 0.75000000000000 78.960 > 49 50 Se 0.00000000000000 0.41392679770491 0.75000000000000 78.960 > 49 51 Se 0.00000000000000 0.74726013103824 0.75000000000000 78.960 > 49 52 Se 0.00000000000000 0.25273986896176 0.25000000000000 78.960 > 52 53 Se 0.00000000000000 0.58607320229509 0.25000000000000 78.960 > 52 54 Se 0.00000000000000 0.91940653562842 0.25000000000000 78.960 > 52 55 Se 0.74745451147154 0.27481966974392 0.34090942815561 78.960 > 55 56 Se 0.74745451147154 0.60815300307725 0.34090942815561 78.960 > 55 57 Se 0.74745451147154 0.94148633641059 0.34090942815561 78.960 > 55 58 Se 0.75254548852846 0.10815300307725 0.15909057184439 78.960 > 58 59 Se 0.75254548852846 0.44148633641059 0.15909057184439 78.960 > 58 60 Se 0.75254548852846 0.77481966974392 0.15909057184439 78.960 > 58 61 Se 0.25254548852846 0.05851366358941 0.65909057184439 78.960 > 61 62 Se 0.25254548852846 0.39184699692275 0.65909057184439 78.960 > 61 63 Se 0.25254548852846 0.72518033025608 0.65909057184439 78.960 > 61 64 Se 0.24745451147154 0.22518033025608 0.84090942815561 78.960 > 64 65 Se 0.24745451147154 0.55851366358941 0.84090942815561 78.960 > 64 66 Se 0.24745451147154 0.89184699692275 0.84090942815561 78.960 > 64 67 Se 0.56533829880210 0.27700071435520 0.06065385434137 78.960 > 67 68 Se 0.56533829880210 0.61033404768853 0.06065385434137 78.960 > 67 69 Se 0.56533829880210 0.94366738102187 0.06065385434137 78.960 > 67 70 Se 0.93466170119790 0.11033404768853 0.43934614565863 78.960 > 70 71 Se 0.93466170119790 0.44366738102187 0.43934614565863 78.960 > 70 72 Se 0.93466170119790 0.77700071435520 0.43934614565863 78.960 > 70 73 Se 0.43466170119790 0.05633261897813 0.93934614565862 78.960 > 73 74 Se 0.43466170119790 0.38966595231147 0.93934614565862 78.960 > 73 75 Se 0.43466170119790 0.72299928564480 0.93934614565862 78.960 > 73 76 Se 0.06533829880210 0.22299928564480 0.56065385434138 78.960 > 76 77 Se 0.06533829880210 0.55633261897813 0.56065385434138 78.960 > 76 78 Se 0.06533829880210 0.88966595231147 0.56065385434138 78.960 > 76 79 Se 0.50000000000000 0.24726013103824 0.75000000000000 78.960 > 49 80 Se 0.50000000000000 0.58059346437158 0.75000000000000 78.960 > 49 81 Se 0.50000000000000 0.91392679770491 0.75000000000000 78.960 > 49 82 Se 0.50000000000000 0.08607320229509 0.25000000000000 78.960 > 52 83 Se 0.50000000000000 0.41940653562842 0.25000000000000 78.960 > 52 84 Se 0.50000000000000 0.75273986896176 0.25000000000000 78.960 > 52 85 Se 0.24745451147154 0.10815300307725 0.34090942815561 78.960 > 55 86 Se 0.24745451147154 0.44148633641059 0.34090942815561 78.960 > 55 87 Se 0.24745451147154 0.77481966974392 0.34090942815561 78.960 > 55 88 Se 0.25254548852846 0.27481966974392 0.15909057184439 78.960 > 58 89 Se 0.25254548852846 0.60815300307725 0.15909057184439 78.960 > 58 90 Se 0.25254548852846 0.94148633641059 0.15909057184439 78.960 > 58 91 Se 0.75254548852846 0.22518033025608 0.65909057184439 78.960 > 61 92 Se 0.75254548852846 0.55851366358941 0.65909057184439 78.960 > 61 93 Se 0.75254548852846 0.89184699692275 0.65909057184439 78.960 > 61 94 Se 0.74745451147154 0.05851366358941 0.84090942815561 78.960 > 64 95 Se 0.74745451147154 0.39184699692275 0.84090942815561 78.960 > 64 96 Se 0.74745451147154 0.72518033025608 0.84090942815561 78.960 > 64 97 Se 0.06533829880210 0.11033404768853 0.06065385434137 78.960 > 67 98 Se 0.06533829880210 0.44366738102187 0.06065385434137 78.960 > 67 99 Se 0.06533829880210 0.77700071435520 0.06065385434137 78.960 > 67 100 Se 0.43466170119790 0.27700071435520 0.43934614565863 78.960 > 70 101 Se 0.43466170119790 0.61033404768853 0.43934614565863 78.960 > 70 102 Se 0.43466170119790 0.94366738102187 0.43934614565863 78.960 > 70 103 Se 0.93466170119790 0.22299928564480 0.93934614565862 78.960 > 73 104 Se 0.93466170119790 0.55633261897813 0.93934614565862 78.960 > 73 105 Se 0.93466170119790 0.88966595231147 0.93934614565862 78.960 > 73 106 Se 0.56533829880210 0.05633261897813 0.56065385434138 78.960 > 76 107 Se 0.56533829880210 0.38966595231147 0.56065385434138 78.960 > 76 108 Se 0.56533829880210 0.72299928564480 0.56065385434138 78.960 > 76 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 6.8275083 0.0000000 0.9805175 0.0000000 8.3714125 0.0000000 0.9805184 0.0000000 7.9509172 -------------------------- Born effective charges -------------------------- 1 Li 1.1247049 0.1141950 -0.2178526 0.1894966 1.3218655 -0.2946322 -0.1164941 -0.0119723 1.2404845 2 Li 1.1247049 -0.1141950 -0.2178526 -0.1894966 1.3218655 0.2946322 -0.1164941 0.0119723 1.2404845 3 Li 1.1247049 0.1141950 -0.2178526 0.1894966 1.3218655 -0.2946322 -0.1164941 -0.0119723 1.2404845 4 Li 1.1247049 -0.1141950 -0.2178526 -0.1894966 1.3218655 0.2946322 -0.1164941 0.0119723 1.2404845 5 B 1.2276975 -0.2574853 0.1756418 0.3415734 1.4369992 -0.1626447 -0.0880458 0.1703441 1.5755228 6 B 1.2276975 0.2574853 0.1756418 -0.3415734 1.4369992 0.1626447 -0.0880458 -0.1703441 1.5755228 7 B 1.2276975 -0.2574853 0.1756418 0.3415734 1.4369992 -0.1626447 -0.0880458 0.1703441 1.5755228 8 B 1.2276975 0.2574853 0.1756418 -0.3415734 1.4369992 0.1626447 -0.0880458 -0.1703441 1.5755228 9 Se -1.3066461 0.0000000 0.0163271 0.0000000 -1.0449029 0.0000000 0.1696506 0.0000000 -1.2768008 10 Se -1.3066461 0.0000000 0.0163271 0.0000000 -1.0449029 0.0000000 0.1696506 0.0000000 -1.2768008 11 Se -1.1069020 -0.1100347 -0.0917907 -0.2255971 -1.8827934 0.1562638 -0.1213993 -0.2941059 -1.4880523 12 Se -1.1069020 0.1100347 -0.0917907 0.2255971 -1.8827934 -0.1562638 -0.1213993 0.2941059 -1.4880523 13 Se -1.1069020 -0.1100347 -0.0917907 -0.2255971 -1.8827934 0.1562638 -0.1213993 -0.2941059 -1.4880523 14 Se -1.1069020 0.1100347 -0.0917907 0.2255971 -1.8827934 -0.1562638 -0.1213993 0.2941059 -1.4880523 15 Se -0.5921773 -0.4345407 0.1258380 -0.4606159 -0.3536198 -0.6230824 0.2411139 -0.9748603 -0.6895546 16 Se -0.5921773 0.4345407 0.1258380 0.4606159 -0.3536198 0.6230824 0.2411139 0.9748603 -0.6895546 17 Se -0.5921773 -0.4345407 0.1258380 -0.4606159 -0.3536198 -0.6230824 0.2411139 -0.9748603 -0.6895546 18 Se -0.5921773 0.4345407 0.1258380 0.4606159 -0.3536198 0.6230824 0.2411139 0.9748603 -0.6895546 ---------------------------------------------------------------------------- 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 55, 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 67, 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:34:57]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:34:57]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 3 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.306298534647102 -2.621404560000000 0.000000000000000 b 5.306298534647102 2.621404560000000 0.000000000000000 c -4.276793360051092 0.000000000000000 11.660561190399964 Atomic positions (fractional): 1 Li 0.11262155783512 0.14467623284654 0.43345510308445 6.941 2 Li 0.85532376715346 0.88737844216488 0.06654489691555 6.941 3 Li 0.88737844216488 0.85532376715346 0.56654489691555 6.941 4 Li 0.14467623284654 0.11262155783512 0.93345510308445 6.941 5 B 0.58819495385703 0.69215101119743 0.20667362865792 10.811 6 B 0.30784898880257 0.41180504614297 0.29332637134208 10.811 7 B 0.41180504614297 0.30784898880257 0.79332637134207 10.811 8 B 0.69215101119743 0.58819495385703 0.70667362865793 10.811 9 Se 0.75821960688527 0.24178039311473 0.75000000000000 78.960 10 Se 0.24178039311473 0.75821960688527 0.25000000000000 78.960 11 Se 0.92299550223978 0.57191352070330 0.34090942815561 78.960 12 Se 0.42808647929670 0.07700449776022 0.15909057184439 78.960 13 Se 0.07700449776022 0.42808647929670 0.65909057184439 78.960 14 Se 0.57191352070330 0.92299550223978 0.84090942815561 78.960 15 Se 0.73433615573650 0.39634044186770 0.06065385434137 78.960 16 Se 0.60365955813230 0.26566384426350 0.43934614565863 78.960 17 Se 0.26566384426350 0.60365955813230 0.93934614565862 78.960 18 Se 0.39634044186770 0.73433615573650 0.56065385434138 78.960 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.612597069294203 0.000000000000000 0.000000000000000 b 0.000000000000000 15.728427360000001 0.000000000000000 c -4.276793360051092 0.000000000000000 11.660561190399964 Atomic positions (fractional): 1 Li 0.12864889534083 0.00534244583524 0.43345510308445 6.941 > 1 2 Li 0.12864889534083 0.33867577916857 0.43345510308445 6.941 > 1 3 Li 0.12864889534083 0.67200911250190 0.43345510308445 6.941 > 1 4 Li 0.87135110465917 0.00534244583524 0.06654489691555 6.941 > 4 5 Li 0.87135110465917 0.33867577916857 0.06654489691555 6.941 > 4 6 Li 0.87135110465917 0.67200911250190 0.06654489691555 6.941 > 4 7 Li 0.87135110465917 0.32799088749810 0.56654489691555 6.941 > 7 8 Li 0.87135110465917 0.66132422083143 0.56654489691555 6.941 > 7 9 Li 0.87135110465917 0.99465755416476 0.56654489691555 6.941 > 7 10 Li 0.12864889534083 0.32799088749810 0.93345510308445 6.941 > 10 11 Li 0.12864889534083 0.66132422083143 0.93345510308445 6.941 > 10 12 Li 0.12864889534083 0.99465755416476 0.93345510308445 6.941 > 10 13 Li 0.62864889534083 0.17200911250190 0.43345510308445 6.941 > 1 14 Li 0.62864889534083 0.50534244583524 0.43345510308445 6.941 > 1 15 Li 0.62864889534083 0.83867577916857 0.43345510308445 6.941 > 1 16 Li 0.37135110465917 0.17200911250190 0.06654489691555 6.941 > 4 17 Li 0.37135110465917 0.50534244583524 0.06654489691555 6.941 > 4 18 Li 0.37135110465917 0.83867577916857 0.06654489691555 6.941 > 4 19 Li 0.37135110465917 0.16132422083143 0.56654489691555 6.941 > 7 20 Li 0.37135110465917 0.49465755416476 0.56654489691555 6.941 > 7 21 Li 0.37135110465917 0.82799088749810 0.56654489691555 6.941 > 7 22 Li 0.62864889534083 0.16132422083143 0.93345510308445 6.941 > 10 23 Li 0.62864889534083 0.49465755416476 0.93345510308445 6.941 > 10 24 Li 0.62864889534083 0.82799088749810 0.93345510308445 6.941 > 10 25 B 0.64017298252723 0.01732600955673 0.20667362865792 10.811 > 25 26 B 0.64017298252723 0.35065934289007 0.20667362865792 10.811 > 25 27 B 0.64017298252723 0.68399267622340 0.20667362865792 10.811 > 25 28 B 0.85982701747277 0.18399267622340 0.29332637134208 10.811 > 28 29 B 0.85982701747277 0.51732600955673 0.29332637134208 10.811 > 28 30 B 0.85982701747277 0.85065934289007 0.29332637134208 10.811 > 28 31 B 0.35982701747277 0.31600732377660 0.79332637134207 10.811 > 31 32 B 0.35982701747277 0.64934065710993 0.79332637134207 10.811 > 31 33 B 0.35982701747277 0.98267399044327 0.79332637134207 10.811 > 31 34 B 0.14017298252723 0.14934065710993 0.70667362865793 10.811 > 34 35 B 0.14017298252723 0.48267399044327 0.70667362865793 10.811 > 34 36 B 0.14017298252723 0.81600732377660 0.70667362865793 10.811 > 34 37 B 0.14017298252723 0.18399267622340 0.20667362865792 10.811 > 25 38 B 0.14017298252723 0.51732600955673 0.20667362865792 10.811 > 25 39 B 0.14017298252723 0.85065934289007 0.20667362865792 10.811 > 25 40 B 0.35982701747277 0.01732600955673 0.29332637134208 10.811 > 28 41 B 0.35982701747277 0.35065934289007 0.29332637134208 10.811 > 28 42 B 0.35982701747277 0.68399267622340 0.29332637134208 10.811 > 28 43 B 0.85982701747277 0.14934065710993 0.79332637134207 10.811 > 31 44 B 0.85982701747277 0.48267399044327 0.79332637134207 10.811 > 31 45 B 0.85982701747277 0.81600732377660 0.79332637134207 10.811 > 31 46 B 0.64017298252723 0.31600732377660 0.70667362865793 10.811 > 34 47 B 0.64017298252723 0.64934065710993 0.70667362865793 10.811 > 34 48 B 0.64017298252723 0.98267399044327 0.70667362865793 10.811 > 34 49 Se 0.00000000000000 0.08059346437158 0.75000000000000 78.960 > 49 50 Se 0.00000000000000 0.41392679770491 0.75000000000000 78.960 > 49 51 Se 0.00000000000000 0.74726013103824 0.75000000000000 78.960 > 49 52 Se 0.00000000000000 0.25273986896176 0.25000000000000 78.960 > 52 53 Se 0.00000000000000 0.58607320229509 0.25000000000000 78.960 > 52 54 Se 0.00000000000000 0.91940653562842 0.25000000000000 78.960 > 52 55 Se 0.74745451147154 0.27481966974392 0.34090942815561 78.960 > 55 56 Se 0.74745451147154 0.60815300307725 0.34090942815561 78.960 > 55 57 Se 0.74745451147154 0.94148633641059 0.34090942815561 78.960 > 55 58 Se 0.75254548852846 0.10815300307725 0.15909057184439 78.960 > 58 59 Se 0.75254548852846 0.44148633641059 0.15909057184439 78.960 > 58 60 Se 0.75254548852846 0.77481966974392 0.15909057184439 78.960 > 58 61 Se 0.25254548852846 0.05851366358941 0.65909057184439 78.960 > 61 62 Se 0.25254548852846 0.39184699692275 0.65909057184439 78.960 > 61 63 Se 0.25254548852846 0.72518033025608 0.65909057184439 78.960 > 61 64 Se 0.24745451147154 0.22518033025608 0.84090942815561 78.960 > 64 65 Se 0.24745451147154 0.55851366358941 0.84090942815561 78.960 > 64 66 Se 0.24745451147154 0.89184699692275 0.84090942815561 78.960 > 64 67 Se 0.56533829880210 0.27700071435520 0.06065385434137 78.960 > 67 68 Se 0.56533829880210 0.61033404768853 0.06065385434137 78.960 > 67 69 Se 0.56533829880210 0.94366738102187 0.06065385434137 78.960 > 67 70 Se 0.93466170119790 0.11033404768853 0.43934614565863 78.960 > 70 71 Se 0.93466170119790 0.44366738102187 0.43934614565863 78.960 > 70 72 Se 0.93466170119790 0.77700071435520 0.43934614565863 78.960 > 70 73 Se 0.43466170119790 0.05633261897813 0.93934614565862 78.960 > 73 74 Se 0.43466170119790 0.38966595231147 0.93934614565862 78.960 > 73 75 Se 0.43466170119790 0.72299928564480 0.93934614565862 78.960 > 73 76 Se 0.06533829880210 0.22299928564480 0.56065385434138 78.960 > 76 77 Se 0.06533829880210 0.55633261897813 0.56065385434138 78.960 > 76 78 Se 0.06533829880210 0.88966595231147 0.56065385434138 78.960 > 76 79 Se 0.50000000000000 0.24726013103824 0.75000000000000 78.960 > 49 80 Se 0.50000000000000 0.58059346437158 0.75000000000000 78.960 > 49 81 Se 0.50000000000000 0.91392679770491 0.75000000000000 78.960 > 49 82 Se 0.50000000000000 0.08607320229509 0.25000000000000 78.960 > 52 83 Se 0.50000000000000 0.41940653562842 0.25000000000000 78.960 > 52 84 Se 0.50000000000000 0.75273986896176 0.25000000000000 78.960 > 52 85 Se 0.24745451147154 0.10815300307725 0.34090942815561 78.960 > 55 86 Se 0.24745451147154 0.44148633641059 0.34090942815561 78.960 > 55 87 Se 0.24745451147154 0.77481966974392 0.34090942815561 78.960 > 55 88 Se 0.25254548852846 0.27481966974392 0.15909057184439 78.960 > 58 89 Se 0.25254548852846 0.60815300307725 0.15909057184439 78.960 > 58 90 Se 0.25254548852846 0.94148633641059 0.15909057184439 78.960 > 58 91 Se 0.75254548852846 0.22518033025608 0.65909057184439 78.960 > 61 92 Se 0.75254548852846 0.55851366358941 0.65909057184439 78.960 > 61 93 Se 0.75254548852846 0.89184699692275 0.65909057184439 78.960 > 61 94 Se 0.74745451147154 0.05851366358941 0.84090942815561 78.960 > 64 95 Se 0.74745451147154 0.39184699692275 0.84090942815561 78.960 > 64 96 Se 0.74745451147154 0.72518033025608 0.84090942815561 78.960 > 64 97 Se 0.06533829880210 0.11033404768853 0.06065385434137 78.960 > 67 98 Se 0.06533829880210 0.44366738102187 0.06065385434137 78.960 > 67 99 Se 0.06533829880210 0.77700071435520 0.06065385434137 78.960 > 67 100 Se 0.43466170119790 0.27700071435520 0.43934614565863 78.960 > 70 101 Se 0.43466170119790 0.61033404768853 0.43934614565863 78.960 > 70 102 Se 0.43466170119790 0.94366738102187 0.43934614565863 78.960 > 70 103 Se 0.93466170119790 0.22299928564480 0.93934614565862 78.960 > 73 104 Se 0.93466170119790 0.55633261897813 0.93934614565862 78.960 > 73 105 Se 0.93466170119790 0.88966595231147 0.93934614565862 78.960 > 73 106 Se 0.56533829880210 0.05633261897813 0.56065385434138 78.960 > 76 107 Se 0.56533829880210 0.38966595231147 0.56065385434138 78.960 > 76 108 Se 0.56533829880210 0.72299928564480 0.56065385434138 78.960 > 76 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 6.8275083 0.0000000 0.9805175 0.0000000 8.3714125 0.0000000 0.9805184 0.0000000 7.9509172 -------------------------- Born effective charges -------------------------- 1 Li 1.1247049 0.1141950 -0.2178526 0.1894966 1.3218655 -0.2946322 -0.1164941 -0.0119723 1.2404845 2 Li 1.1247049 -0.1141950 -0.2178526 -0.1894966 1.3218655 0.2946322 -0.1164941 0.0119723 1.2404845 3 Li 1.1247049 0.1141950 -0.2178526 0.1894966 1.3218655 -0.2946322 -0.1164941 -0.0119723 1.2404845 4 Li 1.1247049 -0.1141950 -0.2178526 -0.1894966 1.3218655 0.2946322 -0.1164941 0.0119723 1.2404845 5 B 1.2276975 -0.2574853 0.1756418 0.3415734 1.4369992 -0.1626447 -0.0880458 0.1703441 1.5755228 6 B 1.2276975 0.2574853 0.1756418 -0.3415734 1.4369992 0.1626447 -0.0880458 -0.1703441 1.5755228 7 B 1.2276975 -0.2574853 0.1756418 0.3415734 1.4369992 -0.1626447 -0.0880458 0.1703441 1.5755228 8 B 1.2276975 0.2574853 0.1756418 -0.3415734 1.4369992 0.1626447 -0.0880458 -0.1703441 1.5755228 9 Se -1.3066461 0.0000000 0.0163271 0.0000000 -1.0449029 0.0000000 0.1696506 0.0000000 -1.2768008 10 Se -1.3066461 0.0000000 0.0163271 0.0000000 -1.0449029 0.0000000 0.1696506 0.0000000 -1.2768008 11 Se -1.1069020 -0.1100347 -0.0917907 -0.2255971 -1.8827934 0.1562638 -0.1213993 -0.2941059 -1.4880523 12 Se -1.1069020 0.1100347 -0.0917907 0.2255971 -1.8827934 -0.1562638 -0.1213993 0.2941059 -1.4880523 13 Se -1.1069020 -0.1100347 -0.0917907 -0.2255971 -1.8827934 0.1562638 -0.1213993 -0.2941059 -1.4880523 14 Se -1.1069020 0.1100347 -0.0917907 0.2255971 -1.8827934 -0.1562638 -0.1213993 0.2941059 -1.4880523 15 Se -0.5921773 -0.4345407 0.1258380 -0.4606159 -0.3536198 -0.6230824 0.2411139 -0.9748603 -0.6895546 16 Se -0.5921773 0.4345407 0.1258380 0.4606159 -0.3536198 0.6230824 0.2411139 0.9748603 -0.6895546 17 Se -0.5921773 -0.4345407 0.1258380 -0.4606159 -0.3536198 -0.6230824 0.2411139 -0.9748603 -0.6895546 18 Se -0.5921773 0.4345407 0.1258380 0.4606159 -0.3536198 0.6230824 0.2411139 0.9748603 -0.6895546 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (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 ... [ 11 11 4 ] 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: 0.60, Number of G-points: 303, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/138) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 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 1.521 ( 0.000 0.000 0.000) 0.000 2.174 ( 0.000 0.000 0.000) 0.000 2.243 ( 0.000 0.000 0.000) 0.000 2.425 ( 0.000 0.000 0.000) 0.000 2.683 ( 0.000 0.000 0.000) 0.000 2.802 ( 0.000 0.000 0.000) 0.000 2.899 ( 0.000 0.000 0.000) 0.000 3.071 ( 0.000 0.000 0.000) 0.000 3.191 ( 0.000 0.000 0.000) 0.000 3.243 ( 0.000 0.000 0.000) 0.000 3.402 ( 0.000 0.000 0.000) 0.000 3.666 ( 0.000 0.000 0.000) 0.000 4.427 ( 0.000 0.000 0.000) 0.000 4.632 ( 0.000 0.000 0.000) 0.000 4.918 ( 0.000 0.000 0.000) 0.000 5.142 ( 0.000 0.000 0.000) 0.000 5.292 ( 0.000 0.000 0.000) 0.000 5.465 ( 0.000 0.000 0.000) 0.000 5.511 ( 0.000 0.000 0.000) 0.000 5.699 ( 0.000 0.000 0.000) 0.000 5.713 ( 0.000 0.000 0.000) 0.000 5.888 ( 0.000 0.000 0.000) 0.000 6.175 ( 0.000 0.000 0.000) 0.000 6.395 ( 0.000 0.000 0.000) 0.000 6.433 ( 0.000 0.000 0.000) 0.000 6.463 ( 0.000 0.000 0.000) 0.000 6.578 ( 0.000 0.000 0.000) 0.000 7.339 ( 0.000 0.000 0.000) 0.000 7.399 ( 0.000 0.000 0.000) 0.000 7.452 ( 0.000 0.000 0.000) 0.000 7.494 ( 0.000 0.000 0.000) 0.000 8.550 ( 0.000 0.000 0.000) 0.000 8.776 ( 0.000 0.000 0.000) 0.000 8.780 ( 0.000 0.000 0.000) 0.000 9.006 ( 0.000 0.000 0.000) 0.000 10.258 ( 0.000 0.000 0.000) 0.000 10.408 ( 0.000 0.000 0.000) 0.000 10.456 ( 0.000 0.000 0.000) 0.000 10.560 ( 0.000 0.000 0.000) 0.000 15.740 ( 0.000 0.000 0.000) 0.000 15.765 ( 0.000 0.000 0.000) 0.000 16.547 ( 0.000 0.000 0.000) 0.000 16.705 ( 0.000 0.000 0.000) 0.000 17.722 ( 0.000 0.000 0.000) 0.000 17.809 ( 0.000 0.000 0.000) 0.000 17.890 ( 0.000 0.000 0.000) 0.000 18.214 ( 0.000 0.000 0.000) 0.000 18.566 ( 0.000 0.000 0.000) 0.000 18.841 ( 0.000 0.000 0.000) 0.000 18.937 ( 0.000 0.000 0.000) 0.000 19.417 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/138) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.470 ( 4.543 -24.430 -0.735) 24.859 0.527 ( 12.343 -24.451 -4.232) 27.715 0.862 ( 21.220 -33.395 20.003) 44.336 1.641 ( 9.130 -7.569 1.654) 11.974 2.101 ( 0.732 4.241 -7.281) 8.458 2.272 ( -1.923 -2.203 -1.032) 3.101 2.411 ( 1.872 2.073 0.423) 2.825 2.689 ( -0.535 -0.173 -0.380) 0.678 2.798 ( 0.791 9.750 3.463) 10.377 2.917 ( -6.127 -1.585 -3.564) 7.263 3.102 ( 0.296 -2.715 1.400) 3.069 3.157 ( -1.477 2.804 -0.466) 3.203 3.257 ( -2.324 -4.158 -10.703) 11.715 3.413 ( 0.260 -0.532 3.601) 3.649 3.715 ( 2.757 -2.406 3.014) 4.741 4.392 ( -1.087 4.192 -1.170) 4.486 4.621 ( -1.389 0.879 1.997) 2.586 4.886 ( -9.389 4.196 -2.278) 10.533 5.148 ( 5.318 2.749 2.623) 6.536 5.247 ( -2.898 4.379 -3.206) 6.152 5.301 ( 2.584 7.794 1.302) 8.314 5.559 ( -2.974 -0.065 1.340) 3.262 5.680 ( -3.591 1.565 0.955) 4.032 5.915 ( 7.743 -5.186 1.178) 9.393 5.959 ( -0.622 -5.525 1.680) 5.808 6.276 ( 1.484 -0.701 -0.135) 1.647 6.444 ( -0.643 -1.490 -2.183) 2.720 6.467 ( 1.514 -2.594 -0.775) 3.102 6.549 ( 5.018 -0.689 0.773) 5.124 6.591 ( 3.816 -1.330 0.493) 4.071 7.329 ( 0.125 1.205 0.317) 1.252 7.390 ( -1.017 0.422 -1.339) 1.734 7.435 ( -0.682 1.552 1.071) 2.005 7.486 ( -1.482 0.350 -0.063) 1.525 8.571 ( -0.379 -1.628 2.810) 3.269 8.772 ( -0.087 0.906 0.491) 1.034 8.793 ( -0.257 -1.800 0.179) 1.827 9.108 ( -4.401 -1.721 0.206) 4.730 10.281 ( 1.479 -0.391 -1.502) 2.144 10.433 ( 0.889 -2.095 -0.014) 2.275 10.563 ( -0.271 -0.438 -0.094) 0.524 10.864 ( -5.522 -3.409 -12.279) 13.888 15.752 ( 3.895 1.687 0.945) 4.348 15.852 ( 6.548 -1.665 1.327) 6.885 16.668 ( -4.802 0.209 -1.833) 5.144 16.821 ( -3.783 -5.686 -1.671) 7.031 17.692 ( -8.918 -2.159 -0.987) 9.229 17.814 ( -5.286 -2.941 -0.841) 6.107 17.920 ( 7.816 1.755 -2.170) 8.299 18.216 ( 1.876 0.952 1.680) 2.692 18.752 ( -0.136 -4.970 -10.484) 11.603 18.891 ( 3.258 2.623 15.415) 15.972 18.976 ( 1.871 -3.379 -0.286) 3.873 19.374 ( 1.986 5.545 -1.048) 5.983 ======================= Grid point 2 (3/138) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( 2.155 -22.830 -1.161) 22.961 1.016 ( 10.605 -21.346 -4.816) 24.317 1.588 ( 13.712 -23.822 15.740) 31.674 1.814 ( 0.684 -1.104 5.075) 5.239 2.123 ( 13.593 -7.647 -12.203) 19.803 2.272 ( -2.955 -1.208 -1.364) 3.471 2.425 ( 5.934 -0.710 2.828) 6.612 2.566 ( -2.192 9.293 -0.397) 9.556 2.779 ( 3.814 -2.328 3.294) 5.552 2.869 ( -3.996 1.210 -1.956) 4.610 3.087 ( -1.465 2.482 0.278) 2.896 3.163 ( 1.315 -1.958 2.823) 3.679 3.277 ( -2.119 -4.387 -10.760) 11.812 3.451 ( 1.860 -1.695 2.505) 3.551 3.772 ( 1.928 -0.143 3.604) 4.090 4.247 ( -0.813 10.331 -3.035) 10.799 4.574 ( -4.420 3.836 3.284) 6.711 4.676 ( -9.599 7.333 -4.947) 13.053 5.055 ( 2.947 8.755 1.195) 9.315 5.207 ( -0.318 4.485 0.696) 4.550 5.259 ( 2.766 -1.377 -3.168) 4.425 5.494 ( -4.019 1.473 -0.731) 4.342 5.672 ( -2.464 -1.713 6.058) 6.761 6.027 ( -3.330 -3.348 -2.614) 5.397 6.068 ( -0.907 -6.465 0.459) 6.544 6.230 ( -1.889 1.545 0.887) 2.597 6.504 ( 1.822 -1.231 -0.694) 2.306 6.543 ( 5.954 -2.001 0.640) 6.314 6.585 ( 4.680 -1.831 -0.747) 5.080 6.744 ( 10.994 -7.149 -0.255) 13.116 7.308 ( 0.050 1.203 0.532) 1.316 7.356 ( -2.220 1.049 -1.738) 3.008 7.414 ( -1.005 0.381 1.255) 1.652 7.456 ( -1.666 1.362 0.014) 2.152 8.612 ( -0.007 -2.374 1.157) 2.641 8.751 ( -0.427 1.588 0.613) 1.755 8.825 ( -0.787 -2.034 0.461) 2.229 9.095 ( -2.764 -0.207 -0.419) 2.804 10.295 ( -1.747 -1.315 0.253) 2.201 10.482 ( 0.242 -2.614 -0.074) 2.627 10.565 ( -0.533 0.027 -0.064) 0.538 10.824 ( -0.516 1.780 -4.700) 5.053 15.790 ( 3.717 -2.052 0.088) 4.247 15.952 ( 4.355 -4.123 -0.406) 6.010 16.619 ( -4.516 0.516 -0.037) 4.545 16.876 ( -2.335 -3.860 -0.712) 4.567 17.657 ( -10.408 -3.881 -1.533) 11.213 17.822 ( -7.723 -4.889 -0.523) 9.155 17.956 ( 4.920 -0.328 -0.432) 4.950 18.222 ( 2.513 1.222 2.042) 3.460 18.817 ( 3.906 -2.974 -3.832) 6.228 18.920 ( 7.709 4.115 7.946) 11.811 19.068 ( 2.535 -4.675 -0.314) 5.327 19.261 ( 3.551 9.407 -1.866) 10.227 ======================= Grid point 3 (4/138) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( 1.001 -18.158 -1.299) 18.232 1.333 ( -1.912 -8.034 -5.023) 9.666 1.767 ( 2.379 -2.151 -8.206) 8.811 2.027 ( 4.866 -11.070 16.708) 20.625 2.254 ( -2.453 -1.032 -4.073) 4.866 2.349 ( 3.470 -1.868 -2.857) 4.868 2.449 ( 1.957 -0.587 5.768) 6.120 2.605 ( 12.650 -5.685 2.790) 14.146 2.776 ( -1.038 5.001 -3.260) 6.059 2.913 ( 1.976 -7.948 1.544) 8.335 3.103 ( 3.727 -3.668 2.875) 5.967 3.226 ( 3.928 -3.956 0.964) 5.657 3.312 ( -0.968 -4.621 -7.001) 8.444 3.510 ( 3.358 -1.275 1.314) 3.825 3.787 ( 2.699 1.322 4.567) 5.467 4.039 ( 2.643 11.589 -3.776) 12.472 4.394 ( -9.101 8.763 2.317) 12.845 4.510 ( -6.124 3.731 -4.787) 8.622 4.968 ( 5.392 6.886 3.364) 9.370 5.049 ( -2.548 9.386 -4.342) 10.651 5.323 ( -3.609 -6.596 -5.334) 9.219 5.462 ( -0.454 1.379 0.834) 1.674 5.691 ( -3.813 -0.094 6.135) 7.224 5.933 ( -6.543 4.465 -1.432) 8.050 6.154 ( -1.733 -5.005 -4.112) 6.705 6.275 ( 0.774 -3.428 3.822) 5.192 6.530 ( 1.330 -1.229 1.268) 2.211 6.599 ( 6.751 0.645 -0.398) 6.793 6.692 ( 3.928 -4.393 0.730) 5.938 6.976 ( 11.158 -7.760 -1.553) 13.680 7.289 ( -1.674 0.380 -0.027) 1.717 7.324 ( -0.515 0.743 -0.783) 1.196 7.399 ( -2.303 0.078 0.864) 2.462 7.434 ( 0.422 0.078 0.353) 0.556 8.654 ( -0.124 -2.054 1.188) 2.376 8.711 ( -1.044 2.333 -0.118) 2.558 8.848 ( -0.929 -1.189 0.939) 1.777 9.063 ( -2.464 1.069 -1.178) 2.933 10.293 ( -2.547 -0.474 0.595) 2.658 10.509 ( -0.655 0.385 -0.668) 1.012 10.544 ( -1.184 0.858 0.491) 1.542 10.778 ( 0.210 1.674 -1.969) 2.593 15.880 ( 3.881 -4.399 -0.373) 5.878 16.060 ( 3.821 -4.308 -1.045) 5.853 16.570 ( -4.018 1.295 1.512) 4.484 16.906 ( -2.515 -2.207 -0.782) 3.436 17.634 ( -7.856 -2.862 -1.777) 8.548 17.850 ( -8.027 -5.858 0.537) 9.952 18.028 ( 1.632 -5.121 0.123) 5.376 18.236 ( 2.072 -0.322 1.342) 2.490 18.875 ( 5.153 1.739 -0.990) 5.528 18.923 ( 7.790 4.511 4.423) 10.030 19.106 ( 4.842 10.066 -2.876) 11.535 19.169 ( 1.457 -3.637 0.239) 3.925 ======================= Grid point 4 (5/138) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( -12.078 7.688 -1.733) 14.421 1.548 ( 0.296 -12.153 -1.902) 12.305 1.885 ( 7.669 -6.103 -12.286) 15.716 2.220 ( -4.195 -0.445 -2.532) 4.920 2.271 ( 2.569 -6.140 6.613) 9.383 2.364 ( 2.473 -0.454 9.079) 9.421 2.532 ( -2.609 -4.797 5.090) 7.465 2.621 ( 0.532 3.733 -0.961) 3.892 2.756 ( 3.639 2.597 -0.569) 4.507 3.067 ( -2.033 -9.145 0.308) 9.373 3.248 ( 3.018 -6.364 3.065) 7.681 3.344 ( -0.834 -1.504 -0.723) 1.866 3.410 ( 10.152 -5.289 -5.280) 12.606 3.554 ( 6.534 1.427 1.657) 6.890 3.835 ( 5.696 -0.940 5.604) 8.046 3.952 ( 10.761 0.629 -4.302) 11.606 4.192 ( -7.929 6.045 2.224) 10.216 4.379 ( -6.166 3.607 -3.586) 7.993 4.808 ( -0.987 11.359 -0.566) 11.416 4.958 ( 2.874 2.564 -1.752) 4.231 5.325 ( -11.008 0.060 -2.799) 11.358 5.437 ( -1.224 0.351 0.598) 1.406 5.642 ( -0.402 2.817 3.386) 4.423 5.843 ( -4.650 0.308 -1.408) 4.868 6.177 ( 0.575 -0.248 -3.860) 3.910 6.346 ( -2.214 -4.359 1.882) 5.238 6.571 ( 3.980 0.311 2.292) 4.604 6.638 ( 3.257 -0.025 -0.983) 3.402 6.799 ( 2.562 -4.070 2.058) 5.231 7.158 ( 6.977 -3.868 -1.254) 8.075 7.275 ( -2.257 -0.953 -0.735) 2.558 7.309 ( 0.419 0.394 -0.128) 0.589 7.401 ( -0.404 -0.960 1.539) 1.859 7.457 ( 1.245 -1.904 -0.314) 2.296 8.651 ( -1.421 2.822 -0.255) 3.170 8.691 ( -0.180 -1.734 0.650) 1.861 8.858 ( -0.328 -0.415 1.301) 1.404 9.008 ( -2.407 2.247 -1.386) 3.572 10.276 ( -2.115 0.157 0.480) 2.175 10.436 ( -1.196 4.994 -0.470) 5.157 10.543 ( -1.322 -0.768 0.271) 1.553 10.762 ( 0.067 0.124 -0.793) 0.805 15.993 ( 3.369 -4.696 -0.727) 5.825 16.153 ( 3.041 -3.231 -1.084) 4.567 16.514 ( -3.359 1.971 1.997) 4.377 16.909 ( -2.083 -0.920 -0.629) 2.363 17.609 ( -4.460 -0.968 -1.247) 4.731 17.881 ( -5.897 -4.170 1.255) 7.331 18.156 ( -0.791 -8.605 -0.083) 8.642 18.293 ( 0.474 -5.007 0.487) 5.053 18.810 ( 5.251 9.346 0.923) 10.760 18.888 ( 5.444 10.064 0.780) 11.469 19.022 ( 4.261 1.201 -1.303) 4.615 19.235 ( 0.429 -2.659 -0.222) 2.703 ======================= Grid point 5 (6/138) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.995 ( -6.296 4.699 -0.578) 7.877 1.689 ( 0.449 -4.048 -0.593) 4.115 1.981 ( 3.887 -2.328 -5.998) 7.517 2.209 ( -2.589 -2.358 -0.439) 3.529 2.278 ( -0.478 3.395 -1.598) 3.782 2.400 ( 0.529 0.884 5.054) 5.158 2.575 ( -5.435 -6.128 2.607) 8.595 2.670 ( 3.739 6.919 -0.061) 7.865 2.746 ( 3.564 -5.392 2.728) 7.015 3.188 ( -3.000 -6.257 1.182) 7.039 3.314 ( -0.708 1.509 -1.719) 2.394 3.375 ( -4.301 -6.682 4.386) 9.077 3.438 ( 8.657 6.314 -2.570) 11.019 3.581 ( 2.535 2.249 -4.571) 5.690 3.942 ( 7.708 -2.643 5.580) 9.876 4.080 ( -0.965 -3.873 -3.658) 5.414 4.116 ( 3.951 1.060 0.545) 4.127 4.266 ( -4.383 2.539 -0.439) 5.084 4.706 ( 6.368 -0.363 1.345) 6.518 4.878 ( -6.527 6.071 -2.849) 9.358 5.188 ( -5.212 3.012 0.385) 6.032 5.412 ( -2.526 0.151 0.266) 2.544 5.658 ( 2.986 -0.892 0.786) 3.214 5.798 ( -3.256 0.512 -1.021) 3.451 6.171 ( 0.704 0.293 -1.464) 1.651 6.392 ( -1.416 -2.065 0.426) 2.540 6.602 ( 3.366 0.413 1.490) 3.704 6.639 ( -0.660 0.471 -1.261) 1.499 6.875 ( 1.013 -1.802 1.363) 2.476 7.227 ( 3.558 -0.390 0.583) 3.626 7.261 ( -3.097 -0.220 -1.212) 3.333 7.328 ( 1.017 -0.851 -0.228) 1.345 7.417 ( 0.068 -0.472 0.715) 0.860 7.506 ( 1.086 -1.655 -0.170) 1.986 8.598 ( -0.774 1.503 -0.359) 1.728 8.716 ( -0.086 -0.842 0.385) 0.930 8.871 ( 0.515 -0.530 1.095) 1.321 8.947 ( -1.595 1.793 -1.066) 2.626 10.262 ( -0.835 0.050 0.192) 0.858 10.356 ( -0.609 2.471 -0.160) 2.550 10.543 ( -0.557 -0.239 0.057) 0.608 10.761 ( -0.022 -0.069 -0.217) 0.229 16.077 ( 1.499 -2.243 -0.475) 2.739 16.210 ( 1.316 -1.243 -0.504) 1.879 16.466 ( -1.619 1.237 1.026) 2.281 16.904 ( -0.795 -0.244 -0.221) 0.860 17.589 ( -1.452 -0.101 -0.421) 1.516 17.897 ( -2.102 -1.315 0.656) 2.565 18.288 ( -0.847 -6.278 0.097) 6.336 18.399 ( -1.073 -5.692 -0.154) 5.794 18.684 ( 1.948 7.065 -0.357) 7.338 18.757 ( 3.460 7.366 0.710) 8.169 19.049 ( 1.692 -0.355 -0.162) 1.736 19.266 ( -0.045 -0.900 -0.159) 0.915 ======================= Grid point 12 (7/138) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.531 ( 24.521 0.000 17.350) 30.039 0.561 ( 24.961 0.000 17.221) 30.325 0.762 ( 37.625 0.000 15.071) 40.532 1.693 ( 17.229 0.000 2.728) 17.444 2.126 ( -0.478 -0.000 -12.047) 12.056 2.206 ( -3.853 -0.000 -1.066) 3.997 2.455 ( 3.473 0.000 -0.475) 3.506 2.693 ( 0.421 0.000 1.769) 1.818 2.767 ( -2.948 -0.000 -4.735) 5.577 2.952 ( 2.616 0.000 8.916) 9.292 3.036 ( -3.805 -0.000 0.432) 3.829 3.129 ( -3.146 -0.000 -17.623) 17.902 3.162 ( -2.070 -0.000 -2.679) 3.386 3.420 ( -0.722 -0.000 5.954) 5.997 3.746 ( 6.568 0.000 2.873) 7.169 4.401 ( -3.728 -0.000 -1.679) 4.089 4.634 ( -1.650 -0.000 5.087) 5.348 4.850 ( -6.908 -0.000 -0.797) 6.954 5.141 ( -2.368 -0.000 0.500) 2.420 5.251 ( -3.150 -0.000 -4.140) 5.202 5.456 ( -6.110 -0.000 1.111) 6.210 5.495 ( 4.045 0.000 2.738) 4.885 5.684 ( -1.118 -0.000 -1.515) 1.883 5.862 ( -3.496 -0.000 1.205) 3.698 6.239 ( 4.083 0.000 -1.481) 4.343 6.259 ( 6.115 0.000 1.772) 6.367 6.328 ( -1.356 -0.000 -1.013) 1.693 6.465 ( 3.406 0.000 -0.547) 3.450 6.561 ( 7.314 0.000 3.063) 7.930 6.608 ( 3.960 0.000 -1.487) 4.230 7.344 ( 0.276 0.000 0.627) 0.686 7.378 ( -1.780 -0.000 -1.538) 2.352 7.455 ( -1.446 -0.000 0.879) 1.692 7.457 ( -4.013 -0.000 -0.492) 4.043 8.571 ( -3.261 -0.000 9.912) 10.435 8.775 ( -0.197 -0.000 0.332) 0.386 8.780 ( -0.341 -0.000 1.022) 1.078 8.986 ( -2.437 -0.000 0.344) 2.461 10.404 ( -0.638 -0.000 1.492) 1.623 10.489 ( 9.749 0.000 -26.384) 28.128 10.510 ( 4.736 0.000 2.344) 5.285 10.556 ( 0.112 0.000 -1.184) 1.189 15.784 ( 2.927 0.000 -2.087) 3.595 16.052 ( 1.037 0.000 -3.227) 3.389 16.529 ( -2.202 -0.000 0.557) 2.272 16.700 ( -0.554 -0.000 0.008) 0.554 17.580 ( -11.299 -0.000 -3.205) 11.744 17.728 ( -7.681 -0.000 -0.043) 7.682 18.020 ( 7.154 0.000 -8.730) 11.286 18.232 ( -0.485 -0.000 3.963) 3.993 18.653 ( 9.662 0.000 -0.114) 9.662 18.954 ( 4.245 0.000 1.315) 4.444 19.036 ( 5.569 0.000 15.506) 16.476 19.441 ( 3.458 0.000 -2.409) 4.214 ======================= Grid point 13 (8/138) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.722 ( 21.070 -2.971 11.995) 24.426 0.919 ( 21.907 -9.461 5.359) 24.458 1.396 ( 24.634 -22.399 18.456) 38.068 1.878 ( 10.013 0.909 5.285) 11.358 2.086 ( 9.637 -3.542 -14.293) 17.598 2.199 ( -4.126 -2.668 -4.462) 6.637 2.480 ( 5.774 0.395 0.107) 5.789 2.654 ( -2.940 4.958 -3.374) 6.679 2.744 ( -4.513 -2.398 -2.717) 5.788 2.918 ( 2.952 4.026 5.861) 7.699 3.094 ( -2.431 -1.751 -7.639) 8.206 3.103 ( -1.906 -4.082 2.690) 5.247 3.151 ( 1.089 -3.652 -8.794) 9.584 3.443 ( -0.312 -1.081 5.694) 5.804 3.810 ( 5.609 0.392 2.152) 6.020 4.331 ( -4.520 3.075 -3.958) 6.749 4.602 ( -3.022 2.983 4.760) 6.379 4.718 ( -8.672 6.696 -1.655) 11.081 5.128 ( -8.070 0.887 -3.869) 8.993 5.170 ( -3.731 0.437 -0.756) 3.832 5.379 ( 2.741 2.842 1.637) 4.274 5.510 ( -1.154 4.827 2.173) 5.418 5.658 ( -0.906 0.204 3.776) 3.889 5.894 ( -4.257 -5.694 -1.677) 7.304 6.115 ( 10.964 6.878 3.147) 13.320 6.211 ( -6.122 0.827 -2.250) 6.574 6.500 ( 3.552 -1.286 -2.081) 4.312 6.552 ( 9.642 -5.642 1.315) 11.249 6.624 ( 5.534 0.482 -2.151) 5.957 6.715 ( 8.549 -6.429 0.777) 10.725 7.334 ( -0.081 1.341 0.695) 1.512 7.348 ( -2.727 0.940 -1.181) 3.117 7.403 ( -4.038 0.488 0.378) 4.085 7.450 ( -2.002 -0.177 -0.018) 2.010 8.584 ( -0.263 -1.247 2.739) 3.021 8.773 ( -0.611 0.944 1.311) 1.727 8.788 ( -0.449 -1.410 0.541) 1.575 9.021 ( -5.088 -4.178 -0.066) 6.584 10.311 ( 2.824 4.600 -1.735) 5.669 10.461 ( 2.328 -0.850 -0.233) 2.489 10.551 ( -0.894 -0.498 -0.402) 1.099 10.749 ( -0.027 -8.184 -6.626) 10.530 15.810 ( 4.322 -0.231 -2.009) 4.772 15.983 ( 5.420 3.034 0.513) 6.233 16.553 ( -5.876 -2.485 -0.404) 6.393 16.762 ( -2.388 -5.861 -0.800) 6.379 17.494 ( -11.578 -2.802 -2.337) 12.139 17.684 ( -8.348 -2.741 0.145) 8.788 18.012 ( 3.669 2.315 -2.349) 4.933 18.246 ( -0.968 -0.346 3.323) 3.478 18.798 ( 9.093 -3.997 -1.864) 10.106 19.021 ( 6.153 -2.008 -0.569) 6.497 19.119 ( 10.867 3.084 10.810) 15.635 19.418 ( 4.384 5.389 -3.402) 7.736 ======================= Grid point 14 (9/138) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.035 ( 13.667 -11.370 5.279) 18.546 1.235 ( 9.235 -7.465 1.186) 11.934 1.800 ( 8.702 1.663 -8.670) 12.396 1.960 ( 7.451 -9.815 20.745) 24.130 2.189 ( -3.768 -1.893 -5.675) 7.071 2.308 ( 12.548 -7.068 -5.462) 15.403 2.504 ( -2.664 4.592 -3.175) 6.186 2.608 ( 10.460 -5.436 1.303) 11.860 2.768 ( -3.898 -3.850 3.584) 6.547 2.907 ( 3.841 3.293 -0.001) 5.059 3.095 ( 3.110 -2.815 4.110) 5.872 3.182 ( 2.166 -5.273 -13.494) 14.648 3.212 ( 3.118 -2.785 2.849) 5.059 3.497 ( 1.411 -3.105 3.997) 5.254 3.839 ( 3.069 1.145 3.047) 4.474 4.195 ( -2.879 6.594 -5.105) 8.822 4.488 ( -7.907 9.530 0.478) 12.392 4.511 ( -5.335 4.890 -1.583) 7.408 5.022 ( -3.939 1.143 -4.728) 6.259 5.147 ( -8.093 -0.930 0.490) 8.161 5.298 ( 2.490 9.882 0.483) 10.203 5.454 ( -2.314 -1.160 0.757) 2.697 5.675 ( -0.960 -0.125 7.230) 7.295 5.910 ( -7.048 -1.711 -4.603) 8.590 6.105 ( 3.873 2.481 0.557) 4.633 6.223 ( 1.542 -4.055 1.420) 4.565 6.526 ( 1.817 -0.635 -0.539) 1.998 6.674 ( 6.012 -1.357 -1.527) 6.349 6.698 ( 9.662 -0.796 1.550) 9.818 6.931 ( 10.783 -8.112 -1.704) 13.601 7.286 ( -3.664 1.589 0.653) 4.047 7.322 ( -1.119 0.240 -0.248) 1.171 7.373 ( -2.992 -0.261 0.485) 3.042 7.436 ( -0.688 0.021 -0.466) 0.832 8.620 ( 0.074 -2.098 1.028) 2.337 8.743 ( -0.993 2.062 0.942) 2.475 8.813 ( -0.975 -1.797 1.117) 2.330 9.028 ( -4.073 -1.580 -1.266) 4.548 10.277 ( -0.051 1.002 -0.156) 1.015 10.495 ( 1.086 -1.012 0.364) 1.528 10.548 ( -1.305 -0.002 -0.361) 1.354 10.790 ( -0.804 0.103 -2.579) 2.703 15.863 ( 5.116 -1.906 -1.140) 5.577 16.032 ( 4.712 -2.502 -0.673) 5.377 16.535 ( -5.299 -1.041 1.409) 5.581 16.822 ( -3.049 -4.136 -1.151) 5.265 17.468 ( -9.927 -5.495 -2.075) 11.534 17.684 ( -7.735 -5.147 0.649) 9.314 18.004 ( 1.112 0.096 -0.572) 1.254 18.246 ( -1.279 0.111 2.658) 2.952 18.914 ( 8.662 -1.194 -1.169) 8.821 19.103 ( 6.625 -0.013 0.845) 6.679 19.175 ( 10.490 3.860 5.794) 12.590 19.316 ( 4.843 9.186 -3.843) 11.073 ======================= Grid point 15 (10/138) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.252 ( -5.606 5.731 -0.815) 8.058 1.352 ( 8.911 -12.065 3.037) 15.304 1.866 ( 12.989 -2.639 -10.960) 17.199 2.156 ( -4.549 -0.678 -4.074) 6.144 2.219 ( 5.950 -6.979 12.174) 15.242 2.414 ( 4.004 0.763 -0.908) 4.176 2.460 ( -2.262 -2.671 3.619) 5.034 2.736 ( 0.465 5.800 0.920) 5.890 2.784 ( 4.081 -4.075 0.583) 5.796 2.937 ( -0.511 -4.659 3.360) 5.767 3.175 ( -0.365 -0.908 -2.906) 3.067 3.296 ( 7.083 -6.834 -0.392) 9.850 3.372 ( 10.029 -6.575 -0.032) 11.993 3.605 ( 7.720 -4.132 0.927) 8.805 3.864 ( 2.605 -0.701 3.953) 4.786 4.059 ( 1.046 4.935 -4.822) 6.979 4.269 ( -4.340 8.425 0.063) 9.477 4.371 ( -6.441 4.029 -2.789) 8.094 4.944 ( -5.545 5.407 -4.998) 9.217 5.021 ( -4.668 5.732 1.463) 7.536 5.212 ( -4.633 -0.228 -0.490) 4.665 5.449 ( -2.022 0.410 0.671) 2.169 5.664 ( -3.837 1.238 5.818) 7.078 5.850 ( -1.356 1.368 -2.165) 2.898 6.133 ( 2.210 -2.409 -3.861) 5.059 6.276 ( -0.629 -0.603 0.784) 1.171 6.579 ( 2.669 -2.302 1.743) 3.932 6.749 ( 8.055 -0.046 0.012) 8.056 6.773 ( 6.035 -0.471 1.046) 6.143 7.135 ( 8.014 -5.832 -1.720) 10.060 7.242 ( -3.545 0.184 0.883) 3.658 7.301 ( -2.740 -0.265 -0.423) 2.785 7.378 ( 0.205 -1.392 0.942) 1.694 7.439 ( 0.311 -0.897 -0.720) 1.192 8.659 ( -0.217 -2.002 0.840) 2.182 8.692 ( -1.157 2.934 0.399) 3.179 8.838 ( -1.068 -1.537 1.552) 2.431 9.001 ( -3.452 0.399 -2.048) 4.034 10.261 ( -1.259 0.309 0.277) 1.326 10.499 ( -0.940 2.982 0.230) 3.135 10.522 ( -0.834 -0.260 -0.338) 0.937 10.759 ( -1.359 0.676 -0.917) 1.773 15.952 ( 4.744 -3.533 -0.896) 5.983 16.121 ( 3.916 -3.383 -1.505) 5.389 16.506 ( -4.723 0.188 2.605) 5.397 16.852 ( -2.785 -2.807 -1.136) 4.115 17.491 ( -7.205 -5.881 -1.905) 9.494 17.730 ( -6.429 -6.617 1.174) 9.300 18.037 ( -0.443 -4.012 0.101) 4.038 18.247 ( -1.355 -1.173 1.699) 2.469 18.967 ( 6.223 3.198 -0.077) 6.997 19.103 ( 7.244 7.282 2.859) 10.662 19.171 ( 4.884 9.947 -3.054) 11.494 19.228 ( 6.692 0.078 0.483) 6.710 ======================= Grid point 16 (11/138) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( -2.243 7.661 0.701) 8.013 1.610 ( 6.170 -8.778 2.625) 11.046 1.963 ( 7.491 -0.520 -7.862) 10.872 2.123 ( -3.773 -2.005 -3.445) 5.488 2.297 ( -0.715 0.774 -3.396) 3.556 2.482 ( -2.285 -1.820 3.766) 4.766 2.518 ( 6.335 -0.038 8.107) 10.289 2.686 ( 5.131 -2.006 2.439) 6.025 2.845 ( 4.104 4.155 5.940) 8.330 3.027 ( -1.815 -7.138 -0.154) 7.367 3.212 ( -3.356 -6.500 -0.199) 7.318 3.329 ( -2.028 1.597 0.076) 2.583 3.569 ( 10.119 -2.215 -8.097) 13.148 3.671 ( 5.437 5.569 0.454) 7.796 3.942 ( 0.694 -4.482 3.013) 5.445 4.000 ( -4.072 1.641 -3.447) 5.581 4.210 ( 10.804 0.928 0.194) 10.846 4.277 ( -2.744 1.165 1.224) 3.223 4.751 ( -5.377 4.655 -0.684) 7.145 4.884 ( -11.343 5.114 -2.841) 12.763 5.161 ( -5.334 0.782 -0.668) 5.433 5.423 ( -0.251 1.152 2.964) 3.190 5.651 ( -0.996 -1.165 1.410) 2.083 5.830 ( 3.344 1.857 0.493) 3.856 6.178 ( 2.265 -1.434 -4.795) 5.493 6.271 ( -4.943 -2.271 0.996) 5.531 6.621 ( 2.155 0.247 -0.274) 2.186 6.783 ( 10.281 4.910 0.617) 11.410 6.850 ( 1.903 -2.931 1.753) 3.910 7.212 ( -3.843 -0.788 0.313) 3.935 7.242 ( 1.799 -1.223 0.337) 2.202 7.313 ( 0.721 -2.458 -0.977) 2.742 7.404 ( 0.057 -0.587 0.641) 0.871 7.477 ( 1.373 -2.571 -0.711) 3.000 8.630 ( -0.692 2.765 -0.363) 2.873 8.694 ( -0.372 -1.667 1.577) 2.325 8.860 ( -0.449 -1.331 1.419) 1.996 8.947 ( -3.272 1.386 -2.279) 4.221 10.249 ( -1.152 -0.167 0.307) 1.204 10.406 ( -2.177 4.554 0.012) 5.048 10.531 ( 0.181 -0.686 -0.533) 0.887 10.748 ( -1.324 -0.659 -0.043) 1.479 16.046 ( 3.189 -3.175 -0.763) 4.564 16.195 ( 2.747 -2.164 -1.627) 3.857 16.467 ( -3.718 0.801 2.509) 4.556 16.871 ( -1.643 -2.106 -0.730) 2.769 17.526 ( -4.082 -4.256 -1.227) 6.024 17.801 ( -4.470 -6.160 1.308) 7.722 18.139 ( -1.131 -8.115 0.143) 8.195 18.289 ( -1.017 -4.693 0.658) 4.847 18.876 ( 2.679 11.082 0.457) 11.411 18.969 ( 2.025 11.601 0.009) 11.777 19.109 ( 6.192 3.613 -1.028) 7.243 19.280 ( 5.286 0.232 0.401) 5.306 ======================= Grid point 17 (12/138) ======================= q-point: ( 0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( 9.371 0.264 2.092) 9.605 1.760 ( 5.200 -1.185 2.996) 6.117 1.948 ( -4.242 0.453 -2.111) 4.760 2.151 ( -2.395 -3.854 0.107) 4.539 2.285 ( 3.393 -0.915 -2.673) 4.415 2.485 ( 5.272 3.173 -1.673) 6.377 2.574 ( 3.813 -1.184 5.690) 6.951 2.762 ( 5.953 8.970 1.692) 10.898 2.785 ( -1.387 0.320 1.530) 2.089 3.146 ( -1.158 -7.398 -0.919) 7.545 3.284 ( -2.462 -1.273 -2.472) 3.714 3.320 ( -4.351 -5.177 5.319) 8.604 3.526 ( 5.045 9.566 -7.156) 12.968 3.596 ( 1.628 3.096 -0.934) 3.621 3.879 ( -11.193 1.654 -6.829) 13.216 4.041 ( -2.607 -1.774 5.932) 6.718 4.221 ( 4.426 6.031 -1.614) 7.653 4.279 ( 3.224 -0.831 3.328) 4.708 4.652 ( -13.180 4.286 -2.902) 14.160 4.792 ( -0.795 -7.636 2.057) 7.948 5.148 ( 2.396 -3.378 -1.812) 4.521 5.438 ( 2.398 -0.772 2.118) 3.291 5.657 ( -0.591 1.009 0.561) 1.297 5.855 ( 6.691 0.676 2.121) 7.051 6.182 ( 1.220 1.132 -0.913) 1.899 6.285 ( -7.913 -5.077 -1.106) 9.467 6.622 ( 2.843 1.386 -0.646) 3.228 6.765 ( 7.878 6.224 0.017) 10.040 6.890 ( 1.127 0.529 0.172) 1.257 7.183 ( -5.015 -0.778 -0.246) 5.081 7.278 ( 1.499 -1.104 1.298) 2.269 7.341 ( 0.327 0.400 -0.149) 0.538 7.407 ( -0.900 -0.305 -0.481) 1.066 7.512 ( -0.239 -0.346 -0.354) 0.549 8.597 ( 0.636 0.558 0.238) 0.880 8.717 ( -0.325 -0.717 1.389) 1.596 8.870 ( -1.171 0.652 -1.260) 1.840 8.917 ( -0.855 -2.080 -0.106) 2.251 10.255 ( -0.078 -0.996 0.135) 1.008 10.339 ( -1.326 0.925 0.051) 1.618 10.545 ( 1.006 -0.587 -0.768) 1.395 10.752 ( -1.133 -0.750 0.486) 1.443 16.093 ( 0.498 -0.085 -0.103) 0.516 16.221 ( 0.499 0.524 -0.734) 1.031 16.449 ( -0.995 -0.949 0.826) 1.604 16.894 ( -0.183 -1.636 -0.254) 1.666 17.564 ( -1.092 -3.097 -0.393) 3.307 17.870 ( -1.587 -4.396 0.608) 4.713 18.279 ( -0.361 -7.554 -0.076) 7.563 18.392 ( 0.243 -6.607 0.039) 6.612 18.687 ( -1.344 9.540 0.192) 9.636 18.777 ( -1.120 10.521 0.192) 10.582 19.088 ( 2.889 3.302 -0.853) 4.470 19.308 ( 4.237 1.597 0.572) 4.564 ======================= Grid point 18 (13/138) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( 16.386 -6.227 2.265) 17.675 1.738 ( 2.722 7.777 2.246) 8.540 1.931 ( -5.151 -1.964 6.279) 8.355 2.183 ( -2.982 -2.339 -0.785) 3.871 2.340 ( 5.473 1.243 -1.113) 5.722 2.433 ( 5.672 7.198 -3.101) 9.674 2.622 ( -2.359 4.297 -0.863) 4.977 2.654 ( 1.491 6.571 -0.828) 6.789 2.720 ( 5.488 0.513 1.228) 5.647 3.215 ( 0.591 2.812 -2.486) 3.799 3.244 ( -11.616 1.478 -0.787) 11.736 3.358 ( 0.483 -5.128 5.001) 7.179 3.388 ( 0.488 4.346 -6.759) 8.050 3.543 ( -6.059 6.495 2.845) 9.327 3.759 ( -4.968 -1.418 -7.093) 8.775 3.920 ( -13.874 7.003 4.215) 16.103 4.182 ( 5.691 -0.862 -2.514) 6.281 4.366 ( 3.889 -3.749 2.320) 5.879 4.633 ( -1.372 -7.985 0.617) 8.126 4.862 ( -6.804 -4.799 1.374) 8.439 5.310 ( 7.462 -7.496 -1.552) 10.690 5.499 ( 3.847 -2.591 0.556) 4.672 5.615 ( 1.037 3.793 2.735) 4.790 5.911 ( 6.628 0.899 1.622) 6.882 6.175 ( 0.060 -0.226 0.431) 0.491 6.290 ( -8.752 -4.141 -1.525) 9.802 6.620 ( 5.229 3.102 0.167) 6.082 6.701 ( 2.482 5.964 -1.284) 6.586 6.852 ( 0.744 4.225 -1.218) 4.460 7.152 ( -5.070 0.671 1.122) 5.236 7.299 ( -0.474 0.324 -0.581) 0.817 7.311 ( -0.267 1.443 1.430) 2.049 7.400 ( -0.690 -0.123 -1.591) 1.739 7.484 ( -1.400 2.094 0.249) 2.531 8.623 ( 1.514 -1.947 0.546) 2.526 8.716 ( -0.099 1.033 0.553) 1.176 8.849 ( -0.909 -0.514 -1.633) 1.938 8.974 ( 0.949 -3.561 0.610) 3.735 10.279 ( 1.202 -1.090 -0.235) 1.639 10.361 ( -0.122 -3.986 0.407) 4.009 10.561 ( 1.751 -0.095 -0.866) 1.956 10.755 ( -1.016 -0.460 0.819) 1.384 16.052 ( -1.644 4.019 0.504) 4.372 16.186 ( -1.605 2.621 0.280) 3.086 16.488 ( 1.535 -2.822 -0.855) 3.324 16.922 ( 0.998 -1.063 0.132) 1.464 17.616 ( 1.376 -2.822 0.330) 3.157 17.931 ( 2.107 -2.424 -0.546) 3.258 18.310 ( 1.874 6.385 0.043) 6.655 18.427 ( 1.780 6.942 0.137) 7.168 18.612 ( -6.383 -4.197 -0.815) 7.683 18.677 ( -4.432 -7.266 0.616) 8.534 19.038 ( 0.279 3.672 -0.281) 3.693 19.297 ( 2.501 3.197 0.422) 4.081 ======================= Grid point 19 (14/138) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 8.665 1.177 3.144) 9.293 1.605 ( 6.097 9.016 2.893) 11.262 1.910 ( 2.762 7.465 10.667) 13.310 2.115 ( -7.509 5.842 -8.725) 12.909 2.289 ( 2.554 1.835 -2.680) 4.132 2.355 ( 4.396 5.393 -4.207) 8.130 2.497 ( -2.445 5.607 -1.946) 6.419 2.592 ( -4.555 3.992 0.671) 6.094 2.748 ( -0.742 0.901 3.315) 3.515 3.008 ( -9.585 7.466 1.056) 12.195 3.162 ( 1.006 4.593 -4.878) 6.775 3.295 ( -4.971 9.422 1.346) 10.738 3.372 ( 0.945 -0.888 -0.114) 1.302 3.478 ( -2.116 -1.724 -0.370) 2.755 3.733 ( -2.308 0.258 -2.859) 3.683 3.817 ( -7.169 -8.988 2.351) 11.735 4.325 ( 8.851 -7.539 -2.458) 11.883 4.478 ( 1.585 -5.364 3.595) 6.649 4.761 ( -4.670 -7.758 -3.576) 9.736 4.942 ( -0.122 -8.127 4.947) 9.515 5.406 ( -2.115 -0.171 -1.200) 2.438 5.540 ( 8.283 5.576 6.782) 12.070 5.650 ( 2.445 -5.881 -2.659) 6.902 5.942 ( 4.318 0.120 -0.469) 4.345 6.198 ( 0.409 -1.838 -1.502) 2.408 6.269 ( -5.783 -0.983 0.238) 5.871 6.587 ( 3.645 5.738 -0.673) 6.831 6.613 ( 0.716 4.184 -0.428) 4.266 6.759 ( -0.822 6.001 -0.647) 6.092 7.026 ( -8.685 7.290 1.232) 11.405 7.300 ( -0.547 -1.434 -0.018) 1.535 7.305 ( 0.815 0.137 0.743) 1.111 7.398 ( 0.366 -0.828 -1.152) 1.465 7.440 ( -0.712 1.643 -0.081) 1.792 8.671 ( 0.780 -1.170 -0.744) 1.591 8.696 ( 0.388 0.567 0.729) 1.002 8.855 ( 0.106 -0.603 -0.805) 1.011 9.045 ( 1.217 -3.035 0.604) 3.325 10.309 ( 1.785 -0.862 -0.485) 2.040 10.455 ( 0.468 -5.539 0.830) 5.621 10.567 ( 1.764 1.045 -0.937) 2.254 10.757 ( -1.020 -0.622 1.072) 1.605 15.947 ( -2.158 5.814 0.319) 6.210 16.112 ( -2.161 4.102 0.649) 4.681 16.553 ( 2.105 -2.971 -1.089) 3.801 16.944 ( 1.433 0.037 0.339) 1.473 17.686 ( 3.330 -2.542 0.892) 4.283 17.983 ( 6.456 0.673 -1.126) 6.588 18.165 ( 0.187 10.001 0.290) 10.007 18.257 ( -3.589 7.995 0.190) 8.766 18.686 ( -6.215 -8.836 -2.119) 11.009 18.836 ( -1.138 -10.064 0.848) 10.164 18.973 ( -2.321 2.044 0.622) 3.155 19.242 ( 0.658 4.706 0.088) 4.753 ======================= Grid point 20 (15/138) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( -3.800 19.117 -0.557) 19.499 1.504 ( 9.124 22.638 13.864) 28.070 1.805 ( -5.827 10.834 -16.933) 20.930 1.911 ( 9.633 9.018 3.099) 13.555 2.198 ( -16.365 11.607 5.167) 20.718 2.313 ( 1.724 2.309 -3.695) 4.686 2.362 ( -0.654 -3.546 -2.912) 4.635 2.455 ( -3.441 0.920 1.138) 3.739 2.794 ( -0.659 -0.675 1.254) 1.569 2.864 ( -0.946 0.378 -0.850) 1.327 3.105 ( 2.202 3.940 0.632) 4.557 3.166 ( -1.915 1.568 -1.712) 3.009 3.377 ( 1.928 2.309 4.096) 5.082 3.447 ( -2.840 1.185 -2.229) 3.800 3.733 ( -0.977 -2.215 -1.650) 2.929 4.028 ( -0.774 -14.945 1.626) 15.053 4.517 ( 5.925 -5.986 -3.024) 8.949 4.621 ( 2.866 -8.909 5.341) 10.775 4.836 ( -5.564 -8.665 -3.669) 10.931 5.112 ( 2.328 -7.223 2.075) 7.867 5.319 ( -3.863 5.272 0.732) 6.577 5.552 ( 6.249 2.604 6.311) 9.255 5.688 ( -0.588 1.105 -6.359) 6.481 6.033 ( 2.965 -6.011 0.392) 6.714 6.195 ( -2.549 -0.039 -2.996) 3.934 6.234 ( 3.043 4.914 2.029) 6.126 6.516 ( -1.934 2.141 -0.661) 2.960 6.562 ( 3.500 4.208 0.545) 5.500 6.632 ( -3.059 6.178 0.016) 6.894 6.802 ( -8.027 9.115 0.336) 12.150 7.296 ( -0.116 0.015 -0.101) 0.155 7.351 ( 1.111 -2.331 1.219) 2.856 7.410 ( -0.321 0.718 -1.059) 1.319 7.434 ( 0.676 -2.124 -0.184) 2.236 8.650 ( 0.047 2.090 -0.535) 2.158 8.725 ( 0.384 -1.692 0.068) 1.736 8.855 ( 0.370 0.794 -0.289) 0.922 9.097 ( 0.882 -1.624 0.362) 1.883 10.327 ( 1.370 0.327 -0.434) 1.474 10.532 ( 0.970 0.299 1.571) 1.870 10.550 ( 0.161 -0.483 -1.484) 1.568 10.780 ( -0.586 -2.812 1.275) 3.143 15.832 ( -1.604 5.210 -0.039) 5.451 16.015 ( -1.630 5.215 0.457) 5.483 16.616 ( 1.720 -2.560 -0.428) 3.114 16.940 ( 0.997 1.796 0.265) 2.071 17.764 ( 5.131 -1.819 1.061) 5.546 17.977 ( 0.963 8.947 -0.515) 9.013 17.994 ( 3.864 6.009 0.027) 7.144 18.158 ( -5.605 -1.345 -0.294) 5.771 18.762 ( -4.148 -5.652 -1.800) 7.238 18.872 ( 0.093 3.529 0.318) 3.545 19.054 ( -2.407 -11.302 1.023) 11.601 19.152 ( -0.412 5.584 -0.199) 5.602 ======================= Grid point 21 (16/138) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( 0.000 23.094 -0.000) 23.094 1.111 ( 0.000 29.769 -0.000) 29.769 1.307 ( 0.000 32.233 -0.000) 32.233 1.789 ( 0.000 12.778 -0.000) 12.778 2.044 ( -0.000 -1.927 0.000) 1.927 2.303 ( 0.000 0.598 -0.000) 0.598 2.368 ( -0.000 -1.316 0.000) 1.316 2.583 ( -0.000 -11.645 0.000) 11.645 2.732 ( 0.000 3.386 -0.000) 3.386 2.928 ( -0.000 -2.885 0.000) 2.885 3.106 ( -0.000 -2.704 0.000) 2.704 3.131 ( 0.000 1.778 -0.000) 1.778 3.349 ( 0.000 3.328 -0.000) 3.328 3.411 ( 0.000 0.458 -0.000) 0.458 3.741 ( 0.000 1.118 -0.000) 1.118 4.264 ( -0.000 -11.184 0.000) 11.184 4.603 ( -0.000 -2.412 0.000) 2.412 4.832 ( -0.000 -9.081 0.000) 9.081 4.963 ( -0.000 -10.404 0.000) 10.404 5.218 ( 0.000 2.467 -0.000) 2.467 5.220 ( -0.000 -3.747 0.000) 3.747 5.575 ( 0.000 0.397 -0.000) 0.397 5.652 ( -0.000 -0.978 0.000) 0.978 6.060 ( 0.000 4.380 -0.000) 4.380 6.101 ( 0.000 12.474 -0.000) 12.474 6.240 ( -0.000 -5.138 0.000) 5.138 6.467 ( 0.000 2.239 -0.000) 2.239 6.518 ( 0.000 2.626 -0.000) 2.626 6.545 ( 0.000 1.833 -0.000) 1.833 6.621 ( 0.000 6.523 -0.000) 6.523 7.305 ( -0.000 -1.148 0.000) 1.148 7.395 ( 0.000 0.147 -0.000) 0.147 7.402 ( -0.000 -2.207 0.000) 2.207 7.474 ( -0.000 -1.722 0.000) 1.722 8.608 ( 0.000 2.544 -0.000) 2.544 8.752 ( -0.000 -1.336 0.000) 1.336 8.831 ( 0.000 2.095 -0.000) 2.095 9.121 ( -0.000 -0.696 0.000) 0.696 10.314 ( 0.000 1.823 -0.000) 1.823 10.483 ( 0.000 3.637 -0.000) 3.637 10.569 ( -0.000 -0.154 0.000) 0.154 10.850 ( -0.000 -4.557 0.000) 4.557 15.751 ( 0.000 2.981 -0.000) 2.981 15.913 ( 0.000 5.582 -0.000) 5.582 16.664 ( -0.000 -1.998 0.000) 1.998 16.901 ( 0.000 3.158 -0.000) 3.158 17.815 ( 0.000 6.543 -0.000) 6.543 17.844 ( -0.000 -2.611 0.000) 2.611 17.918 ( 0.000 5.393 -0.000) 5.393 18.174 ( -0.000 -2.280 0.000) 2.280 18.808 ( -0.000 -2.488 0.000) 2.488 18.817 ( 0.000 2.409 -0.000) 2.409 19.050 ( 0.000 5.406 -0.000) 5.406 19.232 ( -0.000 -9.629 0.000) 9.629 ======================= Grid point 24 (17/138) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.036 ( 19.449 0.000 8.970) 21.418 1.046 ( 23.106 0.000 14.808) 27.444 1.454 ( 29.488 0.000 20.153) 35.717 2.021 ( 2.357 0.000 12.510) 12.730 2.050 ( 3.253 0.000 -15.263) 15.606 2.135 ( 11.133 0.000 -12.859) 17.009 2.524 ( 5.115 0.000 -3.734) 6.333 2.625 ( -6.765 -0.000 -11.459) 13.307 2.722 ( 0.804 0.000 5.524) 5.582 2.955 ( -4.099 -0.000 -6.142) 7.384 3.033 ( 3.962 0.000 -7.843) 8.787 3.082 ( 2.654 0.000 8.419) 8.827 3.124 ( 3.882 0.000 -1.931) 4.336 3.449 ( -1.096 -0.000 8.015) 8.090 3.884 ( 8.429 0.000 -1.720) 8.603 4.280 ( -8.050 -0.000 -4.613) 9.278 4.637 ( -2.896 -0.000 7.741) 8.265 4.703 ( -8.706 -0.000 -1.203) 8.788 5.034 ( -9.085 -0.000 -0.718) 9.114 5.136 ( -7.564 -0.000 -3.464) 8.319 5.351 ( -5.262 -0.000 -0.978) 5.352 5.599 ( -0.473 -0.000 -1.575) 1.644 5.694 ( 6.872 0.000 6.451) 9.425 5.786 ( -6.138 -0.000 1.372) 6.290 6.145 ( -7.179 -0.000 -3.450) 7.965 6.399 ( 9.018 0.000 -2.682) 9.409 6.476 ( 12.728 0.000 0.040) 12.728 6.536 ( 5.064 0.000 1.541) 5.294 6.678 ( 4.957 0.000 -2.762) 5.674 6.725 ( 9.172 0.000 2.914) 9.624 7.330 ( -2.586 -0.000 -0.423) 2.620 7.343 ( -3.844 -0.000 -0.688) 3.905 7.367 ( -3.053 -0.000 0.813) 3.159 7.428 ( -1.980 -0.000 0.077) 1.981 8.581 ( -0.366 -0.000 2.899) 2.922 8.774 ( -0.208 -0.000 0.645) 0.678 8.781 ( -0.508 -0.000 1.588) 1.668 8.932 ( -3.649 -0.000 -0.220) 3.656 10.406 ( -0.313 -0.000 1.529) 1.560 10.488 ( 3.465 0.000 -9.920) 10.508 10.551 ( 0.741 0.000 -2.472) 2.580 10.625 ( 5.341 0.000 5.039) 7.343 15.840 ( 5.485 0.000 -3.107) 6.304 16.051 ( 0.337 0.000 -0.961) 1.018 16.481 ( -3.866 -0.000 1.008) 3.995 16.688 ( -0.713 -0.000 -0.306) 0.776 17.360 ( -11.428 -0.000 -2.697) 11.742 17.591 ( -8.011 -0.000 0.972) 8.070 18.047 ( 0.686 0.000 -3.582) 3.647 18.235 ( -2.041 -0.000 4.921) 5.328 18.857 ( 12.906 0.000 0.475) 12.915 19.062 ( 8.444 0.000 -2.534) 8.816 19.291 ( 13.078 0.000 11.836) 17.639 19.492 ( 4.768 0.000 -4.538) 6.582 ======================= Grid point 25 (18/138) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( 22.035 4.404 14.119) 26.538 1.236 ( 10.836 -2.928 1.070) 11.275 1.853 ( 11.850 -4.704 4.103) 13.393 1.955 ( 3.717 -2.980 12.143) 13.045 2.096 ( 0.759 -3.289 -10.028) 10.580 2.316 ( 16.101 -3.997 -3.541) 16.963 2.512 ( -4.418 1.805 -9.147) 10.317 2.588 ( 3.644 -3.935 -4.495) 6.998 2.733 ( 1.347 0.301 7.337) 7.466 2.928 ( -2.474 -1.354 -6.228) 6.837 3.087 ( 8.940 -1.995 -3.859) 9.939 3.127 ( 5.266 -2.983 -0.621) 6.084 3.225 ( 8.739 -1.861 4.547) 10.025 3.475 ( -1.187 -1.495 8.599) 8.808 3.916 ( 6.326 2.823 -2.477) 7.356 4.182 ( -8.502 1.044 -6.885) 10.990 4.560 ( -7.743 5.998 1.963) 9.989 4.590 ( -2.964 5.885 1.660) 6.795 4.948 ( -10.222 -0.718 -0.516) 10.260 5.056 ( -8.313 -0.274 -0.849) 8.361 5.337 ( -4.631 -2.509 -2.417) 5.795 5.508 ( -2.960 5.683 -0.318) 6.416 5.738 ( 2.206 1.708 5.959) 6.580 5.787 ( -4.731 -1.328 -0.482) 4.937 6.116 ( -1.839 -3.776 -0.287) 4.210 6.321 ( 10.780 8.535 -0.408) 13.756 6.550 ( 4.424 1.104 -1.460) 4.788 6.702 ( 4.658 -0.285 -2.354) 5.227 6.740 ( 10.546 -5.729 1.089) 12.051 6.870 ( 8.588 -6.846 0.059) 10.983 7.271 ( -6.727 1.010 0.006) 6.803 7.307 ( -2.468 0.298 -0.080) 2.487 7.361 ( -0.374 0.250 1.317) 1.392 7.418 ( -1.519 -0.678 -0.952) 1.917 8.596 ( 0.387 -1.095 0.957) 1.505 8.767 ( -1.010 1.118 1.457) 2.096 8.788 ( -0.170 -0.840 1.092) 1.388 8.937 ( -4.253 -3.452 -1.023) 5.573 10.346 ( 2.120 5.034 -0.809) 5.522 10.498 ( 1.987 -0.786 -1.436) 2.574 10.532 ( -0.607 0.466 -0.442) 0.883 10.748 ( 1.060 -3.863 0.821) 4.089 15.885 ( 6.036 -0.547 -2.524) 6.566 16.045 ( 2.287 -0.009 -0.252) 2.301 16.467 ( -4.919 -1.713 1.383) 5.389 16.721 ( -1.804 -3.903 -0.960) 4.406 17.291 ( -9.976 -3.681 -2.315) 10.883 17.553 ( -7.215 -2.766 1.232) 7.825 18.020 ( -0.776 1.325 -1.767) 2.340 18.238 ( -2.155 -0.277 4.046) 4.592 18.979 ( 11.353 -0.948 0.112) 11.393 19.137 ( 8.059 -0.855 -2.216) 8.402 19.402 ( 13.710 4.644 9.422) 17.271 19.471 ( 4.813 5.171 -5.064) 8.691 ======================= Grid point 26 (19/138) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( -0.160 2.033 -1.200) 2.366 1.388 ( 17.278 -0.872 11.108) 20.559 1.874 ( 2.547 -2.996 -7.517) 8.483 2.111 ( 3.820 0.008 -11.334) 11.960 2.210 ( 6.547 -5.647 16.915) 18.996 2.418 ( -3.233 0.027 -2.680) 4.200 2.440 ( 4.364 -0.793 -4.957) 6.652 2.735 ( 6.014 -6.377 2.490) 9.113 2.765 ( -1.268 -0.495 1.421) 1.968 2.910 ( -0.087 -0.196 -1.457) 1.472 3.199 ( 2.207 0.711 2.384) 3.326 3.259 ( 14.849 -5.429 -3.728) 16.244 3.388 ( 13.622 -4.090 4.353) 14.874 3.562 ( 3.061 -6.315 6.322) 9.445 3.902 ( 2.802 1.735 -0.701) 3.369 4.059 ( -6.870 2.019 -9.292) 11.731 4.382 ( -5.331 7.107 0.902) 8.930 4.435 ( -2.190 8.536 -1.043) 8.874 4.921 ( -5.663 -2.486 -0.660) 6.220 4.959 ( -13.197 1.827 0.745) 13.343 5.272 ( -5.033 4.350 -2.225) 7.015 5.436 ( -0.051 0.334 0.502) 0.605 5.698 ( -3.925 4.777 5.596) 8.339 5.768 ( -4.360 -4.612 -3.655) 7.324 6.182 ( 5.310 1.088 0.373) 5.433 6.304 ( 5.709 2.164 0.087) 6.106 6.574 ( 4.204 -0.955 0.578) 4.349 6.754 ( 4.155 -1.811 -1.119) 4.669 6.862 ( 7.775 -0.039 0.322) 7.782 7.072 ( 5.986 -7.841 -1.774) 10.023 7.215 ( -4.878 -0.372 1.456) 5.105 7.275 ( -2.332 1.006 -0.217) 2.549 7.368 ( 0.902 -0.843 1.023) 1.603 7.419 ( -0.596 -0.961 -1.224) 1.667 8.627 ( 0.181 -1.729 0.340) 1.772 8.731 ( -1.071 2.318 1.105) 2.783 8.808 ( -0.622 -1.331 1.624) 2.190 8.948 ( -3.902 -2.043 -2.032) 4.851 10.290 ( 1.520 3.148 -0.257) 3.505 10.516 ( -1.596 0.418 -0.618) 1.762 10.521 ( 1.315 -0.130 0.418) 1.386 10.760 ( -1.963 1.212 0.214) 2.317 15.947 ( 5.432 -1.666 -1.275) 5.823 16.095 ( 3.466 -2.711 -1.365) 4.607 16.459 ( -5.140 -1.484 2.566) 5.933 16.766 ( -2.364 -3.726 -1.299) 4.600 17.301 ( -7.821 -6.844 -2.057) 10.595 17.572 ( -5.995 -5.507 1.322) 8.247 17.996 ( -1.325 -0.436 -0.425) 1.458 18.230 ( -2.116 0.095 2.755) 3.475 19.066 ( 8.698 1.167 0.033) 8.776 19.198 ( 5.228 0.531 -1.395) 5.437 19.379 ( 5.680 8.349 -4.587) 11.090 19.418 ( 11.678 8.594 6.276) 15.800 ======================= Grid point 27 (20/138) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.189 ( -0.247 5.816 0.726) 5.866 1.584 ( 11.080 -3.022 9.667) 15.012 1.949 ( -2.499 -5.502 -3.765) 7.120 2.105 ( 8.775 1.199 -11.301) 14.358 2.282 ( -2.499 1.432 -6.451) 7.064 2.474 ( -0.180 -1.385 2.769) 3.101 2.487 ( 3.853 -6.481 11.284) 13.571 2.741 ( 0.795 0.612 -6.037) 6.120 2.899 ( 3.345 -6.905 2.315) 8.014 2.936 ( 4.878 0.438 7.373) 8.851 3.188 ( 2.993 2.035 1.413) 3.885 3.357 ( -0.104 3.292 1.998) 3.852 3.565 ( 10.768 -4.056 -3.581) 12.051 3.751 ( 5.945 -3.676 0.980) 7.058 3.925 ( 3.943 0.492 0.017) 3.973 3.956 ( -6.676 -0.747 -5.829) 8.894 4.270 ( -3.552 1.919 1.063) 4.175 4.327 ( 8.092 2.765 0.177) 8.554 4.752 ( -15.129 5.988 -0.210) 16.273 4.851 ( -11.905 3.472 -2.549) 12.660 5.173 ( -0.668 2.998 0.231) 3.080 5.454 ( 2.363 0.363 1.330) 2.736 5.620 ( -4.637 0.182 3.391) 5.748 5.816 ( -2.384 -5.035 -2.554) 6.128 6.181 ( 5.224 2.695 -1.633) 6.101 6.295 ( 2.548 3.235 0.016) 4.118 6.643 ( 4.092 -1.146 0.688) 4.305 6.825 ( 3.098 -2.545 0.531) 4.045 6.903 ( 5.187 0.788 -0.879) 5.320 7.170 ( -4.929 -1.509 2.245) 5.622 7.226 ( 0.845 -1.790 -0.001) 1.979 7.259 ( 1.254 -2.162 -0.899) 2.656 7.406 ( 1.581 -0.774 0.420) 1.809 7.439 ( 0.714 -2.359 -1.296) 2.785 8.653 ( -0.588 -0.695 -0.302) 0.959 8.686 ( -0.175 1.767 1.740) 2.486 8.832 ( -0.803 -1.539 1.674) 2.411 8.924 ( -3.621 0.173 -2.632) 4.480 10.257 ( 0.552 1.732 0.090) 1.820 10.462 ( -2.965 3.739 -0.061) 4.772 10.530 ( 1.424 0.269 -0.072) 1.451 10.722 ( -2.638 -0.048 0.073) 2.640 16.023 ( 3.869 -2.562 -0.671) 4.689 16.172 ( 3.616 -2.875 -2.389) 5.201 16.442 ( -4.929 -0.497 3.207) 5.901 16.805 ( -1.753 -3.329 -1.025) 3.899 17.370 ( -5.447 -7.873 -1.638) 9.713 17.644 ( -4.528 -7.256 1.257) 8.644 18.022 ( -1.245 -4.128 0.283) 4.321 18.228 ( -1.710 -1.464 1.453) 2.679 19.070 ( 5.084 6.319 0.684) 8.139 19.150 ( 0.458 7.902 -1.185) 8.004 19.273 ( 7.114 8.554 -2.188) 11.338 19.389 ( 9.234 5.260 2.389) 10.892 ======================= Grid point 28 (21/138) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.151 ( 9.224 2.573 2.924) 10.012 1.717 ( 0.321 -3.573 6.256) 7.212 1.954 ( -5.099 0.081 -2.249) 5.574 2.158 ( 9.718 2.581 -1.283) 10.136 2.237 ( 1.020 -4.367 -8.066) 9.229 2.507 ( 1.906 -1.261 1.710) 2.854 2.644 ( 1.913 -3.884 6.324) 7.664 2.745 ( 0.758 -1.646 -4.267) 4.636 2.967 ( 4.576 4.125 3.995) 7.343 3.057 ( 6.973 -3.476 3.153) 8.405 3.213 ( 1.374 -1.253 4.881) 5.224 3.274 ( -3.534 1.304 -0.716) 3.834 3.619 ( 4.314 1.377 -9.922) 10.907 3.746 ( 1.776 10.737 -2.019) 11.069 3.800 ( -6.929 1.341 -3.495) 7.876 4.018 ( -0.746 -2.579 5.068) 5.735 4.262 ( 0.565 -2.454 -1.113) 2.753 4.360 ( -1.334 5.754 1.783) 6.170 4.617 ( -13.531 6.017 -4.121) 15.371 4.646 ( -3.525 -5.621 2.500) 7.090 5.145 ( 3.685 0.736 -0.648) 3.813 5.450 ( -0.612 1.275 3.894) 4.143 5.646 ( 0.931 -3.238 -0.637) 3.429 5.885 ( 0.390 -4.420 0.271) 4.446 6.177 ( 1.672 0.903 -2.184) 2.895 6.250 ( 1.139 3.617 0.975) 3.916 6.676 ( 4.739 1.079 -0.684) 4.908 6.857 ( 0.423 1.070 -0.712) 1.353 6.942 ( 4.640 -0.056 -0.350) 4.654 7.136 ( -4.685 0.280 1.919) 5.070 7.255 ( 0.417 -2.037 0.055) 2.080 7.323 ( 0.080 -2.097 1.096) 2.368 7.415 ( 1.285 0.563 -0.743) 1.587 7.488 ( 0.245 -2.027 -0.996) 2.272 8.626 ( 0.312 1.859 -0.137) 1.890 8.700 ( -0.125 -1.340 2.391) 2.744 8.861 ( -0.532 -1.293 0.695) 1.562 8.872 ( -3.254 0.256 -2.606) 4.177 10.243 ( 0.265 0.135 0.191) 0.353 10.362 ( -2.809 3.683 -0.006) 4.631 10.542 ( 1.442 -0.413 -0.694) 1.653 10.719 ( -2.058 -1.507 0.456) 2.591 16.085 ( 1.685 -1.621 -0.301) 2.358 16.228 ( 2.588 -0.867 -2.196) 3.503 16.421 ( -3.439 -0.730 2.487) 4.306 16.847 ( -0.717 -3.056 -0.550) 3.187 17.459 ( -2.850 -6.751 -0.894) 7.382 17.745 ( -2.876 -7.362 0.985) 7.965 18.122 ( -0.907 -8.136 0.306) 8.192 18.276 ( -0.739 -5.307 0.464) 5.379 18.911 ( 0.853 14.363 0.500) 14.397 18.973 ( -0.236 11.291 -0.490) 11.304 19.197 ( 4.665 5.746 -1.281) 7.511 19.397 ( 6.498 3.068 1.007) 7.256 ======================= Grid point 29 (22/138) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.282 ( 16.458 -3.515 1.908) 16.937 1.772 ( -7.656 -5.443 3.356) 9.975 1.866 ( -4.088 3.719 -0.822) 5.587 2.187 ( 5.535 0.580 1.790) 5.846 2.367 ( 7.714 -3.821 -0.173) 8.610 2.546 ( 3.552 0.952 -1.168) 3.859 2.690 ( -3.120 1.298 2.582) 4.253 2.750 ( 5.550 2.172 -3.092) 6.714 2.881 ( 5.357 8.612 2.616) 10.474 3.158 ( 2.149 -2.738 0.231) 3.489 3.187 ( -5.688 1.650 -1.714) 6.166 3.311 ( -0.183 -3.451 2.771) 4.429 3.476 ( -5.192 10.948 -8.331) 14.705 3.617 ( -1.553 2.681 2.764) 4.152 3.723 ( 1.441 3.454 -6.525) 7.522 3.948 ( -12.343 6.667 4.946) 14.875 4.228 ( -2.118 3.289 -0.022) 3.912 4.337 ( 3.291 -3.076 -0.287) 4.514 4.512 ( -3.272 -5.947 -0.171) 6.790 4.714 ( -5.569 -3.092 0.650) 6.402 5.249 ( 8.198 -6.120 -1.422) 10.329 5.445 ( -2.955 -1.810 1.670) 3.847 5.706 ( 4.328 -0.314 1.640) 4.639 5.968 ( 3.370 -2.419 1.431) 4.388 6.154 ( -2.848 0.217 -3.274) 4.345 6.206 ( -0.485 1.921 2.447) 3.148 6.702 ( 6.033 1.161 0.166) 6.146 6.801 ( -0.561 4.543 -1.892) 4.953 6.941 ( 0.943 2.736 -1.898) 3.461 7.123 ( -0.286 -0.448 2.737) 2.788 7.286 ( -1.511 -0.770 -1.623) 2.347 7.326 ( -1.705 0.450 2.291) 2.891 7.405 ( 1.122 1.539 -0.970) 2.137 7.494 ( -1.296 0.262 -0.436) 1.393 8.617 ( 1.213 -0.194 0.318) 1.268 8.726 ( 0.101 -0.384 2.565) 2.595 8.821 ( -2.277 -0.082 -3.049) 3.806 8.914 ( -0.006 -3.606 0.424) 3.631 10.262 ( 0.826 -1.566 0.106) 1.774 10.312 ( -1.724 -0.485 0.017) 1.791 10.564 ( 1.532 -0.785 -0.874) 1.931 10.732 ( -1.409 -1.316 0.700) 2.051 16.095 ( -0.161 1.490 0.120) 1.504 16.220 ( -0.019 2.219 -0.566) 2.290 16.442 ( -0.309 -2.924 0.412) 2.969 16.893 ( 0.131 -2.637 -0.174) 2.646 17.548 ( -0.561 -5.381 -0.234) 5.416 17.851 ( -0.861 -6.487 0.364) 6.554 18.274 ( -0.090 -9.267 -0.123) 9.268 18.404 ( 0.940 -8.808 0.075) 8.859 18.651 ( -2.449 13.517 0.196) 13.739 18.750 ( -1.478 13.409 0.111) 13.490 19.129 ( 2.194 5.313 -0.742) 5.796 19.386 ( 3.602 3.661 0.562) 5.166 ======================= Grid point 30 (23/138) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( 15.871 -4.471 1.954) 16.604 1.735 ( -4.262 3.803 -1.034) 5.805 1.850 ( -7.419 -7.678 2.601) 10.989 2.228 ( 6.526 3.412 4.347) 8.552 2.370 ( -1.196 9.025 -4.590) 10.195 2.516 ( 4.207 2.569 -0.486) 4.953 2.568 ( -1.455 7.068 -1.539) 7.378 2.717 ( 4.587 8.719 -1.072) 9.910 2.846 ( 5.049 6.903 5.902) 10.391 3.021 ( -10.176 5.299 0.313) 11.477 3.183 ( -4.634 1.397 -4.391) 6.535 3.302 ( -1.477 -4.104 -4.611) 6.347 3.434 ( 3.565 -2.804 1.307) 4.720 3.477 ( 0.678 9.598 3.201) 10.141 3.633 ( -9.959 0.521 -3.445) 10.551 3.780 ( -2.030 4.405 1.283) 5.017 4.263 ( 4.015 -5.577 -0.428) 6.886 4.401 ( -0.307 -3.448 0.185) 3.467 4.644 ( 1.241 -3.560 0.174) 3.775 4.757 ( -4.756 -11.633 1.253) 12.630 5.391 ( 2.837 -1.737 -0.759) 3.412 5.498 ( -1.030 -7.947 -0.539) 8.032 5.729 ( 4.945 3.395 3.919) 7.165 6.002 ( 2.701 3.142 -0.186) 4.148 6.122 ( -3.753 -2.914 -3.428) 5.859 6.208 ( -0.988 -1.961 2.521) 3.344 6.681 ( -1.065 5.626 -1.543) 5.930 6.735 ( 5.795 3.434 0.877) 6.793 6.866 ( -0.578 5.231 -1.543) 5.485 7.096 ( -1.641 6.209 1.803) 6.671 7.257 ( -2.163 -1.722 -0.703) 2.852 7.321 ( 0.016 0.567 0.506) 0.761 7.386 ( 0.007 0.323 -0.811) 0.873 7.467 ( -0.579 1.622 0.201) 1.734 8.647 ( 0.753 -1.751 0.120) 1.910 8.720 ( 0.047 1.434 0.731) 1.610 8.826 ( -0.573 -2.083 -0.982) 2.373 8.987 ( 0.292 -4.292 0.175) 4.305 10.295 ( 0.721 -1.465 -0.145) 1.639 10.358 ( -0.329 -5.290 0.255) 5.306 10.584 ( 1.146 -0.306 -0.620) 1.338 10.742 ( -0.799 -0.675 0.564) 1.188 16.033 ( -0.699 4.958 0.197) 5.011 16.165 ( -0.734 3.380 0.102) 3.460 16.504 ( 0.628 -3.623 -0.333) 3.692 16.936 ( 0.450 -1.831 0.042) 1.886 17.636 ( 0.598 -4.758 0.132) 4.797 17.957 ( 0.974 -5.521 -0.242) 5.612 18.355 ( 2.828 9.843 0.362) 10.248 18.453 ( 0.708 5.858 0.225) 5.905 18.495 ( -4.952 1.226 -1.208) 5.243 18.625 ( -2.042 -11.286 0.697) 11.490 19.045 ( 0.406 5.382 -0.168) 5.400 19.334 ( 1.212 4.710 0.179) 4.867 ======================= Grid point 31 (24/138) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 0.000 13.267 -0.000) 13.267 1.755 ( -0.000 -3.234 0.000) 3.234 1.956 ( -0.000 -1.768 0.000) 1.768 2.025 ( 0.000 14.944 -0.000) 14.944 2.279 ( 0.000 2.790 -0.000) 2.790 2.415 ( 0.000 8.443 -0.000) 8.443 2.437 ( 0.000 12.377 -0.000) 12.377 2.543 ( 0.000 10.094 -0.000) 10.094 2.740 ( -0.000 -0.327 0.000) 0.327 2.914 ( 0.000 4.247 -0.000) 4.247 3.154 ( -0.000 -0.362 0.000) 0.362 3.270 ( 0.000 11.509 -0.000) 11.509 3.386 ( -0.000 -3.962 0.000) 3.962 3.451 ( 0.000 2.116 -0.000) 2.116 3.708 ( 0.000 0.225 -0.000) 0.225 3.758 ( -0.000 -13.793 0.000) 13.793 4.441 ( -0.000 -11.078 0.000) 11.078 4.460 ( -0.000 -4.268 0.000) 4.268 4.695 ( -0.000 -4.456 0.000) 4.456 4.967 ( -0.000 -11.362 0.000) 11.362 5.375 ( 0.000 2.901 -0.000) 2.901 5.639 ( -0.000 -5.707 0.000) 5.707 5.685 ( 0.000 5.332 -0.000) 5.332 5.959 ( -0.000 -0.523 0.000) 0.523 6.160 ( -0.000 -2.470 0.000) 2.470 6.256 ( -0.000 -2.520 0.000) 2.520 6.572 ( 0.000 5.277 -0.000) 5.277 6.697 ( 0.000 4.809 -0.000) 4.809 6.738 ( 0.000 8.646 -0.000) 8.646 6.931 ( 0.000 9.703 -0.000) 9.703 7.294 ( -0.000 -1.678 0.000) 1.678 7.315 ( -0.000 -0.668 0.000) 0.668 7.398 ( -0.000 -1.797 0.000) 1.797 7.433 ( 0.000 1.900 -0.000) 1.900 8.674 ( -0.000 -0.024 0.000) 0.024 8.704 ( -0.000 -0.250 0.000) 0.250 8.853 ( -0.000 -1.101 0.000) 1.101 9.058 ( -0.000 -3.353 0.000) 3.353 10.324 ( -0.000 -1.188 0.000) 1.188 10.461 ( -0.000 -5.964 0.000) 5.964 10.582 ( 0.000 1.255 -0.000) 1.255 10.749 ( -0.000 -0.761 0.000) 0.761 15.928 ( 0.000 6.270 -0.000) 6.270 16.094 ( 0.000 4.433 -0.000) 4.433 16.568 ( -0.000 -3.419 0.000) 3.419 16.958 ( -0.000 -0.272 0.000) 0.272 17.720 ( -0.000 -4.372 0.000) 4.372 18.053 ( -0.000 -4.722 0.000) 4.722 18.165 ( 0.000 10.929 -0.000) 10.929 18.210 ( 0.000 13.710 -0.000) 13.710 18.620 ( -0.000 -8.550 0.000) 8.550 18.834 ( -0.000 -12.450 0.000) 12.450 18.954 ( 0.000 5.072 -0.000) 5.072 19.249 ( 0.000 5.538 -0.000) 5.538 ======================= Grid point 36 (25/138) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.289 ( 7.195 0.000 -1.693) 7.392 1.448 ( 12.261 0.000 3.642) 12.790 1.896 ( -6.344 -0.000 0.359) 6.354 2.003 ( 16.083 0.000 28.130) 32.403 2.092 ( 12.697 0.000 -13.486) 18.523 2.421 ( 14.825 0.000 0.852) 14.849 2.449 ( -5.579 -0.000 -8.136) 9.865 2.548 ( 1.090 0.000 -5.180) 5.293 2.788 ( 2.966 0.000 1.813) 3.476 2.849 ( -2.576 -0.000 -7.982) 8.387 3.148 ( 7.090 0.000 3.888) 8.086 3.175 ( 16.563 0.000 -3.552) 16.939 3.324 ( 13.059 0.000 4.476) 13.805 3.475 ( -2.749 -0.000 9.739) 10.119 4.000 ( 8.506 0.000 -8.083) 11.734 4.079 ( -10.820 -0.000 -6.179) 12.461 4.551 ( -8.167 -0.000 -0.678) 8.196 4.626 ( -3.883 -0.000 6.715) 7.757 4.865 ( -9.566 -0.000 1.052) 9.623 4.952 ( -11.752 -0.000 -0.861) 11.784 5.278 ( -2.326 -0.000 -1.978) 3.053 5.489 ( -8.991 -0.000 -2.808) 9.419 5.677 ( -6.953 -0.000 0.179) 6.955 5.860 ( 1.469 0.000 3.865) 4.135 6.070 ( 4.047 0.000 2.109) 4.563 6.481 ( 4.151 0.000 -7.508) 8.580 6.677 ( 8.281 0.000 2.151) 8.556 6.695 ( 12.407 0.000 -1.004) 12.448 6.729 ( 2.967 0.000 0.229) 2.976 6.891 ( 7.702 0.000 1.496) 7.846 7.208 ( -8.013 -0.000 -0.992) 8.074 7.298 ( -1.290 -0.000 0.908) 1.578 7.369 ( -0.034 -0.000 1.381) 1.381 7.391 ( -1.746 -0.000 -1.202) 2.120 8.595 ( 0.711 0.000 0.530) 0.887 8.776 ( -0.119 -0.000 0.775) 0.784 8.783 ( -0.528 -0.000 1.627) 1.711 8.868 ( -3.116 -0.000 -1.013) 3.277 10.409 ( -0.323 -0.000 1.179) 1.223 10.482 ( 0.838 0.000 -3.816) 3.907 10.553 ( 1.385 0.000 -2.830) 3.150 10.737 ( 3.395 0.000 5.566) 6.520 15.929 ( 6.894 0.000 -2.878) 7.471 16.052 ( 0.088 0.000 0.109) 0.140 16.414 ( -4.660 -0.000 1.304) 4.839 16.674 ( -0.493 -0.000 -0.719) 0.872 17.170 ( -8.786 -0.000 -2.229) 9.064 17.474 ( -6.477 -0.000 1.476) 6.643 18.012 ( -2.241 -0.000 -2.276) 3.194 18.234 ( -1.559 -0.000 4.934) 5.174 19.072 ( 11.277 0.000 0.315) 11.281 19.196 ( 8.542 0.000 -2.506) 8.902 19.538 ( 4.170 0.000 -5.622) 7.000 19.596 ( 13.900 0.000 9.107) 16.618 ======================= Grid point 37 (26/138) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( -0.031 1.409 -3.326) 3.613 1.527 ( 5.526 -4.394 -5.173) 8.753 1.842 ( 1.883 4.590 7.546) 9.031 2.154 ( 10.853 0.515 -9.651) 14.533 2.250 ( 8.383 -2.820 18.583) 20.580 2.375 ( -4.266 0.540 -4.801) 6.445 2.473 ( 4.557 1.789 -1.624) 5.158 2.652 ( 2.860 -6.789 0.679) 7.398 2.784 ( 0.872 1.142 -2.723) 3.079 2.877 ( 5.158 -4.619 -2.784) 7.463 3.243 ( 6.720 0.241 6.932) 9.658 3.356 ( 20.792 -1.520 -5.907) 21.668 3.454 ( 10.319 -3.362 6.347) 12.572 3.513 ( 1.401 -3.031 7.203) 7.939 3.930 ( -6.690 3.130 -4.927) 8.879 4.034 ( 3.950 1.430 -10.417) 11.232 4.431 ( -7.482 4.992 0.997) 9.050 4.552 ( -3.600 6.213 0.775) 7.223 4.801 ( -7.688 -2.321 3.097) 8.607 4.887 ( -10.895 -1.390 0.897) 11.020 5.244 ( -3.869 0.950 -1.340) 4.203 5.401 ( -9.012 -1.080 -1.301) 9.169 5.631 ( -5.833 -2.015 -3.388) 7.040 5.807 ( -2.214 4.753 2.224) 5.695 6.198 ( 8.205 -4.130 5.389) 10.650 6.429 ( 4.024 5.039 -5.524) 8.491 6.659 ( 7.809 4.692 0.570) 9.128 6.748 ( 2.309 -1.261 -0.598) 2.698 6.911 ( 7.971 -2.931 1.463) 8.618 6.972 ( 2.034 -5.536 -1.610) 6.114 7.159 ( -3.891 -1.314 0.253) 4.114 7.284 ( -0.768 0.795 0.157) 1.116 7.367 ( 0.020 -0.147 0.703) 0.719 7.391 ( -0.708 -1.172 -0.439) 1.438 8.609 ( 0.734 -0.774 -0.017) 1.067 8.759 ( -0.811 1.516 1.271) 2.138 8.794 ( -0.041 -0.698 1.244) 1.427 8.867 ( -2.904 -2.555 -1.574) 4.176 10.372 ( 1.313 3.672 -0.165) 3.903 10.492 ( -1.017 -1.114 -0.946) 1.780 10.543 ( 1.889 0.925 -1.272) 2.458 10.773 ( 0.042 0.902 3.229) 3.352 15.977 ( 5.669 0.023 -1.647) 5.904 16.074 ( 1.865 -2.128 -0.706) 2.916 16.393 ( -4.948 -1.581 1.916) 5.536 16.691 ( -0.860 -2.457 -0.962) 2.776 17.132 ( -6.945 -4.187 -1.936) 8.337 17.453 ( -5.402 -2.984 1.354) 6.318 17.980 ( -2.318 0.329 -1.331) 2.693 18.232 ( -1.363 0.604 3.929) 4.202 19.158 ( 8.899 0.578 -0.017) 8.918 19.254 ( 6.765 0.528 -2.002) 7.074 19.516 ( 4.178 4.228 -5.006) 7.771 19.679 ( 11.842 6.348 6.982) 15.142 ======================= Grid point 38 (27/138) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.259 ( -0.191 1.889 0.821) 2.069 1.676 ( 3.199 -9.887 -7.639) 12.897 1.806 ( 0.860 4.647 10.437) 11.458 2.176 ( 7.808 2.468 -10.970) 13.689 2.274 ( -1.813 1.563 -2.635) 3.560 2.419 ( 2.286 -3.035 2.313) 4.448 2.505 ( 2.645 -1.473 7.532) 8.117 2.740 ( 0.461 0.002 2.326) 2.371 2.788 ( 1.502 -5.460 -4.329) 7.128 3.030 ( 10.488 -2.621 2.269) 11.046 3.259 ( 2.048 3.145 5.579) 6.724 3.449 ( 6.039 2.921 0.607) 6.736 3.615 ( 6.938 -2.142 -0.641) 7.290 3.698 ( 8.430 -8.157 2.813) 12.062 3.830 ( -4.969 -0.344 -2.899) 5.764 4.017 ( 8.064 2.335 -7.084) 10.984 4.297 ( -4.801 4.341 2.569) 6.964 4.430 ( 1.256 4.103 -0.715) 4.350 4.716 ( -14.388 4.700 1.557) 15.216 4.799 ( -9.682 1.636 -0.876) 9.858 5.196 ( -1.645 0.681 0.686) 1.908 5.406 ( -2.808 -6.517 -1.944) 7.358 5.627 ( -2.554 -1.218 -2.837) 4.007 5.710 ( -4.326 2.637 2.875) 5.825 6.287 ( 5.655 2.596 -0.169) 6.224 6.387 ( 4.354 3.176 0.119) 5.391 6.672 ( 5.688 0.380 0.768) 5.753 6.802 ( 2.347 -3.021 -0.493) 3.858 6.938 ( 0.613 1.191 -0.831) 1.577 7.069 ( -4.257 -4.104 1.383) 6.073 7.195 ( 1.988 -3.069 -0.729) 3.729 7.271 ( 1.316 0.483 -0.446) 1.471 7.396 ( 1.551 -2.106 0.381) 2.643 7.407 ( -0.095 -1.121 -0.138) 1.133 8.630 ( 0.157 -1.126 -0.103) 1.142 8.725 ( -0.391 2.027 1.250) 2.413 8.811 ( -0.264 -0.909 1.398) 1.689 8.875 ( -2.948 -1.531 -2.137) 3.950 10.321 ( 2.017 3.766 -0.166) 4.275 10.477 ( -2.214 1.064 -0.394) 2.488 10.555 ( 2.184 0.051 -0.134) 2.189 10.723 ( -2.913 3.225 1.307) 4.538 16.020 ( 3.125 -1.175 -0.385) 3.360 16.145 ( 4.240 -3.119 -2.475) 5.817 16.387 ( -5.308 -1.697 2.931) 6.296 16.730 ( -0.939 -3.232 -0.875) 3.477 17.179 ( -5.009 -7.578 -1.594) 9.223 17.495 ( -3.917 -5.920 1.091) 7.182 17.966 ( -1.646 -1.316 -0.259) 2.123 18.216 ( -1.364 0.772 2.262) 2.752 19.193 ( 5.821 2.855 -0.118) 6.484 19.257 ( 2.664 3.985 -1.445) 5.006 19.453 ( 5.510 5.954 -3.110) 8.688 19.627 ( 8.397 10.817 4.166) 14.314 ======================= Grid point 39 (28/138) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( 7.285 1.009 4.879) 8.826 1.745 ( -6.700 2.242 5.757) 9.114 1.837 ( 2.407 -5.950 -3.579) 7.349 2.141 ( -1.854 -1.129 -10.144) 10.373 2.272 ( 7.824 -0.078 -2.349) 8.170 2.482 ( 0.297 -2.866 1.295) 3.159 2.591 ( -0.604 -3.671 7.067) 7.986 2.736 ( 4.936 1.631 -1.715) 5.474 2.927 ( 2.393 -6.918 -0.189) 7.322 3.132 ( 1.843 -0.766 4.176) 4.628 3.258 ( 5.314 1.024 -2.368) 5.907 3.371 ( 2.252 7.718 6.985) 10.650 3.665 ( 5.724 1.729 -5.718) 8.273 3.790 ( 1.055 0.894 -1.529) 2.062 3.851 ( -2.711 -3.385 -0.665) 4.388 4.006 ( 3.697 5.341 -1.442) 6.654 4.219 ( -3.213 0.894 0.872) 3.447 4.406 ( -8.000 4.791 1.811) 9.499 4.568 ( -2.010 -2.736 0.727) 3.472 4.624 ( -7.111 5.861 -2.295) 9.497 5.192 ( 1.646 0.360 0.718) 1.832 5.519 ( 3.185 1.626 1.473) 3.867 5.563 ( -2.099 -2.691 -0.152) 3.416 5.728 ( -5.893 -7.884 -1.388) 9.940 6.266 ( 4.553 3.827 -0.659) 5.984 6.346 ( 2.583 5.070 0.360) 5.702 6.725 ( 4.996 -0.436 -0.377) 5.029 6.880 ( 2.885 0.078 0.239) 2.895 6.912 ( -2.091 -2.191 -0.605) 3.088 7.074 ( -6.816 -2.472 1.067) 7.329 7.255 ( 2.583 -1.105 -0.209) 2.818 7.296 ( 1.743 -1.832 0.594) 2.598 7.421 ( 0.452 -0.507 0.236) 0.719 7.452 ( 0.980 -2.191 -1.009) 2.603 8.642 ( -0.423 -0.099 -0.244) 0.498 8.704 ( 0.772 0.736 1.909) 2.186 8.830 ( -0.446 -1.291 0.874) 1.621 8.851 ( -2.842 0.526 -2.302) 3.695 10.278 ( 1.689 2.823 0.040) 3.290 10.408 ( -2.992 4.063 -0.122) 5.047 10.561 ( 2.154 1.206 -0.119) 2.471 10.674 ( -2.950 -0.971 0.408) 3.132 16.067 ( 1.448 -1.918 -0.119) 2.406 16.223 ( 4.482 -2.121 -3.110) 5.853 16.377 ( -4.964 -1.261 3.237) 6.059 16.781 ( -0.545 -3.523 -0.517) 3.602 17.288 ( -2.992 -9.044 -0.980) 9.577 17.591 ( -2.401 -7.670 0.756) 8.072 18.005 ( -0.844 -4.582 0.272) 4.667 18.212 ( -0.944 -1.466 0.856) 1.942 19.142 ( 2.729 7.957 0.179) 8.413 19.144 ( -0.050 9.705 -0.702) 9.731 19.362 ( 4.288 8.926 -1.357) 9.995 19.533 ( 5.523 6.618 1.516) 8.752 ======================= Grid point 40 (29/138) ======================= q-point: ( 0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.371 ( 12.024 -1.416 2.274) 12.319 1.665 ( -8.949 0.271 3.390) 9.574 1.860 ( -2.370 0.810 -2.101) 3.269 2.180 ( 0.412 -5.371 -3.441) 6.392 2.394 ( 10.351 -4.660 0.345) 11.357 2.544 ( 1.194 -3.008 0.910) 3.362 2.617 ( -6.747 -0.752 3.980) 7.869 2.791 ( 8.339 -1.987 -2.331) 8.884 3.002 ( -1.207 3.212 -3.969) 5.247 3.081 ( -6.045 -2.732 -0.233) 6.638 3.279 ( 0.525 2.610 2.584) 3.710 3.353 ( 10.393 4.517 5.851) 12.753 3.628 ( 1.046 6.542 -4.567) 8.046 3.696 ( 1.244 12.207 -0.556) 12.283 3.790 ( 2.525 1.813 -4.202) 5.227 3.952 ( -10.201 2.800 3.632) 11.185 4.225 ( -3.288 -7.176 0.541) 7.912 4.250 ( -5.248 2.314 -0.262) 5.741 4.439 ( -3.186 3.543 -2.882) 5.569 4.695 ( 2.483 -1.157 2.206) 3.517 5.235 ( 5.400 -2.585 -0.862) 6.048 5.426 ( -3.640 3.212 2.499) 5.460 5.684 ( 3.146 -4.985 -0.917) 5.966 5.842 ( -3.384 -9.645 -0.302) 10.226 6.224 ( 2.909 4.902 -0.040) 5.700 6.273 ( 0.363 4.672 0.503) 4.713 6.770 ( 6.087 0.665 -0.496) 6.143 6.848 ( -1.300 1.151 0.421) 1.787 6.925 ( -3.494 1.046 -1.942) 4.132 7.098 ( -1.464 -4.848 1.552) 5.297 7.287 ( 3.569 0.343 -2.159) 4.185 7.321 ( -2.046 0.356 3.133) 3.759 7.438 ( 1.700 0.037 -0.031) 1.700 7.470 ( -1.354 -0.873 -1.120) 1.962 8.632 ( 0.298 0.664 -0.083) 0.732 8.724 ( 0.966 -1.122 2.689) 3.070 8.799 ( -2.449 1.280 -2.882) 3.993 8.863 ( -0.129 -2.357 0.430) 2.399 10.258 ( 1.085 0.640 0.115) 1.264 10.317 ( -2.033 2.894 -0.077) 3.537 10.563 ( 1.053 -0.050 -0.373) 1.119 10.691 ( -1.239 -2.239 0.338) 2.581 16.101 ( 0.346 -0.819 -0.017) 0.889 16.254 ( 1.551 1.116 -1.349) 2.339 16.386 ( -1.781 -2.777 1.333) 3.558 16.838 ( -0.141 -3.473 -0.196) 3.482 17.421 ( -1.029 -8.134 -0.328) 8.206 17.715 ( -1.013 -7.949 0.360) 8.022 18.113 ( -0.325 -8.180 0.165) 8.188 18.270 ( -0.206 -5.917 0.161) 5.923 18.913 ( -0.283 15.927 -0.007) 15.930 18.973 ( 0.183 12.242 -0.009) 12.243 19.247 ( 1.776 6.680 -0.559) 6.935 19.484 ( 2.585 4.273 0.447) 5.014 ======================= Grid point 41 (30/138) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -0.000 -7.384 0.000) 7.384 1.626 ( -0.000 -1.868 0.000) 1.868 1.817 ( 0.000 1.958 -0.000) 1.958 2.251 ( -0.000 -2.390 0.000) 2.390 2.528 ( 0.000 3.224 -0.000) 3.224 2.550 ( 0.000 1.322 -0.000) 1.322 2.592 ( -0.000 -1.916 0.000) 1.916 2.861 ( 0.000 4.946 -0.000) 4.946 2.903 ( -0.000 -3.483 0.000) 3.483 3.142 ( -0.000 -3.189 0.000) 3.189 3.165 ( 0.000 10.834 -0.000) 10.834 3.284 ( 0.000 7.827 -0.000) 7.827 3.509 ( 0.000 4.551 -0.000) 4.551 3.511 ( 0.000 5.108 -0.000) 5.108 3.748 ( 0.000 11.369 -0.000) 11.369 3.818 ( 0.000 0.358 -0.000) 0.358 4.208 ( -0.000 -1.465 0.000) 1.465 4.383 ( 0.000 0.986 -0.000) 0.986 4.461 ( -0.000 -16.250 0.000) 16.250 4.674 ( 0.000 2.839 -0.000) 2.839 5.349 ( -0.000 -6.745 0.000) 6.745 5.392 ( -0.000 -0.711 0.000) 0.711 5.762 ( -0.000 -2.171 0.000) 2.171 5.977 ( -0.000 -7.008 0.000) 7.008 6.139 ( 0.000 6.030 -0.000) 6.030 6.210 ( 0.000 2.160 -0.000) 2.160 6.759 ( 0.000 3.608 -0.000) 3.608 6.827 ( 0.000 3.955 -0.000) 3.955 6.878 ( -0.000 -1.123 0.000) 1.123 7.184 ( -0.000 -4.162 0.000) 4.162 7.228 ( 0.000 6.489 -0.000) 6.489 7.324 ( -0.000 -0.600 0.000) 0.600 7.415 ( 0.000 2.609 -0.000) 2.609 7.478 ( -0.000 -0.278 0.000) 0.278 8.630 ( -0.000 -0.432 0.000) 0.432 8.750 ( 0.000 1.657 -0.000) 1.657 8.775 ( -0.000 -2.708 0.000) 2.708 8.916 ( -0.000 -3.759 0.000) 3.759 10.282 ( -0.000 -2.820 0.000) 2.820 10.284 ( 0.000 0.026 -0.000) 0.026 10.576 ( -0.000 -0.834 0.000) 0.834 10.720 ( -0.000 -1.548 0.000) 1.548 16.093 ( 0.000 2.008 -0.000) 2.008 16.218 ( 0.000 2.932 -0.000) 2.932 16.441 ( -0.000 -3.686 0.000) 3.686 16.894 ( -0.000 -2.993 0.000) 2.993 17.542 ( -0.000 -6.247 0.000) 6.247 17.845 ( -0.000 -7.253 0.000) 7.253 18.273 ( -0.000 -10.132 0.000) 10.132 18.415 ( -0.000 -10.458 0.000) 10.458 18.627 ( 0.000 16.025 -0.000) 16.025 18.737 ( 0.000 14.693 -0.000) 14.693 19.146 ( 0.000 5.906 -0.000) 5.906 19.420 ( 0.000 4.405 -0.000) 4.405 ======================= Grid point 48 (31/138) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( 0.288 0.000 -4.336) 4.346 1.376 ( -8.332 -0.000 -16.592) 18.567 1.996 ( 6.538 0.000 12.779) 14.355 2.226 ( 9.561 0.000 -4.941) 10.762 2.334 ( -3.554 -0.000 -4.076) 5.407 2.365 ( 6.030 0.000 15.827) 16.936 2.533 ( 1.294 0.000 -1.083) 1.688 2.629 ( 6.643 0.000 5.131) 8.394 2.792 ( 4.968 0.000 -10.012) 11.176 2.858 ( 5.516 0.000 3.980) 6.802 3.364 ( 12.614 0.000 3.813) 13.177 3.442 ( -4.644 -0.000 10.603) 11.576 3.512 ( 18.070 0.000 -3.759) 18.457 3.546 ( 7.807 0.000 -3.528) 8.568 3.890 ( -4.447 -0.000 -0.666) 4.497 4.068 ( 6.755 0.000 -12.191) 13.937 4.429 ( -5.209 -0.000 1.365) 5.385 4.563 ( -6.626 -0.000 -1.113) 6.719 4.742 ( -6.889 -0.000 3.484) 7.720 4.767 ( -8.231 -0.000 1.661) 8.397 5.239 ( -3.001 -0.000 3.719) 4.779 5.279 ( -12.570 -0.000 -1.947) 12.720 5.557 ( -5.588 -0.000 -3.465) 6.575 5.814 ( -3.392 -0.000 -1.905) 3.891 6.270 ( 11.073 0.000 7.677) 13.474 6.464 ( 0.153 0.000 -7.854) 7.856 6.727 ( 0.696 0.000 0.142) 0.710 6.869 ( 7.456 0.000 -0.979) 7.520 6.878 ( 8.435 0.000 4.694) 9.653 6.932 ( -3.607 -0.000 -3.580) 5.082 7.138 ( 1.679 0.000 1.799) 2.461 7.277 ( -1.889 -0.000 -1.369) 2.333 7.368 ( 0.068 0.000 -0.251) 0.260 7.373 ( -0.478 -0.000 1.187) 1.280 8.610 ( 0.889 0.000 -0.194) 0.910 8.779 ( -0.067 -0.000 0.625) 0.629 8.784 ( -0.441 -0.000 1.316) 1.388 8.819 ( -1.696 -0.000 -1.232) 2.096 10.410 ( -0.316 -0.000 0.724) 0.790 10.471 ( -0.024 -0.000 -1.447) 1.447 10.561 ( 1.212 0.000 -1.865) 2.224 10.806 ( 1.242 0.000 3.897) 4.090 16.031 ( 6.577 0.000 -2.128) 6.912 16.053 ( -0.147 -0.000 0.416) 0.441 16.343 ( -4.567 -0.000 1.426) 4.785 16.664 ( -0.066 -0.000 -0.675) 0.679 17.036 ( -5.332 -0.000 -1.608) 5.569 17.388 ( -4.522 -0.000 1.108) 4.656 17.956 ( -2.516 -0.000 -1.446) 2.902 18.245 ( -0.557 -0.000 3.922) 3.961 19.233 ( 7.324 0.000 -0.370) 7.333 19.311 ( 6.099 0.000 -1.742) 6.342 19.566 ( 2.871 0.000 -4.497) 5.335 19.855 ( 10.124 0.000 5.969) 11.753 ======================= Grid point 49 (32/138) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( -2.410 -0.862 -2.511) 3.586 1.399 ( -4.930 -9.671 -12.860) 16.829 2.024 ( 5.178 5.995 11.868) 14.269 2.250 ( 1.591 3.715 -6.690) 7.816 2.293 ( 2.346 0.619 -0.250) 2.439 2.428 ( 1.751 -0.694 3.428) 3.912 2.528 ( 0.679 2.026 1.766) 2.772 2.691 ( 1.570 -3.973 3.431) 5.480 2.810 ( 9.309 1.793 -3.120) 9.980 3.032 ( 7.112 -5.860 6.045) 11.021 3.371 ( -0.998 3.671 5.156) 6.407 3.499 ( -0.006 -5.466 -3.724) 6.614 3.531 ( 1.742 2.181 -3.658) 4.601 3.717 ( 13.542 -4.214 -0.156) 14.183 3.869 ( 3.397 2.976 3.214) 5.543 4.081 ( 6.074 -0.098 -7.008) 9.275 4.362 ( 0.252 4.580 2.054) 5.025 4.468 ( -4.643 2.394 -3.309) 6.184 4.683 ( -9.273 2.113 2.263) 9.776 4.729 ( -7.400 -0.370 0.550) 7.430 5.184 ( -7.178 -0.325 1.561) 7.353 5.251 ( -2.718 -4.513 1.982) 5.629 5.528 ( -3.754 -2.949 -4.703) 6.701 5.763 ( -2.435 2.652 -0.336) 3.615 6.367 ( 5.302 1.911 0.888) 5.705 6.450 ( 3.871 -0.558 0.561) 3.951 6.734 ( 1.009 0.422 -0.101) 1.098 6.824 ( 4.957 4.837 0.091) 6.926 6.880 ( -6.268 -2.969 -2.785) 7.474 7.048 ( 4.736 -2.015 3.738) 6.362 7.163 ( 1.688 -0.991 -1.246) 2.320 7.264 ( -0.831 -1.079 -1.704) 2.181 7.376 ( 0.681 -1.123 0.211) 1.330 7.389 ( -0.024 -1.271 1.061) 1.655 8.620 ( 0.566 -0.433 -0.213) 0.744 8.756 ( -0.347 1.613 0.946) 1.902 8.800 ( 0.017 -0.790 0.724) 1.072 8.820 ( -1.478 -1.597 -1.244) 2.506 10.390 ( 0.775 2.196 0.089) 2.330 10.469 ( -0.963 0.016 -0.474) 1.074 10.565 ( 1.326 -0.172 -0.956) 1.644 10.786 ( -0.560 4.167 2.255) 4.771 16.034 ( 1.340 0.656 -0.057) 1.493 16.121 ( 4.638 -3.290 -1.805) 5.966 16.322 ( -4.649 -1.361 1.876) 5.195 16.679 ( -0.079 -1.823 -0.501) 1.892 17.032 ( -3.560 -4.326 -1.202) 5.730 17.386 ( -3.067 -3.315 0.758) 4.579 17.936 ( -1.734 -0.419 -0.740) 1.931 18.238 ( -0.471 1.458 2.518) 2.948 19.273 ( 4.666 1.329 -0.486) 4.876 19.333 ( 3.511 2.134 -1.216) 4.285 19.552 ( 2.769 2.567 -2.773) 4.685 19.876 ( 6.747 7.664 3.758) 10.880 ======================= Grid point 50 (33/138) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.318 ( 4.355 -3.674 6.755) 8.837 1.501 ( -7.557 -11.914 -11.867) 18.436 1.975 ( 4.301 7.637 8.705) 12.353 2.135 ( -2.161 5.115 -6.896) 8.854 2.305 ( 2.360 0.641 0.054) 2.446 2.457 ( 1.864 -0.368 -0.063) 1.901 2.528 ( -2.328 -3.682 1.387) 4.572 2.816 ( 3.379 -6.360 -3.263) 7.907 2.871 ( 9.865 2.228 6.260) 11.894 3.097 ( -7.207 -0.309 3.752) 8.131 3.339 ( 6.494 2.399 -5.903) 9.098 3.477 ( -2.181 1.215 2.353) 3.430 3.608 ( -0.018 -7.155 -0.662) 7.186 3.821 ( 3.685 1.266 0.798) 3.977 3.839 ( 1.838 2.945 -1.744) 3.885 4.142 ( 6.706 1.752 -0.211) 6.934 4.283 ( 1.447 6.268 1.728) 6.661 4.428 ( -2.225 1.830 1.814) 3.404 4.516 ( -8.431 3.974 -2.814) 9.736 4.643 ( -4.261 1.848 -0.373) 4.660 5.172 ( -2.772 -2.391 1.126) 3.830 5.396 ( 3.300 -10.244 -0.077) 10.763 5.554 ( -4.119 -4.997 -2.511) 6.945 5.670 ( -1.383 6.527 1.244) 6.787 6.342 ( 1.669 2.429 -1.303) 3.222 6.463 ( 2.679 4.913 1.685) 5.844 6.743 ( 2.349 -0.712 -0.561) 2.518 6.842 ( 1.966 -3.239 0.695) 3.852 6.892 ( -3.069 -2.770 -1.131) 4.286 7.026 ( -1.664 3.821 1.262) 4.354 7.227 ( 1.382 -3.443 0.010) 3.710 7.280 ( 0.323 -1.410 -1.272) 1.926 7.415 ( 0.098 -1.270 1.697) 2.123 7.418 ( 1.030 -2.127 -1.087) 2.602 8.631 ( 0.045 -0.561 -0.095) 0.570 8.732 ( 0.180 1.276 0.803) 1.518 8.815 ( 0.002 -0.697 0.434) 0.821 8.826 ( -1.371 -0.619 -1.050) 1.834 10.351 ( 1.336 3.313 -0.035) 3.573 10.441 ( -1.419 2.026 -0.157) 2.478 10.590 ( 1.757 -1.303 -0.362) 2.217 10.683 ( -2.127 5.736 0.873) 6.180 16.047 ( 0.525 -1.193 0.005) 1.304 16.212 ( 4.802 -2.955 -2.477) 6.159 16.316 ( -4.745 -1.708 2.502) 5.629 16.719 ( -0.109 -2.953 -0.255) 2.966 17.113 ( -1.760 -7.858 -0.632) 8.077 17.453 ( -1.395 -6.252 0.393) 6.418 17.944 ( -0.686 -1.988 -0.089) 2.105 18.211 ( -0.431 1.377 0.898) 1.699 19.258 ( 1.846 3.941 -0.511) 4.382 19.280 ( 0.933 5.630 -0.287) 5.714 19.511 ( 2.245 4.579 -0.983) 5.194 19.745 ( 3.040 11.999 1.453) 12.463 ======================= Grid point 51 (34/138) ======================= q-point: ( 0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( -0.000 -1.465 0.000) 1.465 1.592 ( -0.000 -5.119 0.000) 5.119 1.896 ( 0.000 4.758 -0.000) 4.758 2.076 ( -0.000 -2.853 0.000) 2.853 2.336 ( -0.000 -3.692 0.000) 3.692 2.495 ( -0.000 -3.096 0.000) 3.096 2.589 ( -0.000 -2.625 0.000) 2.625 2.861 ( 0.000 4.589 -0.000) 4.589 2.946 ( -0.000 -6.678 0.000) 6.678 3.042 ( 0.000 1.442 -0.000) 1.442 3.327 ( 0.000 1.767 -0.000) 1.767 3.461 ( 0.000 1.699 -0.000) 1.699 3.709 ( -0.000 -0.078 0.000) 0.078 3.801 ( 0.000 1.163 -0.000) 1.163 3.843 ( -0.000 -5.772 0.000) 5.772 3.987 ( 0.000 15.641 -0.000) 15.641 4.193 ( 0.000 5.832 -0.000) 5.832 4.315 ( 0.000 6.051 -0.000) 6.051 4.460 ( 0.000 0.682 -0.000) 0.682 4.668 ( -0.000 -3.712 0.000) 3.712 5.209 ( -0.000 -2.594 0.000) 2.594 5.528 ( 0.000 8.534 -0.000) 8.534 5.611 ( -0.000 -5.121 0.000) 5.121 5.623 ( -0.000 -12.356 0.000) 12.356 6.306 ( 0.000 2.939 -0.000) 2.939 6.372 ( 0.000 6.108 -0.000) 6.108 6.785 ( -0.000 -2.559 0.000) 2.559 6.856 ( 0.000 2.739 -0.000) 2.739 6.958 ( 0.000 2.419 -0.000) 2.419 6.974 ( -0.000 -7.102 0.000) 7.102 7.279 ( -0.000 -1.917 0.000) 1.917 7.315 ( -0.000 -1.941 0.000) 1.941 7.431 ( -0.000 -0.566 0.000) 0.566 7.452 ( -0.000 -1.176 0.000) 1.176 8.637 ( -0.000 -0.089 0.000) 0.089 8.723 ( 0.000 0.046 -0.000) 0.046 8.809 ( 0.000 1.285 -0.000) 1.285 8.832 ( -0.000 -1.261 0.000) 1.261 10.300 ( 0.000 3.092 -0.000) 3.092 10.375 ( 0.000 4.363 -0.000) 4.363 10.589 ( 0.000 2.842 -0.000) 2.842 10.641 ( -0.000 -2.695 0.000) 2.695 16.077 ( -0.000 -1.820 0.000) 1.820 16.268 ( -0.000 -0.745 0.000) 0.745 16.330 ( -0.000 -2.499 0.000) 2.499 16.775 ( -0.000 -3.518 0.000) 3.518 17.259 ( -0.000 -9.450 0.000) 9.450 17.573 ( -0.000 -7.818 0.000) 7.818 17.998 ( -0.000 -4.811 0.000) 4.811 18.207 ( -0.000 -1.438 0.000) 1.438 19.140 ( 0.000 9.855 -0.000) 9.855 19.168 ( 0.000 9.040 -0.000) 9.040 19.395 ( 0.000 9.225 -0.000) 9.225 19.586 ( 0.000 6.914 -0.000) 6.914 ======================= Grid point 61 (35/138) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.163 ( -4.570 -0.000 -8.523) 9.671 1.291 ( -0.384 -0.000 -1.778) 1.819 2.130 ( 1.725 0.000 6.067) 6.308 2.273 ( -1.225 -0.000 -2.108) 2.438 2.322 ( 3.437 0.000 -0.661) 3.500 2.420 ( -0.569 -0.000 -0.311) 0.648 2.577 ( 1.085 0.000 1.357) 1.738 2.663 ( -0.951 -0.000 0.504) 1.076 2.952 ( 12.562 0.000 -2.810) 12.873 3.065 ( 9.459 0.000 14.509) 17.321 3.332 ( -9.719 -0.000 4.390) 10.664 3.386 ( -7.381 -0.000 -13.976) 15.805 3.634 ( 8.244 0.000 1.132) 8.322 3.772 ( 9.635 0.000 -1.159) 9.705 3.943 ( 1.571 0.000 5.614) 5.829 4.075 ( 0.949 0.000 -5.476) 5.558 4.427 ( -3.702 -0.000 -4.968) 6.195 4.449 ( 7.690 0.000 0.151) 7.691 4.624 ( -10.474 -0.000 2.565) 10.783 4.699 ( -1.949 -0.000 1.120) 2.248 5.095 ( -5.983 -0.000 -0.555) 6.008 5.222 ( -2.551 -0.000 5.879) 6.408 5.459 ( -1.988 -0.000 -4.497) 4.917 5.762 ( -1.281 -0.000 -1.054) 1.659 6.417 ( -0.688 -0.000 -3.239) 3.312 6.491 ( 8.736 0.000 5.704) 10.434 6.739 ( 0.303 0.000 0.437) 0.532 6.767 ( -7.918 -0.000 -3.910) 8.831 6.974 ( 3.165 0.000 -0.789) 3.262 7.024 ( 4.833 0.000 3.172) 5.781 7.200 ( 2.323 0.000 0.844) 2.471 7.218 ( -2.597 -0.000 -2.469) 3.583 7.368 ( -0.553 -0.000 0.511) 0.753 7.378 ( 0.520 0.000 0.258) 0.581 8.620 ( 0.390 0.000 -0.146) 0.416 8.781 ( -0.030 -0.000 0.241) 0.242 8.784 ( -0.222 -0.000 0.734) 0.767 8.795 ( -0.433 -0.000 -0.761) 0.876 10.409 ( -0.135 -0.000 0.243) 0.278 10.465 ( -0.076 -0.000 -0.386) 0.394 10.568 ( 0.466 0.000 -0.609) 0.767 10.834 ( 0.212 0.000 1.340) 1.357 16.053 ( -0.130 -0.000 0.185) 0.226 16.114 ( 3.654 0.000 -1.095) 3.814 16.283 ( -2.830 -0.000 0.943) 2.982 16.663 ( 0.108 0.000 -0.221) 0.246 16.968 ( -1.800 -0.000 -0.636) 1.909 17.338 ( -1.700 -0.000 0.368) 1.740 17.918 ( -1.053 -0.000 -0.506) 1.168 18.258 ( -0.065 -0.000 1.536) 1.538 19.315 ( 2.456 0.000 -0.413) 2.491 19.375 ( 2.190 0.000 -0.622) 2.277 19.581 ( 1.100 0.000 -1.585) 1.929 20.001 ( 3.672 0.000 2.096) 4.228 ======================= Grid point 62 (36/138) ======================= q-point: ( 0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.219 ( -0.000 -9.664 0.000) 9.664 1.312 ( -0.000 -2.777 0.000) 2.777 2.113 ( 0.000 3.867 -0.000) 3.867 2.214 ( 0.000 5.328 -0.000) 5.328 2.333 ( 0.000 0.675 -0.000) 0.675 2.444 ( -0.000 -3.210 0.000) 3.210 2.524 ( 0.000 5.087 -0.000) 5.087 2.716 ( -0.000 -5.335 0.000) 5.335 2.999 ( 0.000 1.479 -0.000) 1.479 3.071 ( 0.000 4.123 -0.000) 4.123 3.343 ( -0.000 -3.324 0.000) 3.324 3.398 ( -0.000 -6.914 0.000) 6.914 3.603 ( 0.000 4.870 -0.000) 4.870 3.848 ( -0.000 -1.561 0.000) 1.561 3.908 ( 0.000 4.102 -0.000) 4.102 4.129 ( -0.000 -5.087 0.000) 5.087 4.376 ( 0.000 3.104 -0.000) 3.104 4.503 ( 0.000 3.551 -0.000) 3.551 4.519 ( 0.000 1.911 -0.000) 1.911 4.655 ( 0.000 3.247 -0.000) 3.247 5.099 ( -0.000 -3.161 0.000) 3.161 5.272 ( -0.000 -5.859 0.000) 5.859 5.465 ( -0.000 -2.490 0.000) 2.490 5.740 ( 0.000 2.125 -0.000) 2.125 6.385 ( 0.000 2.186 -0.000) 2.186 6.541 ( 0.000 1.429 -0.000) 1.429 6.742 ( -0.000 -0.237 0.000) 0.237 6.767 ( -0.000 -5.071 0.000) 5.071 6.888 ( 0.000 5.037 -0.000) 5.037 7.121 ( 0.000 5.674 -0.000) 5.674 7.152 ( -0.000 -6.002 0.000) 6.002 7.253 ( -0.000 -1.742 0.000) 1.742 7.382 ( -0.000 -1.701 0.000) 1.701 7.396 ( -0.000 -1.445 0.000) 1.445 8.624 ( -0.000 -0.285 0.000) 0.285 8.757 ( 0.000 1.495 -0.000) 1.495 8.803 ( -0.000 -1.042 0.000) 1.042 8.803 ( -0.000 -0.887 0.000) 0.887 10.398 ( 0.000 1.385 -0.000) 1.385 10.458 ( 0.000 0.693 -0.000) 0.693 10.574 ( -0.000 -0.684 0.000) 0.684 10.787 ( 0.000 5.371 -0.000) 5.371 16.041 ( 0.000 0.418 -0.000) 0.418 16.170 ( -0.000 -3.741 0.000) 3.741 16.276 ( -0.000 -0.635 0.000) 0.635 16.678 ( -0.000 -1.680 0.000) 1.680 16.997 ( -0.000 -4.329 0.000) 4.329 17.362 ( -0.000 -3.491 0.000) 3.491 17.918 ( -0.000 -0.704 0.000) 0.704 18.243 ( 0.000 1.808 -0.000) 1.808 19.311 ( 0.000 1.562 -0.000) 1.562 19.359 ( 0.000 2.891 -0.000) 2.891 19.569 ( 0.000 1.729 -0.000) 1.729 19.947 ( 0.000 8.147 -0.000) 8.147 ======================= Grid point 125 (37/138) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.506 ( -11.513 -0.000 22.705) 25.457 0.661 ( 6.721 0.000 29.550) 30.305 1.052 ( 7.884 0.000 47.177) 47.831 1.363 ( 6.820 0.000 -12.591) 14.320 1.884 ( -1.879 -0.000 -20.990) 21.074 2.343 ( -1.753 -0.000 6.025) 6.275 2.436 ( -0.352 -0.000 0.385) 0.522 2.702 ( -1.446 -0.000 -7.954) 8.084 2.762 ( 0.889 0.000 2.672) 2.816 2.880 ( -9.363 -0.000 -25.096) 26.786 3.004 ( 2.182 0.000 6.984) 7.316 3.071 ( 0.950 0.000 -0.407) 1.033 3.159 ( -0.418 -0.000 -0.395) 0.575 3.444 ( 2.279 0.000 -2.135) 3.123 3.787 ( 0.712 0.000 10.997) 11.020 4.350 ( -0.580 -0.000 -9.801) 9.818 4.715 ( 3.920 0.000 7.019) 8.040 4.947 ( -4.657 -0.000 0.606) 4.696 5.176 ( 3.244 0.000 3.135) 4.511 5.292 ( -6.518 -0.000 -0.342) 6.527 5.439 ( 2.645 0.000 -1.611) 3.097 5.482 ( 2.155 0.000 -2.773) 3.511 5.709 ( -3.433 -0.000 0.757) 3.516 5.771 ( 15.367 0.000 -2.379) 15.550 5.976 ( 1.532 0.000 6.314) 6.497 6.208 ( -1.477 -0.000 2.507) 2.910 6.314 ( -0.924 -0.000 -5.688) 5.763 6.404 ( -0.519 -0.000 -2.807) 2.855 6.499 ( 4.126 0.000 2.404) 4.775 6.576 ( -1.725 -0.000 -0.410) 1.773 7.347 ( 0.464 0.000 0.597) 0.756 7.380 ( -1.008 -0.000 -1.239) 1.598 7.466 ( 0.900 0.000 0.835) 1.228 7.490 ( -0.449 -0.000 -0.329) 0.556 8.779 ( -1.332 -0.000 0.247) 1.355 8.782 ( 1.203 0.000 0.138) 1.211 9.028 ( 0.098 0.000 1.889) 1.891 9.120 ( -3.696 -0.000 -1.499) 3.989 10.411 ( 3.851 0.000 0.160) 3.855 10.416 ( -27.200 -0.000 -0.066) 27.200 10.469 ( 0.764 0.000 1.241) 1.458 10.543 ( -0.151 -0.000 -1.432) 1.440 15.767 ( -2.811 -0.000 0.190) 2.818 15.781 ( 9.756 0.000 -0.324) 9.761 16.571 ( -0.172 -0.000 2.143) 2.150 16.683 ( 0.194 0.000 -1.984) 1.994 17.735 ( 0.747 0.000 1.157) 1.377 17.796 ( -0.539 -0.000 -1.090) 1.216 17.970 ( -9.549 -0.000 3.276) 10.095 18.161 ( 6.952 0.000 -4.193) 8.118 18.635 ( -1.985 -0.000 5.583) 5.926 18.889 ( 0.472 0.000 -4.219) 4.245 19.308 ( -3.718 -0.000 1.499) 4.008 19.396 ( -1.868 -0.000 -1.768) 2.572 ======================= Grid point 126 (38/138) ======================= q-point: ( 0.09 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.705 ( 4.634 -13.721 16.398) 21.877 0.807 ( 9.728 -3.003 25.314) 27.285 1.468 ( 15.071 -14.075 5.995) 21.475 1.533 ( 9.174 -11.206 5.567) 15.515 1.791 ( 4.178 -1.344 -10.103) 11.015 2.327 ( -3.888 1.461 5.543) 6.926 2.435 ( 1.155 0.007 1.147) 1.627 2.591 ( -5.345 3.231 -14.615) 15.894 2.813 ( -2.929 -4.618 -6.471) 8.472 2.845 ( -0.160 -4.916 -5.287) 7.221 3.017 ( 0.344 0.900 0.634) 1.153 3.079 ( -0.700 -1.201 -1.363) 1.946 3.176 ( 0.088 -1.881 3.755) 4.201 3.446 ( 2.373 0.868 -3.666) 4.452 3.843 ( 0.556 -1.031 9.453) 9.525 4.268 ( -1.432 4.324 -9.994) 10.983 4.704 ( 1.689 5.822 6.403) 8.817 4.847 ( -8.709 6.090 -3.207) 11.100 5.175 ( -6.746 5.059 -2.758) 8.872 5.229 ( 4.773 -0.076 4.553) 6.596 5.332 ( 1.927 6.804 1.634) 7.258 5.524 ( -0.372 2.031 -4.439) 4.896 5.726 ( -1.612 -4.584 2.715) 5.566 5.885 ( 4.623 -3.392 -2.487) 6.250 6.041 ( 1.593 -3.268 4.872) 6.079 6.235 ( -2.256 -0.614 -4.188) 4.796 6.365 ( 4.862 -6.962 -1.136) 8.567 6.435 ( 3.279 -3.326 -2.474) 5.285 6.549 ( 1.279 0.562 -0.019) 1.397 6.583 ( 4.987 -1.929 0.020) 5.347 7.344 ( 0.450 1.056 0.853) 1.430 7.360 ( -1.310 0.742 -1.150) 1.894 7.459 ( -0.822 0.810 1.032) 1.548 7.480 ( -1.714 0.188 -0.518) 1.801 8.747 ( -4.227 2.876 2.463) 5.675 8.785 ( 0.713 0.925 0.596) 1.311 8.865 ( -3.479 4.865 7.802) 9.831 9.084 ( -2.232 0.604 -2.396) 3.329 10.317 ( -5.319 -2.732 3.695) 7.029 10.448 ( 1.158 -1.313 1.273) 2.165 10.549 ( -0.305 -1.116 -1.009) 1.535 10.633 ( 1.884 -8.869 -5.691) 10.705 15.757 ( -0.169 -0.713 -0.031) 0.733 15.850 ( 7.115 -0.256 -1.117) 7.207 16.626 ( -2.688 -3.491 0.227) 4.412 16.738 ( 0.074 -6.138 -3.635) 7.134 17.716 ( -9.898 -1.737 2.186) 10.284 17.791 ( -5.174 -2.693 -1.449) 6.010 17.935 ( 1.781 0.620 2.608) 3.218 18.199 ( 7.364 1.592 -3.107) 8.149 18.701 ( 1.631 -4.548 3.871) 6.191 18.924 ( 2.518 -3.803 -4.204) 6.203 19.191 ( 1.614 8.715 8.866) 12.537 19.333 ( 0.153 5.617 -2.652) 6.213 ======================= Grid point 127 (39/138) ======================= q-point: ( 0.18 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.028 ( 2.585 -14.648 13.166) 19.864 1.116 ( 11.314 -12.330 11.460) 20.282 1.553 ( -1.260 0.991 -17.268) 17.343 1.833 ( 18.205 -13.473 -13.600) 26.418 2.148 ( 9.792 -14.360 21.998) 28.036 2.277 ( -3.519 0.895 4.376) 5.687 2.448 ( 1.551 3.036 -5.024) 6.072 2.515 ( 0.999 -5.622 -1.240) 5.843 2.833 ( -2.257 0.074 -7.424) 7.760 2.905 ( -0.866 -4.901 2.708) 5.666 3.026 ( -0.523 -3.814 -1.430) 4.106 3.113 ( 0.778 -2.098 2.610) 3.438 3.226 ( 1.070 -1.256 2.703) 3.167 3.455 ( 3.905 -0.897 -3.886) 5.582 3.869 ( 0.533 1.483 5.718) 5.931 4.113 ( -0.799 8.765 -8.682) 12.363 4.571 ( -7.910 8.257 -3.054) 11.835 4.652 ( -3.077 7.155 3.236) 8.434 5.016 ( -5.209 5.500 -3.764) 8.459 5.232 ( 4.885 10.028 0.961) 11.196 5.257 ( -0.731 -0.008 3.112) 3.196 5.460 ( 0.930 1.499 -2.882) 3.379 5.809 ( -2.970 -4.070 5.539) 7.487 5.928 ( -4.609 -2.585 -4.868) 7.185 6.115 ( -1.071 -0.310 2.416) 2.661 6.233 ( -0.967 -4.651 -0.687) 4.799 6.494 ( 3.652 -4.019 -0.307) 5.439 6.538 ( 2.555 -0.217 -0.827) 2.695 6.593 ( 7.143 -4.954 1.511) 8.823 6.700 ( 9.889 -5.854 -2.782) 11.824 7.326 ( -1.275 1.477 -0.542) 2.025 7.331 ( 0.452 1.033 0.980) 1.494 7.439 ( -2.879 0.266 0.381) 2.916 7.453 ( -1.294 0.641 0.171) 1.454 8.688 ( -2.638 0.508 3.417) 4.347 8.764 ( 0.081 2.177 0.608) 2.262 8.859 ( -0.988 -1.397 3.357) 3.768 9.039 ( -1.770 0.911 -4.544) 4.961 10.331 ( -4.536 -1.968 2.356) 5.477 10.486 ( 0.935 -1.380 0.454) 1.728 10.561 ( -1.232 -0.912 -0.270) 1.557 10.727 ( 3.489 -1.279 -2.668) 4.574 15.796 ( 1.647 -2.940 0.477) 3.403 15.925 ( 5.325 -2.708 -1.667) 6.202 16.651 ( -3.687 -2.089 3.112) 5.258 16.814 ( -1.274 -4.385 -4.305) 6.276 17.665 ( -12.504 -3.244 1.940) 13.063 17.804 ( -6.561 -5.225 -1.036) 8.451 17.971 ( 3.463 -1.044 1.664) 3.981 18.213 ( 6.254 2.329 -2.789) 7.233 18.810 ( 3.071 -4.090 3.079) 5.970 19.015 ( 3.116 -4.300 -3.845) 6.556 19.112 ( 7.179 8.548 7.591) 13.499 19.205 ( 2.106 8.320 -3.166) 9.148 ======================= Grid point 128 (40/138) ======================= q-point: ( 0.27 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( -0.338 -14.026 6.793) 15.588 1.370 ( -0.735 -3.462 7.246) 8.065 1.512 ( 4.658 -4.364 -11.406) 13.070 2.058 ( 6.026 -6.114 -11.441) 14.303 2.278 ( -2.211 -0.129 -2.072) 3.033 2.407 ( 3.545 -8.128 9.619) 13.082 2.492 ( 4.630 -5.561 5.280) 8.957 2.666 ( 2.661 0.963 -4.579) 5.383 2.786 ( 3.905 -3.528 4.010) 6.616 3.003 ( 0.021 -3.718 2.268) 4.356 3.121 ( -3.677 -7.282 -1.109) 8.233 3.192 ( 7.038 -3.548 3.502) 8.625 3.267 ( 4.063 -1.733 1.144) 4.563 3.510 ( 4.465 -1.727 -2.571) 5.434 3.851 ( 2.249 2.768 0.723) 3.639 3.926 ( 2.957 9.479 -5.147) 11.184 4.354 ( -8.826 5.808 -3.680) 11.188 4.521 ( -6.706 5.099 4.467) 9.535 4.879 ( -0.356 5.693 -6.686) 8.789 5.080 ( 2.331 10.304 3.686) 11.188 5.277 ( -1.781 -2.437 0.650) 3.087 5.460 ( 1.226 0.174 -0.882) 1.520 5.825 ( -4.275 0.508 5.234) 6.777 5.873 ( -5.394 1.763 -3.936) 6.906 6.084 ( -3.014 0.032 -1.533) 3.382 6.312 ( -2.390 -4.809 -0.233) 5.375 6.573 ( 1.677 -1.988 -0.573) 2.663 6.588 ( 7.401 0.265 2.018) 7.676 6.714 ( 4.030 -4.749 0.671) 6.265 6.932 ( 11.669 -8.742 -1.669) 14.676 7.292 ( -1.267 0.950 0.236) 1.601 7.320 ( 0.148 1.033 0.414) 1.123 7.411 ( -2.080 -0.496 0.120) 2.141 7.443 ( -1.056 -0.133 0.406) 1.139 8.683 ( -1.190 0.068 0.531) 1.305 8.721 ( -0.487 2.030 1.183) 2.399 8.886 ( -0.983 -1.279 2.923) 3.339 8.998 ( -2.004 0.442 -4.577) 5.016 10.319 ( -3.887 -0.302 1.257) 4.096 10.498 ( 0.791 1.676 -0.134) 1.859 10.550 ( -2.481 -0.050 -0.066) 2.482 10.745 ( 1.862 0.502 -0.474) 1.985 15.883 ( 2.584 -4.466 0.655) 5.201 16.020 ( 4.610 -3.830 -1.971) 6.309 16.650 ( -4.236 -0.076 5.333) 6.811 16.844 ( -1.687 -2.346 -4.643) 5.469 17.632 ( -9.636 -3.141 1.509) 10.247 17.846 ( -6.708 -6.124 -0.731) 9.112 18.045 ( 1.135 -4.859 1.285) 5.152 18.220 ( 4.562 0.625 -2.620) 5.298 18.895 ( 3.473 0.180 2.482) 4.273 19.029 ( 4.096 6.344 -3.544) 8.342 19.033 ( 6.972 8.833 4.441) 12.098 19.149 ( 2.925 -1.787 -1.722) 3.836 ======================= Grid point 129 (41/138) ======================= q-point: ( 0.36 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( -11.238 8.013 1.831) 13.923 1.610 ( 1.570 -10.411 7.590) 12.979 1.687 ( 8.535 -8.463 -5.003) 13.019 2.167 ( -1.636 -5.348 -2.436) 6.100 2.257 ( -2.298 -3.172 -4.816) 6.208 2.520 ( 0.108 3.358 0.048) 3.360 2.613 ( -1.820 -3.559 5.421) 6.736 2.662 ( 6.116 -5.209 4.929) 9.425 2.851 ( 4.003 6.985 2.965) 8.579 3.087 ( -3.142 -7.969 3.012) 9.080 3.200 ( -1.119 -5.628 -3.940) 6.960 3.299 ( 4.466 1.306 -2.933) 5.501 3.338 ( 4.593 -2.030 -2.724) 5.714 3.581 ( 5.212 0.011 0.160) 5.215 3.795 ( 8.528 2.591 -7.328) 11.539 3.928 ( 8.139 -3.584 1.241) 8.980 4.204 ( -7.030 3.047 -0.279) 7.667 4.417 ( -6.092 1.620 5.753) 8.534 4.764 ( 1.530 6.101 -2.436) 6.746 4.952 ( -0.015 7.184 1.007) 7.254 5.276 ( -6.782 -0.400 -1.145) 6.890 5.456 ( -0.569 0.275 1.101) 1.269 5.766 ( -3.515 4.331 6.965) 8.923 5.791 ( -1.451 1.266 -3.274) 3.798 6.077 ( 0.128 -1.811 -4.362) 4.725 6.365 ( -4.170 -4.660 0.004) 6.253 6.606 ( -0.521 -1.254 -1.464) 1.997 6.623 ( 7.594 2.899 1.645) 8.293 6.826 ( 2.430 -3.743 -0.248) 4.470 7.146 ( 8.469 -5.422 0.447) 10.066 7.271 ( -1.917 0.178 0.472) 1.982 7.303 ( -0.223 0.325 -0.356) 0.531 7.430 ( -0.858 -0.895 0.927) 1.548 7.444 ( 0.836 -1.807 -0.842) 2.162 8.641 ( -1.301 2.427 -0.332) 2.774 8.720 ( 0.316 -0.416 1.269) 1.372 8.901 ( -0.949 -0.387 2.611) 2.805 8.956 ( -2.465 0.725 -3.218) 4.118 10.289 ( -2.604 0.602 0.465) 2.713 10.431 ( -0.489 5.069 0.157) 5.095 10.538 ( -2.133 -0.768 -0.614) 2.349 10.753 ( 0.817 -0.154 0.142) 0.844 15.987 ( 2.598 -4.464 0.377) 5.179 16.116 ( 3.511 -3.539 -1.677) 5.260 16.615 ( -4.472 1.772 6.428) 8.028 16.846 ( -0.826 -1.162 -5.032) 5.230 17.614 ( -5.868 -1.798 1.628) 6.349 17.879 ( -4.531 -3.225 -1.483) 5.756 18.167 ( -0.664 -8.405 1.130) 8.507 18.272 ( 1.428 -4.694 -2.207) 5.380 18.816 ( 4.516 10.904 -0.757) 11.827 18.901 ( 5.600 10.718 0.625) 12.109 19.049 ( 2.355 -1.361 3.512) 4.442 19.205 ( 1.933 -2.214 -2.360) 3.769 ======================= Grid point 130 (42/138) ======================= q-point: ( 0.45 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.018 ( -4.459 5.134 2.248) 7.162 1.761 ( 1.292 -2.909 6.008) 6.799 1.898 ( 6.315 -8.833 -0.765) 10.885 2.230 ( -5.129 -7.161 2.805) 9.244 2.268 ( -1.612 0.301 -0.002) 1.640 2.487 ( -1.048 0.857 1.129) 1.763 2.632 ( -2.275 -0.700 3.467) 4.206 2.677 ( 2.309 10.669 0.100) 10.916 2.813 ( 3.213 1.633 2.041) 4.142 3.141 ( -0.362 -0.489 -3.730) 3.779 3.221 ( 2.189 5.599 -10.072) 11.730 3.300 ( -0.004 -6.643 -3.105) 7.333 3.404 ( -0.509 -4.421 -0.293) 4.460 3.566 ( 0.976 1.260 -0.505) 1.672 3.904 ( 11.092 -4.128 -4.909) 12.813 4.040 ( -8.327 -1.115 -0.913) 8.451 4.163 ( 7.371 -0.476 4.648) 8.727 4.385 ( -3.289 1.038 6.574) 7.424 4.738 ( 5.107 -1.423 0.743) 5.354 4.805 ( -5.276 5.983 -2.014) 8.227 5.187 ( -6.476 1.681 -0.360) 6.700 5.448 ( -0.066 0.774 1.845) 2.002 5.708 ( -2.829 1.632 3.482) 4.774 5.776 ( 3.663 0.690 -0.548) 3.768 6.115 ( 1.729 -2.489 -3.202) 4.409 6.397 ( -3.487 -2.571 0.149) 4.334 6.599 ( -2.309 -0.160 -1.506) 2.761 6.644 ( 5.616 1.638 1.529) 6.047 6.864 ( 0.102 0.116 -2.248) 2.254 7.250 ( -2.486 0.088 0.356) 2.513 7.253 ( 4.260 -0.629 1.277) 4.492 7.318 ( 0.484 -1.464 -0.652) 1.675 7.425 ( -0.593 0.174 0.083) 0.623 7.497 ( 0.991 -1.920 -0.483) 2.214 8.602 ( -0.468 0.840 0.567) 1.116 8.729 ( 0.825 0.442 0.714) 1.177 8.888 ( -1.985 1.111 -0.429) 2.315 8.933 ( -0.619 -0.875 0.572) 1.215 10.264 ( -0.883 0.520 -0.031) 1.025 10.356 ( -0.435 2.341 0.216) 2.391 10.532 ( -1.061 -0.461 -0.838) 1.429 10.762 ( 0.512 -0.114 0.272) 0.591 16.070 ( 1.491 -2.551 -0.075) 2.956 16.181 ( 1.558 -1.774 -1.308) 2.699 16.563 ( -3.739 2.135 6.858) 8.098 16.846 ( 0.864 -0.697 -5.072) 5.192 17.607 ( -2.442 -0.991 1.956) 3.282 17.872 ( -0.704 0.296 -2.702) 2.808 18.306 ( -1.681 -6.343 1.370) 6.703 18.374 ( -0.236 -5.911 -1.903) 6.214 18.673 ( 3.064 6.867 -0.419) 7.531 18.766 ( 2.736 8.184 -0.013) 8.629 19.092 ( -0.780 -1.121 3.629) 3.878 19.240 ( 1.798 -0.726 -2.221) 2.948 ======================= Grid point 131 (43/138) ======================= q-point: (-0.45 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( 7.414 -4.800 2.283) 9.123 1.773 ( -0.687 3.895 5.540) 6.807 2.070 ( 0.125 -7.660 -1.192) 7.753 2.215 ( -1.365 3.307 1.786) 3.998 2.318 ( -3.272 1.679 2.520) 4.458 2.420 ( -4.659 3.777 6.196) 8.623 2.492 ( 8.107 11.034 -4.259) 14.339 2.685 ( -4.125 3.053 1.443) 5.331 2.731 ( -0.034 -4.504 1.846) 4.868 3.089 ( 5.803 5.123 -8.241) 11.307 3.219 ( 3.005 -3.451 -3.758) 5.921 3.366 ( 0.458 4.223 0.797) 4.322 3.423 ( -5.588 -7.078 -3.801) 9.786 3.620 ( -1.010 -5.090 -3.481) 6.249 3.849 ( -14.085 7.550 -0.714) 15.997 4.033 ( 6.566 -1.870 -1.957) 7.102 4.187 ( -7.744 5.372 3.206) 9.955 4.374 ( 2.514 -2.204 5.609) 6.530 4.703 ( -2.823 -3.206 1.044) 4.397 4.890 ( 4.972 -4.970 -1.554) 7.199 5.174 ( 3.170 -3.715 -0.546) 4.914 5.455 ( 4.302 1.139 2.931) 5.329 5.662 ( -3.773 1.140 1.222) 4.126 5.816 ( 5.855 0.247 0.724) 5.905 6.154 ( -0.307 -2.226 -3.214) 3.922 6.389 ( -0.961 1.466 0.483) 1.818 6.572 ( -2.293 0.377 -0.987) 2.525 6.667 ( 0.673 -0.070 1.150) 1.334 6.826 ( -1.120 2.164 -2.378) 3.405 7.234 ( -2.332 -0.350 1.042) 2.578 7.281 ( 2.618 0.544 0.291) 2.689 7.323 ( -1.170 0.535 -0.783) 1.506 7.409 ( -1.057 1.121 0.403) 1.593 7.502 ( -0.764 1.238 -0.490) 1.535 8.611 ( 0.832 -1.197 0.488) 1.537 8.721 ( 0.464 1.305 0.891) 1.646 8.855 ( -0.849 0.686 -0.361) 1.149 8.964 ( 1.089 -1.917 0.400) 2.241 10.259 ( 0.796 0.009 -0.033) 0.797 10.360 ( 0.814 -2.574 0.215) 2.709 10.531 ( 0.130 -0.113 -0.825) 0.843 10.768 ( 0.439 -0.017 0.260) 0.511 16.084 ( -1.009 1.447 0.017) 1.764 16.189 ( -0.918 0.695 -1.660) 2.020 16.536 ( -1.294 0.629 6.603) 6.758 16.856 ( 2.554 -0.499 -4.558) 5.249 17.622 ( 0.803 -0.795 2.340) 2.599 17.851 ( 2.900 2.020 -3.062) 4.675 18.297 ( 0.510 6.150 0.796) 6.223 18.383 ( 1.882 6.138 -1.377) 6.566 18.687 ( -2.827 -6.371 -0.218) 6.974 18.744 ( -2.493 -7.494 -0.149) 7.899 19.095 ( -3.473 -0.192 3.497) 4.933 19.245 ( 1.345 1.014 -2.130) 2.715 ======================= Grid point 132 (44/138) ======================= q-point: (-0.36 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.272 ( 13.002 -9.187 2.729) 16.152 1.641 ( -3.309 11.107 3.890) 12.225 2.047 ( -3.648 16.598 -6.673) 18.257 2.114 ( -5.451 6.086 0.648) 8.197 2.150 ( -2.930 0.259 -4.760) 5.595 2.385 ( 1.188 0.990 11.334) 11.439 2.402 ( 5.166 3.124 -4.786) 7.704 2.698 ( -2.552 -5.235 4.610) 7.428 2.841 ( -1.736 -0.600 2.653) 3.227 3.031 ( 4.347 3.945 -0.042) 5.871 3.237 ( -5.993 5.885 1.838) 8.598 3.301 ( 3.372 -2.858 -3.531) 5.658 3.449 ( -8.945 7.631 -5.069) 12.804 3.506 ( -8.212 0.819 0.351) 8.260 3.730 ( -3.343 -3.961 -4.117) 6.619 3.990 ( -11.366 1.766 0.034) 11.502 4.152 ( 7.852 -5.063 -0.530) 9.357 4.490 ( 4.871 -3.829 4.632) 7.736 4.795 ( -3.515 -7.246 -1.510) 8.194 4.985 ( 1.494 -5.705 0.182) 5.900 5.324 ( 8.366 -5.055 -2.367) 10.057 5.486 ( 6.797 3.285 3.873) 8.485 5.622 ( -1.746 0.514 1.100) 2.127 5.857 ( 4.521 -0.035 0.340) 4.534 6.170 ( -2.169 -2.619 -4.816) 5.895 6.333 ( 0.938 5.167 1.371) 5.427 6.545 ( -1.038 0.919 0.006) 1.387 6.650 ( -4.828 -0.046 0.179) 4.832 6.771 ( -1.493 2.721 -0.137) 3.107 7.181 ( -7.456 4.086 0.451) 8.514 7.286 ( 2.481 1.445 0.063) 2.872 7.307 ( -0.257 -1.417 -0.270) 1.465 7.385 ( -0.034 0.633 0.456) 0.781 7.458 ( -1.084 2.097 -0.174) 2.367 8.642 ( 1.176 -0.986 -0.477) 1.607 8.710 ( 0.012 0.288 1.641) 1.666 8.845 ( 0.954 0.725 0.236) 1.221 9.011 ( 2.108 -1.774 -1.057) 2.951 10.275 ( 1.946 -0.366 0.405) 2.021 10.445 ( 1.578 -5.161 0.248) 5.403 10.531 ( 0.894 0.539 -0.626) 1.217 10.774 ( 0.162 -0.527 0.118) 0.564 16.009 ( -3.403 4.554 0.560) 5.713 16.137 ( -2.627 2.672 -2.242) 4.366 16.557 ( 1.292 -0.541 5.556) 5.730 16.873 ( 3.513 0.205 -3.785) 5.168 17.658 ( 4.093 0.254 2.585) 4.847 17.835 ( 6.150 3.366 -2.470) 7.433 18.169 ( 0.221 8.614 1.120) 8.689 18.260 ( 0.893 6.427 -2.127) 6.829 18.788 ( -7.444 -9.572 -0.800) 12.152 18.892 ( -3.165 -9.352 1.144) 9.939 19.075 ( -5.223 -1.630 3.047) 6.262 19.211 ( -0.007 2.718 -2.398) 3.624 ======================= Grid point 133 (45/138) ======================= q-point: (-0.27 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( -6.524 16.131 2.539) 17.585 1.549 ( 11.494 -2.177 3.822) 12.307 1.660 ( -3.442 20.545 -1.975) 20.925 1.922 ( -8.565 10.427 2.439) 13.712 2.074 ( -2.558 1.333 -15.731) 15.993 2.418 ( 2.481 0.182 1.103) 2.721 2.472 ( 1.004 -5.179 8.021) 9.600 2.613 ( -13.351 10.185 0.175) 16.794 2.822 ( -0.114 -3.896 0.506) 3.931 2.965 ( -6.759 6.218 5.896) 10.913 3.094 ( -0.728 6.519 1.173) 6.663 3.223 ( -4.590 3.514 0.960) 5.860 3.364 ( 2.358 -0.886 -0.810) 2.646 3.465 ( -4.874 0.425 -2.901) 5.688 3.746 ( -0.770 -1.156 0.807) 1.607 4.032 ( -2.423 -11.459 -3.967) 12.366 4.325 ( 8.229 -6.928 -2.895) 11.140 4.617 ( 7.305 -3.945 3.491) 9.006 4.874 ( -5.845 -8.756 -4.498) 11.449 5.116 ( 0.957 -6.524 1.779) 6.830 5.403 ( -3.751 -0.102 -2.491) 4.504 5.461 ( 9.098 5.180 1.536) 10.581 5.618 ( 3.562 2.380 2.038) 4.743 5.940 ( 6.044 -4.516 -0.586) 7.568 6.174 ( -1.588 -1.014 -3.748) 4.195 6.241 ( 1.456 7.161 2.714) 7.795 6.527 ( -0.666 0.301 0.556) 0.918 6.605 ( -6.268 -0.391 0.646) 6.313 6.689 ( -3.577 4.270 0.303) 5.579 6.976 ( -11.841 8.798 -1.526) 14.830 7.292 ( 1.243 -0.011 0.172) 1.255 7.337 ( 1.149 -1.340 0.082) 1.767 7.402 ( 2.214 -0.569 1.441) 2.702 7.425 ( -0.657 0.282 -0.510) 0.878 8.660 ( 0.462 -0.314 1.292) 1.408 8.722 ( 0.247 -0.829 0.972) 1.301 8.840 ( 1.570 1.396 0.456) 2.150 9.046 ( 2.553 -0.455 -2.547) 3.635 10.301 ( 2.360 0.042 1.085) 2.598 10.519 ( 1.117 1.593 0.062) 1.947 10.535 ( 0.824 -3.015 -0.151) 3.129 10.799 ( -0.567 -2.834 -0.451) 2.925 15.894 ( -4.234 4.618 0.758) 6.311 16.044 ( -3.535 3.931 -2.313) 5.770 16.602 ( 2.894 -0.515 4.286) 5.197 16.875 ( 3.514 2.014 -3.417) 5.299 17.689 ( 7.700 3.013 2.277) 8.576 17.824 ( 8.520 4.380 -1.412) 9.684 18.042 ( -2.862 4.171 1.445) 5.261 18.183 ( -0.935 1.977 -2.785) 3.541 18.855 ( -8.750 -5.511 -0.314) 10.346 18.952 ( -3.018 -0.630 4.245) 5.247 19.128 ( -2.584 -0.835 -2.405) 3.628 19.151 ( -4.924 -5.602 0.130) 7.460 ======================= Grid point 134 (46/138) ======================= q-point: (-0.18 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.944 ( -10.021 18.833 3.058) 21.551 1.238 ( -5.621 24.321 9.617) 26.751 1.568 ( -8.786 20.185 18.815) 28.959 1.621 ( -0.204 5.843 -11.551) 12.946 1.977 ( -4.896 -0.844 -19.524) 20.147 2.380 ( -8.780 3.142 5.628) 10.892 2.422 ( 0.089 0.329 -0.478) 0.587 2.604 ( 0.600 -6.843 0.380) 6.880 2.851 ( -5.516 1.161 11.353) 12.676 2.882 ( 2.366 -0.306 -3.132) 3.937 3.038 ( 2.523 0.473 -3.667) 4.476 3.145 ( -0.466 4.237 0.406) 4.281 3.346 ( -3.366 2.644 -3.539) 5.554 3.427 ( -1.136 -0.082 0.168) 1.152 3.763 ( 0.716 0.398 3.128) 3.233 4.213 ( 0.656 -10.194 -5.824) 11.759 4.485 ( 6.655 -4.987 -3.328) 8.958 4.798 ( 10.954 -6.214 5.108) 13.590 4.978 ( -6.222 -10.460 -5.298) 13.273 5.219 ( -1.452 -4.812 1.681) 5.300 5.309 ( -4.780 2.388 0.968) 5.430 5.482 ( 6.082 0.917 -3.861) 7.263 5.631 ( 4.867 0.804 4.518) 6.689 6.010 ( 3.488 4.168 -1.779) 5.719 6.124 ( 0.369 7.781 2.810) 8.281 6.205 ( 2.028 -4.298 -1.117) 4.882 6.504 ( -4.523 1.446 -0.733) 4.805 6.542 ( -2.562 4.181 0.197) 4.907 6.601 ( -5.097 -0.197 1.042) 5.206 6.696 ( -11.056 9.956 -3.540) 15.294 7.307 ( 0.143 -1.141 0.278) 1.183 7.380 ( 1.980 -1.610 -0.383) 2.580 7.404 ( 0.110 0.219 0.874) 0.908 7.456 ( 2.290 -1.199 0.243) 2.596 8.683 ( -0.357 -1.806 5.509) 5.808 8.745 ( 0.431 -1.236 0.634) 1.455 8.826 ( 1.182 1.794 0.902) 2.330 9.058 ( 3.112 0.453 -3.508) 4.711 10.319 ( 1.930 0.462 1.917) 2.759 10.491 ( -0.105 2.216 0.689) 2.323 10.560 ( 0.556 0.259 -0.473) 0.775 10.849 ( -2.496 -4.146 -3.031) 5.710 15.794 ( -3.868 2.853 0.567) 4.840 15.933 ( -3.984 4.163 -1.873) 6.059 16.643 ( 3.365 0.358 2.236) 4.056 16.836 ( 3.075 4.538 -3.808) 6.675 17.703 ( 9.144 4.050 1.708) 10.145 17.819 ( 8.571 4.318 -1.075) 9.657 17.993 ( -5.826 -1.699 2.873) 6.715 18.146 ( -1.810 -0.203 -3.940) 4.340 18.814 ( -6.012 2.146 0.460) 6.400 18.977 ( -3.490 -4.362 7.780) 9.578 19.033 ( -1.996 4.496 -3.413) 5.987 19.279 ( -5.420 -9.849 -0.294) 11.246 ======================= Grid point 135 (47/138) ======================= q-point: (-0.09 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.608 ( -6.213 11.008 18.655) 22.534 0.781 ( -18.251 19.073 15.205) 30.464 1.165 ( -1.754 24.303 33.660) 41.553 1.459 ( -1.031 7.575 -11.734) 14.004 1.922 ( -3.897 -3.923 -19.829) 20.585 2.338 ( -2.510 -0.027 5.928) 6.437 2.428 ( -0.443 -0.998 -0.276) 1.127 2.700 ( -0.539 -4.641 -5.902) 7.528 2.822 ( 1.299 5.109 -2.948) 6.040 2.903 ( -0.489 -2.839 9.414) 9.845 3.058 ( -0.730 -0.970 -11.512) 11.576 3.083 ( 1.712 3.001 -1.215) 3.663 3.209 ( -4.889 4.938 -5.644) 8.952 3.429 ( 1.451 0.054 -0.282) 1.479 3.770 ( 1.105 1.482 7.888) 8.101 4.327 ( 1.117 -4.660 -7.415) 8.829 4.613 ( 4.974 -4.488 2.289) 7.080 4.973 ( 2.940 -0.987 3.973) 5.040 5.086 ( 0.433 -7.795 -3.359) 8.499 5.285 ( -3.981 -5.578 0.344) 6.862 5.303 ( 0.005 -3.862 3.084) 4.942 5.508 ( 5.739 0.697 -3.959) 7.007 5.692 ( 3.668 -1.280 2.514) 4.627 5.853 ( -2.791 11.581 -1.615) 12.021 6.012 ( 0.014 5.947 4.356) 7.372 6.268 ( -1.539 0.229 -0.931) 1.813 6.374 ( -1.658 5.308 -5.417) 7.764 6.471 ( -5.135 4.780 -2.620) 7.488 6.490 ( 0.805 1.923 1.176) 2.394 6.591 ( -3.217 -0.780 0.551) 3.356 7.332 ( 0.326 -1.114 0.444) 1.243 7.389 ( -1.012 -0.318 -1.234) 1.628 7.438 ( 2.260 -1.153 1.168) 2.793 7.486 ( 1.430 -0.280 -0.098) 1.460 8.758 ( 1.255 -1.968 0.926) 2.511 8.787 ( -1.391 -2.066 1.787) 3.066 8.836 ( 0.895 -6.595 10.330) 12.288 9.077 ( 4.615 -0.355 -2.555) 5.287 10.340 ( 0.407 -1.467 2.493) 2.921 10.452 ( -1.853 1.300 1.692) 2.825 10.550 ( 0.525 0.829 -1.234) 1.576 10.815 ( -11.110 2.578 -11.910) 16.490 15.739 ( -1.146 0.867 0.563) 1.543 15.828 ( -3.548 3.334 -0.539) 4.899 16.645 ( 1.969 3.231 -1.472) 4.060 16.743 ( 2.033 6.834 -3.800) 8.079 17.721 ( 5.472 1.895 1.111) 5.897 17.809 ( 5.231 3.237 -1.333) 6.294 18.001 ( -8.378 -4.139 3.910) 10.130 18.133 ( 1.391 -0.342 -5.154) 5.349 18.707 ( -4.451 4.782 2.053) 6.848 18.937 ( -1.296 3.247 -3.820) 5.178 19.129 ( 0.994 -11.651 11.198) 16.190 19.375 ( -3.814 -5.744 -1.089) 6.980 ======================= Grid point 137 (48/138) ======================= q-point: ( 0.09 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.778 ( 21.957 0.000 13.211) 25.625 1.033 ( 14.289 0.000 24.995) 28.791 1.477 ( 8.466 0.000 20.628) 22.297 1.562 ( 23.008 0.000 -12.134) 26.011 1.793 ( 7.339 0.000 -2.996) 7.927 2.307 ( -9.761 -0.000 6.121) 11.521 2.453 ( 1.481 0.000 1.802) 2.333 2.467 ( -4.677 -0.000 -26.400) 26.811 2.742 ( 1.879 0.000 -9.856) 10.034 2.814 ( 2.028 0.000 5.412) 5.779 3.022 ( -0.862 -0.000 -5.452) 5.520 3.048 ( -3.348 -0.000 0.558) 3.394 3.183 ( 1.163 0.000 8.597) 8.675 3.468 ( 3.847 0.000 -5.443) 6.665 3.866 ( -0.101 -0.000 11.158) 11.158 4.246 ( -3.376 -0.000 -11.571) 12.053 4.818 ( -8.153 -0.000 -3.156) 8.743 4.820 ( 0.999 0.000 11.270) 11.314 5.159 ( -5.976 -0.000 -4.591) 7.535 5.193 ( -5.739 -0.000 4.167) 7.092 5.442 ( -4.977 -0.000 -2.201) 5.442 5.515 ( 6.449 0.000 -1.577) 6.639 5.674 ( 1.278 0.000 0.936) 1.585 5.897 ( -1.319 -0.000 -0.452) 1.394 6.120 ( 12.494 0.000 -2.097) 12.669 6.170 ( -3.986 -0.000 -5.340) 6.663 6.335 ( 6.174 0.000 2.475) 6.652 6.431 ( 5.657 0.000 -2.849) 6.334 6.567 ( 1.811 0.000 -2.443) 3.041 6.617 ( 7.436 0.000 2.078) 7.721 7.352 ( -1.316 -0.000 -0.707) 1.494 7.360 ( 0.291 0.000 0.650) 0.712 7.448 ( -4.002 -0.000 -0.332) 4.015 7.463 ( -1.660 -0.000 0.271) 1.682 8.736 ( -4.287 -0.000 0.655) 4.337 8.800 ( 0.514 0.000 0.655) 0.833 8.923 ( -12.196 -0.000 7.608) 14.374 9.006 ( -3.919 -0.000 1.275) 4.121 10.289 ( 2.946 0.000 0.213) 2.954 10.444 ( -0.411 -0.000 2.287) 2.323 10.534 ( -0.024 -0.000 -1.525) 1.525 10.579 ( 8.704 0.000 4.161) 9.648 15.746 ( 1.076 0.000 -1.292) 1.681 15.932 ( 7.748 0.000 -3.931) 8.688 16.564 ( -2.338 -0.000 2.500) 3.423 16.666 ( -0.382 -0.000 -2.603) 2.631 17.602 ( -14.370 -0.000 2.605) 14.604 17.713 ( -6.448 -0.000 -1.195) 6.558 17.972 ( 3.815 0.000 1.156) 3.986 18.258 ( 4.541 0.000 -1.637) 4.827 18.711 ( 6.841 0.000 5.212) 8.601 18.904 ( 4.560 0.000 -4.153) 6.167 19.318 ( 3.728 0.000 8.196) 9.004 19.382 ( 1.534 0.000 -2.678) 3.087 ======================= Grid point 138 (49/138) ======================= q-point: ( 0.18 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( 19.415 -3.576 11.531) 22.862 1.169 ( 13.401 1.871 21.271) 25.210 1.534 ( 3.279 1.500 -18.444) 18.793 1.774 ( 19.806 -6.502 -14.670) 25.491 2.076 ( 14.299 -13.367 24.986) 31.740 2.253 ( -6.188 -2.002 3.862) 7.564 2.404 ( -1.203 -1.923 -15.884) 16.045 2.491 ( 3.509 -1.648 1.906) 4.320 2.725 ( 1.464 -1.097 -10.969) 11.120 2.861 ( -0.970 -1.571 6.243) 6.510 2.983 ( -3.063 -0.146 -3.596) 4.726 3.094 ( 3.169 -5.273 1.347) 6.297 3.232 ( 2.445 -0.705 7.516) 7.935 3.477 ( 5.120 0.850 -6.058) 7.977 3.897 ( -1.227 -0.102 8.780) 8.866 4.150 ( -4.565 2.733 -11.777) 12.923 4.658 ( -7.400 8.338 -3.290) 11.623 4.767 ( -4.398 7.631 8.633) 12.333 5.049 ( -3.868 4.668 -2.939) 6.737 5.198 ( -8.025 -3.820 3.162) 9.433 5.383 ( -1.809 0.756 -1.440) 2.433 5.492 ( 0.815 4.889 -3.420) 6.022 5.755 ( 4.473 -2.262 3.084) 5.885 5.857 ( -5.419 0.250 -1.292) 5.577 6.141 ( -0.859 -3.816 -1.707) 4.268 6.170 ( 5.190 3.033 0.379) 6.023 6.450 ( 4.668 -3.166 -1.409) 5.814 6.552 ( 8.350 -4.989 -0.651) 9.748 6.584 ( 6.780 -1.943 -1.762) 7.270 6.710 ( 8.525 -2.118 -0.339) 8.791 7.331 ( -1.200 0.859 -0.251) 1.497 7.353 ( -1.117 0.688 0.775) 1.524 7.410 ( -3.892 0.065 0.161) 3.895 7.443 ( -2.484 0.127 -0.280) 2.503 8.684 ( -4.434 1.143 3.004) 5.476 8.796 ( -0.008 1.101 0.769) 1.343 8.847 ( -2.801 0.410 4.889) 5.650 8.999 ( -5.232 -1.393 -2.191) 5.841 10.296 ( 1.128 1.000 0.689) 1.658 10.475 ( 0.699 -1.754 1.399) 2.350 10.531 ( -0.609 -0.698 -1.312) 1.606 10.719 ( 5.949 -3.725 2.782) 7.550 15.775 ( 3.207 -1.632 -0.937) 3.719 15.960 ( 5.938 0.959 -1.697) 6.249 16.577 ( -3.921 -2.860 2.593) 5.503 16.704 ( -1.212 -4.802 -3.758) 6.217 17.505 ( -13.981 -2.406 2.345) 14.379 17.676 ( -6.732 -2.644 -0.734) 7.269 17.997 ( 2.173 0.357 0.763) 2.330 18.272 ( 2.187 1.054 -1.370) 2.788 18.817 ( 8.729 -1.951 3.496) 9.604 18.971 ( 6.096 -3.218 -3.518) 7.739 19.335 ( 5.173 5.956 0.927) 7.943 19.346 ( 6.560 5.573 3.478) 9.284 ======================= Grid point 139 (50/138) ======================= q-point: ( 0.27 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( 9.598 -2.903 10.351) 14.412 1.357 ( 6.871 -3.545 12.220) 14.460 1.505 ( 11.484 -0.599 -14.571) 18.562 1.948 ( 3.676 -6.282 -15.393) 17.028 2.279 ( 2.095 0.668 -1.332) 2.571 2.343 ( 0.426 -4.212 3.597) 5.555 2.464 ( 4.427 -5.210 11.512) 13.389 2.637 ( 8.880 -7.825 1.078) 11.884 2.744 ( 1.139 -2.549 -11.726) 12.054 2.916 ( 3.403 -3.382 -0.703) 4.849 3.007 ( -2.857 -5.915 6.448) 9.204 3.228 ( 6.664 -2.978 4.664) 8.662 3.297 ( 6.024 -1.001 6.129) 8.652 3.514 ( 6.469 -1.428 -5.074) 8.345 3.896 ( -1.328 1.241 4.858) 5.187 4.011 ( -4.751 3.674 -10.890) 12.436 4.424 ( -5.028 10.062 -3.066) 11.658 4.583 ( -8.636 8.252 4.240) 12.675 4.948 ( 0.237 4.403 -1.003) 4.522 5.182 ( -8.920 -0.522 2.579) 9.300 5.302 ( -0.323 6.610 -0.357) 6.628 5.441 ( -1.127 -0.802 -2.032) 2.458 5.779 ( -5.809 -2.171 -6.248) 8.803 5.826 ( -0.814 0.712 5.501) 5.606 6.125 ( 0.737 3.236 0.832) 3.421 6.237 ( 2.414 -2.691 -0.416) 3.639 6.539 ( 2.134 -3.920 1.614) 4.746 6.626 ( 7.249 -2.365 -2.017) 7.887 6.732 ( 7.764 -0.580 0.964) 7.845 6.879 ( 11.789 -8.345 -2.207) 14.611 7.302 ( -1.363 1.261 0.429) 1.906 7.325 ( -3.805 0.214 0.197) 3.816 7.386 ( -1.332 0.029 0.834) 1.572 7.425 ( -1.857 -0.461 -0.453) 1.966 8.664 ( -1.987 -0.785 1.931) 2.879 8.762 ( -0.766 2.527 0.750) 2.745 8.860 ( -1.315 -1.552 3.358) 3.926 8.962 ( -3.387 -0.332 -4.703) 5.806 10.289 ( -1.221 0.178 0.918) 1.537 10.505 ( 0.730 -0.538 0.363) 0.977 10.536 ( -1.223 -0.714 -0.449) 1.485 10.778 ( 1.719 1.133 1.569) 2.589 15.848 ( 4.350 -3.023 0.077) 5.297 16.009 ( 4.912 -1.620 -1.127) 5.294 16.601 ( -4.740 -2.594 4.340) 6.930 16.755 ( -2.144 -4.068 -4.585) 6.494 17.467 ( -11.442 -5.013 1.670) 12.603 17.686 ( -6.532 -5.193 -0.387) 8.353 18.012 ( 0.311 -0.896 1.093) 1.447 18.256 ( 0.791 1.383 -1.915) 2.491 18.930 ( 8.135 -1.294 2.567) 8.628 19.071 ( 5.936 -2.779 -2.799) 7.127 19.230 ( 3.869 8.303 -3.840) 9.932 19.316 ( 10.438 9.274 5.578) 15.036 ======================= Grid point 140 (51/138) ======================= q-point: ( 0.36 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( -5.259 4.988 2.422) 7.642 1.551 ( 10.907 -5.322 13.843) 18.409 1.657 ( 14.926 -5.017 -7.522) 17.451 2.020 ( -3.041 -7.649 -8.319) 11.703 2.217 ( -2.167 2.873 -5.542) 6.608 2.452 ( -0.410 -5.525 -4.509) 7.143 2.611 ( 3.510 -3.632 12.251) 13.251 2.685 ( 0.999 1.319 -0.051) 1.655 2.892 ( 6.595 -8.639 -0.449) 10.878 3.001 ( 3.389 -1.643 -3.662) 5.253 3.081 ( -3.929 -2.924 6.541) 8.171 3.342 ( 4.339 -0.738 1.250) 4.575 3.403 ( 9.768 1.565 2.853) 10.296 3.594 ( 9.077 -3.691 -4.336) 10.715 3.885 ( 2.074 1.089 -1.800) 2.955 3.919 ( -1.719 -0.461 -4.010) 4.387 4.241 ( -0.783 6.426 -1.497) 6.644 4.411 ( -7.436 3.261 4.466) 9.267 4.866 ( 0.115 5.935 -1.245) 6.065 5.043 ( -9.908 6.342 0.783) 11.790 5.228 ( -4.104 0.925 1.302) 4.404 5.442 ( -1.452 -0.813 -0.667) 1.792 5.763 ( -4.614 -3.369 -4.106) 7.035 5.804 ( -1.215 2.636 4.050) 4.983 6.083 ( 2.913 2.701 0.020) 3.972 6.275 ( -0.450 -1.527 -0.484) 1.664 6.598 ( 2.134 -0.487 -0.256) 2.203 6.747 ( 8.212 -1.958 -0.201) 8.444 6.784 ( 4.573 -0.854 -0.316) 4.663 7.114 ( 9.611 -7.386 0.242) 12.124 7.266 ( -2.203 1.135 0.407) 2.511 7.292 ( -3.817 -0.375 0.177) 3.839 7.401 ( 0.599 -1.655 1.041) 2.044 7.421 ( -0.983 -0.650 -0.908) 1.488 8.663 ( -1.085 0.711 -0.256) 1.322 8.721 ( -0.536 0.890 1.693) 1.987 8.885 ( -1.359 -1.323 2.900) 3.465 8.924 ( -2.959 0.008 -4.751) 5.597 10.273 ( -1.852 0.259 0.587) 1.960 10.504 ( -2.010 3.190 0.031) 3.770 10.514 ( 0.258 -0.130 -0.133) 0.318 10.758 ( -0.664 0.936 0.802) 1.400 15.946 ( 4.277 -3.661 0.583) 5.660 16.085 ( 3.768 -2.971 -1.309) 4.974 16.603 ( -5.184 -0.626 5.734) 7.756 16.783 ( -1.609 -2.972 -5.062) 6.087 17.487 ( -8.148 -5.991 1.458) 10.218 17.736 ( -5.726 -6.533 -0.653) 8.712 18.055 ( -0.794 -4.196 1.315) 4.468 18.238 ( -0.028 -0.175 -2.539) 2.546 18.997 ( 5.747 2.694 2.476) 6.813 19.093 ( 5.040 9.579 -3.431) 11.354 19.133 ( 3.926 1.762 -0.245) 4.311 19.258 ( 9.263 6.678 1.878) 11.572 ======================= Grid point 141 (52/138) ======================= q-point: ( 0.45 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( -1.092 7.532 2.767) 8.098 1.747 ( 6.901 -4.121 7.750) 11.165 1.885 ( 15.890 -5.798 1.512) 16.983 2.070 ( -7.030 -3.860 -0.134) 8.021 2.181 ( -3.739 -5.366 -6.876) 9.490 2.481 ( 0.198 -1.204 -5.632) 5.762 2.625 ( -2.568 1.323 4.501) 5.348 2.784 ( 3.409 -2.682 4.397) 6.176 2.955 ( 5.761 7.636 -1.333) 9.658 3.073 ( 0.517 -5.808 5.461) 7.988 3.173 ( 0.964 -6.808 0.237) 6.880 3.281 ( -1.070 2.750 -6.106) 6.782 3.389 ( 2.733 5.718 -5.249) 8.229 3.672 ( 4.220 5.250 -1.426) 6.886 3.913 ( 8.348 -3.808 -5.109) 10.502 3.947 ( -4.625 -2.035 1.876) 5.389 4.211 ( 4.576 -1.015 0.368) 4.701 4.399 ( 0.871 -0.944 6.197) 6.329 4.749 ( -4.600 3.081 0.521) 5.561 4.829 ( -12.834 6.276 -1.305) 14.346 5.169 ( -4.173 2.135 1.131) 4.822 5.456 ( 1.417 -1.200 -0.064) 1.858 5.722 ( -5.274 2.397 4.448) 7.304 5.815 ( 3.968 -1.678 -2.881) 5.183 6.093 ( 3.468 -0.483 -1.577) 3.840 6.292 ( -3.111 -2.283 1.074) 4.005 6.607 ( 2.069 0.749 -0.881) 2.370 6.783 ( 8.020 4.060 -0.417) 8.999 6.852 ( 2.226 -1.766 -1.591) 3.256 7.230 ( -3.346 0.737 0.985) 3.565 7.264 ( 1.393 -1.685 0.846) 2.344 7.295 ( 2.431 -3.169 -0.104) 3.995 7.413 ( -0.921 -0.137 0.172) 0.947 7.460 ( 1.133 -2.991 -0.585) 3.252 8.624 ( -0.465 1.930 -0.130) 1.990 8.733 ( 0.293 -0.887 1.633) 1.881 8.877 ( -3.166 0.684 -3.018) 4.427 8.904 ( -1.473 -1.444 1.727) 2.690 10.257 ( -1.336 0.071 0.204) 1.353 10.408 ( -2.342 4.605 0.126) 5.168 10.519 ( 0.284 -0.304 -0.359) 0.549 10.752 ( -1.062 -0.713 0.346) 1.325 16.041 ( 3.186 -2.984 0.440) 4.387 16.157 ( 2.226 -2.473 -1.271) 3.562 16.574 ( -4.954 0.884 6.529) 8.243 16.805 ( -0.028 -2.421 -5.274) 5.803 17.532 ( -4.732 -4.829 1.706) 6.972 17.797 ( -3.856 -5.361 -1.612) 6.798 18.156 ( -1.399 -7.902 1.409) 8.148 18.264 ( -0.146 -4.384 -2.679) 5.140 18.889 ( 3.463 12.915 0.267) 13.374 18.955 ( 1.196 9.480 -0.682) 9.579 19.127 ( 3.850 2.438 2.259) 5.087 19.273 ( 7.148 1.390 -1.001) 7.351 ======================= Grid point 142 (53/138) ======================= q-point: (-0.45 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.075 ( 8.909 0.553 1.159) 9.001 1.854 ( 3.444 0.321 4.037) 5.316 1.984 ( -0.423 -0.712 4.901) 4.971 2.183 ( -2.108 -5.395 1.841) 6.078 2.263 ( 4.269 -7.915 0.685) 9.019 2.455 ( -1.007 3.083 -0.493) 3.280 2.642 ( 2.097 -3.648 0.755) 4.275 2.754 ( 3.961 8.160 -2.010) 9.291 2.824 ( -0.891 10.864 -0.982) 10.945 3.143 ( 1.824 0.045 1.766) 2.539 3.183 ( -1.183 -0.776 -5.264) 5.451 3.292 ( 3.587 -0.814 -9.386) 10.081 3.402 ( 0.984 -4.392 1.706) 4.813 3.562 ( -0.921 3.612 -2.631) 4.562 3.850 ( -11.162 5.138 1.923) 12.438 4.063 ( 7.904 -2.164 -0.801) 8.234 4.232 ( -4.233 4.213 1.777) 6.231 4.398 ( 0.167 1.452 4.453) 4.687 4.609 ( -10.028 -0.936 -0.043) 10.072 4.800 ( -3.033 -5.575 -1.192) 6.458 5.145 ( 3.115 -1.821 1.629) 3.958 5.498 ( 3.132 -0.736 1.631) 3.607 5.666 ( -2.007 1.071 1.039) 2.500 5.874 ( 6.019 -0.725 -1.203) 6.181 6.118 ( 0.348 -0.449 -2.959) 3.013 6.309 ( -4.984 -3.057 2.293) 6.280 6.617 ( 4.097 0.903 0.306) 4.207 6.749 ( 3.698 5.306 -1.428) 6.623 6.861 ( 2.846 2.108 -1.983) 4.059 7.199 ( -3.642 -0.583 1.299) 3.911 7.283 ( -0.654 -1.075 -0.865) 1.527 7.348 ( 2.684 0.852 0.140) 2.819 7.405 ( -1.811 0.086 0.868) 2.010 7.500 ( -0.273 -0.902 -0.660) 1.150 8.607 ( 0.574 -0.019 0.467) 0.741 8.746 ( 0.520 0.717 0.692) 1.124 8.838 ( -2.760 -0.566 -0.920) 2.964 8.931 ( -0.495 -2.228 1.093) 2.530 10.255 ( -0.050 -0.670 -0.081) 0.677 10.340 ( -1.460 0.710 0.088) 1.626 10.529 ( 1.114 -0.394 -0.404) 1.249 10.759 ( -0.990 -0.842 0.058) 1.301 16.093 ( 1.057 -0.396 0.075) 1.131 16.188 ( 0.230 -0.065 -1.411) 1.431 16.546 ( -3.295 0.249 6.958) 7.703 16.835 ( 1.636 -2.133 -5.081) 5.748 17.585 ( -1.619 -3.814 2.194) 4.689 17.842 ( -0.753 -3.032 -2.917) 4.274 18.288 ( -1.010 -7.111 0.811) 7.228 18.370 ( 0.907 -7.102 -1.614) 7.340 18.694 ( -0.760 9.309 0.484) 9.353 18.770 ( -1.230 10.740 -0.801) 10.840 19.117 ( 1.200 2.433 3.138) 4.148 19.295 ( 5.277 2.102 -1.751) 5.944 ======================= Grid point 143 (54/138) ======================= q-point: (-0.36 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( 15.659 -7.393 0.530) 17.325 1.796 ( -0.891 7.804 1.102) 7.932 2.030 ( -5.435 -4.054 1.978) 7.063 2.177 ( -0.775 2.849 -1.527) 3.324 2.333 ( 2.543 10.002 3.106) 10.778 2.405 ( 1.470 1.550 0.584) 2.215 2.599 ( -0.987 8.607 -0.259) 8.667 2.647 ( 4.263 3.807 0.894) 5.785 2.813 ( 5.998 -5.221 4.635) 9.205 3.114 ( 1.605 2.096 -6.277) 6.809 3.242 ( 1.538 -3.290 -2.410) 4.359 3.266 ( -9.810 3.968 1.902) 10.752 3.383 ( 1.259 -3.195 -3.495) 4.900 3.588 ( -6.182 9.127 -0.345) 11.029 3.614 ( -4.607 -1.357 -3.917) 6.197 3.972 ( -13.634 8.061 0.925) 15.866 4.168 ( 7.060 -1.039 1.696) 7.335 4.453 ( 0.602 -4.666 4.138) 6.265 4.657 ( -2.623 -5.161 1.021) 5.879 4.853 ( -5.063 -7.873 -1.969) 9.566 5.283 ( 7.189 -5.408 -0.547) 9.012 5.545 ( 0.811 -2.598 2.912) 3.986 5.650 ( 3.817 2.402 -0.522) 4.540 5.925 ( 5.731 1.061 0.068) 5.829 6.096 ( -2.721 -0.797 -5.256) 5.972 6.324 ( -5.189 -2.636 2.696) 6.414 6.634 ( 7.075 4.129 1.168) 8.274 6.668 ( -0.458 3.991 -1.468) 4.277 6.826 ( 1.843 3.796 -0.786) 4.293 7.178 ( -4.760 1.282 0.805) 4.995 7.279 ( -1.343 -0.424 -0.800) 1.620 7.332 ( 1.225 2.054 -0.195) 2.399 7.383 ( -1.790 0.187 0.663) 1.918 7.484 ( -0.945 1.517 -0.160) 1.795 8.631 ( 1.219 -1.344 0.084) 1.816 8.725 ( -0.467 1.200 -0.022) 1.288 8.847 ( -0.428 -1.232 1.519) 2.002 8.979 ( 0.605 -2.910 -0.260) 2.984 10.277 ( 1.233 -1.171 0.110) 1.704 10.366 ( -0.248 -4.185 -0.066) 4.193 10.547 ( 2.029 -0.077 -0.226) 2.043 10.762 ( -1.076 -0.568 -0.270) 1.247 16.064 ( -1.422 3.626 0.393) 3.915 16.155 ( -1.279 2.276 -2.190) 3.408 16.561 ( -0.870 -1.423 6.631) 6.837 16.873 ( 2.651 -1.700 -4.504) 5.495 17.654 ( 0.813 -3.607 2.872) 4.681 17.879 ( 2.770 -1.631 -3.721) 4.917 18.324 ( 1.940 6.071 1.153) 6.477 18.412 ( 2.457 6.614 -1.368) 7.187 18.591 ( -6.803 -2.436 -0.860) 7.277 18.689 ( -4.094 -8.159 0.413) 9.137 19.081 ( -0.953 2.967 3.772) 4.893 19.275 ( 3.146 3.636 -2.463) 5.402 ======================= Grid point 144 (55/138) ======================= q-point: (-0.27 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.523 ( 11.107 -2.650 3.281) 11.881 1.592 ( -0.275 9.963 -4.759) 11.045 1.962 ( -5.522 7.637 -3.945) 10.216 2.078 ( 3.874 8.007 -12.705) 15.509 2.111 ( 0.704 13.330 9.121) 16.167 2.407 ( -1.941 0.135 5.779) 6.097 2.524 ( 6.144 3.861 4.161) 8.365 2.654 ( -5.006 1.094 3.037) 5.956 2.793 ( -5.278 5.633 -0.827) 7.763 3.029 ( -9.476 7.211 2.334) 12.134 3.161 ( 1.521 -2.462 4.327) 5.206 3.293 ( -3.939 10.576 -2.445) 11.548 3.341 ( 2.810 -3.785 -1.371) 4.909 3.441 ( -1.166 1.127 -1.990) 2.567 3.679 ( -0.347 -6.700 -3.915) 7.768 3.820 ( -7.412 -3.624 0.002) 8.250 4.296 ( 8.719 -4.660 0.254) 9.889 4.573 ( 0.304 -7.239 4.023) 8.287 4.694 ( -3.714 -4.199 -2.974) 6.346 4.987 ( -1.907 -9.526 -0.537) 9.730 5.360 ( -0.128 -0.283 -2.559) 2.578 5.609 ( 2.934 5.709 -3.926) 7.524 5.649 ( 3.253 -4.992 4.220) 7.301 5.938 ( 4.311 0.598 1.806) 4.712 6.110 ( 0.009 -3.659 -4.528) 5.821 6.322 ( -3.140 -0.108 2.421) 3.967 6.570 ( 0.528 4.425 -0.348) 4.469 6.630 ( 4.915 4.901 1.698) 7.146 6.752 ( -1.366 4.982 -0.008) 5.166 7.026 ( -9.484 8.105 -1.204) 12.534 7.299 ( -0.487 -1.733 -0.123) 1.804 7.312 ( 0.584 0.487 -0.217) 0.791 7.394 ( 0.482 -1.777 0.952) 2.072 7.446 ( -0.421 1.920 0.377) 2.002 8.661 ( 1.217 -0.715 -0.039) 1.412 8.713 ( -0.540 -0.332 0.540) 0.832 8.866 ( 0.532 -0.063 1.874) 1.949 9.031 ( 1.264 -2.267 -1.889) 3.210 10.315 ( 1.920 -1.231 0.954) 2.472 10.456 ( -0.144 -5.625 -0.775) 5.679 10.560 ( 2.523 0.892 0.479) 2.718 10.759 ( -1.591 -0.680 -0.935) 1.967 15.962 ( -2.419 5.781 0.963) 6.340 16.081 ( -1.720 3.806 -2.900) 5.085 16.611 ( 0.546 -1.928 5.787) 6.125 16.903 ( 2.644 -0.422 -3.968) 4.786 17.738 ( 2.450 -3.219 3.600) 5.415 17.923 ( 6.394 -0.243 -3.903) 7.495 18.173 ( -0.170 11.033 0.358) 11.040 18.242 ( -1.917 8.587 -1.266) 8.889 18.670 ( -4.904 -8.830 0.845) 10.135 18.848 ( -2.593 -11.279 -0.019) 11.573 19.025 ( -3.167 2.591 3.833) 5.607 19.210 ( 1.426 4.993 -3.044) 6.019 ======================= Grid point 145 (56/138) ======================= q-point: (-0.18 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -3.027 19.607 2.344) 19.978 1.542 ( -7.745 15.849 -1.890) 17.741 1.784 ( 10.209 9.111 -6.007) 14.944 1.897 ( -3.180 6.407 -18.671) 19.994 1.963 ( 6.625 13.557 16.744) 22.540 2.375 ( -8.023 2.133 4.175) 9.292 2.449 ( -3.056 5.292 -0.889) 6.176 2.557 ( 0.615 1.107 8.247) 8.343 2.795 ( -1.860 -5.584 -1.048) 5.978 2.891 ( -2.957 2.519 4.448) 5.905 3.116 ( 0.303 6.682 -0.198) 6.692 3.202 ( 0.116 1.757 3.240) 3.688 3.355 ( -3.480 2.997 -3.539) 5.798 3.410 ( 1.507 -0.849 -1.667) 2.402 3.753 ( 0.675 -3.074 1.922) 3.688 3.970 ( -1.279 -14.331 -5.180) 15.292 4.451 ( 7.548 -4.810 -2.138) 9.202 4.718 ( -7.255 -9.938 -0.672) 12.323 4.780 ( 6.743 -7.114 1.438) 9.906 5.112 ( -1.984 -6.991 -1.809) 7.489 5.308 ( -3.465 2.874 -0.683) 4.553 5.506 ( -1.194 2.884 -7.120) 7.774 5.738 ( 5.309 0.985 7.193) 8.994 6.025 ( 2.803 -4.282 -1.287) 5.277 6.162 ( 2.962 -1.827 -0.222) 3.487 6.276 ( -0.800 4.905 1.673) 5.244 6.512 ( -0.030 2.597 0.252) 2.610 6.581 ( 1.698 4.403 1.400) 4.922 6.634 ( -3.334 5.771 0.157) 6.667 6.775 ( -8.058 9.927 -2.441) 13.016 7.297 ( 0.012 -0.112 0.185) 0.217 7.344 ( -0.503 -2.348 -1.214) 2.691 7.424 ( 0.751 0.816 1.344) 1.743 7.442 ( 0.802 -2.129 0.974) 2.475 8.678 ( 0.269 -0.306 2.294) 2.330 8.727 ( -0.095 -1.307 0.175) 1.322 8.866 ( 0.613 1.228 1.659) 2.153 9.061 ( 1.320 -0.891 -3.477) 3.825 10.350 ( 1.738 -0.267 2.307) 2.901 10.516 ( -0.616 -1.090 -1.823) 2.212 10.567 ( 1.750 0.584 1.685) 2.498 10.759 ( -2.361 -2.018 -2.959) 4.290 15.848 ( -1.751 5.250 1.471) 5.726 15.982 ( -1.380 4.794 -3.063) 5.854 16.662 ( 0.663 -1.223 4.372) 4.588 16.900 ( 1.881 1.796 -3.802) 4.606 17.823 ( 3.731 -1.880 3.996) 5.781 17.955 ( 7.502 4.342 -2.312) 8.971 17.985 ( -2.342 7.508 -0.022) 7.865 18.113 ( -4.804 1.534 -3.096) 5.918 18.772 ( -1.433 -4.682 3.114) 5.802 18.943 ( -1.880 1.231 4.937) 5.424 19.041 ( -3.970 -9.656 -2.336) 10.699 19.119 ( 0.704 4.288 -2.614) 5.071 ======================= Grid point 146 (57/138) ======================= q-point: (-0.09 0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( 2.125 18.471 9.916) 21.072 1.071 ( -13.143 24.002 7.489) 28.371 1.624 ( 11.446 15.095 -10.527) 21.672 1.695 ( -1.763 10.143 -1.914) 10.472 1.849 ( 6.723 10.424 7.638) 14.567 2.317 ( -3.639 -0.922 3.868) 5.390 2.423 ( 0.853 -0.267 -0.105) 0.900 2.578 ( -2.607 -3.483 -3.402) 5.523 2.865 ( -1.942 -1.328 9.232) 9.527 2.887 ( 1.151 -0.594 -2.663) 2.961 3.039 ( 0.804 1.881 -4.501) 4.944 3.155 ( 0.361 4.636 -2.005) 5.064 3.232 ( -4.851 4.139 -2.567) 6.874 3.427 ( 1.511 -0.472 -2.012) 2.560 3.813 ( 1.454 -0.986 5.736) 5.999 4.171 ( -0.299 -10.760 -7.412) 13.069 4.577 ( 4.599 -4.600 0.050) 6.505 4.800 ( -9.896 -9.598 -4.838) 14.610 5.016 ( 8.363 -9.177 4.760) 13.297 5.182 ( -1.842 -3.734 -2.270) 4.742 5.255 ( -2.001 -0.876 2.923) 3.649 5.482 ( -0.402 -2.892 -5.749) 6.448 5.768 ( 4.168 2.913 7.072) 8.710 6.014 ( -1.869 5.868 -3.620) 7.144 6.135 ( -1.905 8.098 2.443) 8.670 6.237 ( 1.768 -2.116 -0.826) 2.879 6.459 ( 1.776 5.605 -0.391) 5.893 6.499 ( -2.493 3.707 -1.464) 4.701 6.548 ( -0.908 1.701 0.609) 2.023 6.601 ( 2.366 5.171 -1.095) 5.791 7.314 ( 0.416 -1.323 0.722) 1.564 7.360 ( -1.499 -1.219 -1.566) 2.487 7.439 ( 1.041 -0.667 1.721) 2.119 7.476 ( -0.310 -1.300 0.058) 1.338 8.702 ( -1.880 -2.229 5.420) 6.154 8.755 ( 0.531 -1.556 0.244) 1.662 8.848 ( 0.099 1.567 2.538) 2.984 9.072 ( 1.122 -0.979 -4.218) 4.473 10.362 ( -0.199 1.011 4.001) 4.131 10.485 ( -0.874 2.551 -0.137) 2.700 10.568 ( 0.398 0.886 0.335) 1.028 10.748 ( -2.942 0.010 -7.412) 7.975 15.773 ( 0.133 2.828 1.879) 3.398 15.882 ( 0.346 4.668 -2.467) 5.291 16.678 ( -0.816 0.846 1.860) 2.200 16.846 ( 0.878 4.434 -4.228) 6.189 17.826 ( -1.503 6.072 1.099) 6.351 17.893 ( -3.968 -0.523 2.572) 4.758 17.900 ( 0.678 3.073 -0.058) 3.148 18.118 ( 4.576 -2.433 -4.694) 6.992 18.775 ( -0.616 4.207 3.028) 5.220 18.990 ( 0.924 -2.173 3.258) 4.024 19.012 ( 0.427 0.199 0.918) 1.032 19.212 ( -1.297 -9.360 -2.031) 9.666 ======================= Grid point 149 (58/138) ======================= q-point: ( 0.18 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.189 ( 12.644 0.000 8.720) 15.359 1.381 ( 8.245 0.000 9.382) 12.490 1.566 ( 13.604 0.000 -18.515) 22.976 1.812 ( 10.238 0.000 -12.129) 15.872 2.157 ( 16.107 0.000 26.483) 30.997 2.203 ( 9.146 0.000 -4.320) 10.115 2.360 ( -0.661 -0.000 -5.174) 5.216 2.498 ( 1.602 0.000 3.449) 3.803 2.727 ( 2.874 0.000 -7.678) 8.199 2.851 ( -3.288 -0.000 4.196) 5.331 2.998 ( -1.481 -0.000 1.153) 1.877 3.017 ( 7.535 0.000 -3.388) 8.262 3.283 ( 4.290 0.000 7.660) 8.779 3.518 ( 6.789 0.000 -7.381) 10.028 3.906 ( -3.036 -0.000 8.598) 9.119 4.085 ( -6.617 -0.000 -12.161) 13.845 4.655 ( -7.828 -0.000 -3.574) 8.605 4.839 ( -7.267 -0.000 7.980) 10.793 5.070 ( -9.950 -0.000 3.797) 10.650 5.084 ( -0.602 -0.000 0.597) 0.848 5.305 ( -7.661 -0.000 -3.255) 8.324 5.520 ( -2.123 -0.000 -5.033) 5.462 5.814 ( -7.139 -0.000 0.175) 7.141 5.830 ( 9.660 0.000 4.413) 10.621 6.058 ( -2.931 -0.000 -3.442) 4.521 6.275 ( 7.151 0.000 -5.433) 8.981 6.497 ( 9.982 0.000 1.744) 10.133 6.546 ( 8.721 0.000 -0.667) 8.746 6.619 ( 6.342 0.000 -2.500) 6.817 6.767 ( 8.465 0.000 0.862) 8.509 7.326 ( -5.978 -0.000 -0.485) 5.997 7.331 ( -1.001 -0.000 0.370) 1.068 7.393 ( -0.796 -0.000 1.098) 1.356 7.417 ( -3.307 -0.000 -0.840) 3.412 8.665 ( -4.149 -0.000 2.677) 4.937 8.807 ( -0.130 -0.000 0.645) 0.658 8.840 ( -3.810 -0.000 4.564) 5.946 8.924 ( -5.162 -0.000 -0.833) 5.229 10.359 ( 4.759 0.000 -1.965) 5.148 10.446 ( -0.858 -0.000 2.183) 2.346 10.526 ( 0.163 0.000 -1.120) 1.132 10.751 ( 6.005 0.000 6.493) 8.845 15.794 ( 5.144 0.000 -0.796) 5.205 16.009 ( 3.974 0.000 -2.033) 4.464 16.525 ( -4.092 -0.000 2.780) 4.947 16.640 ( -0.338 -0.000 -3.541) 3.557 17.371 ( -13.635 -0.000 2.674) 13.894 17.593 ( -6.642 -0.000 -0.555) 6.665 18.012 ( 0.154 0.000 0.003) 0.154 18.287 ( 0.258 0.000 -0.572) 0.628 18.901 ( 10.856 0.000 3.537) 11.417 18.997 ( 8.752 0.000 -3.473) 9.416 19.403 ( 3.036 0.000 -3.739) 4.816 19.506 ( 11.009 0.000 7.290) 13.204 ======================= Grid point 150 (59/138) ======================= q-point: ( 0.27 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( 1.722 -1.881 2.866) 3.836 1.430 ( 1.228 -3.377 -1.172) 3.780 1.619 ( 21.308 4.106 -9.924) 23.862 1.879 ( 8.299 -0.206 -4.111) 9.264 2.286 ( 3.164 -1.766 -7.934) 8.722 2.329 ( 3.487 2.179 2.158) 4.644 2.462 ( 9.409 -6.851 16.929) 20.544 2.580 ( 5.177 -6.169 3.373) 8.731 2.722 ( 3.186 0.753 -6.741) 7.494 2.891 ( -2.757 -5.081 3.392) 6.703 2.962 ( 10.778 1.032 0.069) 10.827 3.202 ( 7.174 -7.314 3.628) 10.868 3.358 ( 6.984 -1.116 6.250) 9.438 3.550 ( 8.054 0.369 -6.985) 10.667 3.894 ( -5.193 -0.051 4.610) 6.944 3.967 ( -7.102 2.233 -10.481) 12.856 4.523 ( -5.521 6.241 -3.155) 8.910 4.682 ( -8.544 9.348 2.690) 12.947 5.019 ( -5.662 1.340 7.388) 9.404 5.070 ( -6.605 -1.508 2.172) 7.115 5.267 ( -5.979 -1.921 -3.896) 7.391 5.464 ( -2.352 1.774 -3.572) 4.630 5.704 ( -8.112 2.802 -4.323) 9.609 5.871 ( 0.367 0.959 3.031) 3.200 6.132 ( 5.480 -3.797 1.394) 6.811 6.277 ( 4.966 1.849 -3.059) 6.118 6.537 ( 6.677 0.878 0.745) 6.775 6.654 ( 6.164 -0.768 -1.230) 6.333 6.764 ( 11.186 -6.469 0.781) 12.945 6.851 ( 7.964 -2.667 -1.566) 8.543 7.269 ( -7.073 -0.385 -0.173) 7.085 7.313 ( -1.422 1.099 0.447) 1.852 7.383 ( -2.127 0.096 -0.309) 2.151 7.401 ( -0.347 -0.643 0.431) 0.848 8.644 ( -2.249 -0.138 2.424) 3.310 8.793 ( -0.834 1.464 0.648) 1.805 8.836 ( -1.578 -0.999 3.236) 3.736 8.896 ( -4.409 -1.584 -2.884) 5.502 10.335 ( 2.539 3.828 0.083) 4.594 10.489 ( -0.043 -2.894 0.526) 2.941 10.517 ( 0.160 0.624 -0.694) 0.947 10.814 ( 1.872 0.172 4.163) 4.567 15.854 ( 6.010 -1.417 0.035) 6.175 16.031 ( 3.290 -0.017 -0.787) 3.383 16.522 ( -4.726 -2.708 3.455) 6.450 16.658 ( -0.889 -3.275 -4.292) 5.472 17.298 ( -11.552 -3.315 2.483) 12.273 17.559 ( -6.399 -2.747 -0.570) 6.988 18.005 ( -1.328 0.032 0.288) 1.359 18.273 ( -0.495 1.116 -1.097) 1.641 19.006 ( 10.125 -0.250 2.235) 10.372 19.083 ( 8.653 -1.747 -2.498) 9.175 19.374 ( 4.317 5.057 -3.931) 7.724 19.570 ( 11.558 6.256 5.440) 14.224 ======================= Grid point 151 (60/138) ======================= q-point: ( 0.36 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( -0.829 1.089 3.871) 4.106 1.564 ( 1.342 -10.488 -1.712) 10.711 1.729 ( 19.504 0.910 -6.411) 20.551 1.905 ( 3.954 2.242 -0.367) 4.560 2.244 ( -0.693 2.435 -5.139) 5.729 2.366 ( 1.303 -2.413 -2.748) 3.882 2.619 ( 1.971 -3.073 10.776) 11.378 2.698 ( -0.439 0.950 -1.521) 1.846 2.787 ( 6.045 -8.846 1.444) 10.811 2.966 ( 2.822 -3.886 1.890) 5.161 3.115 ( 12.348 0.273 -0.667) 12.369 3.352 ( 3.827 -2.294 4.000) 5.993 3.499 ( 10.556 -3.913 3.941) 11.927 3.623 ( 10.567 -1.603 -5.240) 11.903 3.832 ( -5.945 -1.316 -7.944) 10.009 3.886 ( -3.230 0.522 3.746) 4.974 4.371 ( 0.284 6.498 -1.682) 6.718 4.452 ( -7.640 8.430 1.703) 11.504 4.961 ( -3.931 4.022 3.863) 6.823 4.994 ( -13.865 2.313 2.070) 14.208 5.211 ( -4.370 0.517 -2.573) 5.097 5.426 ( -1.077 -0.067 -1.179) 1.598 5.625 ( -5.445 -3.405 -6.052) 8.824 5.847 ( -3.161 1.808 4.526) 5.809 6.173 ( 5.000 2.931 -0.968) 5.876 6.303 ( 5.510 1.490 -0.138) 5.710 6.607 ( 4.207 -1.741 1.726) 4.870 6.725 ( 5.163 -2.770 -0.921) 5.931 6.860 ( 6.419 0.974 -0.664) 6.526 7.052 ( 8.580 -8.893 0.333) 12.362 7.222 ( -6.309 -1.071 -1.122) 6.497 7.277 ( -2.145 1.191 0.632) 2.533 7.379 ( -0.371 -1.215 -0.526) 1.375 7.414 ( 0.584 -0.225 1.091) 1.258 8.647 ( -1.111 -0.939 1.141) 1.849 8.752 ( -0.846 2.279 0.791) 2.557 8.856 ( -1.480 -1.430 2.570) 3.293 8.877 ( -2.850 -0.954 -4.173) 5.142 10.295 ( 1.145 2.703 0.596) 2.995 10.502 ( -1.328 0.374 -0.538) 1.481 10.528 ( 0.736 -0.727 0.190) 1.052 10.789 ( -1.753 3.121 1.920) 4.062 15.939 ( 5.627 -2.309 0.737) 6.127 16.070 ( 2.813 -1.705 -0.699) 3.363 16.544 ( -5.365 -2.742 4.799) 7.703 16.695 ( -0.971 -3.563 -4.918) 6.151 17.305 ( -8.753 -6.472 2.177) 11.102 17.577 ( -5.654 -5.499 -0.901) 7.938 18.003 ( -1.754 -1.415 0.902) 2.427 18.237 ( -1.068 1.432 -2.251) 2.874 19.085 ( 7.605 0.995 1.434) 7.803 19.168 ( 6.009 -0.676 -1.120) 6.150 19.294 ( 6.652 7.820 -3.008) 10.699 19.523 ( 9.855 10.830 3.015) 14.950 ======================= Grid point 152 (61/138) ======================= q-point: ( 0.45 0.18 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( 2.028 6.461 5.007) 8.422 1.778 ( 2.891 -10.919 1.857) 11.446 1.866 ( 4.951 -2.422 -8.567) 10.187 1.912 ( 5.262 -4.116 2.279) 7.059 2.172 ( 2.351 5.012 0.661) 5.575 2.420 ( 2.846 -3.681 -8.351) 9.560 2.629 ( -3.422 1.056 1.019) 3.723 2.763 ( 1.084 -3.922 8.520) 9.442 2.976 ( 1.141 -6.333 3.553) 7.351 3.074 ( 2.389 -4.683 4.283) 6.781 3.141 ( 14.088 4.058 -5.224) 15.564 3.309 ( -5.450 3.827 -6.904) 9.593 3.568 ( 6.570 8.568 3.980) 11.507 3.766 ( 10.313 -0.127 -4.080) 11.091 3.831 ( -1.611 -4.809 -1.574) 5.310 3.908 ( -0.507 -4.743 1.688) 5.060 4.251 ( -0.184 5.732 -2.615) 6.303 4.406 ( 4.712 -3.072 5.355) 7.767 4.770 ( -14.856 6.389 1.630) 16.254 4.807 ( -13.404 6.625 -1.251) 15.004 5.192 ( 0.864 0.937 1.264) 1.795 5.437 ( 1.275 -2.087 -1.632) 2.940 5.665 ( -3.961 -4.920 -2.588) 6.826 5.792 ( -3.819 0.933 2.443) 4.628 6.164 ( 5.806 2.927 0.332) 6.510 6.301 ( 3.134 2.533 0.476) 4.058 6.646 ( 3.720 0.784 -0.497) 3.834 6.822 ( 3.101 -3.051 -0.658) 4.400 6.887 ( 4.991 0.990 -0.439) 5.107 7.196 ( -5.826 -3.266 -1.452) 6.835 7.231 ( -2.055 0.990 1.004) 2.493 7.256 ( 5.608 -4.993 1.323) 7.625 7.411 ( 0.657 -1.508 -1.138) 2.000 7.427 ( 1.169 -0.629 1.335) 1.883 8.646 ( -0.678 0.739 -0.361) 1.066 8.727 ( -0.002 0.013 1.880) 1.880 8.843 ( -2.810 0.171 -4.436) 5.254 8.876 ( -1.602 -1.161 2.257) 3.001 10.264 ( 0.321 1.723 0.458) 1.811 10.457 ( -2.985 3.208 -0.278) 4.391 10.531 ( 1.343 0.822 0.101) 1.577 10.733 ( -2.705 0.633 0.735) 2.874 16.028 ( 4.256 -2.443 1.107) 5.031 16.128 ( 2.276 -2.556 -1.160) 3.614 16.547 ( -5.672 -1.113 5.854) 8.227 16.735 ( 0.039 -3.421 -5.247) 6.264 17.377 ( -5.910 -7.887 2.193) 10.096 17.642 ( -4.348 -7.122 -1.455) 8.470 18.040 ( -1.616 -4.463 1.288) 4.918 18.208 ( -0.967 -0.673 -3.139) 3.352 19.089 ( 3.398 5.082 0.264) 6.119 19.133 ( 1.996 9.533 0.438) 9.749 19.238 ( 7.717 4.944 -0.750) 9.196 19.425 ( 8.439 8.261 0.648) 11.827 ======================= Grid point 153 (62/138) ======================= q-point: ( 0.55 0.18 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( 8.346 4.723 0.514) 9.604 1.850 ( -5.226 -0.691 2.269) 5.739 1.946 ( -5.053 -6.084 3.255) 8.552 2.101 ( 1.975 -7.239 -2.707) 7.977 2.209 ( 16.488 -2.847 5.492) 17.610 2.481 ( 3.686 -1.426 -5.280) 6.595 2.597 ( 1.032 -1.226 -3.414) 3.771 2.799 ( -5.476 0.830 1.760) 5.811 2.979 ( 0.431 5.032 2.266) 5.536 3.164 ( -3.897 2.198 -3.305) 5.562 3.179 ( 5.966 -3.032 -0.880) 6.750 3.324 ( 11.630 -7.275 -2.523) 13.948 3.408 ( 3.668 12.964 -0.701) 13.491 3.672 ( -2.244 8.985 -1.150) 9.332 3.860 ( -4.330 2.959 4.196) 6.716 4.058 ( 4.829 -6.406 0.210) 8.025 4.227 ( 0.245 -2.234 -2.348) 3.250 4.424 ( -8.057 3.669 3.285) 9.443 4.542 ( -14.099 6.677 -2.135) 15.746 4.685 ( -1.239 -4.593 0.857) 4.834 5.184 ( 3.434 1.569 3.850) 5.393 5.507 ( 4.332 -2.028 -0.760) 4.843 5.642 ( -5.961 -0.356 1.753) 6.224 5.830 ( 0.022 -5.895 -4.848) 7.632 6.161 ( 4.424 3.313 0.705) 5.572 6.285 ( 0.349 1.474 1.848) 2.390 6.668 ( 5.187 0.445 0.084) 5.207 6.835 ( 1.374 2.821 -1.290) 3.392 6.916 ( 2.978 0.311 -1.158) 3.210 7.178 ( -3.545 0.260 1.558) 3.881 7.222 ( -1.762 -2.842 -2.611) 4.242 7.369 ( 2.398 -2.035 2.023) 3.740 7.412 ( 0.780 1.185 0.557) 1.524 7.467 ( 0.026 -2.091 -0.531) 2.157 8.622 ( 0.246 1.072 -0.249) 1.128 8.755 ( 0.918 -1.246 2.300) 2.773 8.795 ( -3.503 0.373 -3.639) 5.065 8.893 ( -1.380 -1.709 1.622) 2.731 10.248 ( 0.234 0.340 0.178) 0.450 10.360 ( -2.980 3.576 -0.158) 4.657 10.537 ( 1.672 0.004 0.302) 1.699 10.724 ( -2.191 -1.424 -0.079) 2.614 16.093 ( 2.142 -1.256 0.974) 2.668 16.178 ( 1.538 -1.372 -1.612) 2.617 16.531 ( -4.899 -0.486 6.712) 8.324 16.783 ( 1.273 -3.278 -5.274) 6.339 17.477 ( -3.180 -7.018 2.446) 8.084 17.729 ( -2.567 -6.719 -2.413) 7.587 18.140 ( -1.448 -7.788 1.251) 8.019 18.244 ( 0.054 -5.551 -3.040) 6.329 18.923 ( 0.315 14.661 0.292) 14.667 18.962 ( 0.579 11.073 -0.272) 11.091 19.209 ( 4.008 4.449 2.291) 6.412 19.394 ( 6.657 3.930 -1.290) 7.837 ======================= Grid point 154 (63/138) ======================= q-point: (-0.36 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( 14.525 -3.739 -1.636) 15.087 1.815 ( -10.357 -1.927 -0.544) 10.548 1.957 ( -5.531 -0.189 9.141) 10.686 2.192 ( 3.569 -0.653 -0.870) 3.732 2.422 ( 8.952 -2.915 -1.203) 9.492 2.481 ( 3.885 1.098 -0.156) 4.040 2.661 ( -4.835 6.480 -3.223) 8.704 2.740 ( 6.573 -7.439 0.614) 9.946 2.887 ( 5.313 7.321 -0.341) 9.052 3.102 ( -3.001 1.211 -5.237) 6.156 3.250 ( -1.683 -0.185 -6.900) 7.105 3.266 ( 6.607 5.109 7.992) 11.559 3.416 ( -2.967 7.255 1.412) 7.965 3.554 ( 4.646 -1.735 -2.740) 5.666 3.708 ( -7.155 9.029 0.680) 11.541 4.015 ( -12.275 8.207 1.163) 14.811 4.227 ( 3.833 0.992 1.065) 4.100 4.372 ( -3.527 -3.325 1.953) 5.226 4.517 ( -3.535 -11.444 0.702) 11.998 4.704 ( -4.035 -0.087 -1.548) 4.322 5.268 ( 7.196 -3.824 3.085) 8.713 5.516 ( -3.725 -0.020 3.876) 5.376 5.677 ( 3.849 -2.773 -3.334) 5.798 5.913 ( 0.880 -4.981 -6.490) 8.228 6.121 ( 2.039 4.581 0.580) 5.048 6.265 ( -2.975 0.091 2.103) 3.644 6.717 ( 5.060 0.686 0.889) 5.183 6.772 ( 3.134 4.888 -0.176) 5.809 6.901 ( 0.294 2.356 -1.455) 2.784 7.173 ( 0.593 0.483 1.549) 1.727 7.236 ( -3.568 -2.119 -2.495) 4.842 7.371 ( -1.909 1.591 0.900) 2.644 7.395 ( 1.583 2.211 0.491) 2.763 7.486 ( -0.782 -0.400 -0.161) 0.893 8.622 ( 0.857 -0.594 0.074) 1.046 8.737 ( -1.527 1.289 -2.392) 3.117 8.812 ( -0.297 -2.643 2.792) 3.856 8.927 ( -0.615 -2.897 0.616) 3.025 10.262 ( 0.869 -1.296 -0.093) 1.563 10.311 ( -1.838 -0.724 -0.088) 1.977 10.560 ( 2.140 -0.507 0.595) 2.278 10.732 ( -1.797 -1.352 -0.729) 2.364 16.105 ( 0.037 1.524 0.696) 1.676 16.179 ( 0.305 1.540 -2.137) 2.652 16.538 ( -2.885 -1.837 7.103) 7.884 16.836 ( 2.075 -2.999 -4.965) 6.161 17.578 ( -1.115 -5.826 2.943) 6.622 17.813 ( -0.082 -5.476 -3.679) 6.597 18.282 ( -0.336 -9.066 0.851) 9.112 18.379 ( 1.258 -9.190 -1.995) 9.488 18.666 ( -2.423 13.199 1.002) 13.457 18.739 ( -1.259 13.509 -1.047) 13.608 19.164 ( 1.414 4.614 3.618) 6.032 19.367 ( 3.920 4.102 -2.302) 6.123 ======================= Grid point 155 (64/138) ======================= q-point: (-0.27 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( 15.910 -7.919 -1.558) 17.840 1.714 ( -9.057 3.883 -1.215) 9.929 1.920 ( -8.736 0.975 5.123) 10.174 2.172 ( 2.484 4.017 -7.776) 9.098 2.381 ( 0.755 9.587 2.515) 9.940 2.513 ( 6.854 6.504 -1.146) 9.518 2.566 ( 0.589 -3.009 3.197) 4.429 2.747 ( 2.893 8.826 3.941) 10.090 2.871 ( -1.510 5.685 -4.021) 7.126 3.059 ( -11.377 5.447 3.268) 13.031 3.123 ( 3.357 -2.573 -0.730) 4.292 3.317 ( 5.139 -1.339 4.123) 6.723 3.385 ( 1.737 0.165 -5.013) 5.308 3.506 ( 0.871 5.742 -0.641) 5.843 3.547 ( -5.362 1.504 -1.611) 5.798 3.802 ( -5.296 4.981 -0.191) 7.272 4.296 ( 4.514 -3.817 3.723) 6.987 4.439 ( -2.496 -5.252 2.325) 6.262 4.648 ( 1.098 -0.585 -0.300) 1.280 4.736 ( -6.352 -13.545 -2.767) 15.215 5.377 ( 3.767 -0.275 0.143) 3.780 5.555 ( -0.782 -6.892 4.786) 8.427 5.686 ( -0.082 3.402 -6.063) 6.952 5.976 ( 1.260 -2.673 -5.652) 6.378 6.075 ( 3.576 1.529 2.084) 4.412 6.255 ( -4.757 -2.198 1.141) 5.363 6.670 ( 2.084 5.313 0.541) 5.733 6.771 ( 3.704 3.017 2.318) 5.310 6.841 ( 2.086 5.014 -0.780) 5.487 7.091 ( -4.817 7.172 -2.042) 8.878 7.257 ( -0.585 -2.594 0.779) 2.771 7.332 ( -0.887 1.247 -0.199) 1.543 7.380 ( 0.938 0.274 0.865) 1.305 7.468 ( -0.775 1.167 -0.271) 1.427 8.650 ( 0.759 -1.518 0.177) 1.706 8.706 ( -0.957 0.301 -1.413) 1.733 8.859 ( 0.040 -1.638 3.221) 3.614 8.982 ( 0.140 -3.411 -0.762) 3.498 10.299 ( 0.947 -1.930 0.441) 2.194 10.354 ( -0.709 -4.993 -0.629) 5.082 10.590 ( 2.219 -0.248 1.123) 2.499 10.731 ( -1.620 -0.661 -1.450) 2.272 16.045 ( -1.125 4.826 0.882) 5.033 16.127 ( 0.038 3.361 -2.774) 4.357 16.584 ( -1.433 -2.851 6.753) 7.469 16.885 ( 2.028 -2.183 -4.559) 5.447 17.678 ( -0.663 -5.234 3.624) 6.401 17.899 ( 2.590 -4.767 -4.680) 7.165 18.373 ( 2.171 10.540 1.180) 10.825 18.450 ( 2.527 11.470 -1.052) 11.792 18.480 ( -4.527 -6.229 0.548) 7.720 18.618 ( -3.393 -10.630 -1.167) 11.220 19.096 ( -0.733 4.990 4.372) 6.675 19.304 ( 1.866 4.989 -2.980) 6.103 ======================= Grid point 156 (65/138) ======================= q-point: (-0.18 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( -3.841 11.778 1.291) 12.455 1.681 ( -0.269 5.625 0.366) 5.643 1.817 ( -4.939 0.893 -10.735) 11.850 2.051 ( 3.431 7.807 -7.626) 11.440 2.257 ( 7.353 8.132 7.399) 13.227 2.435 ( 1.793 7.788 1.680) 8.166 2.548 ( -7.260 10.289 2.684) 12.876 2.650 ( 1.248 -2.160 7.171) 7.593 2.724 ( 0.373 6.293 1.222) 6.421 2.914 ( -2.247 1.932 2.112) 3.639 3.222 ( 1.572 -1.508 2.555) 3.357 3.257 ( 0.331 8.785 -2.110) 9.041 3.366 ( -3.047 2.140 -1.893) 4.177 3.428 ( 4.075 1.396 -0.450) 4.331 3.670 ( 2.596 -11.335 -3.570) 12.164 3.752 ( -1.040 -2.583 0.652) 2.860 4.427 ( 4.044 -4.925 1.147) 6.476 4.507 ( -6.271 -6.066 1.377) 8.832 4.721 ( 5.331 -5.805 2.044) 8.142 4.898 ( -5.499 -11.622 -5.656) 14.047 5.365 ( 2.252 3.308 -0.172) 4.005 5.540 ( -4.639 6.301 -7.735) 11.002 5.721 ( 1.452 -7.729 5.203) 9.429 5.984 ( -1.390 -1.083 -2.287) 2.887 6.165 ( 7.736 -3.311 2.280) 8.718 6.254 ( -5.362 -1.980 -0.489) 5.737 6.604 ( 2.826 5.431 2.658) 6.674 6.694 ( -4.947 5.010 -0.584) 7.065 6.755 ( 3.801 8.883 1.804) 9.829 6.893 ( -0.985 9.358 -3.160) 9.927 7.294 ( 0.073 -1.473 0.035) 1.475 7.308 ( -0.538 0.358 -0.469) 0.799 7.410 ( 0.530 -1.920 1.162) 2.307 7.445 ( -0.093 0.785 0.519) 0.946 8.682 ( 0.866 -1.017 0.577) 1.455 8.699 ( -1.000 -0.809 -0.331) 1.328 8.884 ( -0.102 -0.156 2.775) 2.781 9.030 ( 0.219 -2.265 -2.471) 3.359 10.344 ( 0.118 -2.006 1.781) 2.685 10.440 ( -0.427 -5.170 -1.822) 5.498 10.605 ( 0.798 0.840 1.972) 2.287 10.721 ( -0.764 -0.263 -2.450) 2.579 15.942 ( -0.709 5.957 1.291) 6.137 16.051 ( 0.752 4.548 -3.237) 5.633 16.643 ( -1.280 -2.552 6.033) 6.675 16.910 ( 1.138 -0.482 -4.273) 4.448 17.762 ( -2.706 -4.469 3.807) 6.465 17.994 ( 4.017 -4.544 -4.983) 7.849 18.168 ( -1.102 11.360 0.355) 11.419 18.200 ( -0.120 13.313 -0.793) 13.337 18.656 ( 1.740 -9.443 3.145) 10.104 18.807 ( -0.982 -12.311 -2.396) 12.580 19.009 ( -1.938 5.068 4.588) 7.106 19.213 ( 1.154 5.525 -3.221) 6.498 ======================= Grid point 157 (66/138) ======================= q-point: (-0.09 0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( 3.506 15.982 5.175) 17.161 1.381 ( -9.119 19.883 3.855) 22.212 1.661 ( -6.855 3.429 -15.726) 17.494 1.962 ( 13.330 10.539 -12.188) 20.911 2.236 ( 7.884 10.023 18.679) 22.617 2.310 ( -1.725 4.768 1.034) 5.175 2.409 ( 0.501 0.763 -1.732) 1.958 2.617 ( 2.075 7.735 4.753) 9.313 2.761 ( -2.218 -7.525 1.983) 8.092 2.931 ( 3.724 0.479 4.170) 5.612 3.116 ( 0.201 6.875 1.018) 6.953 3.217 ( -0.533 3.404 -1.151) 3.633 3.251 ( -4.596 3.495 -2.136) 6.157 3.452 ( 4.107 1.142 -2.153) 4.775 3.796 ( 2.497 -3.556 2.522) 5.024 3.927 ( 0.503 -13.949 -5.496) 15.001 4.523 ( -2.340 -5.118 -2.089) 6.002 4.560 ( -5.165 -6.421 -0.398) 8.250 4.918 ( 3.715 -8.250 2.847) 9.485 5.027 ( -2.031 -10.687 -4.373) 11.725 5.293 ( -0.209 5.093 -0.088) 5.098 5.439 ( 0.473 0.070 -4.071) 4.099 5.830 ( 0.048 -1.375 6.484) 6.629 5.988 ( -4.135 -2.619 -3.847) 6.225 6.195 ( -7.216 2.628 -1.409) 7.807 6.276 ( 6.302 0.890 3.130) 7.092 6.530 ( -1.945 4.228 0.030) 4.654 6.561 ( -0.208 3.871 1.009) 4.006 6.643 ( 3.108 6.643 1.188) 7.430 6.764 ( 8.048 8.888 -2.727) 12.296 7.302 ( 0.216 -0.634 0.508) 0.841 7.320 ( -0.845 -1.355 -1.122) 1.952 7.442 ( -1.104 -1.358 0.611) 1.854 7.445 ( 0.112 -0.252 1.268) 1.297 8.691 ( -0.593 0.204 2.203) 2.290 8.723 ( -0.232 -2.282 0.007) 2.294 8.881 ( -0.363 1.195 2.495) 2.790 9.046 ( -0.335 -0.916 -4.130) 4.244 10.368 ( -2.273 -0.515 2.915) 3.732 10.493 ( 0.112 -1.402 -2.016) 2.458 10.586 ( -1.572 1.162 1.803) 2.659 10.720 ( 1.328 -0.446 -3.417) 3.693 15.850 ( 0.549 4.863 1.545) 5.132 15.970 ( 2.474 4.869 -3.041) 6.251 16.676 ( -2.278 -0.762 4.710) 5.288 16.889 ( -0.162 1.909 -4.199) 4.615 17.783 ( -8.731 -1.052 2.667) 9.189 17.972 ( -6.746 6.794 -1.278) 9.660 18.000 ( 2.868 7.600 1.069) 8.193 18.114 ( 9.163 -1.808 -3.826) 10.093 18.827 ( 3.420 -3.182 4.361) 6.390 18.936 ( -0.878 -1.636 4.395) 4.771 19.002 ( 1.476 -8.260 -3.309) 9.020 19.126 ( 1.823 3.862 -2.464) 4.930 ======================= Grid point 161 (67/138) ======================= q-point: ( 0.27 0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.292 ( 0.674 0.000 1.163) 1.344 1.296 ( -8.235 -0.000 -14.886) 17.012 1.817 ( 21.403 0.000 -10.066) 23.652 2.015 ( 12.292 0.000 7.854) 14.587 2.276 ( 0.439 0.000 -7.480) 7.492 2.462 ( 10.639 0.000 1.480) 10.742 2.462 ( 3.191 0.000 5.784) 6.606 2.561 ( 1.685 0.000 7.757) 7.938 2.741 ( 0.883 0.000 -0.535) 1.033 2.866 ( 4.766 0.000 9.693) 10.801 3.097 ( 15.452 0.000 -1.574) 15.532 3.204 ( 12.392 0.000 2.044) 12.560 3.416 ( 6.043 0.000 3.024) 6.757 3.606 ( 8.621 0.000 -7.047) 11.135 3.854 ( -7.365 -0.000 3.031) 7.964 3.896 ( -5.277 -0.000 -8.355) 9.882 4.518 ( -5.798 -0.000 -2.394) 6.273 4.705 ( -9.917 -0.000 -0.745) 9.945 4.939 ( -8.071 -0.000 5.148) 9.572 5.001 ( -12.682 -0.000 3.804) 13.240 5.264 ( 4.239 0.000 2.847) 5.107 5.409 ( -7.509 -0.000 -4.408) 8.707 5.667 ( -9.525 -0.000 -1.540) 9.649 5.834 ( -4.542 -0.000 -4.100) 6.119 6.193 ( 12.213 0.000 7.467) 14.314 6.303 ( 2.308 0.000 -8.271) 8.587 6.679 ( 10.477 0.000 -0.579) 10.493 6.684 ( 5.960 0.000 1.033) 6.049 6.761 ( 10.684 0.000 0.797) 10.713 6.889 ( 4.443 0.000 -1.618) 4.729 7.207 ( -6.071 -0.000 0.961) 6.147 7.307 ( -3.115 -0.000 -0.373) 3.137 7.362 ( -0.976 -0.000 -1.109) 1.477 7.396 ( -0.161 -0.000 0.910) 0.924 8.634 ( -1.577 -0.000 2.516) 2.969 8.802 ( -0.769 -0.000 -0.278) 0.818 8.817 ( -1.774 -0.000 2.590) 3.139 8.841 ( -3.046 -0.000 -1.314) 3.317 10.414 ( 2.900 0.000 -1.771) 3.398 10.442 ( -1.097 -0.000 1.793) 2.102 10.530 ( 0.971 0.000 -0.166) 0.985 10.843 ( 1.098 0.000 3.705) 3.864 15.898 ( 6.644 0.000 0.455) 6.659 16.050 ( 1.733 0.000 -0.160) 1.741 16.465 ( -4.857 -0.000 3.158) 5.793 16.614 ( 0.446 0.000 -4.331) 4.353 17.183 ( -10.172 -0.000 3.143) 10.647 17.479 ( -6.156 -0.000 -1.102) 6.254 17.989 ( -2.387 -0.000 0.007) 2.387 18.277 ( -0.603 -0.000 -1.163) 1.310 19.097 ( 9.556 0.000 2.105) 9.785 19.141 ( 9.593 0.000 -2.402) 9.889 19.444 ( 4.533 0.000 -3.190) 5.543 19.742 ( 11.382 0.000 3.961) 12.051 ======================= Grid point 162 (68/138) ======================= q-point: ( 0.36 0.27 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( -3.893 -7.147 -6.056) 10.144 1.339 ( -1.454 -4.992 -1.289) 5.357 1.914 ( 17.131 4.459 -10.442) 20.552 2.088 ( 7.606 4.092 7.487) 11.430 2.251 ( 0.915 0.757 -3.272) 3.481 2.402 ( 4.679 4.391 0.176) 6.419 2.579 ( -2.150 -3.130 2.505) 4.549 2.673 ( 1.816 -4.657 -0.692) 5.047 2.738 ( 2.276 -1.490 5.906) 6.503 2.988 ( 8.628 -1.657 8.709) 12.371 3.237 ( 16.650 0.044 -6.022) 17.705 3.380 ( 9.781 -3.473 6.126) 12.052 3.484 ( 3.287 -3.496 -4.028) 6.265 3.638 ( 5.011 0.226 -1.902) 5.364 3.792 ( -0.342 -0.594 -5.497) 5.539 3.883 ( 0.892 -0.383 3.554) 3.684 4.431 ( -3.472 3.582 -0.896) 5.068 4.541 ( -8.364 6.910 -1.666) 10.977 4.892 ( -11.530 0.199 3.595) 12.079 4.928 ( -11.250 -1.786 1.612) 11.504 5.263 ( 3.031 4.819 4.136) 7.037 5.351 ( -7.959 -2.304 -2.558) 8.672 5.550 ( -6.033 0.869 -4.000) 7.291 5.815 ( -4.839 -1.806 -0.975) 5.257 6.255 ( 4.511 2.342 -3.923) 6.420 6.371 ( 8.878 -2.325 3.803) 9.934 6.670 ( 7.242 4.179 0.286) 8.367 6.741 ( 4.195 -0.046 0.378) 4.212 6.900 ( 0.927 -0.577 -2.481) 2.711 6.971 ( 8.858 -8.472 1.506) 12.349 7.167 ( -3.632 0.733 0.392) 3.726 7.268 ( -3.044 0.223 -1.205) 3.281 7.361 ( 0.377 -0.451 -0.525) 0.788 7.410 ( 0.010 -1.121 1.088) 1.562 8.633 ( -0.715 -0.230 1.942) 2.082 8.779 ( -1.026 1.414 0.097) 1.750 8.819 ( -2.034 -1.134 -1.472) 2.755 8.833 ( -1.161 -1.158 1.165) 2.011 10.374 ( 1.771 3.773 0.337) 4.181 10.477 ( -1.071 -1.812 -0.218) 2.116 10.534 ( 1.571 0.437 0.226) 1.646 10.832 ( -1.474 2.513 1.528) 3.290 15.965 ( 6.060 -0.957 0.765) 6.182 16.067 ( 1.291 -0.664 0.093) 1.455 16.460 ( -5.171 -2.722 3.966) 7.062 16.627 ( 0.654 -2.173 -4.715) 5.233 17.149 ( -7.933 -3.827 3.313) 9.410 17.450 ( -5.335 -3.056 -1.692) 6.377 17.971 ( -2.434 -0.496 0.471) 2.528 18.250 ( -0.912 1.643 -2.308) 2.976 19.172 ( 7.835 0.845 1.367) 7.998 19.216 ( 7.703 -0.206 -1.136) 7.789 19.443 ( 5.769 3.868 -1.867) 7.192 19.778 ( 9.329 7.250 1.833) 11.956 ======================= Grid point 163 (69/138) ======================= q-point: ( 0.45 0.27 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( 3.227 -0.151 8.653) 9.237 1.445 ( -5.808 -14.676 -9.704) 18.528 1.915 ( 9.635 2.482 -12.045) 15.623 2.052 ( 2.694 7.384 8.215) 11.370 2.257 ( 3.481 0.391 -0.164) 3.507 2.410 ( 6.891 0.740 -0.087) 6.931 2.597 ( -3.379 -1.815 -0.446) 3.862 2.717 ( -0.763 -3.367 4.479) 5.655 2.893 ( 4.243 -6.633 4.016) 8.839 3.094 ( 8.263 -0.351 3.594) 9.018 3.264 ( -4.635 1.429 -13.701) 14.535 3.349 ( 8.876 7.291 1.050) 11.534 3.655 ( 4.166 -6.419 3.563) 8.441 3.747 ( 6.027 -4.485 0.188) 7.515 3.819 ( 0.281 -2.602 -4.408) 5.126 3.911 ( 10.068 4.825 4.303) 11.965 4.353 ( -4.738 6.789 -0.095) 8.279 4.407 ( 3.915 -2.045 1.295) 4.603 4.729 ( -16.470 5.716 -0.340) 17.437 4.802 ( -13.114 4.597 0.242) 13.899 5.237 ( 2.696 1.669 3.506) 4.727 5.350 ( -3.469 -5.419 -3.123) 7.151 5.553 ( -0.748 -4.338 -2.821) 5.228 5.777 ( -6.421 1.213 2.202) 6.895 6.251 ( 4.917 1.440 -1.961) 5.486 6.420 ( 6.269 5.354 1.838) 8.447 6.685 ( 3.786 0.136 0.151) 3.792 6.794 ( 3.621 -2.834 0.006) 4.599 6.917 ( 0.249 -1.000 -0.685) 1.237 7.097 ( -5.033 -0.252 0.004) 5.039 7.190 ( 4.262 -6.171 1.173) 7.591 7.249 ( 0.008 0.096 -1.100) 1.104 7.383 ( 0.991 -1.591 -0.939) 2.096 7.434 ( 0.541 -0.815 1.441) 1.742 8.640 ( -0.476 -0.401 0.827) 1.035 8.745 ( -0.620 1.392 0.430) 1.584 8.813 ( -1.201 -0.330 -3.069) 3.312 8.849 ( -1.466 -1.147 1.753) 2.557 10.327 ( 1.944 3.672 0.665) 4.208 10.469 ( -2.051 0.983 -0.224) 2.285 10.550 ( 1.827 -0.246 -0.215) 1.856 10.748 ( -3.599 4.037 0.632) 5.446 16.034 ( 3.847 -1.510 1.585) 4.426 16.104 ( 2.377 -2.021 -0.967) 3.266 16.478 ( -5.819 -2.780 5.077) 8.207 16.665 ( 1.021 -3.096 -5.047) 6.008 17.199 ( -5.506 -7.239 3.319) 9.682 17.484 ( -3.861 -6.028 -2.096) 7.459 17.975 ( -1.917 -2.005 1.028) 2.958 18.200 ( -1.032 1.676 -3.540) 4.050 19.198 ( 5.020 3.363 0.417) 6.057 19.249 ( 3.555 2.677 0.971) 4.555 19.411 ( 7.379 5.658 -0.851) 9.338 19.675 ( 6.352 11.729 0.096) 13.339 ======================= Grid point 164 (70/138) ======================= q-point: ( 0.55 0.27 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 5.922 5.502 1.333) 8.193 1.604 ( -9.149 -11.710 -9.107) 17.429 1.955 ( -1.508 0.861 3.100) 3.553 2.019 ( 8.821 -3.231 4.688) 10.499 2.295 ( 4.379 -1.256 0.426) 4.575 2.471 ( 3.922 -1.624 -0.909) 4.341 2.614 ( 5.622 -0.281 -1.973) 5.965 2.757 ( -5.375 -0.370 4.253) 6.864 3.008 ( 0.534 -2.528 -0.344) 2.607 3.122 ( -8.476 0.421 -4.758) 9.730 3.178 ( 6.443 -0.710 0.182) 6.484 3.384 ( 15.134 1.107 -4.234) 15.754 3.682 ( 3.896 9.795 2.930) 10.941 3.761 ( -1.382 2.434 0.527) 2.849 3.886 ( -2.479 -6.095 4.495) 7.969 3.950 ( 6.032 1.470 -2.702) 6.771 4.237 ( 0.958 3.179 -0.114) 3.322 4.430 ( -12.355 7.094 0.748) 14.266 4.537 ( -9.249 2.399 -2.161) 9.796 4.623 ( -0.855 -1.147 0.660) 1.575 5.248 ( 1.509 0.634 4.359) 4.656 5.464 ( 5.154 -7.322 -4.264) 9.918 5.603 ( -2.792 0.273 0.466) 2.844 5.704 ( -6.650 -2.652 0.278) 7.165 6.264 ( 4.917 2.459 0.491) 5.519 6.359 ( 2.236 5.201 0.653) 5.699 6.718 ( 4.959 0.047 -0.200) 4.963 6.875 ( 3.802 -0.950 -0.574) 3.961 6.913 ( -1.901 0.082 0.875) 2.095 7.073 ( -7.109 -3.831 -1.275) 8.176 7.222 ( 1.575 0.745 -1.521) 2.313 7.338 ( 2.123 -4.263 2.240) 5.262 7.416 ( 0.515 -1.554 -1.149) 2.000 7.454 ( 0.994 -0.247 1.438) 1.765 8.637 ( -0.185 0.528 -0.196) 0.593 8.734 ( -1.104 -0.638 0.185) 1.288 8.790 ( 0.232 1.117 -2.103) 2.393 8.859 ( -1.754 -1.184 1.342) 2.506 10.286 ( 1.663 2.938 0.581) 3.426 10.402 ( -3.006 3.968 -0.334) 4.989 10.561 ( 2.083 0.766 0.080) 2.221 10.682 ( -3.342 -0.267 0.170) 3.357 16.089 ( 1.237 -1.628 2.056) 2.900 16.163 ( 3.434 -1.930 -2.018) 4.426 16.485 ( -5.827 -1.845 6.101) 8.636 16.718 ( 1.619 -3.513 -5.184) 6.468 17.315 ( -3.239 -8.840 3.369) 10.000 17.572 ( -2.290 -7.594 -2.556) 8.334 18.021 ( -1.430 -4.753 1.227) 5.113 18.174 ( -0.287 -1.301 -3.967) 4.185 19.126 ( 1.655 8.546 -0.241) 8.708 19.172 ( 1.021 9.596 1.536) 9.772 19.355 ( 5.334 7.129 0.836) 8.943 19.538 ( 4.472 7.752 -1.112) 9.018 ======================= Grid point 165 (71/138) ======================= q-point: ( 0.64 0.27 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( 9.441 0.558 -3.088) 9.948 1.623 ( -13.306 -5.423 -5.964) 15.557 1.952 ( -1.572 0.067 9.504) 9.633 2.201 ( 5.460 -4.232 5.438) 8.792 2.392 ( 4.752 -5.698 -3.940) 8.401 2.503 ( 1.007 -0.464 -3.236) 3.420 2.653 ( -10.119 3.233 0.896) 10.661 2.733 ( 14.109 -4.891 -1.519) 15.010 2.992 ( -1.728 2.501 1.417) 3.353 3.090 ( -0.507 0.186 -4.304) 4.338 3.212 ( -0.026 -0.177 -1.540) 1.550 3.481 ( 2.208 0.523 0.979) 2.472 3.529 ( 7.594 12.208 -0.879) 14.404 3.669 ( 6.005 6.837 -0.218) 9.103 3.801 ( -5.347 9.496 3.470) 11.437 4.004 ( -7.677 -1.282 0.385) 7.793 4.239 ( -1.480 -1.882 0.439) 2.434 4.265 ( -7.590 -1.700 2.068) 8.048 4.397 ( 1.635 1.748 -0.790) 2.521 4.687 ( -1.063 -1.280 -2.953) 3.389 5.291 ( 4.377 -1.493 5.593) 7.257 5.501 ( -8.116 2.933 3.960) 9.495 5.626 ( 6.231 -5.611 -3.841) 9.223 5.776 ( -1.307 -7.676 -5.449) 9.504 6.233 ( 2.898 4.894 0.653) 5.725 6.290 ( -1.331 3.861 0.731) 4.149 6.771 ( 5.728 0.103 0.643) 5.765 6.873 ( 3.535 2.434 1.287) 4.480 6.890 ( -4.347 0.553 -0.675) 4.434 7.108 ( -4.287 -5.919 -1.046) 7.383 7.229 ( 3.455 1.043 -1.785) 4.026 7.366 ( -3.075 0.443 -0.220) 3.114 7.452 ( 2.539 0.268 0.999) 2.742 7.464 ( -0.423 -0.761 1.180) 1.467 8.627 ( 0.520 0.399 -0.247) 0.700 8.718 ( -2.845 0.059 -2.924) 4.080 8.797 ( 2.158 -0.734 2.339) 3.266 8.876 ( -1.356 -2.191 0.679) 2.664 10.264 ( 1.129 0.947 0.351) 1.514 10.312 ( -2.126 2.757 -0.370) 3.501 10.572 ( 1.589 -0.135 1.130) 1.954 10.683 ( -1.820 -1.936 -0.968) 2.828 16.119 ( -0.088 -0.373 1.600) 1.645 16.198 ( 2.440 0.268 -2.521) 3.518 16.493 ( -4.467 -2.218 7.025) 8.616 16.780 ( 2.076 -3.562 -5.050) 6.519 17.455 ( -1.448 -8.014 3.396) 8.824 17.682 ( -0.637 -7.481 -3.368) 8.229 18.125 ( -0.998 -8.003 1.013) 8.128 18.231 ( 0.698 -6.547 -3.284) 7.358 18.923 ( -0.247 15.326 0.756) 15.346 18.968 ( 0.173 13.139 -0.430) 13.147 19.279 ( 1.712 5.809 3.224) 6.861 19.464 ( 2.426 4.642 -2.279) 5.712 ======================= Grid point 166 (72/138) ======================= q-point: (-0.27 0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 3.296 -8.007 -1.576) 8.802 1.574 ( -6.479 -3.539 -4.015) 8.404 1.944 ( -3.144 3.105 10.579) 11.465 2.238 ( 0.367 2.852 -0.696) 2.959 2.461 ( -2.214 2.341 -3.618) 4.844 2.515 ( 3.274 -2.960 -6.123) 7.548 2.595 ( -0.976 -3.377 2.049) 4.068 2.893 ( 1.907 7.258 -1.594) 7.671 2.930 ( -1.455 -0.612 1.670) 2.298 3.051 ( 3.916 0.284 -1.794) 4.316 3.161 ( -3.408 3.722 1.412) 5.241 3.392 ( -3.348 1.611 1.295) 3.935 3.436 ( 7.036 6.704 -2.088) 9.940 3.588 ( -1.097 10.206 7.698) 12.831 3.663 ( 7.967 5.204 -5.754) 11.120 3.859 ( -5.350 6.675 -0.054) 8.555 4.234 ( -2.691 -3.372 2.882) 5.189 4.414 ( 6.165 -5.527 -1.095) 8.351 4.447 ( -4.073 -8.132 2.451) 9.419 4.657 ( -0.918 0.422 -2.253) 2.469 5.396 ( 3.927 -1.738 3.106) 5.300 5.443 ( -6.528 -4.542 5.789) 9.837 5.691 ( -0.652 -0.000 -5.354) 5.393 5.886 ( 2.790 -5.787 -7.735) 10.055 6.168 ( 1.400 4.231 2.048) 4.905 6.216 ( -2.805 1.883 0.155) 3.382 6.771 ( 1.655 3.140 1.004) 3.689 6.815 ( -2.979 2.841 -0.760) 4.186 6.922 ( 5.958 0.035 3.608) 6.965 7.129 ( -5.763 0.519 -4.683) 7.444 7.236 ( 4.387 0.301 1.540) 4.659 7.326 ( -2.796 -0.074 -0.905) 2.940 7.429 ( 0.816 2.869 1.429) 3.307 7.478 ( 0.295 0.533 -0.162) 0.630 8.632 ( -0.145 -0.655 0.263) 0.721 8.691 ( -1.014 -0.310 -2.663) 2.866 8.844 ( 1.237 -1.534 3.428) 3.954 8.918 ( -0.679 -3.424 -0.067) 3.491 10.280 ( -1.386 -1.966 -0.106) 2.408 10.283 ( 1.374 -0.731 -0.119) 1.561 10.597 ( 0.632 -0.834 1.823) 2.102 10.699 ( -0.465 -1.340 -1.905) 2.375 16.104 ( -0.616 2.307 0.974) 2.579 16.178 ( 1.435 2.681 -2.517) 3.948 16.533 ( -2.887 -3.308 7.143) 8.385 16.841 ( 1.977 -3.071 -4.836) 6.061 17.581 ( -0.990 -6.255 3.533) 7.252 17.796 ( 1.148 -6.778 -4.286) 8.101 18.285 ( -0.145 -10.443 1.188) 10.511 18.382 ( 0.685 -10.724 -2.577) 11.050 18.645 ( -0.609 15.734 1.535) 15.821 18.722 ( 0.302 14.918 -1.362) 14.983 19.197 ( -0.674 5.567 4.252) 7.037 19.388 ( 0.341 4.555 -2.953) 5.439 ======================= Grid point 167 (73/138) ======================= q-point: (-0.18 0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( -16.297 -4.355 -1.316) 16.920 1.738 ( 8.288 -3.562 -2.649) 9.402 1.831 ( -4.751 8.333 3.922) 10.363 2.164 ( 1.295 4.341 -2.156) 5.017 2.403 ( 1.456 2.413 -0.512) 2.865 2.508 ( -3.140 3.227 -1.201) 4.660 2.627 ( -1.982 2.417 1.963) 3.691 2.750 ( 0.506 3.707 -1.634) 4.082 2.796 ( -7.605 7.535 5.728) 12.142 3.048 ( 8.157 6.489 3.261) 10.921 3.191 ( 4.841 -3.637 -5.578) 8.233 3.345 ( -5.209 -0.567 1.331) 5.406 3.386 ( 1.810 6.248 -5.599) 8.583 3.526 ( 2.903 3.597 9.163) 10.263 3.605 ( 10.336 3.772 -5.054) 12.108 3.763 ( 1.736 2.019 -1.577) 3.095 4.306 ( -4.635 -5.945 3.603) 8.355 4.461 ( -0.959 -0.675 5.406) 5.532 4.616 ( -2.106 -11.179 -3.859) 12.012 4.704 ( 5.585 -4.299 -2.173) 7.376 5.408 ( -1.125 -0.904 1.757) 2.274 5.581 ( -2.753 3.563 -6.796) 8.152 5.594 ( -2.043 -6.305 6.594) 9.349 5.930 ( -1.709 -1.264 -7.303) 7.606 6.168 ( -1.601 -1.412 -0.417) 2.175 6.203 ( 4.869 -1.556 2.778) 5.817 6.709 ( -4.586 3.156 -0.068) 5.567 6.743 ( 1.670 5.237 2.129) 5.894 6.898 ( -3.028 6.709 0.768) 7.401 7.037 ( 4.440 4.526 -2.579) 6.845 7.278 ( 1.713 -0.585 1.183) 2.162 7.311 ( -1.109 0.199 -0.847) 1.410 7.410 ( 1.145 0.290 1.488) 1.900 7.458 ( 0.285 1.334 -0.873) 1.619 8.646 ( -1.512 -1.794 0.144) 2.350 8.694 ( 0.866 -0.433 -1.080) 1.451 8.882 ( 0.055 -0.893 3.372) 3.489 8.974 ( -0.415 -3.365 -1.214) 3.602 10.304 ( -0.934 -2.302 0.595) 2.554 10.346 ( 0.539 -4.520 -0.768) 4.616 10.611 ( -1.553 -0.292 1.622) 2.265 10.711 ( 1.329 -0.500 -1.963) 2.423 16.038 ( -0.211 4.851 0.712) 4.907 16.127 ( 1.901 3.783 -2.528) 4.931 16.593 ( -2.556 -3.455 6.837) 8.075 16.883 ( 1.098 -1.858 -4.718) 5.188 17.672 ( -2.505 -4.504 3.377) 6.161 17.907 ( 1.635 -5.891 -4.448) 7.561 18.364 ( -3.082 10.453 1.219) 10.965 18.440 ( -0.670 11.308 -1.062) 11.377 18.526 ( 4.713 -5.916 1.611) 7.734 18.589 ( 2.466 -10.726 -2.256) 11.235 19.103 ( -1.847 5.553 4.641) 7.468 19.297 ( -0.357 4.650 -3.238) 5.677 ======================= Grid point 168 (74/138) ======================= q-point: (-0.09 0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( -10.904 -1.918 1.630) 11.191 1.609 ( -4.667 12.253 3.951) 13.694 1.672 ( -2.566 10.132 -8.892) 13.723 2.127 ( 7.960 4.981 -6.558) 11.453 2.353 ( -4.263 4.688 -1.633) 6.544 2.439 ( 2.878 0.295 8.532) 9.009 2.551 ( 3.704 7.197 2.260) 8.404 2.651 ( -1.942 2.675 -0.322) 3.321 2.777 ( 0.793 -0.718 7.885) 7.957 3.020 ( 9.031 6.018 2.999) 11.259 3.247 ( -1.723 2.438 -2.343) 3.795 3.248 ( 0.756 3.179 -0.582) 3.319 3.297 ( 1.725 5.617 -4.193) 7.219 3.509 ( 3.358 2.209 1.733) 4.377 3.709 ( 5.572 -8.348 -5.417) 11.405 3.796 ( 5.161 -1.454 1.267) 5.509 4.350 ( -8.309 -4.984 -0.405) 9.698 4.485 ( -3.753 -2.726 4.499) 6.462 4.783 ( -1.380 -9.573 -7.466) 12.218 4.857 ( 7.174 -7.874 3.757) 11.295 5.393 ( -3.274 7.397 -4.151) 9.092 5.433 ( 0.488 -1.300 0.284) 1.417 5.761 ( -1.358 -7.555 7.095) 10.453 5.893 ( -5.260 -1.089 -4.879) 7.257 6.145 ( -4.727 -0.148 -3.457) 5.858 6.332 ( 7.534 -2.427 2.684) 8.358 6.586 ( -4.924 5.244 -0.419) 7.206 6.643 ( -1.627 5.418 1.605) 5.880 6.776 ( 2.127 5.509 0.517) 5.928 6.991 ( 9.582 7.703 -1.356) 12.369 7.292 ( -0.808 -0.151 -0.215) 0.850 7.301 ( 0.324 -0.567 0.053) 0.655 7.424 ( 0.285 0.199 1.026) 1.084 7.446 ( -0.141 -0.107 0.047) 0.184 8.669 ( -1.567 -2.349 -0.486) 2.865 8.704 ( 0.675 0.041 0.935) 1.154 8.897 ( -0.582 0.133 2.950) 3.010 9.006 ( -1.100 -1.706 -2.937) 3.570 10.331 ( -2.527 -1.717 1.282) 3.313 10.431 ( 0.463 -4.844 -1.006) 4.969 10.587 ( -3.084 0.870 0.596) 3.259 10.727 ( 2.195 -0.062 -1.138) 2.473 15.952 ( 1.021 5.402 0.827) 5.559 16.068 ( 3.171 4.441 -2.549) 6.023 16.642 ( -3.202 -2.370 6.260) 7.420 16.888 ( -0.310 0.062 -4.648) 4.659 17.704 ( -5.785 -1.743 2.468) 6.526 17.966 ( -3.528 -0.827 -2.690) 4.513 18.164 ( 0.342 9.553 0.305) 9.564 18.237 ( 3.656 8.997 -1.286) 9.796 18.743 ( 4.782 -10.262 2.353) 11.563 18.803 ( 3.327 -11.285 -1.869) 11.913 19.014 ( -0.651 4.375 4.143) 6.060 19.207 ( 0.532 4.368 -3.031) 5.343 ======================= Grid point 173 (75/138) ======================= q-point: ( 0.36 0.36 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( -1.452 -0.000 -3.033) 3.362 1.313 ( 0.465 0.000 3.699) 3.728 2.084 ( 15.171 0.000 -6.905) 16.668 2.122 ( 0.885 0.000 -9.139) 9.182 2.277 ( -0.160 -0.000 4.355) 4.358 2.463 ( -2.057 -0.000 1.126) 2.345 2.593 ( -0.151 -0.000 1.807) 1.814 2.648 ( 9.733 0.000 -0.814) 9.767 2.756 ( 1.748 0.000 5.619) 5.884 3.074 ( 7.081 0.000 7.827) 10.555 3.305 ( -2.615 -0.000 -7.892) 8.314 3.443 ( 22.251 0.000 -2.103) 22.350 3.528 ( 9.451 0.000 3.937) 10.238 3.662 ( -10.951 -0.000 9.093) 14.234 3.760 ( 9.625 0.000 -15.283) 18.061 3.939 ( 10.349 0.000 5.929) 11.927 4.439 ( -1.842 -0.000 -0.152) 1.848 4.494 ( -12.663 -0.000 -4.018) 13.285 4.804 ( -9.696 -0.000 -0.065) 9.696 4.851 ( -7.181 -0.000 5.474) 9.030 5.217 ( -11.022 -0.000 -3.515) 11.569 5.377 ( 0.797 0.000 8.570) 8.607 5.477 ( -8.327 -0.000 -3.268) 8.945 5.752 ( -1.730 -0.000 -3.236) 3.669 6.290 ( 2.995 0.000 -7.749) 8.307 6.437 ( 9.896 0.000 7.512) 12.425 6.766 ( 2.184 0.000 3.229) 3.899 6.827 ( 0.995 0.000 -4.735) 4.838 6.853 ( 0.863 0.000 -1.545) 1.769 6.948 ( 8.998 0.000 1.786) 9.173 7.186 ( 1.566 0.000 2.463) 2.918 7.226 ( -3.955 -0.000 -2.934) 4.925 7.365 ( 0.873 0.000 -0.217) 0.899 7.392 ( -0.928 -0.000 0.398) 1.010 8.635 ( -0.337 -0.000 2.237) 2.262 8.775 ( -0.823 -0.000 -2.038) 2.198 8.806 ( -1.162 -0.000 1.584) 1.965 8.812 ( -0.745 -0.000 0.332) 0.816 10.432 ( -1.139 -0.000 1.329) 1.750 10.438 ( 1.311 0.000 -1.367) 1.894 10.556 ( 1.438 0.000 1.087) 1.802 10.849 ( -1.128 -0.000 -0.336) 1.177 16.010 ( 5.705 0.000 0.277) 5.712 16.067 ( 0.045 0.000 0.829) 0.830 16.404 ( -4.792 -0.000 4.072) 6.289 16.604 ( 1.615 0.000 -4.758) 5.025 17.066 ( -6.222 -0.000 4.205) 7.509 17.374 ( -4.461 -0.000 -2.515) 5.121 17.948 ( -2.251 -0.000 0.643) 2.341 18.251 ( -0.873 -0.000 -3.253) 3.368 19.249 ( 6.541 0.000 2.112) 6.874 19.278 ( 7.359 0.000 -1.148) 7.448 19.517 ( 4.975 0.000 -0.260) 4.982 19.919 ( 7.290 0.000 -0.198) 7.293 ======================= Grid point 174 (76/138) ======================= q-point: ( 0.45 0.36 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( 1.095 -6.780 0.939) 6.932 1.375 ( 1.884 -4.195 8.719) 9.858 2.023 ( 3.412 5.973 -12.887) 14.608 2.169 ( 3.819 2.068 0.400) 4.362 2.267 ( 1.189 0.327 -2.804) 3.063 2.502 ( 0.627 -3.781 4.709) 6.071 2.547 ( -0.302 4.226 1.601) 4.529 2.696 ( 2.224 -1.044 0.933) 2.628 2.853 ( 6.672 -3.278 2.271) 7.773 3.100 ( -5.889 -1.451 -9.002) 10.854 3.273 ( 7.120 2.825 -0.965) 7.721 3.504 ( -2.728 4.205 5.922) 7.758 3.633 ( 8.581 -3.026 3.781) 9.853 3.717 ( 4.882 -4.989 0.977) 7.049 3.804 ( 10.577 0.382 -8.484) 13.565 4.061 ( 7.961 -0.257 5.861) 9.889 4.370 ( -6.994 1.653 -3.758) 8.110 4.420 ( 2.632 1.076 1.872) 3.404 4.702 ( -8.687 3.991 -1.464) 9.672 4.768 ( -11.029 3.221 2.991) 11.873 5.157 ( -8.280 -4.309 -2.637) 9.699 5.328 ( -4.478 -0.160 0.925) 4.575 5.479 ( 1.101 -1.513 3.059) 3.586 5.745 ( -1.925 -0.400 -1.272) 2.342 6.294 ( 4.777 0.439 -4.250) 6.409 6.543 ( 5.019 0.641 4.619) 6.851 6.726 ( -0.844 2.066 -1.885) 2.921 6.813 ( 2.377 0.845 0.504) 2.573 6.850 ( -0.331 -1.267 0.016) 1.310 7.109 ( -0.026 -3.324 -2.845) 4.376 7.133 ( 3.602 0.824 2.959) 4.734 7.239 ( 0.542 -1.141 -0.395) 1.324 7.369 ( 0.499 -0.467 -0.700) 0.979 7.410 ( -0.576 -2.102 0.536) 2.245 8.639 ( -0.161 0.064 1.783) 1.792 8.757 ( -0.850 0.942 -1.387) 1.879 8.797 ( 0.011 -0.209 -0.166) 0.268 8.823 ( -1.066 -1.055 0.988) 1.796 10.400 ( 0.857 2.418 0.702) 2.660 10.457 ( -0.829 -0.560 -0.454) 1.099 10.566 ( 1.639 0.341 1.012) 1.956 10.798 ( -2.264 3.971 -1.317) 4.757 16.049 ( 1.892 -0.074 1.335) 2.317 16.092 ( 2.866 -1.872 -0.700) 3.493 16.399 ( -5.177 -2.239 4.881) 7.459 16.619 ( 1.897 -1.721 -4.887) 5.517 17.070 ( -4.158 -4.017 4.577) 7.374 17.363 ( -2.860 -3.469 -2.947) 5.376 17.940 ( -1.515 -0.739 1.173) 2.054 18.213 ( -0.930 1.830 -4.490) 4.937 19.290 ( 4.583 1.748 1.868) 5.249 19.319 ( 4.431 1.406 0.130) 4.650 19.535 ( 4.885 2.717 1.086) 5.694 19.895 ( 4.097 7.749 -2.023) 8.996 ======================= Grid point 175 (77/138) ======================= q-point: ( 0.55 0.36 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( -3.684 -6.307 -3.160) 7.958 1.520 ( 6.984 -1.680 7.437) 10.339 1.922 ( -0.929 0.838 -6.493) 6.613 2.137 ( 4.330 4.214 4.987) 7.834 2.276 ( 0.741 -1.452 -5.245) 5.493 2.489 ( 0.446 2.008 2.391) 3.155 2.595 ( -2.138 -4.653 5.525) 7.533 2.751 ( 2.773 -1.224 -1.580) 3.418 2.934 ( -0.433 -2.577 -7.118) 7.583 3.029 ( -5.877 -1.809 -2.988) 6.837 3.293 ( 10.246 4.758 1.420) 11.386 3.478 ( 0.432 -1.071 0.309) 1.195 3.720 ( -0.514 -2.513 5.970) 6.498 3.778 ( 3.369 1.400 -2.473) 4.408 3.865 ( 3.691 0.238 1.875) 4.147 4.079 ( 2.923 3.041 -2.783) 5.053 4.304 ( 1.627 3.517 -1.180) 4.051 4.476 ( -6.572 5.582 0.954) 8.676 4.485 ( -1.900 2.290 1.368) 3.275 4.622 ( -5.214 3.135 -1.549) 6.278 5.199 ( -3.982 -5.881 1.723) 7.308 5.384 ( 2.732 -6.777 -1.614) 7.483 5.536 ( 0.981 -3.238 1.191) 3.587 5.691 ( -3.908 4.031 0.503) 5.637 6.325 ( 4.457 0.543 -0.073) 4.491 6.481 ( -0.857 6.222 -0.295) 6.288 6.745 ( 3.372 -1.048 0.609) 3.584 6.855 ( 3.058 -3.327 -0.158) 4.521 6.879 ( -3.198 -2.509 0.733) 4.130 7.015 ( -3.336 3.648 -1.957) 5.317 7.232 ( 0.781 -0.778 0.358) 1.159 7.285 ( 2.359 -4.102 1.171) 4.875 7.390 ( 0.552 -1.483 -0.998) 1.871 7.444 ( -0.363 -1.904 0.714) 2.066 8.640 ( -0.112 0.125 0.891) 0.906 8.726 ( -1.046 0.992 -1.375) 1.992 8.806 ( 1.484 -0.009 -0.389) 1.534 8.830 ( -1.563 -0.794 0.740) 1.903 10.364 ( 1.343 3.329 1.065) 3.744 10.435 ( -1.353 2.022 -0.443) 2.473 10.586 ( 2.250 -0.451 0.057) 2.296 10.685 ( -3.395 4.617 -0.685) 5.772 16.071 ( -0.293 -1.386 2.170) 2.592 16.157 ( 4.414 -2.093 -2.177) 5.348 16.412 ( -5.743 -2.609 5.781) 8.556 16.662 ( 2.112 -2.869 -4.940) 6.091 17.159 ( -2.095 -7.455 4.648) 9.032 17.424 ( -1.165 -6.386 -3.178) 7.228 17.957 ( -0.896 -2.047 1.448) 2.663 18.160 ( -0.329 1.291 -4.977) 5.152 19.268 ( 2.653 5.292 1.163) 6.033 19.295 ( 0.628 4.283 1.509) 4.584 19.512 ( 3.946 5.093 1.225) 6.558 19.732 ( 1.025 11.507 -2.615) 11.845 ======================= Grid point 176 (78/138) ======================= q-point: (-0.36 -0.64 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( -7.179 -3.441 -3.374) 8.646 1.530 ( 5.212 3.449 -7.660) 9.887 1.956 ( -1.636 -2.723 7.069) 7.750 2.201 ( 6.850 -3.059 9.586) 12.173 2.314 ( 1.213 -4.456 -4.763) 6.634 2.487 ( 0.311 -0.103 -0.593) 0.677 2.628 ( -8.578 0.659 5.329) 10.120 2.732 ( -0.393 -1.749 -5.877) 6.144 2.965 ( 4.574 -3.353 -5.876) 8.167 3.052 ( -1.651 -2.686 -1.545) 3.511 3.268 ( 1.676 5.028 2.072) 5.690 3.480 ( -6.758 0.828 -0.294) 6.815 3.730 ( 4.135 5.723 0.321) 7.068 3.765 ( 1.127 -0.868 -1.488) 2.059 3.904 ( -0.428 -2.630 4.052) 4.850 3.996 ( 3.554 9.874 0.374) 10.501 4.216 ( -3.927 2.561 2.353) 5.246 4.286 ( -1.842 5.598 -1.238) 6.022 4.477 ( 6.203 3.314 0.366) 7.042 4.609 ( -2.569 -2.793 -4.927) 6.219 5.274 ( -2.449 -4.174 5.946) 7.667 5.529 ( -2.081 3.786 -0.866) 4.406 5.593 ( 4.451 -6.298 -1.491) 7.855 5.607 ( -0.643 -4.322 -1.090) 4.503 6.321 ( 0.408 3.134 1.272) 3.407 6.369 ( -0.797 5.561 -0.377) 5.631 6.805 ( 2.238 -2.349 1.723) 3.674 6.860 ( -1.940 1.865 0.165) 2.697 6.943 ( 0.166 1.405 -1.046) 1.760 6.959 ( -0.304 -6.119 -1.336) 6.271 7.251 ( 1.887 -0.723 -0.216) 2.033 7.335 ( -2.738 -0.819 -1.229) 3.111 7.428 ( 0.795 -2.397 1.587) 2.983 7.473 ( 0.102 -1.143 0.744) 1.368 8.638 ( 0.382 0.355 0.254) 0.580 8.695 ( -1.644 0.754 -2.034) 2.722 8.823 ( 2.900 0.179 0.809) 3.016 8.834 ( -1.534 -1.286 0.155) 2.008 10.312 ( -0.464 3.392 1.076) 3.589 10.366 ( 0.438 4.368 -0.812) 4.464 10.595 ( 0.474 1.686 0.649) 1.868 10.634 ( -0.765 -1.952 -0.636) 2.191 16.101 ( -0.893 -1.634 2.044) 2.765 16.212 ( 3.480 -0.868 -2.900) 4.613 16.430 ( -4.986 -2.738 6.734) 8.815 16.722 ( 2.415 -3.472 -4.799) 6.396 17.309 ( -0.407 -8.901 4.435) 9.954 17.535 ( 0.295 -7.778 -3.518) 8.542 18.010 ( -0.685 -4.578 1.227) 4.789 18.152 ( 0.861 -2.153 -4.385) 4.961 19.152 ( 0.980 10.334 1.016) 10.430 19.177 ( -1.100 9.978 0.465) 10.049 19.420 ( 0.865 8.058 2.311) 8.427 19.558 ( -0.859 6.683 -2.546) 7.203 ======================= Grid point 177 (79/138) ======================= q-point: (-0.27 -0.64 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( -12.488 -3.353 -2.424) 13.155 1.546 ( 8.284 -2.993 -5.469) 10.368 1.998 ( -0.384 0.001 9.439) 9.446 2.282 ( -1.639 3.491 4.249) 5.738 2.407 ( -0.668 -5.565 -2.003) 5.952 2.471 ( 1.320 -1.613 -5.291) 5.687 2.542 ( -4.578 0.156 2.446) 5.193 2.837 ( -0.243 -7.885 2.143) 8.175 3.006 ( -1.361 6.311 -12.229) 13.828 3.061 ( 4.053 -3.164 -3.347) 6.135 3.172 ( -7.122 2.032 5.549) 9.254 3.347 ( -11.369 1.842 1.537) 11.619 3.655 ( 7.100 9.072 0.671) 11.539 3.750 ( 4.279 6.119 -0.569) 7.488 3.860 ( 5.413 6.621 1.470) 8.678 3.910 ( -4.098 2.587 1.221) 4.997 4.210 ( 1.763 0.482 0.220) 1.841 4.286 ( 6.887 -3.843 2.153) 8.176 4.498 ( 6.878 2.163 2.549) 7.647 4.599 ( -4.282 -2.820 -6.399) 8.200 5.326 ( -8.609 -3.183 6.661) 11.341 5.417 ( 0.021 1.338 2.171) 2.550 5.653 ( -0.947 -1.957 -3.635) 4.235 5.789 ( 6.499 -7.202 -4.780) 10.815 6.235 ( -3.336 4.555 0.659) 5.684 6.275 ( -0.003 4.718 0.692) 4.769 6.784 ( -6.082 1.400 0.587) 6.268 6.853 ( 2.086 1.172 0.545) 2.454 6.969 ( 3.691 -1.926 2.131) 4.677 7.042 ( -0.127 -3.100 -3.481) 4.663 7.280 ( -0.104 -0.753 -0.522) 0.922 7.294 ( -1.041 0.753 -0.844) 1.537 7.458 ( -1.461 0.210 1.266) 1.944 7.493 ( 1.245 -0.444 0.772) 1.531 8.634 ( -0.037 0.886 0.284) 0.931 8.668 ( -0.668 -0.339 -2.146) 2.273 8.855 ( 1.948 -0.604 1.521) 2.544 8.857 ( -0.063 -2.367 0.183) 2.375 10.261 ( -1.547 1.044 0.331) 1.896 10.314 ( 2.413 2.707 -0.354) 3.644 10.585 ( -1.492 -0.572 1.447) 2.156 10.671 ( 1.758 -1.672 -1.282) 2.744 16.117 ( -1.039 -0.353 1.335) 1.729 16.222 ( 1.900 1.314 -2.729) 3.575 16.469 ( -3.361 -3.399 7.094) 8.555 16.788 ( 2.453 -3.325 -4.650) 6.220 17.469 ( 0.273 -7.562 3.958) 8.539 17.668 ( 1.675 -7.720 -3.945) 8.830 18.121 ( -0.217 -8.324 1.007) 8.387 18.227 ( 1.241 -6.715 -3.248) 7.562 18.924 ( -0.514 15.483 0.853) 15.515 18.967 ( 0.382 13.155 -0.525) 13.171 19.300 ( -2.078 6.158 3.872) 7.565 19.446 ( -2.431 4.270 -2.941) 5.727 ======================= Grid point 178 (80/138) ======================= q-point: (-0.18 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( -16.278 -4.268 -1.673) 16.911 1.719 ( 8.624 -6.364 -0.578) 10.734 1.972 ( -0.656 7.481 7.757) 10.797 2.178 ( -4.850 0.587 1.971) 5.268 2.423 ( -2.061 0.339 1.581) 2.619 2.510 ( -1.451 -1.112 -2.775) 3.322 2.586 ( 0.067 -3.353 -3.619) 4.935 2.782 ( -5.503 5.790 -5.859) 9.906 2.870 ( -7.616 4.091 6.448) 10.785 3.099 ( 0.541 -5.470 -5.113) 7.507 3.192 ( 4.613 0.875 -5.204) 7.009 3.285 ( -4.726 -2.736 4.160) 6.865 3.536 ( 4.316 10.371 -1.038) 11.281 3.668 ( 1.942 7.051 3.588) 8.146 3.792 ( 7.104 6.467 -6.055) 11.356 3.872 ( 8.400 3.835 4.340) 10.203 4.220 ( -1.261 -0.908 0.751) 1.726 4.400 ( -2.005 -3.934 2.940) 5.305 4.532 ( 5.230 0.009 2.779) 5.922 4.659 ( 4.880 -6.027 -4.526) 8.979 5.311 ( -8.857 -4.258 3.633) 10.477 5.492 ( -0.894 -5.384 6.201) 8.261 5.618 ( -0.718 3.055 -5.273) 6.136 5.876 ( -0.421 -1.458 -6.526) 6.700 6.160 ( -0.585 2.103 -0.889) 2.357 6.239 ( 3.220 -0.027 2.977) 4.386 6.705 ( -5.375 2.117 0.319) 5.786 6.841 ( 1.695 2.815 1.582) 3.646 6.936 ( -8.076 3.616 -3.288) 9.439 7.096 ( 6.090 -1.198 1.215) 6.325 7.277 ( -1.478 -1.701 -1.908) 2.953 7.318 ( 3.499 0.540 1.344) 3.787 7.424 ( -1.516 1.233 0.493) 2.016 7.498 ( 1.488 1.421 -0.138) 2.062 8.615 ( -1.431 -0.017 0.226) 1.449 8.684 ( 1.166 -1.199 -1.078) 1.990 8.883 ( 0.490 -0.741 1.930) 2.125 8.909 ( 0.313 -3.043 0.016) 3.059 10.259 ( -0.836 -1.640 -0.089) 1.843 10.311 ( 1.745 -0.342 -0.087) 1.781 10.587 ( -2.344 -0.767 0.853) 2.609 10.709 ( 2.369 -1.045 -0.992) 2.772 16.100 ( -0.391 2.046 0.520) 2.147 16.192 ( 1.689 2.600 -2.099) 3.744 16.528 ( -2.911 -3.663 7.016) 8.434 16.843 ( 1.806 -2.364 -4.744) 5.600 17.587 ( -0.727 -4.826 3.309) 5.896 17.800 ( 2.288 -6.715 -4.057) 8.172 18.290 ( -0.280 -9.894 1.328) 9.987 18.372 ( 0.222 -9.472 -2.502) 9.799 18.662 ( 1.309 14.115 1.147) 14.222 18.735 ( 2.094 13.362 -1.113) 13.571 19.191 ( -3.269 5.283 4.439) 7.636 19.345 ( -2.814 3.601 -3.155) 5.553 ======================= Grid point 179 (81/138) ======================= q-point: (-0.09 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.191 ( -15.325 -6.992 0.383) 16.849 1.758 ( -3.616 5.856 3.862) 7.892 1.825 ( 3.168 9.753 -2.260) 10.500 2.216 ( 3.626 -1.337 1.742) 4.239 2.361 ( -7.935 2.364 1.147) 8.358 2.468 ( 2.184 4.301 -0.749) 4.881 2.622 ( -0.254 -7.308 0.485) 7.328 2.729 ( -1.775 5.961 4.868) 7.899 2.742 ( -2.669 0.777 1.803) 3.313 3.187 ( -0.136 -2.000 -7.430) 7.696 3.205 ( 7.157 -2.537 -4.105) 8.632 3.297 ( -1.021 4.533 2.805) 5.428 3.398 ( 2.580 4.858 -3.211) 6.370 3.564 ( -1.398 3.851 1.765) 4.461 3.758 ( 10.893 4.333 -7.522) 13.929 3.904 ( 12.657 5.046 3.498) 14.068 4.220 ( -7.372 -2.799 1.270) 7.987 4.420 ( -5.543 -1.500 5.949) 8.269 4.634 ( 4.385 -5.821 0.373) 7.297 4.809 ( 6.233 -6.071 -2.428) 9.034 5.330 ( -8.595 -4.015 -0.131) 9.488 5.478 ( -3.131 2.871 -1.062) 4.378 5.654 ( 1.808 -5.209 6.870) 8.809 5.833 ( -4.308 0.408 -5.378) 6.903 6.121 ( -0.524 1.427 -2.980) 3.345 6.346 ( 7.136 -3.948 2.038) 8.406 6.622 ( -3.410 3.194 0.306) 4.682 6.711 ( -7.636 6.552 -0.550) 10.077 6.858 ( 1.365 1.916 -0.895) 2.517 7.148 ( 6.696 2.148 0.860) 7.085 7.282 ( -1.266 -0.463 -0.747) 1.542 7.312 ( 0.877 1.754 0.306) 1.984 7.425 ( 0.189 -0.997 0.400) 1.091 7.475 ( 1.735 2.512 -0.371) 3.076 8.617 ( -1.562 -1.578 0.164) 2.227 8.710 ( 1.132 -0.605 0.035) 1.284 8.899 ( -0.394 -0.302 2.490) 2.539 8.953 ( -1.005 -2.270 -1.365) 2.833 10.284 ( -1.388 -1.829 0.146) 2.300 10.354 ( 0.491 -3.490 -0.106) 3.525 10.571 ( -2.749 0.190 -0.199) 2.763 10.739 ( 1.984 -0.403 -0.291) 2.045 16.047 ( 0.957 4.088 0.184) 4.202 16.154 ( 2.532 3.176 -1.783) 4.436 16.584 ( -3.516 -3.225 6.850) 8.348 16.866 ( 0.567 -0.804 -4.920) 5.018 17.641 ( -3.018 -2.020 2.464) 4.388 17.897 ( 0.128 -3.852 -3.341) 5.100 18.328 ( -2.124 7.389 1.646) 7.863 18.404 ( -1.732 7.182 -1.815) 7.608 18.608 ( 4.757 -7.108 -1.180) 8.634 18.677 ( 6.512 -6.050 0.675) 8.914 19.094 ( -2.215 4.363 4.384) 6.570 19.259 ( -1.279 3.002 -3.034) 4.456 ======================= Grid point 185 (82/138) ======================= q-point: ( 0.45 0.45 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( 7.839 0.000 14.383) 16.381 1.358 ( 0.643 0.000 7.644) 7.671 2.041 ( -1.787 -0.000 -11.814) 11.948 2.226 ( 6.339 0.000 -6.887) 9.360 2.278 ( -0.623 -0.000 0.841) 1.047 2.459 ( -0.332 -0.000 2.158) 2.183 2.585 ( -1.657 -0.000 -1.021) 1.947 2.685 ( -1.846 -0.000 1.630) 2.462 2.920 ( 9.456 0.000 -0.866) 9.495 2.975 ( -8.411 -0.000 -13.810) 16.169 3.393 ( 10.930 0.000 6.332) 12.632 3.457 ( -14.282 -0.000 6.701) 15.776 3.696 ( 3.948 0.000 4.455) 5.953 3.746 ( 12.031 0.000 -1.412) 12.114 3.898 ( 12.636 0.000 -8.661) 15.320 4.050 ( -10.618 -0.000 3.369) 11.139 4.374 ( 7.585 0.000 1.397) 7.713 4.478 ( 5.850 0.000 1.919) 6.157 4.688 ( -3.322 -0.000 -2.012) 3.884 4.715 ( -13.026 -0.000 4.547) 13.797 5.049 ( -3.962 -0.000 -3.253) 5.126 5.209 ( -11.030 -0.000 -5.323) 12.247 5.524 ( 2.292 0.000 8.434) 8.740 5.736 ( 1.322 0.000 -1.441) 1.956 6.332 ( 6.485 0.000 -3.714) 7.474 6.565 ( -4.414 -0.000 -0.277) 4.423 6.713 ( 1.846 0.000 0.601) 1.942 6.799 ( -1.187 -0.000 4.282) 4.443 6.949 ( 4.606 0.000 -1.635) 4.887 7.031 ( -1.178 -0.000 -2.591) 2.847 7.191 ( 2.901 0.000 0.190) 2.908 7.226 ( 0.348 0.000 1.548) 1.587 7.370 ( -1.381 -0.000 -0.283) 1.410 7.373 ( 0.216 0.000 -0.669) 0.703 8.645 ( -0.246 -0.000 2.228) 2.242 8.759 ( 0.169 0.000 -1.860) 1.867 8.796 ( -0.917 -0.000 0.985) 1.346 8.806 ( -0.158 -0.000 0.436) 0.464 10.421 ( -0.956 -0.000 0.882) 1.300 10.449 ( 0.957 0.000 -0.940) 1.342 10.587 ( 0.910 0.000 2.308) 2.481 10.815 ( -1.396 -0.000 -3.046) 3.351 16.066 ( -0.743 -0.000 1.004) 1.249 16.090 ( 3.685 0.000 -0.921) 3.799 16.355 ( -4.284 -0.000 5.289) 6.806 16.607 ( 2.184 0.000 -4.785) 5.260 17.022 ( -2.479 -0.000 5.361) 5.907 17.304 ( -1.245 -0.000 -3.500) 3.715 17.930 ( -0.527 -0.000 1.785) 1.862 18.206 ( -0.942 -0.000 -5.757) 5.833 19.341 ( 2.126 0.000 2.538) 3.310 19.369 ( 3.443 0.000 -0.045) 3.443 19.601 ( 3.468 0.000 3.344) 4.818 19.976 ( 0.869 0.000 -4.260) 4.347 ======================= Grid point 186 (83/138) ======================= q-point: (-0.45 -0.55 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.289 ( 3.391 2.645 8.420) 9.455 1.519 ( 6.298 -8.158 14.665) 17.924 1.931 ( -4.101 4.907 -11.864) 13.477 2.235 ( 3.585 1.334 -2.188) 4.407 2.258 ( 1.335 1.495 -3.623) 4.141 2.474 ( -7.626 -4.304 -4.202) 9.712 2.552 ( 0.281 2.572 3.697) 4.512 2.688 ( -3.014 -2.801 -1.842) 4.508 2.904 ( -1.121 -1.340 -5.256) 5.539 2.976 ( 2.865 -0.452 -2.727) 3.981 3.390 ( -9.079 -2.456 3.310) 9.971 3.484 ( 12.461 4.025 2.536) 13.339 3.683 ( -6.886 0.281 5.982) 9.126 3.836 ( 2.465 -0.944 -1.143) 2.877 3.916 ( -1.735 1.667 0.536) 2.465 4.016 ( 2.095 -2.980 -6.549) 7.494 4.439 ( 8.350 4.025 3.497) 9.907 4.527 ( 3.540 2.856 1.356) 4.746 4.538 ( -10.691 5.295 1.533) 12.028 4.642 ( 0.584 2.290 -0.881) 2.523 5.077 ( 1.046 -4.889 -0.868) 5.074 5.205 ( -4.232 -8.811 -4.408) 10.723 5.562 ( 2.552 0.022 6.402) 6.892 5.732 ( 0.806 2.147 -1.039) 2.517 6.379 ( 5.958 0.822 0.034) 6.015 6.488 ( -8.306 -0.116 -4.026) 9.231 6.760 ( 2.380 0.154 2.184) 3.234 6.832 ( 2.002 -3.137 4.099) 5.536 6.873 ( -0.699 4.956 -1.207) 5.148 7.037 ( -2.375 0.699 -4.545) 5.176 7.215 ( 0.147 -1.218 2.488) 2.774 7.258 ( 1.986 -1.880 0.248) 2.746 7.369 ( 0.201 -1.066 -0.495) 1.192 7.394 ( -1.269 -2.354 -0.439) 2.710 8.647 ( -0.356 0.233 1.918) 1.964 8.739 ( -0.221 1.459 -1.567) 2.152 8.804 ( -0.386 -0.989 0.418) 1.141 8.814 ( 0.443 -0.522 0.372) 0.780 10.408 ( -0.611 1.067 0.918) 1.535 10.451 ( 0.769 0.538 -0.635) 1.133 10.597 ( 0.642 0.256 2.234) 2.338 10.750 ( -1.378 4.510 -3.229) 5.715 16.058 ( -0.800 -0.122 1.461) 1.670 16.140 ( 2.589 -2.606 -1.984) 4.175 16.350 ( -4.019 -1.368 5.821) 7.205 16.626 ( 2.277 -1.646 -4.654) 5.436 17.062 ( -0.646 -4.105 5.620) 6.989 17.321 ( 0.480 -3.579 -3.756) 5.211 17.940 ( 0.308 -0.459 2.244) 2.311 18.166 ( -0.437 1.360 -6.300) 6.460 19.341 ( -0.602 1.694 2.112) 2.774 19.368 ( 1.124 2.537 0.630) 2.845 19.613 ( 2.077 2.892 4.229) 5.528 19.886 ( -2.422 7.380 -5.348) 9.430 ======================= Grid point 187 (84/138) ======================= q-point: (-0.36 -0.55 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.284 ( -0.208 1.980 4.043) 4.506 1.628 ( 2.525 5.810 -9.531) 11.444 1.870 ( -2.902 -6.868 9.057) 11.731 2.237 ( -0.558 -2.033 -7.187) 7.490 2.272 ( 6.816 0.321 7.184) 9.908 2.457 ( -8.659 -4.595 -8.276) 12.829 2.544 ( -1.599 -0.258 6.995) 7.180 2.689 ( -2.567 0.474 -2.698) 3.754 2.943 ( 0.067 -4.019 0.793) 4.097 2.993 ( 2.105 -0.492 -2.881) 3.603 3.342 ( -7.025 1.747 -4.039) 8.289 3.454 ( -3.871 5.091 2.829) 6.994 3.692 ( 1.097 -4.654 0.974) 4.879 3.816 ( -3.174 0.767 1.470) 3.580 3.885 ( -5.946 -0.934 1.829) 6.291 4.091 ( 7.646 -0.682 -2.116) 7.963 4.278 ( -8.211 8.720 -0.090) 11.978 4.409 ( 4.960 6.019 0.916) 7.853 4.536 ( 1.061 1.755 -1.369) 2.466 4.651 ( 10.331 3.201 -0.277) 10.819 5.176 ( -1.565 -5.150 2.317) 5.860 5.381 ( 1.942 -11.968 -1.852) 12.265 5.622 ( 4.989 -1.702 3.329) 6.234 5.640 ( -1.822 7.295 -1.733) 7.716 6.365 ( -3.489 1.780 0.180) 3.920 6.429 ( -0.489 2.843 -0.610) 2.949 6.766 ( -4.075 -0.030 1.161) 4.238 6.825 ( -0.976 -2.970 -0.756) 3.216 6.920 ( 3.152 -0.467 1.413) 3.486 6.982 ( 1.918 1.153 -2.161) 3.111 7.238 ( -0.856 -1.641 1.077) 2.141 7.295 ( -1.266 -0.982 -1.144) 1.969 7.402 ( 0.687 -2.055 1.151) 2.453 7.428 ( -1.465 -2.934 -0.208) 3.286 8.646 ( -0.081 0.098 1.291) 1.297 8.703 ( -0.358 1.673 -1.630) 2.363 8.806 ( -1.305 -0.539 -0.263) 1.436 8.845 ( 2.743 -0.879 0.464) 2.918 10.365 ( -1.934 3.294 1.075) 3.968 10.439 ( 2.114 2.177 -0.443) 3.066 10.599 ( -2.236 0.199 0.376) 2.276 10.658 ( 2.283 3.520 -1.016) 4.317 16.069 ( -1.432 -1.421 1.818) 2.716 16.198 ( 1.436 -2.513 -2.888) 4.089 16.369 ( -3.011 -2.153 6.264) 7.276 16.673 ( 2.653 -2.934 -4.367) 5.893 17.183 ( 1.084 -7.374 5.476) 9.248 17.407 ( 1.845 -6.339 -3.947) 7.692 17.964 ( 0.374 -1.294 1.998) 2.410 18.131 ( 0.959 0.236 -5.560) 5.647 19.280 ( -3.110 4.287 1.047) 5.399 19.304 ( 0.133 5.843 1.537) 6.043 19.556 ( -0.499 6.031 3.340) 6.912 19.675 ( -4.831 10.224 -4.659) 12.231 ======================= Grid point 188 (85/138) ======================= q-point: (-0.27 -0.55 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.231 ( -3.864 3.399 1.618) 5.395 1.533 ( 0.795 -0.871 -8.777) 8.856 1.989 ( 0.201 -3.308 7.555) 8.250 2.282 ( -1.573 -5.297 -5.835) 8.037 2.363 ( 4.780 -0.414 9.018) 10.215 2.441 ( -6.795 -4.046 -6.345) 10.140 2.489 ( -7.181 4.728 3.950) 9.462 2.720 ( 4.407 -6.117 1.355) 7.660 2.983 ( -4.880 -1.085 -4.048) 6.432 3.034 ( 0.474 -1.827 -3.692) 4.146 3.169 ( -10.237 4.838 0.540) 11.335 3.325 ( -5.043 4.189 -0.301) 6.563 3.778 ( -1.797 -0.682 0.717) 2.052 3.825 ( 6.247 -0.820 -2.368) 6.731 3.865 ( -6.432 -3.314 4.900) 8.738 4.010 ( -2.568 9.211 -0.296) 9.567 4.220 ( 2.453 -1.524 0.364) 2.910 4.388 ( 6.539 2.992 1.049) 7.267 4.512 ( 4.119 0.928 -2.924) 5.136 4.671 ( 11.895 5.597 0.152) 13.147 5.232 ( -5.037 -2.885 4.559) 7.381 5.455 ( -4.120 4.834 -3.105) 7.070 5.574 ( 0.692 -5.350 -0.412) 5.410 5.746 ( 8.327 -4.495 0.244) 9.466 6.279 ( -4.725 3.913 0.272) 6.141 6.350 ( -1.984 4.474 0.760) 4.953 6.729 ( -6.564 -1.365 -0.146) 6.706 6.868 ( -3.271 -0.569 -0.616) 3.377 6.932 ( 3.523 -1.792 1.192) 4.129 7.041 ( 5.917 -1.609 -1.549) 6.325 7.247 ( -3.097 0.148 -0.970) 3.248 7.289 ( -0.123 -1.602 0.518) 1.688 7.438 ( -1.377 -1.428 0.910) 2.182 7.468 ( -0.605 -2.565 0.568) 2.696 8.652 ( 0.599 -0.245 0.828) 1.051 8.665 ( -0.405 1.849 -1.423) 2.368 8.810 ( -0.819 -1.449 -0.922) 1.903 8.885 ( 3.626 -0.290 0.731) 3.710 10.285 ( -2.113 3.212 0.603) 3.891 10.405 ( 3.317 4.195 -0.388) 5.362 10.565 ( -2.425 0.072 0.145) 2.431 10.670 ( 3.338 -0.536 0.138) 3.383 16.088 ( -2.103 -1.765 1.486) 3.122 16.226 ( 0.023 -1.089 -2.728) 2.938 16.413 ( -1.451 -2.740 6.235) 6.964 16.741 ( 3.101 -3.310 -4.056) 6.085 17.354 ( 2.171 -8.236 4.790) 9.772 17.540 ( 3.048 -7.711 -3.939) 9.180 18.015 ( 0.289 -4.100 1.381) 4.336 18.149 ( 1.984 -2.713 -4.109) 5.308 19.136 ( -3.214 9.556 -0.119) 10.083 19.174 ( 0.096 9.925 1.266) 10.006 19.409 ( -4.183 8.614 2.695) 9.948 19.481 ( -5.627 5.142 -2.855) 8.140 ======================= Grid point 189 (86/138) ======================= q-point: (-0.18 -0.55 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( -7.083 3.752 0.298) 8.021 1.643 ( 3.539 -9.023 0.506) 9.705 2.055 ( 1.641 -1.478 5.786) 6.193 2.215 ( -4.321 7.367 2.944) 9.034 2.398 ( -3.414 0.118 3.450) 4.855 2.431 ( -7.077 -4.637 -6.044) 10.397 2.495 ( 2.119 -5.953 -2.452) 6.778 2.800 ( -10.994 5.621 -6.525) 13.965 2.874 ( -2.282 -1.018 5.477) 6.020 2.965 ( -1.916 -2.266 -5.032) 5.841 3.206 ( -0.885 -4.331 3.969) 5.940 3.238 ( 2.650 2.082 -4.155) 5.350 3.720 ( -1.670 7.103 -1.187) 7.393 3.799 ( -3.149 4.987 0.543) 5.923 3.860 ( 1.731 -0.494 -4.840) 5.164 3.966 ( 5.910 -0.415 8.915) 10.704 4.225 ( -2.900 0.722 -4.656) 5.532 4.389 ( -0.567 0.327 3.601) 3.660 4.593 ( 10.362 -2.610 -2.297) 10.930 4.675 ( 12.791 5.797 0.950) 14.076 5.208 ( -6.629 -0.458 4.337) 7.935 5.415 ( -2.476 -2.903 1.038) 3.954 5.630 ( 0.988 -1.067 -1.675) 2.218 5.843 ( 1.272 -0.518 -2.977) 3.279 6.200 ( 0.281 1.825 -0.439) 1.898 6.271 ( -1.446 2.103 2.529) 3.593 6.690 ( -5.013 0.355 0.393) 5.041 6.852 ( -1.935 -1.059 -1.799) 2.846 6.920 ( -6.259 3.484 -1.212) 7.265 7.124 ( 6.257 -2.227 0.903) 6.703 7.232 ( -0.157 -1.279 -1.444) 1.935 7.334 ( 1.236 -1.916 1.733) 2.864 7.427 ( -2.535 0.697 0.068) 2.630 7.501 ( -0.505 -1.530 0.098) 1.614 8.626 ( -0.259 1.780 -0.349) 1.832 8.672 ( 1.035 -0.961 0.333) 1.451 8.839 ( -0.308 -2.577 -1.149) 2.838 8.918 ( 3.094 0.239 1.192) 3.324 10.243 ( -0.490 0.425 0.184) 0.674 10.360 ( 2.913 3.554 -0.159) 4.598 10.556 ( -1.923 -0.732 0.328) 2.084 10.711 ( 2.784 -0.963 -0.110) 2.948 16.100 ( -1.846 -1.107 0.811) 2.301 16.222 ( -0.110 0.452 -2.252) 2.300 16.471 ( -1.288 -2.856 6.410) 7.135 16.806 ( 2.919 -2.516 -4.182) 5.686 17.512 ( 1.865 -5.813 3.641) 7.108 17.691 ( 3.816 -7.361 -3.625) 9.049 18.131 ( 0.563 -8.317 1.197) 8.421 18.233 ( 1.743 -6.308 -2.924) 7.168 18.910 ( -1.476 13.218 0.353) 13.304 18.975 ( 0.360 12.959 -0.349) 12.968 19.255 ( -5.745 5.268 3.637) 8.601 19.356 ( -5.417 2.967 -2.654) 6.722 ======================= Grid point 190 (87/138) ======================= q-point: (-0.09 -0.55 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.018 ( -7.143 0.048 1.142) 7.234 1.777 ( -2.448 -2.066 4.454) 5.486 2.031 ( 3.195 9.247 3.391) 10.354 2.180 ( 2.472 -4.002 2.658) 5.403 2.369 ( -4.968 1.639 3.609) 6.356 2.452 ( -2.768 -7.692 -3.623) 8.942 2.516 ( -5.388 0.442 1.066) 5.510 2.724 ( -1.132 -1.000 -1.191) 1.924 2.776 ( -4.770 2.548 0.941) 5.489 3.066 ( 2.076 -7.658 -8.741) 11.805 3.192 ( 2.374 1.342 -3.976) 4.821 3.324 ( 2.978 -3.530 1.816) 4.963 3.528 ( -3.419 9.711 -2.505) 10.595 3.667 ( -1.664 7.710 -1.479) 8.025 3.887 ( 7.131 1.178 -3.955) 8.239 4.070 ( 3.157 -3.045 7.186) 8.419 4.141 ( -2.525 3.802 -2.563) 5.234 4.386 ( -4.182 -0.504 5.886) 7.238 4.702 ( 12.919 4.126 1.813) 13.683 4.720 ( 2.930 -5.612 -3.907) 7.439 5.201 ( -5.349 -2.458 2.202) 6.285 5.438 ( -3.987 -1.897 1.333) 4.612 5.660 ( 3.620 -1.003 2.283) 4.396 5.797 ( -3.496 1.399 -3.106) 4.882 6.159 ( 1.058 3.061 -2.018) 3.816 6.331 ( 4.929 -4.540 1.896) 6.964 6.642 ( -2.512 1.308 1.069) 3.028 6.738 ( -9.861 6.274 -2.473) 11.947 6.862 ( -0.626 -0.979 -1.616) 1.991 7.207 ( 5.069 -0.928 1.481) 5.362 7.254 ( -0.514 -1.155 -0.698) 1.444 7.351 ( -0.831 1.473 0.405) 1.740 7.411 ( 0.191 -1.031 0.047) 1.050 7.511 ( 0.183 0.139 -0.452) 0.507 8.602 ( -0.301 0.673 0.550) 0.920 8.703 ( 1.109 -1.283 0.266) 1.717 8.875 ( -0.915 -2.103 -0.651) 2.384 8.937 ( 1.509 0.370 1.172) 1.946 10.252 ( 0.037 -1.072 -0.077) 1.075 10.339 ( 1.500 0.950 0.072) 1.777 10.550 ( -1.712 -0.207 -0.421) 1.775 10.746 ( 1.872 -0.641 0.087) 1.980 16.096 ( -0.406 0.741 0.088) 0.849 16.202 ( 0.606 1.218 -1.668) 2.153 16.525 ( -2.315 -2.653 6.777) 7.637 16.845 ( 2.041 -1.044 -4.658) 5.192 17.599 ( 0.010 -2.207 2.613) 3.420 17.821 ( 2.833 -5.057 -3.331) 6.685 18.292 ( -0.295 -7.917 0.944) 7.979 18.367 ( 0.979 -7.274 -1.773) 7.551 18.692 ( 1.090 10.370 0.695) 10.451 18.763 ( 1.082 9.893 -0.939) 9.996 19.146 ( -4.704 3.425 3.992) 7.057 19.272 ( -2.656 1.614 -2.653) 4.086 ======================= Grid point 197 (88/138) ======================= q-point: (-0.45 -0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( 0.866 0.000 10.498) 10.534 1.513 ( 9.748 0.000 20.591) 22.782 1.908 ( -5.439 -0.000 -12.124) 13.288 2.218 ( -4.582 -0.000 -16.386) 17.015 2.302 ( 3.651 0.000 1.066) 3.804 2.326 ( -7.484 -0.000 -5.940) 9.555 2.598 ( 1.910 0.000 5.395) 5.723 2.640 ( -3.614 -0.000 -1.800) 4.038 2.854 ( -0.038 -0.000 -2.276) 2.276 2.979 ( -0.448 -0.000 -2.397) 2.438 3.316 ( -5.604 -0.000 3.549) 6.634 3.610 ( -7.605 -0.000 4.865) 9.028 3.646 ( 3.111 0.000 1.996) 3.696 3.791 ( -6.422 -0.000 0.337) 6.431 3.826 ( -9.335 -0.000 -4.734) 10.466 4.096 ( 13.960 0.000 -1.695) 14.063 4.493 ( -12.749 -0.000 2.837) 13.061 4.544 ( 2.196 0.000 4.056) 4.612 4.610 ( 5.667 0.000 0.419) 5.683 4.663 ( 3.746 0.000 -0.203) 3.752 5.082 ( 9.570 0.000 -0.897) 9.612 5.085 ( 2.712 0.000 -5.367) 6.013 5.590 ( 0.296 0.000 5.925) 5.932 5.767 ( 2.821 0.000 -1.153) 3.048 6.366 ( -11.904 -0.000 -5.256) 13.012 6.460 ( 8.651 0.000 1.529) 8.785 6.782 ( -3.307 -0.000 3.291) 4.665 6.847 ( 7.446 0.000 3.446) 8.205 6.930 ( -6.315 -0.000 -4.726) 7.888 6.974 ( -0.589 -0.000 -1.122) 1.267 7.193 ( -4.754 -0.000 0.229) 4.760 7.263 ( 2.817 0.000 1.137) 3.038 7.355 ( -0.064 -0.000 -0.462) 0.467 7.366 ( -0.119 -0.000 -0.603) 0.615 8.651 ( -0.871 -0.000 2.431) 2.582 8.752 ( 0.348 0.000 -1.932) 1.963 8.788 ( -0.668 -0.000 0.741) 0.998 8.814 ( 0.740 0.000 0.553) 0.924 10.411 ( -0.686 -0.000 0.487) 0.842 10.462 ( 1.186 0.000 -0.574) 1.318 10.616 ( 0.287 0.000 3.789) 3.800 10.766 ( -1.503 -0.000 -4.512) 4.756 16.058 ( -0.778 -0.000 0.563) 0.960 16.117 ( -0.118 -0.000 -0.826) 0.834 16.332 ( -1.853 -0.000 5.273) 5.589 16.616 ( 2.194 0.000 -4.422) 4.936 17.045 ( 0.919 0.000 6.056) 6.126 17.289 ( 2.266 0.000 -4.115) 4.698 17.954 ( 1.521 0.000 3.146) 3.494 18.153 ( -0.297 -0.000 -7.175) 7.181 19.344 ( -3.409 -0.000 1.632) 3.780 19.391 ( -1.071 -0.000 0.630) 1.242 19.671 ( 0.807 0.000 6.594) 6.644 19.895 ( -6.009 -0.000 -7.306) 9.460 ======================= Grid point 198 (89/138) ======================= q-point: (-0.36 -0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( 1.840 5.746 10.593) 12.191 1.706 ( -1.320 6.434 -12.096) 13.764 1.755 ( -3.469 -6.460 12.906) 14.843 2.122 ( -10.552 -5.517 -19.413) 22.774 2.289 ( -2.625 -0.342 -2.806) 3.858 2.357 ( 7.186 -0.135 5.594) 9.107 2.580 ( -1.405 1.024 4.711) 5.022 2.663 ( 0.250 -2.046 1.078) 2.327 2.875 ( -2.596 -1.409 0.531) 3.001 2.983 ( 0.219 -2.075 -1.118) 2.367 3.279 ( -5.296 0.825 -1.744) 5.636 3.459 ( -15.160 1.319 0.355) 15.221 3.675 ( -3.911 1.127 -0.326) 4.083 3.702 ( -12.393 -2.924 1.003) 12.772 3.826 ( 2.515 -1.776 -0.662) 3.149 4.190 ( 8.871 1.606 2.345) 9.315 4.330 ( -7.384 6.472 -1.009) 9.870 4.507 ( 0.526 3.794 0.405) 3.851 4.649 ( 7.309 1.975 -0.971) 7.633 4.744 ( 7.748 -1.352 2.202) 8.167 5.133 ( 6.199 -1.409 -1.750) 6.594 5.247 ( 9.516 -7.062 0.558) 11.863 5.628 ( 1.644 -2.138 4.194) 4.986 5.742 ( 1.072 5.140 -2.892) 5.995 6.275 ( -9.893 -2.711 -4.171) 11.073 6.512 ( 4.519 3.370 3.598) 6.687 6.759 ( -2.405 0.815 1.984) 3.222 6.786 ( -6.403 2.805 -3.107) 7.650 6.950 ( 6.112 -1.464 3.489) 7.188 6.976 ( -2.527 -1.407 -3.152) 4.278 7.177 ( -4.241 -2.974 0.408) 5.196 7.279 ( -0.235 0.100 -0.780) 0.821 7.362 ( -0.912 -1.328 -0.609) 1.722 7.388 ( 1.059 -1.794 0.859) 2.254 8.649 ( -0.961 0.051 2.297) 2.490 8.730 ( 0.334 1.726 -1.563) 2.352 8.790 ( -0.803 -0.298 -0.078) 0.860 8.842 ( 2.007 -1.724 0.570) 2.707 10.396 ( -1.167 1.522 0.551) 1.996 10.471 ( 1.681 0.147 -0.335) 1.721 10.607 ( -1.564 2.138 2.508) 3.648 10.721 ( 0.684 1.888 -2.797) 3.443 16.047 ( -1.517 0.026 0.973) 1.803 16.137 ( -1.869 -3.001 -0.858) 3.638 16.348 ( 0.053 -0.944 4.606) 4.702 16.639 ( 2.459 -1.969 -4.124) 5.190 17.116 ( 2.608 -4.101 6.114) 7.810 17.332 ( 3.655 -3.379 -4.330) 6.598 17.976 ( 1.757 0.442 3.211) 3.686 18.127 ( 0.890 0.290 -6.619) 6.685 19.294 ( -5.753 1.571 1.013) 6.049 19.360 ( -2.778 1.803 0.912) 3.435 19.654 ( -1.357 4.282 6.421) 7.836 19.750 ( -8.601 6.210 -7.321) 12.889 ======================= Grid point 199 (90/138) ======================= q-point: (-0.27 -0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.334 ( 1.042 6.410 7.177) 9.679 1.474 ( -9.362 2.236 -11.686) 15.140 1.941 ( 1.478 -6.302 9.417) 11.427 2.099 ( -9.734 -7.898 -16.001) 20.326 2.278 ( -2.346 -1.958 -3.550) 4.684 2.440 ( 5.229 1.064 8.990) 10.454 2.577 ( -1.432 3.807 8.783) 9.679 2.689 ( 3.079 -2.700 0.083) 4.096 2.851 ( -10.139 -2.806 -3.023) 10.946 3.026 ( -0.256 -0.959 0.564) 1.142 3.157 ( -7.623 3.086 -1.273) 8.322 3.359 ( -2.542 2.615 -4.174) 5.542 3.616 ( -14.693 -6.185 -0.914) 15.967 3.707 ( -11.124 -7.958 3.159) 14.038 3.866 ( 5.072 1.695 -1.418) 5.532 4.114 ( -3.619 5.764 0.727) 6.845 4.275 ( 6.022 3.415 0.346) 6.932 4.445 ( 0.454 3.870 1.792) 4.289 4.688 ( 14.930 3.463 -0.679) 15.341 4.826 ( 9.039 0.745 0.536) 9.086 5.197 ( 4.262 -0.480 1.299) 4.482 5.421 ( 1.127 -4.798 -1.144) 5.059 5.589 ( -0.873 7.134 -3.915) 8.185 5.739 ( 5.602 -4.617 3.260) 7.958 6.252 ( -6.039 -2.177 -2.089) 6.751 6.420 ( -4.093 6.725 1.950) 8.111 6.662 ( -6.208 0.987 0.032) 6.286 6.807 ( -1.660 -2.832 -0.014) 3.283 6.942 ( -1.599 -0.087 -0.482) 1.672 7.058 ( 6.260 -2.002 0.200) 6.575 7.212 ( -2.884 -3.608 0.933) 4.712 7.256 ( -1.278 0.483 -1.258) 1.857 7.381 ( -2.005 -2.388 -0.827) 3.226 7.433 ( 0.478 -1.799 1.475) 2.375 8.650 ( -0.584 -0.247 1.721) 1.834 8.698 ( 0.762 1.856 -1.057) 2.268 8.786 ( -0.478 -0.404 -0.900) 1.096 8.900 ( 3.395 -1.775 0.175) 3.835 10.332 ( -2.238 3.893 0.700) 4.545 10.480 ( 2.540 1.226 -0.235) 2.830 10.553 ( -2.490 1.214 -0.286) 2.785 10.713 ( 3.672 1.341 0.685) 3.969 16.041 ( -3.146 -1.204 1.195) 3.574 16.169 ( -2.687 -3.062 -1.138) 4.230 16.393 ( 1.516 -1.700 4.101) 4.691 16.700 ( 3.398 -3.337 -3.576) 5.956 17.261 ( 3.922 -6.961 5.467) 9.681 17.438 ( 4.791 -6.105 -4.086) 8.770 17.991 ( 1.145 -0.185 2.178) 2.467 18.128 ( 2.474 -0.815 -4.732) 5.402 19.201 ( -6.377 3.368 0.425) 7.225 19.290 ( -2.934 3.914 1.109) 5.016 19.515 ( -9.812 8.429 -5.577) 14.086 19.540 ( -4.176 7.885 4.620) 10.048 ======================= Grid point 200 (91/138) ======================= q-point: (-0.18 -0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.226 ( 1.241 8.901 3.677) 9.710 1.471 ( -3.969 -10.131 0.404) 10.888 2.048 ( 1.262 -2.648 3.666) 4.695 2.138 ( -11.036 -12.330 -12.783) 20.910 2.270 ( -1.803 0.602 -1.913) 2.696 2.418 ( -2.730 4.293 4.406) 6.730 2.494 ( -2.849 4.172 3.136) 5.946 2.751 ( -9.176 0.989 -4.506) 10.271 2.825 ( 3.263 -5.728 2.895) 7.200 2.975 ( -3.857 3.325 5.859) 7.763 3.158 ( 2.351 -3.237 -0.127) 4.003 3.283 ( 1.261 2.791 -4.589) 5.517 3.629 ( -14.030 -8.904 0.908) 16.642 3.769 ( -8.602 -3.361 0.901) 9.279 3.825 ( -1.765 -0.070 -5.040) 5.340 4.058 ( 5.235 2.324 2.225) 6.145 4.209 ( -0.896 5.151 -3.778) 6.451 4.406 ( -0.301 2.175 5.569) 5.986 4.768 ( 17.374 4.883 0.755) 18.063 4.880 ( 11.872 3.540 -0.785) 12.413 5.203 ( -1.339 2.274 2.978) 3.979 5.378 ( -0.465 1.052 -3.539) 3.722 5.589 ( 0.633 -3.268 -0.506) 3.367 5.854 ( 3.201 -0.842 0.944) 3.442 6.207 ( -2.729 0.364 0.158) 2.758 6.302 ( -3.913 2.921 0.595) 4.920 6.625 ( -4.958 -1.648 -0.644) 5.264 6.811 ( -3.141 -0.850 -0.431) 3.282 6.908 ( -6.816 1.522 -0.616) 7.011 7.139 ( 6.087 -1.784 -0.289) 6.349 7.229 ( 1.175 -0.078 0.088) 1.181 7.283 ( -1.656 -4.077 1.492) 4.646 7.396 ( -2.670 -1.571 -0.720) 3.181 7.462 ( -0.825 -1.502 0.585) 1.811 8.648 ( -0.046 0.656 -0.740) 0.990 8.681 ( 0.991 0.804 1.665) 2.097 8.799 ( 0.530 -1.599 -1.478) 2.241 8.951 ( 3.705 -0.349 -0.115) 3.723 10.262 ( -0.837 2.142 0.475) 2.348 10.458 ( 2.953 3.835 -0.294) 4.849 10.533 ( -1.311 -0.434 0.088) 1.384 10.731 ( 3.251 0.445 0.756) 3.368 16.044 ( -3.863 -2.374 0.916) 4.626 16.187 ( -2.698 -2.199 -1.570) 3.818 16.452 ( 1.719 -1.732 4.532) 5.147 16.778 ( 3.905 -2.917 -3.373) 5.927 17.439 ( 4.378 -6.971 4.036) 9.168 17.592 ( 5.662 -7.344 -3.222) 9.817 18.035 ( 0.859 -3.688 1.630) 4.122 18.166 ( 2.610 -2.617 -3.448) 5.055 19.068 ( -4.515 7.068 0.326) 8.394 19.165 ( -2.428 8.979 0.054) 9.301 19.296 ( -8.662 5.140 -1.433) 10.173 19.365 ( -6.912 6.567 1.588) 9.665 ======================= Grid point 201 (92/138) ======================= q-point: (-0.09 -0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( 4.037 8.755 2.762) 10.029 1.662 ( -3.240 -10.404 6.797) 12.843 2.117 ( 1.425 -3.343 2.024) 4.159 2.215 ( -5.026 -3.654 1.912) 6.501 2.253 ( -2.090 -1.795 -5.611) 6.251 2.312 ( -3.530 -1.862 -8.031) 8.968 2.434 ( -6.638 -2.246 2.578) 7.467 2.689 ( -1.272 2.276 4.520) 5.218 2.852 ( -2.387 5.471 3.972) 7.170 2.973 ( 3.530 -4.368 -3.624) 6.684 3.224 ( 2.764 -1.120 0.895) 3.113 3.287 ( 2.677 -2.140 -2.858) 4.462 3.607 ( -6.146 4.222 -7.104) 10.298 3.692 ( -10.288 -2.861 2.471) 10.960 3.841 ( -4.562 -3.112 -3.290) 6.428 4.052 ( 2.692 4.194 0.217) 4.989 4.152 ( -4.506 -3.848 -0.940) 5.999 4.387 ( 0.740 2.556 6.247) 6.790 4.768 ( 7.285 6.870 0.473) 10.024 4.904 ( 10.808 4.279 -1.312) 11.699 5.189 ( 3.385 1.311 1.080) 3.787 5.396 ( 1.127 -1.590 1.636) 2.544 5.645 ( -0.048 -2.829 0.608) 2.894 5.818 ( -0.739 3.215 -0.542) 3.344 6.213 ( 0.367 2.782 -2.671) 3.875 6.283 ( 1.885 -4.958 2.580) 5.898 6.611 ( -4.279 -1.232 -1.216) 4.616 6.757 ( -7.265 4.578 -0.851) 8.629 6.818 ( -3.758 -1.167 -0.799) 4.015 7.220 ( 3.782 -1.925 0.978) 4.355 7.244 ( 0.855 -0.395 0.232) 0.970 7.333 ( -2.511 -2.038 0.501) 3.272 7.390 ( -0.912 -0.848 -0.210) 1.263 7.482 ( -1.382 -1.977 -0.354) 2.438 8.628 ( 0.757 1.516 -0.481) 1.761 8.694 ( 0.593 -0.678 1.736) 1.956 8.834 ( 0.602 -1.886 -1.089) 2.259 8.973 ( 2.766 1.018 0.043) 2.948 10.248 ( 0.921 0.071 0.201) 0.945 10.407 ( 2.530 4.355 0.102) 5.038 10.533 ( -0.690 -0.428 -0.362) 0.889 10.754 ( 1.893 -0.207 0.374) 1.940 16.062 ( -2.994 -2.736 0.504) 4.087 16.191 ( -1.950 -1.243 -1.904) 2.995 16.504 ( 0.597 -1.178 5.654) 5.806 16.836 ( 3.479 -1.307 -3.843) 5.347 17.576 ( 3.291 -3.287 2.788) 5.423 17.751 ( 5.343 -5.994 -2.693) 8.469 18.151 ( 0.769 -8.029 1.339) 8.176 18.248 ( 1.945 -5.990 -2.555) 6.796 18.878 ( -2.852 10.764 0.510) 11.147 18.952 ( -2.978 11.616 -0.965) 12.031 19.161 ( -6.911 3.323 3.046) 8.251 19.256 ( -3.872 0.631 -1.790) 4.312 ======================= Grid point 209 (93/138) ======================= q-point: (-0.36 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -3.581 -0.000 11.844) 12.373 1.667 ( -14.184 -0.000 -2.566) 14.414 1.769 ( 6.527 0.000 3.255) 7.294 1.833 ( -14.843 -0.000 -26.880) 30.706 2.306 ( 0.540 0.000 1.926) 2.000 2.434 ( 8.563 0.000 6.598) 10.810 2.544 ( -5.062 -0.000 -2.653) 5.715 2.662 ( 0.423 0.000 7.131) 7.144 2.862 ( -0.879 -0.000 1.163) 1.458 2.967 ( 0.398 0.000 3.539) 3.561 3.254 ( -3.521 -0.000 -4.201) 5.481 3.293 ( -19.349 -0.000 -0.888) 19.369 3.543 ( -16.987 -0.000 -2.709) 17.201 3.588 ( -15.236 -0.000 2.521) 15.443 3.904 ( 13.720 0.000 -1.068) 13.761 4.233 ( -6.290 -0.000 2.017) 6.605 4.399 ( 7.607 0.000 -0.744) 7.643 4.513 ( -0.754 -0.000 -4.020) 4.091 4.713 ( 7.640 0.000 0.710) 7.673 4.814 ( 8.876 0.000 4.977) 10.176 5.190 ( 8.965 0.000 -1.529) 9.094 5.311 ( 14.421 0.000 1.682) 14.519 5.624 ( 1.158 0.000 2.942) 3.162 5.794 ( 1.116 0.000 -4.638) 4.771 6.145 ( -9.259 -0.000 -2.867) 9.692 6.606 ( 3.810 0.000 5.271) 6.504 6.732 ( -3.976 -0.000 -3.633) 5.386 6.780 ( -6.574 -0.000 -0.310) 6.581 6.884 ( -6.267 -0.000 -0.021) 6.267 6.968 ( -1.976 -0.000 -0.110) 1.980 7.126 ( 1.105 0.000 0.889) 1.418 7.276 ( -0.522 -0.000 -1.225) 1.332 7.353 ( 0.015 0.000 -0.403) 0.403 7.380 ( 1.398 0.000 0.689) 1.558 8.646 ( -1.560 -0.000 2.940) 3.328 8.746 ( 0.422 0.000 -2.159) 2.200 8.784 ( -0.386 -0.000 0.921) 0.999 8.839 ( 1.812 0.000 0.460) 1.869 10.403 ( -0.533 -0.000 0.125) 0.547 10.483 ( 1.536 0.000 -0.394) 1.586 10.649 ( 0.199 0.000 6.077) 6.081 10.704 ( -2.292 -0.000 -5.107) 5.598 16.047 ( -0.577 -0.000 -0.378) 0.689 16.077 ( -4.393 -0.000 1.427) 4.619 16.361 ( 1.685 0.000 3.450) 3.840 16.625 ( 2.039 0.000 -4.159) 4.632 17.130 ( 4.414 0.000 6.578) 7.922 17.327 ( 5.220 0.000 -4.648) 6.990 18.016 ( 2.676 0.000 4.274) 5.042 18.114 ( 1.124 0.000 -6.992) 7.082 19.248 ( -8.380 -0.000 0.721) 8.411 19.341 ( -5.168 -0.000 0.626) 5.206 19.689 ( -11.723 -0.000 -8.384) 14.412 19.701 ( -2.706 -0.000 7.474) 7.949 ======================= Grid point 210 (94/138) ======================= q-point: (-0.27 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.380 ( -18.272 4.853 -11.941) 22.361 1.446 ( -6.446 3.741 9.005) 11.690 1.791 ( -9.610 -8.701 -19.154) 23.128 1.877 ( 2.069 -5.590 4.837) 7.676 2.287 ( 0.858 2.087 2.360) 3.265 2.529 ( 1.812 -0.203 6.409) 6.663 2.566 ( 0.207 -4.837 4.595) 6.675 2.686 ( -0.147 -0.108 3.701) 3.705 2.769 ( -9.221 4.892 -0.458) 10.448 3.003 ( 1.651 -1.228 2.545) 3.273 3.126 ( -10.034 2.078 -0.726) 10.273 3.288 ( -4.411 -7.755 -5.630) 10.550 3.413 ( -15.284 -2.462 -2.499) 15.682 3.478 ( -13.893 -1.911 4.212) 14.643 3.967 ( 5.642 4.731 -1.758) 7.570 4.148 ( -3.285 0.948 -0.671) 3.485 4.412 ( 7.533 4.753 -0.341) 8.914 4.527 ( 2.690 1.667 -1.326) 3.431 4.788 ( 10.500 -1.163 1.936) 10.740 4.918 ( 9.915 -0.038 3.234) 10.429 5.268 ( 8.064 -0.628 0.462) 8.102 5.411 ( 7.478 1.314 0.221) 7.595 5.695 ( -2.658 7.269 -7.915) 11.070 5.704 ( 4.516 -5.126 3.307) 7.590 6.127 ( -4.124 -4.456 -0.751) 6.118 6.513 ( -8.695 9.049 1.340) 12.621 6.642 ( -5.410 1.312 -0.542) 5.593 6.760 ( -0.406 -0.905 0.555) 1.137 6.881 ( -6.264 -2.788 -1.383) 6.995 6.998 ( -5.925 -8.310 0.606) 10.224 7.160 ( 5.069 0.691 0.335) 5.127 7.266 ( 0.868 0.400 -1.042) 1.413 7.348 ( -0.375 -0.125 -0.481) 0.623 7.413 ( 0.885 -1.639 0.908) 2.072 8.645 ( -1.345 -0.296 3.217) 3.500 8.729 ( 0.742 1.337 -1.620) 2.227 8.781 ( -0.185 0.200 0.111) 0.294 8.886 ( 2.846 -2.637 0.126) 3.882 10.378 ( -1.279 2.601 0.258) 2.910 10.500 ( 1.777 -0.397 -0.337) 1.851 10.574 ( -2.954 4.279 0.222) 5.205 10.743 ( 2.148 -2.209 1.806) 3.572 16.010 ( -3.674 0.900 0.861) 3.880 16.086 ( -3.213 -2.951 0.055) 4.363 16.399 ( 2.783 -1.059 2.815) 4.098 16.659 ( 2.777 -3.015 -3.756) 5.560 17.228 ( 5.899 -3.574 6.262) 9.316 17.391 ( 6.533 -3.287 -4.349) 8.509 18.030 ( 1.875 1.851 2.830) 3.867 18.121 ( 2.640 -1.090 -4.681) 5.484 19.166 ( -9.510 0.589 0.557) 9.545 19.285 ( -6.249 0.713 0.303) 6.297 19.513 ( -13.029 4.622 -7.098) 15.540 19.644 ( -4.658 5.505 6.274) 9.558 ======================= Grid point 211 (95/138) ======================= q-point: (-0.18 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -11.371 -8.047 -0.042) 13.930 1.371 ( -3.438 2.851 6.123) 7.579 1.793 ( -9.780 -8.273 -18.250) 22.297 1.993 ( -1.628 -5.588 3.525) 6.805 2.277 ( 0.627 1.163 -0.007) 1.321 2.481 ( -14.773 2.900 0.882) 15.081 2.531 ( 0.099 6.263 2.912) 6.908 2.694 ( 0.958 -2.812 -1.738) 3.442 2.761 ( -0.287 -3.776 6.876) 7.849 3.005 ( -2.777 1.793 3.809) 5.043 3.080 ( -2.782 -4.957 -3.598) 6.727 3.329 ( -5.235 -2.434 -1.452) 5.953 3.346 ( -8.480 -2.511 -0.251) 8.848 3.530 ( -9.179 -12.251 4.193) 15.872 3.846 ( -3.629 5.658 -4.395) 8.031 4.150 ( 5.232 2.727 -1.005) 5.985 4.351 ( 4.279 8.008 -1.600) 9.220 4.489 ( 3.052 4.050 2.391) 5.607 4.945 ( 13.580 -2.414 1.654) 13.891 4.996 ( 9.457 1.603 3.123) 10.087 5.299 ( 2.679 7.219 0.764) 7.738 5.391 ( 0.922 0.187 -3.923) 4.034 5.559 ( 0.065 0.958 -4.864) 4.958 5.859 ( 5.729 -3.707 3.412) 7.630 6.164 ( -3.119 -2.049 -0.850) 3.827 6.301 ( -8.828 3.730 -0.112) 9.584 6.588 ( -3.348 1.195 1.500) 3.858 6.756 ( -4.170 -1.503 -0.856) 4.514 6.852 ( -7.928 -0.361 -0.587) 7.958 7.101 ( -7.288 -8.725 0.393) 11.375 7.188 ( 5.516 0.583 -0.710) 5.592 7.280 ( 3.789 0.303 0.437) 3.827 7.353 ( -0.703 -0.995 -0.307) 1.256 7.442 ( -0.185 -0.860 0.553) 1.039 8.650 ( -0.774 -0.125 2.378) 2.504 8.712 ( 1.153 1.146 -0.234) 1.642 8.783 ( 0.772 -0.575 -0.889) 1.310 8.960 ( 3.762 -2.174 -0.840) 4.425 10.302 ( -1.578 3.442 0.601) 3.834 10.509 ( -0.289 0.605 -0.699) 0.969 10.526 ( 0.714 0.146 0.299) 0.788 10.785 ( 3.558 1.200 2.068) 4.287 15.974 ( -5.167 -1.072 0.774) 5.333 16.106 ( -3.889 -2.983 -0.828) 4.971 16.460 ( 3.589 -1.551 3.000) 4.928 16.743 ( 4.093 -4.000 -3.156) 6.535 17.382 ( 6.513 -5.877 4.305) 9.772 17.523 ( 7.651 -5.868 -2.781) 10.035 18.024 ( 0.943 0.501 1.938) 2.213 18.152 ( 2.985 -0.961 -3.259) 4.523 19.078 ( -8.030 0.910 0.935) 8.136 19.219 ( -5.603 1.274 0.144) 5.748 19.284 ( -12.498 6.118 -5.091) 14.817 19.478 ( -6.239 9.706 4.185) 12.273 ======================= Grid point 212 (96/138) ======================= q-point: (-0.09 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( 6.019 6.658 4.880) 10.216 1.422 ( -4.659 -15.224 8.536) 18.065 1.839 ( -9.740 -14.576 -15.285) 23.259 2.064 ( -6.127 -5.013 5.143) 9.441 2.224 ( -5.831 0.006 -10.320) 11.854 2.356 ( 1.852 3.734 -3.859) 5.680 2.420 ( -2.080 4.777 8.935) 10.344 2.770 ( 3.829 1.669 4.297) 5.993 2.809 ( -6.816 -5.953 -0.448) 9.061 2.969 ( -0.954 0.486 5.185) 5.295 3.164 ( -2.931 -6.559 0.175) 7.186 3.304 ( 2.713 1.268 -2.091) 3.653 3.382 ( -12.642 -9.833 0.631) 16.029 3.600 ( -9.143 -1.289 -1.574) 9.367 3.771 ( -1.829 -1.682 -1.712) 3.018 4.090 ( -1.517 5.081 -1.846) 5.615 4.225 ( 5.118 8.959 -2.669) 10.657 4.481 ( 5.222 2.544 4.426) 7.303 4.964 ( 0.810 8.631 -3.209) 9.244 5.032 ( 7.553 4.137 2.135) 8.872 5.261 ( 8.765 -1.333 2.287) 9.156 5.416 ( 3.796 0.359 -0.319) 3.826 5.585 ( 0.292 -3.411 -1.576) 3.769 5.878 ( 0.759 3.872 0.677) 4.003 6.203 ( 1.472 -5.298 0.239) 5.504 6.236 ( -3.361 0.469 -0.909) 3.513 6.555 ( -2.954 -0.307 0.032) 2.970 6.749 ( -9.620 2.469 -0.330) 9.937 6.752 ( -3.751 -2.256 -0.235) 4.384 7.162 ( -8.576 -6.170 0.255) 10.568 7.236 ( 4.618 -0.790 0.193) 4.689 7.311 ( 2.745 0.127 0.489) 2.791 7.367 ( -0.008 -0.994 0.139) 1.003 7.446 ( -1.165 -0.592 -0.220) 1.325 8.649 ( 0.286 0.424 0.121) 0.526 8.706 ( 0.598 0.712 1.734) 1.967 8.812 ( 1.696 -1.582 -0.896) 2.486 9.007 ( 3.334 -0.054 -1.335) 3.592 10.266 ( 0.940 0.762 0.582) 1.343 10.496 ( 1.558 1.913 -0.023) 2.467 10.525 ( 0.390 0.568 -0.079) 0.693 10.783 ( 1.999 1.772 0.829) 2.797 15.972 ( -4.947 -3.420 0.642) 6.048 16.121 ( -3.723 -3.018 -1.682) 5.079 16.522 ( 3.087 -0.702 4.119) 5.195 16.828 ( 4.210 -2.427 -3.181) 5.808 17.552 ( 6.379 -5.252 2.611) 8.665 17.692 ( 7.691 -6.241 -1.693) 10.049 18.056 ( -0.091 -3.521 1.764) 3.940 18.188 ( 1.980 -2.174 -2.966) 4.177 18.995 ( -4.627 4.603 2.082) 6.850 19.042 ( -10.377 6.226 -2.000) 12.266 19.183 ( -3.164 0.519 -1.613) 3.589 19.255 ( -7.254 8.562 2.128) 11.422 ======================= Grid point 221 (97/138) ======================= q-point: (-0.27 -0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.230 ( -23.060 -0.000 -13.252) 26.597 1.316 ( -22.008 -0.000 -4.795) 22.524 1.629 ( -4.775 -0.000 2.312) 5.305 1.842 ( 1.336 0.000 -5.355) 5.520 2.320 ( -2.933 -0.000 6.615) 7.236 2.449 ( -6.185 -0.000 2.713) 6.754 2.630 ( 7.488 0.000 6.079) 9.645 2.649 ( -8.626 -0.000 -3.074) 9.157 2.786 ( -5.122 -0.000 5.708) 7.669 3.047 ( 0.148 0.000 10.646) 10.647 3.064 ( -6.490 -0.000 -1.126) 6.587 3.106 ( -4.449 -0.000 -6.665) 8.013 3.234 ( -13.524 -0.000 -3.941) 14.087 3.419 ( -5.155 -0.000 1.655) 5.414 4.047 ( -11.373 -0.000 -4.553) 12.250 4.116 ( 11.894 0.000 -2.255) 12.106 4.507 ( 2.623 0.000 -3.699) 4.535 4.572 ( 9.418 0.000 1.953) 9.618 4.898 ( 11.276 0.000 3.736) 11.879 5.005 ( 10.374 0.000 3.159) 10.844 5.307 ( 4.375 0.000 0.535) 4.408 5.539 ( 9.634 0.000 2.403) 9.929 5.686 ( 4.637 0.000 1.508) 4.876 5.693 ( -6.760 -0.000 -9.985) 12.058 6.083 ( 2.316 0.000 1.941) 3.022 6.531 ( -11.722 -0.000 -7.458) 13.894 6.615 ( -4.501 -0.000 2.694) 5.245 6.721 ( -12.535 -0.000 1.326) 12.605 6.776 ( -0.633 -0.000 2.986) 3.053 6.832 ( -9.157 -0.000 -3.655) 9.859 7.240 ( 7.812 0.000 1.795) 8.016 7.275 ( 2.358 0.000 -1.232) 2.661 7.348 ( -0.250 -0.000 -0.402) 0.473 7.404 ( 0.868 0.000 0.124) 0.877 8.641 ( -1.399 -0.000 4.757) 4.958 8.741 ( 0.734 0.000 -2.174) 2.294 8.786 ( -0.211 -0.000 1.359) 1.375 8.881 ( 2.821 0.000 0.055) 2.822 10.393 ( -0.564 -0.000 -0.307) 0.642 10.508 ( 1.660 0.000 -0.579) 1.758 10.624 ( -3.351 -0.000 -4.648) 5.730 10.708 ( 1.202 0.000 9.562) 9.637 15.998 ( -6.133 -0.000 2.966) 6.812 16.029 ( -0.627 -0.000 -2.484) 2.562 16.422 ( 3.156 0.000 2.301) 3.906 16.634 ( 1.999 0.000 -3.959) 4.435 17.280 ( 8.006 0.000 7.179) 10.754 17.410 ( 7.973 0.000 -4.616) 9.213 18.090 ( 2.386 0.000 4.926) 5.473 18.105 ( 2.511 0.000 -5.871) 6.385 19.077 ( -11.726 -0.000 0.638) 11.744 19.228 ( -7.783 -0.000 -0.596) 7.806 19.410 ( -14.773 -0.000 -5.835) 15.883 19.668 ( -5.942 -0.000 5.865) 8.349 ======================= Grid point 222 (98/138) ======================= q-point: (-0.18 -0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( -18.428 -4.464 -1.359) 19.009 1.195 ( -21.457 -7.948 -3.318) 23.121 1.624 ( -6.815 -4.258 -1.499) 8.175 1.853 ( -6.354 -4.751 -4.785) 9.266 2.282 ( -7.835 1.827 2.507) 8.427 2.414 ( -5.476 0.700 1.438) 5.705 2.544 ( -6.391 -2.668 -2.690) 7.430 2.717 ( -1.268 7.044 4.994) 8.727 2.743 ( 3.226 -3.393 3.847) 6.059 2.963 ( -8.569 -0.371 1.158) 8.655 3.048 ( 1.471 0.788 -0.002) 1.669 3.115 ( -8.373 -3.978 -2.525) 9.607 3.297 ( 1.180 -10.320 4.017) 11.136 3.382 ( -1.660 1.186 1.307) 2.423 3.886 ( -7.718 4.678 -4.844) 10.242 4.219 ( 8.169 -0.559 -3.183) 8.785 4.484 ( 3.330 4.076 -3.031) 6.074 4.620 ( 7.450 4.459 2.458) 9.024 5.016 ( 11.963 -1.781 5.137) 13.140 5.101 ( 8.517 0.568 2.812) 8.987 5.361 ( 2.405 -2.554 -0.182) 3.513 5.474 ( -2.420 10.098 -5.107) 11.571 5.580 ( 0.947 3.230 -4.202) 5.383 5.833 ( 6.457 -6.988 2.731) 9.899 6.131 ( 3.269 -0.456 0.725) 3.379 6.292 ( -13.844 6.847 -2.723) 15.683 6.573 ( -3.882 -0.569 0.454) 3.950 6.688 ( -7.939 -0.988 -1.722) 8.184 6.771 ( -6.545 -1.513 2.121) 7.045 6.836 ( -10.365 -10.463 -2.816) 14.994 7.270 ( 6.149 2.333 -0.101) 6.578 7.317 ( 3.790 0.116 0.595) 3.838 7.345 ( 1.078 -0.277 0.034) 1.113 7.426 ( 0.373 -1.235 -0.158) 1.300 8.652 ( -0.742 -0.100 5.789) 5.837 8.735 ( 1.088 0.678 -1.387) 1.889 8.785 ( 0.287 0.211 0.580) 0.681 8.940 ( 3.722 -3.106 -0.774) 4.909 10.355 ( -1.448 3.623 -0.068) 3.902 10.514 ( -1.736 2.007 -0.398) 2.684 10.532 ( 0.285 0.259 -0.452) 0.594 10.815 ( 3.368 -2.988 5.686) 7.252 15.934 ( -5.650 1.438 0.972) 5.910 16.026 ( -3.705 -1.686 -1.850) 4.471 16.475 ( 4.273 -1.657 2.239) 5.101 16.687 ( 3.179 -4.631 -3.504) 6.621 17.392 ( 8.717 -2.015 5.276) 10.387 17.505 ( 9.412 -3.630 -2.737) 10.452 18.067 ( 1.036 2.651 0.963) 3.005 18.152 ( 2.714 -1.214 -1.544) 3.350 18.991 ( -10.817 -1.497 0.953) 10.962 19.158 ( -7.821 -0.410 -2.103) 8.109 19.243 ( -13.854 3.236 -1.867) 14.348 19.576 ( -6.882 5.944 4.121) 9.984 ======================= Grid point 223 (99/138) ======================= q-point: (-0.09 -0.27 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( -9.612 -15.356 9.669) 20.535 1.253 ( -9.249 -17.270 2.888) 19.803 1.622 ( -0.807 -0.562 -9.259) 9.311 1.862 ( -16.649 -8.864 2.236) 18.994 2.154 ( -5.418 1.940 -12.116) 13.414 2.396 ( 2.139 0.513 0.467) 2.249 2.566 ( -4.340 0.544 4.290) 6.127 2.576 ( -8.229 0.399 1.214) 8.328 2.827 ( 3.610 -1.632 3.038) 4.992 2.938 ( -9.537 -2.714 5.975) 11.577 3.029 ( 0.463 -0.657 -3.235) 3.333 3.171 ( -3.620 -6.523 -0.072) 7.460 3.362 ( 0.947 1.160 1.201) 1.920 3.463 ( -2.796 -6.202 1.877) 7.057 3.766 ( -2.065 1.961 -1.928) 3.439 4.211 ( 3.189 6.777 -3.613) 8.316 4.408 ( 4.915 7.064 -4.113) 9.538 4.603 ( 8.145 4.631 3.496) 10.000 5.076 ( -1.109 7.214 -1.145) 7.388 5.169 ( 6.972 1.208 2.561) 7.525 5.312 ( 3.824 0.892 1.670) 4.267 5.414 ( 0.533 -1.994 -2.668) 3.373 5.561 ( 3.310 0.272 -1.678) 3.721 5.957 ( 3.932 0.932 -0.071) 4.042 6.118 ( -2.275 -3.747 1.352) 4.587 6.198 ( -1.620 -0.567 -0.458) 1.776 6.550 ( -2.327 0.909 1.235) 2.786 6.649 ( -7.170 -3.057 -1.738) 7.986 6.707 ( -7.814 1.032 0.715) 7.915 6.923 ( -11.737 -10.183 -2.330) 15.712 7.282 ( 4.066 1.429 0.266) 4.318 7.331 ( 1.481 0.027 0.199) 1.494 7.378 ( 3.312 -0.070 1.145) 3.506 7.436 ( -0.273 0.117 -0.597) 0.667 8.659 ( -0.446 0.460 3.932) 3.984 8.730 ( 0.891 0.859 0.338) 1.283 8.800 ( 1.505 -1.197 -0.269) 1.941 9.016 ( 3.797 -1.762 -2.251) 4.753 10.292 ( 0.048 1.567 0.856) 1.786 10.493 ( -0.630 -0.881 0.183) 1.098 10.549 ( 1.169 -0.120 -0.239) 1.199 10.851 ( 2.097 2.843 1.719) 3.929 15.881 ( -5.812 -1.459 0.253) 5.998 16.023 ( -4.823 -3.155 -1.476) 5.949 16.552 ( 4.755 -1.158 2.903) 5.691 16.795 ( 4.112 -4.505 -3.290) 6.931 17.534 ( 8.665 -4.484 2.388) 10.045 17.662 ( 9.603 -5.145 -0.786) 10.922 18.037 ( -1.298 1.008 2.068) 2.641 18.174 ( 1.280 -0.395 -2.896) 3.191 18.948 ( -8.139 -1.971 0.786) 8.411 19.057 ( -10.316 5.018 0.463) 11.481 19.116 ( -5.352 -1.876 -1.710) 5.923 19.383 ( -6.873 10.083 2.072) 12.377 ======================= Grid point 233 (100/138) ======================= q-point: (-0.18 -0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.769 ( -21.483 -0.000 -2.444) 21.621 0.892 ( -25.198 -0.000 2.433) 25.315 1.435 ( -25.505 -0.000 12.465) 28.388 1.734 ( -7.048 -0.000 -13.724) 15.428 2.236 ( -8.416 -0.000 -2.457) 8.768 2.361 ( -7.299 -0.000 8.573) 11.259 2.487 ( -2.320 -0.000 -3.563) 4.251 2.729 ( 2.879 0.000 -2.785) 4.006 2.810 ( 1.835 0.000 0.961) 2.072 2.895 ( -11.221 -0.000 4.246) 11.997 2.974 ( 0.095 0.000 -1.035) 1.040 3.137 ( 1.253 0.000 -2.145) 2.484 3.241 ( 6.317 0.000 8.891) 10.907 3.371 ( -2.173 -0.000 -1.755) 2.794 3.826 ( -9.075 -0.000 -5.922) 10.836 4.275 ( 8.578 0.000 -3.831) 9.394 4.543 ( 3.285 0.000 -1.467) 3.598 4.744 ( 8.869 0.000 3.470) 9.524 5.097 ( 7.332 0.000 4.738) 8.729 5.203 ( 10.474 0.000 1.825) 10.632 5.352 ( 1.271 0.000 -0.045) 1.272 5.491 ( -6.359 -0.000 -9.155) 11.147 5.684 ( 4.021 0.000 3.216) 5.149 5.789 ( 5.455 0.000 1.792) 5.742 6.188 ( 7.278 0.000 0.845) 7.327 6.240 ( -15.233 -0.000 -12.399) 19.641 6.495 ( -14.054 -0.000 1.572) 14.141 6.544 ( -4.709 -0.000 0.606) 4.748 6.650 ( -8.933 -0.000 -3.771) 9.696 6.731 ( -5.916 -0.000 2.055) 6.263 7.341 ( -0.104 -0.000 -0.219) 0.242 7.342 ( 4.987 0.000 0.149) 4.989 7.376 ( 6.332 0.000 0.968) 6.406 7.411 ( 0.217 0.000 -0.909) 0.934 8.682 ( 1.851 0.000 10.031) 10.201 8.745 ( 1.183 0.000 -1.729) 2.095 8.793 ( -0.163 -0.000 1.924) 1.931 8.934 ( 3.397 0.000 -0.165) 3.401 10.380 ( -0.471 -0.000 -1.031) 1.134 10.530 ( 1.373 0.000 -1.006) 1.702 10.539 ( -3.416 -0.000 -2.816) 4.427 10.822 ( 4.241 0.000 12.043) 12.768 15.911 ( -6.170 -0.000 3.161) 6.932 15.976 ( -2.731 -0.000 -8.056) 8.506 16.490 ( 3.021 0.000 1.901) 3.569 16.648 ( 2.286 0.000 -2.881) 3.678 17.486 ( 10.388 0.000 6.458) 12.231 17.543 ( 10.484 0.000 -3.524) 11.060 18.118 ( 2.655 0.000 -5.047) 5.703 18.150 ( 0.759 0.000 4.516) 4.579 18.872 ( -12.369 -0.000 1.661) 12.480 19.071 ( -8.440 -0.000 -4.043) 9.358 19.165 ( -11.269 -0.000 5.361) 12.480 19.579 ( -7.374 -0.000 2.944) 7.939 ======================= Grid point 234 (101/138) ======================= q-point: (-0.09 -0.18 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 242 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.797 ( -18.904 -10.624 7.644) 22.993 0.826 ( -9.886 -20.073 12.262) 25.515 1.367 ( -27.498 -14.663 13.754) 34.063 1.641 ( -8.351 -2.228 -13.538) 16.061 2.116 ( -5.517 3.183 -13.524) 14.949 2.370 ( -7.182 -3.363 9.251) 12.185 2.446 ( -0.783 1.800 -2.391) 3.094 2.729 ( 1.038 6.966 -4.498) 8.357 2.797 ( 3.486 -4.983 -2.833) 6.709 2.859 ( -6.179 -0.211 13.312) 14.677 3.053 ( 2.149 -5.629 -1.438) 6.194 3.083 ( 2.254 4.616 -4.747) 6.994 3.341 ( -3.499 -3.106 -2.183) 5.163 3.386 ( 2.528 -3.409 3.347) 5.404 3.753 ( -3.532 -0.108 -0.642) 3.592 4.313 ( 5.216 2.210 -4.930) 7.510 4.529 ( 4.188 4.252 -1.621) 6.185 4.789 ( 9.352 4.659 4.796) 11.496 5.174 ( -1.375 1.146 -0.597) 1.887 5.228 ( 6.429 3.491 3.465) 8.095 5.341 ( -3.229 2.309 -0.263) 3.979 5.418 ( 5.703 0.048 -5.432) 7.876 5.636 ( 2.464 5.122 1.893) 5.991 5.927 ( 1.773 -5.881 0.106) 6.144 6.032 ( -9.613 -1.002 -1.902) 9.851 6.236 ( 5.199 1.842 -0.129) 5.518 6.493 ( -6.781 -5.973 -2.347) 9.337 6.532 ( -6.414 -1.597 0.161) 6.612 6.629 ( -9.755 -8.606 -4.123) 13.646 6.671 ( -6.546 0.995 0.856) 6.676 7.327 ( 0.196 1.257 0.012) 1.272 7.371 ( 4.675 1.258 0.414) 4.859 7.401 ( 0.931 0.078 0.432) 1.029 7.440 ( 2.950 -0.531 -0.503) 3.040 8.705 ( 1.445 3.076 8.820) 9.453 8.754 ( 1.489 0.598 1.534) 2.220 8.793 ( 0.182 -0.345 0.605) 0.720 9.004 ( 4.684 -2.851 -1.688) 5.737 10.333 ( -0.777 3.416 0.090) 3.505 10.476 ( -2.096 0.503 0.865) 2.323 10.545 ( 0.943 -0.762 -0.934) 1.531 10.909 ( 2.619 0.611 2.561) 3.714 15.831 ( -6.336 1.968 -1.353) 6.771 15.925 ( -5.952 -2.111 -2.481) 6.785 16.572 ( 5.474 -2.876 1.243) 6.307 16.720 ( 3.097 -6.046 -3.433) 7.611 17.577 ( 9.455 -0.410 2.416) 9.767 17.671 ( 10.378 -3.653 -0.849) 11.035 18.071 ( -1.847 3.727 1.291) 4.355 18.168 ( -0.140 -0.116 -2.394) 2.401 18.823 ( -9.072 -3.797 0.263) 9.838 19.012 ( -5.399 -1.746 -2.408) 6.164 19.079 ( -6.800 3.834 8.843) 11.796 19.471 ( -6.864 5.867 1.229) 9.113 ======================= Grid point 245 (102/138) ======================= q-point: (-0.09 -0.09 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.568 ( -16.459 -0.000 19.318) 25.378 0.601 ( -7.478 -0.000 29.206) 30.148 0.987 ( -33.661 -0.000 24.062) 41.377 1.484 ( -8.913 -0.000 -13.929) 16.537 2.059 ( -5.092 -0.000 -15.775) 16.577 2.331 ( -2.352 -0.000 7.091) 7.471 2.453 ( -1.368 -0.000 -0.747) 1.559 2.731 ( 1.433 0.000 -5.875) 6.047 2.760 ( -1.515 -0.000 -2.071) 2.566 2.909 ( 1.042 0.000 12.107) 12.152 3.024 ( 4.392 0.000 -0.975) 4.499 3.156 ( 1.888 0.000 -2.574) 3.192 3.196 ( -9.238 -0.000 -15.104) 17.705 3.397 ( 3.490 0.000 2.734) 4.433 3.729 ( -1.483 -0.000 5.328) 5.531 4.358 ( 4.617 0.000 -5.132) 6.903 4.610 ( 4.381 0.000 2.498) 5.043 4.909 ( 6.173 0.000 5.140) 8.033 5.158 ( -1.605 -0.000 0.705) 1.753 5.332 ( -0.093 -0.000 4.036) 4.037 5.405 ( 8.444 0.000 -3.527) 9.151 5.410 ( 2.155 0.000 -4.526) 5.013 5.736 ( -0.565 -0.000 3.422) 3.468 5.804 ( -11.877 -0.000 -9.368) 15.127 5.930 ( -3.127 -0.000 1.999) 3.712 6.275 ( -5.052 -0.000 1.743) 5.344 6.322 ( 1.024 0.000 -1.987) 2.235 6.465 ( -4.189 -0.000 -1.271) 4.378 6.500 ( -5.355 -0.000 -1.684) 5.614 6.635 ( -5.391 -0.000 0.948) 5.473 7.340 ( 0.120 0.000 0.180) 0.217 7.400 ( -0.549 -0.000 -0.809) 0.978 7.423 ( 3.643 0.000 0.302) 3.655 7.465 ( 3.382 0.000 0.192) 3.387 8.760 ( 1.476 0.000 -0.812) 1.685 8.786 ( 0.118 0.000 1.306) 1.312 8.904 ( 13.645 0.000 14.044) 19.581 8.991 ( 2.859 0.000 0.611) 2.923 10.372 ( 1.023 0.000 -1.698) 1.982 10.482 ( -2.063 -0.000 -0.205) 2.073 10.541 ( 0.821 0.000 -1.412) 1.633 10.916 ( -4.524 -0.000 -6.954) 8.296 15.804 ( -9.010 -0.000 -9.852) 13.351 15.830 ( -5.102 -0.000 2.104) 5.519 16.544 ( 1.777 0.000 1.895) 2.598 16.675 ( 2.096 0.000 -1.626) 2.653 17.666 ( 6.247 0.000 1.010) 6.328 17.711 ( 9.928 0.000 -1.680) 10.070 18.124 ( 1.960 0.000 -5.254) 5.607 18.134 ( -6.075 -0.000 -0.308) 6.083 18.700 ( -8.878 -0.000 3.807) 9.660 18.942 ( -3.902 -0.000 -3.171) 5.028 19.187 ( 7.883 0.000 15.906) 17.752 19.470 ( -5.832 -0.000 0.050) 5.832 ======================= Grid point 246 (103/138) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.942 ( 11.151 0.000 -15.608) 19.182 0.942 ( -11.151 -0.000 15.608) 19.182 1.344 ( -4.559 -0.000 -22.869) 23.319 1.344 ( 4.559 0.000 22.869) 23.319 2.029 ( -6.498 -0.000 -38.427) 38.972 2.029 ( 6.498 0.000 38.427) 38.972 2.467 ( -3.841 -0.000 -2.711) 4.702 2.467 ( 3.841 0.000 2.711) 4.702 2.729 ( 4.239 0.000 -3.863) 5.735 2.729 ( -4.239 -0.000 3.863) 5.735 3.056 ( -2.915 -0.000 0.654) 2.988 3.056 ( 2.915 0.000 -0.654) 2.988 3.301 ( -0.297 -0.000 -9.592) 9.596 3.301 ( 0.297 0.000 9.592) 9.596 4.078 ( -0.643 -0.000 -14.432) 14.446 4.078 ( 0.643 0.000 14.432) 14.446 4.878 ( -7.150 -0.000 -6.693) 9.794 4.878 ( 7.150 0.000 6.693) 9.794 5.257 ( -8.664 -0.000 -3.272) 9.261 5.257 ( 8.664 0.000 3.272) 9.261 5.430 ( 0.617 0.000 -1.224) 1.371 5.430 ( -0.617 -0.000 1.224) 1.371 5.731 ( -7.568 -0.000 1.360) 7.689 5.731 ( 7.568 0.000 -1.360) 7.689 6.132 ( -2.086 -0.000 -7.730) 8.007 6.132 ( 2.086 0.000 7.730) 8.007 6.320 ( -0.871 -0.000 -4.457) 4.541 6.320 ( 0.871 0.000 4.457) 4.541 6.550 ( -3.544 -0.000 -2.025) 4.082 6.550 ( 3.544 0.000 2.025) 4.082 7.360 ( -0.775 -0.000 -0.626) 0.997 7.360 ( 0.775 0.000 0.626) 0.997 7.481 ( -0.672 -0.000 -0.528) 0.855 7.481 ( 0.672 0.000 0.528) 0.855 8.783 ( -1.787 -0.000 0.080) 1.789 8.783 ( 1.787 0.000 -0.080) 1.789 9.077 ( -0.974 -0.000 -2.369) 2.561 9.077 ( 0.974 0.000 2.369) 2.561 10.414 ( -10.717 -0.000 -0.121) 10.718 10.414 ( 10.717 0.000 0.121) 10.718 10.505 ( -0.474 -0.000 -1.938) 1.996 10.505 ( 0.474 0.000 1.938) 1.996 15.773 ( -5.298 -0.000 0.373) 5.311 15.773 ( 5.298 0.000 -0.373) 5.311 16.628 ( 0.270 0.000 -2.879) 2.891 16.628 ( -0.270 -0.000 2.879) 2.891 17.766 ( -0.902 -0.000 -1.589) 1.827 17.766 ( 0.902 0.000 1.589) 1.827 18.060 ( 8.969 0.000 -4.787) 10.166 18.060 ( -8.969 -0.000 4.787) 10.166 18.770 ( 1.261 0.000 -6.447) 6.569 18.770 ( -1.261 -0.000 6.447) 6.569 19.350 ( -1.324 -0.000 -2.290) 2.645 19.350 ( 1.324 0.000 2.290) 2.645 ======================= Grid point 248 (104/138) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( -0.533 -7.922 2.371) 8.287 1.140 ( 18.831 -11.943 -14.866) 26.800 1.223 ( 0.533 0.278 -11.840) 11.855 1.405 ( 6.674 4.475 22.859) 24.230 1.994 ( -5.076 -13.394 -34.312) 37.182 2.284 ( 5.405 -8.183 20.697) 22.903 2.413 ( -2.766 1.840 1.518) 3.653 2.495 ( 4.928 2.463 7.298) 9.144 2.735 ( -4.935 -2.549 3.961) 6.822 2.816 ( 6.361 -5.042 -0.661) 8.144 3.049 ( -3.141 -2.375 2.245) 4.533 3.080 ( 1.882 -1.059 -0.992) 2.376 3.268 ( 0.663 -0.256 -10.033) 10.058 3.327 ( 0.597 0.370 7.712) 7.744 4.008 ( -1.601 1.998 -12.910) 13.161 4.098 ( -0.572 2.913 12.666) 13.010 4.720 ( -7.681 7.796 -6.369) 12.662 4.892 ( 6.577 7.546 8.560) 13.171 5.114 ( -11.091 4.146 -3.430) 12.328 5.296 ( 7.773 3.978 0.549) 8.749 5.388 ( -3.750 2.827 0.704) 4.749 5.414 ( -0.453 1.608 -1.496) 2.243 5.750 ( -3.707 -4.959 -1.442) 6.357 5.841 ( 4.537 -6.914 -0.625) 8.294 6.121 ( -1.105 -3.198 -5.592) 6.535 6.170 ( 0.216 -0.165 6.661) 6.666 6.361 ( 2.596 -4.702 -2.187) 5.799 6.411 ( 5.952 -5.877 2.482) 8.725 6.526 ( -1.791 -0.646 -1.826) 2.638 6.594 ( 4.940 -0.149 0.432) 4.961 7.343 ( -0.846 0.951 -0.513) 1.373 7.363 ( 0.927 0.603 0.990) 1.484 7.462 ( -2.296 0.506 -0.931) 2.529 7.479 ( -0.910 0.263 0.555) 1.098 8.761 ( -2.393 0.717 0.050) 2.498 8.793 ( 1.157 0.579 0.172) 1.305 9.000 ( -3.748 3.628 2.872) 5.955 9.007 ( -1.376 5.522 -3.357) 6.607 10.368 ( -6.458 -2.153 0.190) 6.810 10.480 ( 2.621 0.050 0.595) 2.688 10.525 ( -1.163 -2.540 -0.217) 2.802 10.622 ( 10.705 -4.593 4.621) 12.531 15.754 ( -1.914 -1.874 -0.404) 2.709 15.828 ( 5.864 -0.872 -0.614) 5.960 16.666 ( -0.473 -4.525 -2.441) 5.163 16.671 ( -1.703 -4.120 2.809) 5.269 17.749 ( -6.895 -2.025 -1.074) 7.266 17.771 ( -5.692 -2.787 1.594) 6.535 18.012 ( -2.128 1.003 4.198) 4.812 18.110 ( 9.570 2.037 -4.418) 10.735 18.802 ( 1.779 -3.173 -2.572) 4.455 18.831 ( 2.917 -4.003 2.965) 5.773 19.265 ( -0.108 7.450 -3.816) 8.371 19.321 ( 4.181 6.408 4.016) 8.641 ======================= Grid point 249 (105/138) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.137 ( 4.341 -8.947 -13.981) 17.157 1.344 ( 0.934 -8.334 10.684) 13.582 1.481 ( 8.162 -9.251 9.102) 15.332 1.538 ( 14.135 -8.766 -1.652) 16.715 2.112 ( -1.401 -10.453 -23.410) 25.676 2.341 ( -0.035 -1.492 1.741) 2.293 2.493 ( 6.155 -1.884 0.300) 6.444 2.560 ( 3.734 -3.577 5.963) 7.893 2.723 ( -4.895 0.262 5.839) 7.624 2.950 ( 0.782 -5.830 4.102) 7.172 3.109 ( 4.824 -1.377 -3.580) 6.163 3.121 ( -0.218 -3.798 0.023) 3.805 3.303 ( 3.891 -3.702 -1.388) 5.548 3.358 ( 2.117 -0.547 4.688) 5.173 3.900 ( -1.978 4.317 -9.239) 10.387 4.042 ( -0.636 6.817 8.948) 11.267 4.486 ( -7.884 8.283 -3.379) 11.924 4.787 ( -2.435 9.057 7.256) 11.858 4.934 ( -4.193 7.108 -3.228) 8.862 5.245 ( 4.295 7.358 -0.082) 8.520 5.333 ( -0.091 1.169 1.248) 1.713 5.398 ( 0.318 -0.553 0.125) 0.650 5.770 ( -5.943 -4.040 -6.590) 9.750 5.950 ( -3.313 -2.042 4.041) 5.610 6.150 ( -1.677 0.086 0.581) 1.777 6.207 ( -0.285 -4.684 -1.373) 4.889 6.489 ( 5.927 -3.773 0.255) 7.031 6.535 ( 0.782 -3.567 0.434) 3.677 6.627 ( 5.768 -3.175 0.851) 6.639 6.648 ( 10.370 -6.867 -1.130) 12.488 7.315 ( -0.545 1.202 -0.361) 1.368 7.359 ( 0.640 1.331 1.257) 1.939 7.426 ( -2.781 0.273 -0.962) 2.955 7.462 ( -1.965 0.332 0.027) 1.993 8.721 ( -2.177 1.294 0.240) 2.544 8.773 ( 0.459 2.467 -0.054) 2.510 8.915 ( -1.245 1.079 -6.503) 6.708 8.961 ( -2.443 -0.179 5.222) 5.768 10.353 ( -4.707 -1.319 -0.689) 4.937 10.500 ( 0.759 -0.573 0.315) 1.002 10.553 ( -1.388 -1.583 -0.142) 2.110 10.748 ( 6.348 0.598 4.333) 7.709 15.804 ( 1.385 -3.913 0.006) 4.151 15.903 ( 5.366 -2.393 0.196) 5.878 16.716 ( -1.673 -3.185 -4.198) 5.528 16.741 ( -3.107 -4.050 4.553) 6.840 17.711 ( -12.193 -3.570 1.350) 12.776 17.791 ( -6.373 -4.930 0.457) 8.070 18.016 ( 2.056 -0.177 1.919) 2.818 18.132 ( 7.536 2.099 -3.478) 8.561 18.874 ( 2.950 -2.901 -1.813) 4.518 18.947 ( 3.610 -4.446 2.036) 6.078 19.117 ( 2.026 7.353 -5.016) 9.128 19.238 ( 6.638 9.746 3.734) 12.368 ======================= Grid point 250 (106/138) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.342 ( 4.978 -10.422 -1.422) 11.636 1.467 ( -5.257 -3.188 3.513) 7.080 1.671 ( 3.862 -4.686 17.286) 18.322 1.824 ( 6.714 -13.826 -8.964) 17.794 2.146 ( -0.036 -3.854 -11.069) 11.721 2.437 ( -3.471 -3.913 -0.936) 5.313 2.578 ( 8.719 -0.405 -2.879) 9.191 2.656 ( 3.160 -8.768 -3.429) 9.931 2.748 ( 1.818 -0.627 5.999) 6.300 3.076 ( -0.910 -7.594 3.938) 8.602 3.125 ( 4.690 -1.441 -6.549) 8.183 3.230 ( 4.533 -3.157 0.941) 5.603 3.360 ( 2.552 3.620 5.443) 7.018 3.408 ( 3.270 -3.149 -3.444) 5.698 3.785 ( 0.742 5.771 -3.969) 7.043 3.936 ( 2.547 6.721 4.302) 8.377 4.299 ( -7.780 4.751 -0.939) 9.164 4.623 ( -9.166 4.361 3.217) 10.648 4.804 ( 4.862 7.444 0.554) 8.908 5.132 ( 0.485 8.118 0.713) 8.164 5.327 ( -0.817 0.990 3.535) 3.761 5.445 ( 0.478 -3.872 0.336) 3.915 5.747 ( -5.640 -1.236 -6.846) 8.956 5.912 ( -5.251 1.235 2.196) 5.824 6.103 ( -1.107 3.721 2.695) 4.726 6.288 ( -2.315 -5.963 -1.656) 6.608 6.545 ( 2.706 -0.811 -1.160) 3.054 6.621 ( 4.723 0.089 0.036) 4.724 6.704 ( 3.779 -4.793 -1.100) 6.202 6.934 ( 12.377 -9.815 1.687) 15.886 7.295 ( -0.773 0.430 -0.039) 0.885 7.332 ( -0.569 1.794 0.487) 1.944 7.414 ( -0.861 -0.756 0.321) 1.190 7.437 ( -1.913 0.187 -1.168) 2.249 8.681 ( -1.433 1.747 -0.536) 2.322 8.739 ( 0.286 1.269 0.030) 1.302 8.892 ( -1.866 -1.152 -4.464) 4.974 8.969 ( -1.916 -0.601 4.250) 4.700 10.325 ( -3.630 0.080 -0.765) 3.710 10.508 ( 0.777 1.293 0.831) 1.723 10.542 ( -2.563 0.528 -0.545) 2.673 10.766 ( 2.156 1.568 1.992) 3.328 15.901 ( 2.664 -4.766 0.486) 5.482 16.000 ( 4.634 -3.492 0.692) 5.844 16.723 ( -1.775 -1.429 -6.178) 6.584 16.774 ( -4.056 -1.395 5.630) 7.078 17.682 ( -10.464 -3.562 2.495) 11.332 17.823 ( -6.237 -4.697 -1.168) 7.894 18.068 ( 2.058 -3.770 0.148) 4.298 18.159 ( 3.675 -1.064 -1.617) 4.154 18.893 ( 6.200 5.709 -2.959) 8.932 19.013 ( 1.516 2.110 0.796) 2.717 19.073 ( 2.678 -1.913 0.112) 3.293 19.139 ( 7.183 7.710 1.255) 10.612 ======================= Grid point 251 (107/138) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.272 ( -11.348 8.893 2.658) 14.661 1.644 ( 7.724 -10.859 0.786) 13.349 1.852 ( 3.047 -6.261 13.171) 14.898 2.079 ( 2.557 -13.107 -6.063) 14.666 2.201 ( -2.128 -5.448 0.588) 5.878 2.411 ( -5.796 -2.856 -6.723) 9.325 2.667 ( 8.668 0.456 -10.628) 13.722 2.750 ( 4.311 2.882 0.852) 5.255 2.779 ( -3.072 -3.122 4.013) 5.940 3.148 ( -2.663 1.827 -6.085) 6.889 3.202 ( -1.215 -2.326 3.165) 4.112 3.279 ( -0.371 -0.818 1.542) 1.784 3.316 ( 4.688 2.484 4.865) 7.199 3.525 ( 9.764 -5.646 -2.676) 11.592 3.690 ( 4.857 5.211 -1.841) 7.357 3.966 ( 9.465 -3.580 2.277) 10.372 4.178 ( -6.191 1.721 -2.227) 6.801 4.521 ( -5.236 1.858 2.282) 6.006 4.755 ( 5.063 3.997 1.538) 6.632 4.974 ( -3.481 8.639 0.874) 9.355 5.280 ( -5.701 2.596 1.352) 6.408 5.494 ( -3.691 -1.822 2.193) 4.664 5.700 ( 1.074 0.728 -4.980) 5.146 5.866 ( -5.398 -0.013 0.720) 5.446 6.055 ( 2.138 2.155 3.753) 4.827 6.358 ( -2.841 -4.877 -0.629) 5.679 6.567 ( 0.306 -0.777 -1.782) 1.968 6.648 ( 5.657 1.411 0.487) 5.851 6.794 ( 1.578 -2.630 -1.953) 3.636 7.170 ( 8.855 -5.580 1.258) 10.542 7.283 ( -2.063 -0.520 0.301) 2.149 7.300 ( -0.296 1.455 0.259) 1.508 7.412 ( -0.226 -0.232 -1.639) 1.670 7.450 ( 0.335 -2.243 0.593) 2.344 8.638 ( -1.229 1.481 0.013) 1.925 8.733 ( 0.834 0.226 -0.178) 0.882 8.880 ( -2.306 -0.716 -2.945) 3.808 8.967 ( -1.614 0.197 2.812) 3.248 10.288 ( -2.380 0.795 -0.538) 2.567 10.442 ( -0.832 5.275 0.561) 5.370 10.526 ( -1.737 -0.559 -0.285) 1.846 10.765 ( 0.533 0.233 0.769) 0.964 16.006 ( 2.393 -4.156 0.929) 4.884 16.099 ( 3.529 -3.374 0.484) 4.906 16.707 ( -0.420 -0.620 -7.416) 7.453 16.759 ( -4.428 0.754 6.439) 7.851 17.664 ( -6.456 -1.763 2.250) 7.060 17.830 ( -3.754 -1.699 -2.288) 4.713 18.193 ( 0.480 -8.978 0.174) 8.993 18.228 ( -0.637 -5.632 -0.508) 5.691 18.790 ( 6.500 10.575 -1.019) 12.454 18.911 ( 3.585 10.474 -0.177) 11.072 19.138 ( 0.873 -2.237 4.151) 4.795 19.143 ( 3.941 -0.848 -3.163) 5.124 ======================= Grid point 252 (108/138) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( -5.618 5.293 0.613) 7.743 1.836 ( 3.478 -4.197 0.388) 5.464 1.979 ( 2.288 -1.358 5.946) 6.514 2.248 ( -0.071 -5.410 -1.426) 5.595 2.320 ( -3.624 -8.511 4.738) 10.393 2.452 ( 0.372 -6.770 -3.523) 7.641 2.601 ( 2.942 6.228 -6.638) 9.566 2.733 ( -3.249 1.207 1.293) 3.699 2.768 ( 3.204 4.723 -2.672) 6.302 2.994 ( -2.603 4.994 -3.951) 6.879 3.196 ( -1.388 -0.071 0.895) 1.653 3.276 ( -0.810 1.767 4.864) 5.238 3.396 ( 2.130 -5.107 -0.615) 5.567 3.554 ( 0.094 4.149 0.866) 4.240 3.845 ( 14.380 -7.893 -0.444) 16.410 4.035 ( -8.407 1.700 -0.641) 8.601 4.216 ( 9.290 -5.270 0.352) 10.687 4.451 ( -3.452 2.794 -0.801) 4.513 4.725 ( -0.083 2.914 -0.815) 3.027 4.834 ( -1.437 3.163 3.071) 4.637 5.175 ( -4.615 2.514 -0.580) 5.287 5.477 ( -2.565 0.009 0.790) 2.684 5.710 ( 3.336 -0.036 -2.461) 4.145 5.816 ( -4.075 0.694 1.718) 4.477 6.082 ( 2.025 -0.593 1.497) 2.587 6.400 ( -1.416 -2.038 -0.101) 2.484 6.570 ( -0.252 -0.168 -0.882) 0.932 6.673 ( 3.044 0.462 0.816) 3.185 6.812 ( -0.237 -0.146 -1.519) 1.544 7.255 ( 1.081 0.603 -0.443) 1.315 7.273 ( -0.067 -0.373 0.779) 0.866 7.309 ( 0.591 -1.241 0.115) 1.379 7.424 ( 0.654 -0.785 -0.420) 1.105 7.492 ( 0.455 -1.380 0.166) 1.463 8.613 ( -0.558 0.550 0.283) 0.833 8.738 ( 0.676 0.016 -0.204) 0.706 8.862 ( -1.306 -0.059 -1.118) 1.720 8.958 ( -0.659 0.226 0.978) 1.201 10.261 ( -0.836 0.431 -0.194) 0.960 10.361 ( -0.648 2.485 0.159) 2.573 10.520 ( -0.618 -0.112 -0.044) 0.630 10.768 ( 0.077 -0.032 0.205) 0.221 16.076 ( 0.948 -1.666 0.565) 1.998 16.168 ( 1.458 -1.556 0.121) 2.136 16.698 ( 1.076 -0.474 -6.047) 6.160 16.726 ( -3.042 1.029 5.535) 6.399 17.650 ( -2.181 -0.402 0.894) 2.391 17.816 ( -1.121 -0.161 -1.103) 1.581 18.320 ( -1.364 -5.281 -0.988) 5.543 18.353 ( -0.998 -7.173 0.996) 7.310 18.675 ( 3.827 5.802 0.554) 6.973 18.755 ( 1.805 8.650 -0.839) 8.876 19.172 ( 0.946 -0.579 -0.917) 1.439 19.182 ( 0.613 -0.861 1.196) 1.596 ======================= Grid point 259 (109/138) ======================= q-point: ( 0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( 11.876 0.000 -7.222) 13.900 1.145 ( 17.167 0.000 -19.165) 25.729 1.222 ( 3.001 0.000 -2.106) 3.666 1.607 ( 11.982 0.000 11.818) 16.829 1.724 ( 2.827 0.000 -27.931) 28.074 2.304 ( 4.955 0.000 16.408) 17.140 2.424 ( -1.621 -0.000 2.097) 2.650 2.589 ( 2.466 0.000 11.109) 11.380 2.693 ( -2.505 -0.000 2.620) 3.624 2.839 ( 11.122 0.000 3.951) 11.803 2.989 ( -5.398 -0.000 2.246) 5.847 3.073 ( -1.226 -0.000 1.733) 2.123 3.239 ( 2.345 0.000 -13.484) 13.686 3.354 ( 0.154 0.000 6.040) 6.042 3.961 ( -2.542 -0.000 -13.726) 13.959 4.152 ( -2.699 -0.000 13.110) 13.385 4.713 ( -7.307 -0.000 -5.947) 9.422 5.032 ( 2.232 0.000 -2.516) 3.364 5.073 ( -5.613 -0.000 6.031) 8.239 5.302 ( -7.563 -0.000 5.502) 9.353 5.383 ( -5.100 -0.000 -2.300) 5.595 5.434 ( 2.148 0.000 -5.016) 5.457 5.710 ( 7.263 0.000 2.051) 7.547 5.824 ( 3.092 0.000 -4.504) 5.463 6.040 ( -3.140 -0.000 -6.183) 6.935 6.200 ( 0.609 0.000 6.368) 6.397 6.356 ( 7.984 0.000 -3.723) 8.810 6.410 ( 5.633 0.000 3.616) 6.694 6.511 ( 1.509 0.000 -2.227) 2.690 6.644 ( 6.399 0.000 0.319) 6.407 7.345 ( -0.592 -0.000 -0.205) 0.626 7.374 ( 0.001 0.000 0.925) 0.925 7.440 ( -3.390 -0.000 -0.586) 3.440 7.466 ( -2.580 -0.000 0.049) 2.580 8.746 ( -2.645 -0.000 0.538) 2.699 8.804 ( 0.741 0.000 -0.341) 0.815 8.996 ( -5.985 -0.000 0.671) 6.022 9.021 ( -7.466 -0.000 -0.610) 7.491 10.328 ( -1.040 -0.000 2.317) 2.540 10.497 ( -0.668 -0.000 2.494) 2.581 10.499 ( 0.630 0.000 -1.509) 1.635 10.704 ( 13.804 0.000 8.030) 15.970 15.733 ( 1.444 0.000 0.253) 1.466 15.873 ( 6.658 0.000 -2.077) 6.974 16.601 ( -1.083 -0.000 -3.133) 3.315 16.625 ( -2.298 -0.000 2.848) 3.660 17.661 ( -12.811 -0.000 2.736) 13.100 17.685 ( -5.558 -0.000 -1.199) 5.686 18.026 ( 0.198 0.000 3.680) 3.685 18.187 ( 6.846 0.000 -4.047) 7.953 18.800 ( 6.508 0.000 -5.143) 8.294 18.840 ( 4.768 0.000 5.993) 7.658 19.330 ( -0.383 -0.000 -2.579) 2.607 19.436 ( 6.614 0.000 3.360) 7.418 ======================= Grid point 260 (110/138) ======================= q-point: ( 0.18 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( 11.908 -1.561 -19.548) 22.943 1.278 ( 6.647 -9.716 -14.532) 18.702 1.349 ( 7.463 -5.857 8.190) 12.533 1.721 ( 15.896 5.653 16.899) 23.879 1.836 ( 12.063 -12.540 -24.251) 29.848 2.377 ( -0.482 3.724 3.524) 5.150 2.465 ( 6.232 -6.889 3.166) 9.814 2.613 ( 1.758 2.701 5.762) 6.602 2.704 ( -2.063 -2.743 6.236) 7.118 2.921 ( 2.118 2.055 6.179) 6.848 3.010 ( -2.786 -5.798 3.330) 7.243 3.142 ( 7.026 -3.221 -0.680) 7.759 3.248 ( 4.664 -4.119 -7.920) 10.072 3.379 ( 1.126 -0.706 4.580) 4.769 3.883 ( -3.726 1.281 -11.451) 12.110 4.135 ( -4.279 2.637 11.074) 12.161 4.563 ( -6.243 7.453 -4.262) 10.616 4.879 ( -11.977 7.545 -1.644) 14.250 5.068 ( 6.708 6.088 6.416) 11.100 5.295 ( -9.288 -2.357 5.357) 10.978 5.319 ( -4.849 -1.479 -4.124) 6.535 5.398 ( 1.876 3.224 -4.375) 5.749 5.715 ( -1.069 4.073 -4.446) 6.124 5.888 ( 2.790 -4.044 2.436) 5.483 6.072 ( -0.099 -5.472 -3.584) 6.542 6.208 ( 0.254 0.953 2.088) 2.309 6.452 ( 6.589 -4.132 1.271) 7.880 6.538 ( 4.887 -0.248 -0.696) 4.942 6.569 ( 10.877 -8.919 1.143) 14.112 6.696 ( 7.111 0.655 -1.055) 7.219 7.330 ( -0.515 1.058 -0.074) 1.179 7.366 ( -3.211 0.274 0.490) 3.260 7.410 ( -1.103 0.153 -0.130) 1.121 7.438 ( -3.788 -0.073 -0.231) 3.796 8.719 ( -2.666 0.698 0.998) 2.931 8.803 ( -0.005 0.620 -0.140) 0.636 8.915 ( -4.773 3.032 -6.075) 8.299 8.947 ( -4.372 0.113 3.719) 5.741 10.321 ( -0.225 0.972 1.094) 1.480 10.497 ( 0.712 0.128 -0.866) 1.129 10.516 ( -0.753 -1.792 1.340) 2.361 10.830 ( 5.962 0.120 6.609) 8.902 15.780 ( 4.384 -1.791 1.586) 4.994 15.927 ( 6.126 -0.680 -1.284) 6.296 16.623 ( -2.355 -3.764 -3.408) 5.597 16.647 ( -3.364 -4.064 3.495) 6.328 17.565 ( -12.937 -1.451 2.580) 13.271 17.662 ( -6.912 -3.216 -0.274) 7.629 18.035 ( 0.098 0.218 2.587) 2.598 18.204 ( 4.028 1.679 -3.938) 5.878 18.869 ( 7.903 -1.916 -2.569) 8.528 18.934 ( 6.441 -2.663 3.568) 7.831 19.250 ( 1.945 6.681 -5.413) 8.816 19.457 ( 8.613 6.102 2.806) 10.922 ======================= Grid point 261 (111/138) ======================= q-point: ( 0.27 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( 13.747 -9.013 -6.550) 17.695 1.446 ( 3.284 -2.709 2.778) 5.084 1.520 ( -2.194 -13.303 -8.614) 15.999 1.813 ( 12.574 3.260 14.653) 19.582 2.059 ( 8.830 -6.154 -14.806) 18.304 2.365 ( -0.725 -2.015 1.595) 2.671 2.592 ( 3.437 0.770 -0.066) 3.523 2.629 ( 9.170 -3.452 -2.079) 10.017 2.767 ( 0.822 -1.740 9.015) 9.218 2.945 ( -1.545 -4.776 3.166) 5.935 3.110 ( -0.342 -3.591 -0.941) 3.728 3.220 ( 11.459 -3.502 -7.014) 13.884 3.378 ( 2.822 -2.537 -1.496) 4.079 3.438 ( 5.087 -1.392 4.668) 7.043 3.802 ( -2.958 0.464 -6.152) 6.842 4.065 ( -3.263 4.913 8.835) 10.622 4.368 ( -3.815 8.325 -1.063) 9.219 4.637 ( -10.830 7.075 0.350) 12.941 4.997 ( 4.772 9.024 4.668) 11.225 5.224 ( -7.136 3.525 -0.637) 7.985 5.300 ( -7.799 -1.850 1.389) 8.135 5.392 ( 2.590 -1.882 -1.322) 3.464 5.633 ( -5.887 -0.986 -6.572) 8.878 5.924 ( -0.989 1.399 3.061) 3.508 6.133 ( -0.450 -1.371 -0.058) 1.444 6.212 ( 2.687 -0.878 -1.439) 3.172 6.564 ( 2.904 -0.555 0.086) 2.958 6.617 ( 6.903 -4.598 1.229) 8.384 6.726 ( 6.985 1.113 -1.148) 7.166 6.870 ( 12.918 -10.741 1.583) 16.874 7.295 ( -3.109 1.201 -0.791) 3.425 7.329 ( -2.700 0.004 0.250) 2.711 7.407 ( -3.649 -0.199 -0.669) 3.715 7.415 ( 0.977 -0.044 0.792) 1.259 8.689 ( -1.791 0.837 0.494) 2.038 8.772 ( -0.373 2.356 -0.273) 2.401 8.842 ( -2.390 -0.402 -5.680) 6.176 8.945 ( -2.712 -1.343 4.054) 5.059 10.302 ( -1.101 0.723 0.095) 1.321 10.501 ( 0.030 -0.465 -0.519) 0.697 10.539 ( -0.823 -0.756 0.546) 1.244 10.835 ( 0.665 3.393 2.729) 4.405 15.867 ( 4.935 -2.957 1.323) 5.903 15.997 ( 5.095 -1.970 0.319) 5.472 16.644 ( -2.887 -2.972 -5.147) 6.608 16.704 ( -4.435 -4.059 4.744) 7.658 17.521 ( -10.924 -4.432 2.697) 12.093 17.671 ( -7.422 -5.098 -0.951) 9.054 18.043 ( -0.336 -0.855 1.504) 1.763 18.185 ( 1.576 1.569 -3.595) 4.227 18.969 ( 8.251 -1.702 -0.938) 8.477 19.041 ( 5.941 -1.915 1.895) 6.523 19.147 ( 5.158 6.619 -3.914) 9.260 19.393 ( 8.846 10.432 1.433) 13.752 ======================= Grid point 262 (112/138) ======================= q-point: ( 0.36 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( -5.403 8.588 4.141) 10.959 1.542 ( 14.272 -11.286 -2.230) 18.331 1.761 ( -2.480 -18.485 -8.339) 20.430 1.913 ( 9.509 0.821 13.437) 16.481 2.151 ( 3.762 -2.331 -2.285) 4.981 2.323 ( -5.387 1.572 -3.358) 6.540 2.663 ( 3.409 -2.648 -8.230) 9.293 2.755 ( 8.447 -3.016 0.153) 8.970 2.818 ( 2.489 0.426 3.719) 4.496 3.052 ( -0.792 -6.529 -0.002) 6.577 3.157 ( -0.519 -2.987 1.790) 3.521 3.304 ( -2.782 4.262 -3.429) 6.137 3.419 ( 11.974 -2.555 -3.567) 12.752 3.539 ( 9.795 -1.434 3.226) 10.412 3.778 ( 0.670 0.587 -2.459) 2.615 4.006 ( 1.322 1.180 5.585) 5.860 4.203 ( -2.355 7.023 -1.197) 7.504 4.501 ( -5.821 0.983 2.586) 6.445 4.892 ( 1.949 7.584 2.971) 8.375 5.054 ( -10.563 6.835 -0.043) 12.582 5.253 ( -7.641 0.014 1.213) 7.736 5.441 ( -1.350 -1.743 0.078) 2.206 5.628 ( -2.566 -5.351 -6.110) 8.518 5.874 ( -0.717 3.725 1.468) 4.068 6.132 ( 1.257 1.713 3.795) 4.349 6.261 ( 0.904 -2.773 -0.929) 3.061 6.575 ( 2.657 0.746 -1.451) 3.118 6.743 ( 7.361 -1.428 -0.071) 7.499 6.764 ( 4.828 -0.238 -1.038) 4.944 7.141 ( 9.991 -7.692 1.728) 12.727 7.250 ( -4.090 -0.434 -1.029) 4.239 7.311 ( -2.670 0.483 0.658) 2.792 7.389 ( -1.078 -0.971 -1.546) 2.120 7.430 ( 1.053 -0.543 1.126) 1.635 8.656 ( -1.064 1.574 -0.403) 1.943 8.743 ( 0.377 0.664 -0.235) 0.799 8.825 ( -2.851 -1.431 -3.319) 4.603 8.955 ( -2.448 -0.786 3.252) 4.145 10.277 ( -1.492 0.707 -0.282) 1.675 10.499 ( -2.158 1.331 -0.255) 2.548 10.520 ( 0.209 1.447 0.364) 1.507 10.782 ( -1.295 2.037 0.944) 2.592 15.969 ( 4.420 -3.546 0.961) 5.748 16.080 ( 3.729 -2.727 1.130) 4.756 16.650 ( -1.595 -2.262 -6.810) 7.351 16.730 ( -5.061 -1.718 5.601) 7.742 17.541 ( -7.945 -5.700 2.912) 10.203 17.704 ( -6.368 -5.894 -2.067) 8.920 18.082 ( -0.495 -4.110 0.572) 4.179 18.169 ( -0.457 -0.786 -2.350) 2.519 19.027 ( 9.623 7.774 -0.606) 12.386 19.040 ( 2.195 3.615 -1.273) 4.416 19.138 ( 4.111 -0.910 1.664) 4.527 19.281 ( 8.440 9.736 -0.077) 12.886 ======================= Grid point 263 (113/138) ======================= q-point: ( 0.45 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( -3.135 9.387 -0.713) 9.923 1.810 ( 8.271 -6.555 -2.922) 10.951 2.037 ( 2.864 -10.541 3.396) 11.439 2.063 ( 7.213 -8.321 7.236) 13.177 2.160 ( -5.074 -0.146 6.599) 8.325 2.313 ( 0.824 -5.920 -7.896) 9.903 2.642 ( -2.730 1.518 -7.834) 8.434 2.784 ( 2.014 3.260 -2.432) 4.538 2.875 ( 9.003 1.516 -1.989) 9.344 3.058 ( -1.427 5.953 -9.577) 11.366 3.161 ( -4.382 -1.200 4.858) 6.652 3.267 ( -1.692 -4.365 1.476) 4.909 3.433 ( 4.317 5.551 7.266) 10.112 3.665 ( 4.515 4.423 2.329) 6.736 3.830 ( 12.046 -7.384 -2.027) 14.274 4.019 ( -3.899 3.420 3.087) 6.036 4.181 ( 4.833 -5.990 -2.532) 8.102 4.470 ( -0.557 1.344 -0.538) 1.552 4.762 ( -8.034 6.344 0.673) 10.259 4.850 ( -10.835 3.809 2.807) 11.823 5.192 ( -1.518 1.966 0.653) 2.568 5.443 ( -1.476 -1.401 -1.233) 2.379 5.706 ( 0.603 -5.408 -5.330) 7.617 5.797 ( -2.147 4.121 1.878) 5.012 6.131 ( 2.403 1.941 4.001) 5.055 6.311 ( -1.500 -3.255 0.196) 3.589 6.593 ( 3.673 -0.211 -0.050) 3.680 6.766 ( 5.584 3.849 -1.128) 6.875 6.817 ( 3.947 -0.481 -0.893) 4.075 7.235 ( -3.309 -1.291 -0.309) 3.565 7.259 ( -1.871 -0.395 -0.876) 2.104 7.318 ( 4.634 -1.898 1.442) 5.211 7.405 ( 0.433 -1.231 -0.980) 1.632 7.465 ( 0.743 -2.002 0.948) 2.336 8.623 ( -0.609 1.121 0.017) 1.275 8.741 ( 0.499 0.177 -1.576) 1.663 8.822 ( -2.589 -1.905 -0.708) 3.292 8.951 ( -2.049 -0.274 1.911) 2.815 10.255 ( -1.084 0.310 -0.310) 1.169 10.409 ( -2.727 4.371 -0.036) 5.153 10.521 ( 0.778 -0.014 0.530) 0.941 10.758 ( -1.603 -0.262 0.071) 1.626 16.059 ( 2.938 -2.395 0.832) 3.881 16.152 ( 1.931 -2.075 0.966) 2.994 16.659 ( 0.599 -2.110 -7.701) 8.007 16.720 ( -4.743 -0.231 6.501) 8.051 17.585 ( -4.367 -4.364 2.388) 6.619 17.744 ( -4.278 -4.665 -2.466) 6.793 18.190 ( -0.725 -8.684 0.070) 8.715 18.203 ( -1.439 -4.868 -0.816) 5.141 18.887 ( 4.027 12.100 -0.220) 12.754 18.945 ( 1.419 10.312 -0.279) 10.413 19.184 ( 3.247 0.239 2.263) 3.965 19.241 ( 7.421 3.405 -1.647) 8.330 ======================= Grid point 264 (114/138) ======================= q-point: ( 0.55 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( 6.685 0.322 -2.108) 7.017 1.883 ( 0.609 0.729 -2.617) 2.784 2.051 ( 2.837 6.772 0.279) 7.348 2.228 ( -2.266 -4.694 0.955) 5.299 2.298 ( -0.081 -10.200 4.280) 11.062 2.484 ( 5.488 -4.642 0.365) 7.198 2.567 ( -2.228 -1.368 -5.275) 5.887 2.735 ( -1.775 2.067 -0.698) 2.813 2.790 ( 5.871 8.206 -0.161) 10.091 2.989 ( 4.461 0.454 -5.281) 6.928 3.153 ( -2.414 -1.097 -1.280) 2.944 3.321 ( 0.619 0.085 4.871) 4.911 3.437 ( 2.570 1.240 3.173) 4.267 3.572 ( 0.057 5.824 3.846) 6.980 3.867 ( -10.066 6.473 -0.210) 11.969 4.076 ( 11.184 -3.836 1.577) 11.928 4.216 ( -8.381 3.380 -3.486) 9.686 4.447 ( 1.746 -0.502 0.138) 1.822 4.645 ( -7.393 -3.131 2.691) 8.467 4.753 ( -7.460 -1.068 -2.701) 8.005 5.200 ( 6.167 -0.490 2.407) 6.638 5.476 ( 3.090 -2.006 -2.414) 4.404 5.719 ( -4.142 1.648 2.828) 5.279 5.780 ( 2.630 -3.298 -6.127) 7.438 6.112 ( 0.420 2.931 1.879) 3.506 6.346 ( -3.803 -3.209 0.619) 5.015 6.642 ( 5.950 0.207 1.637) 6.175 6.712 ( 2.757 5.439 -1.271) 6.229 6.840 ( 3.317 1.190 0.181) 3.529 7.222 ( -3.361 -0.732 0.509) 3.477 7.258 ( -1.620 -1.426 -1.181) 2.460 7.348 ( 2.497 1.871 0.294) 3.134 7.419 ( -0.997 -0.376 -0.282) 1.102 7.497 ( -0.147 -0.472 0.589) 0.769 8.611 ( 0.264 -0.006 -0.158) 0.307 8.729 ( -1.072 0.113 -1.754) 2.059 8.850 ( -0.093 -2.301 1.435) 2.713 8.948 ( -0.941 -0.653 0.221) 1.167 10.252 ( -0.008 -0.765 -0.132) 0.777 10.341 ( -1.640 0.745 -0.067) 1.802 10.534 ( 1.748 -0.007 0.752) 1.903 10.754 ( -1.651 -0.728 -0.457) 1.862 16.095 ( 0.959 0.534 0.116) 1.104 16.177 ( -0.554 0.408 0.432) 0.813 16.687 ( 1.942 -2.148 -5.533) 6.245 16.713 ( -2.464 -0.730 5.247) 5.843 17.633 ( -0.396 -3.083 0.953) 3.252 17.780 ( -2.150 -3.564 -1.164) 4.322 18.304 ( -0.287 -7.041 0.257) 7.051 18.345 ( -0.317 -8.123 -0.246) 8.133 18.704 ( -0.576 9.967 0.049) 9.984 18.752 ( -1.241 10.189 -0.360) 10.271 19.197 ( 1.552 1.690 3.687) 4.342 19.236 ( 5.222 3.032 -3.454) 6.957 ======================= Grid point 265 (115/138) ======================= q-point: (-0.36 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.228 ( 14.447 -7.867 -2.412) 16.626 1.783 ( -2.600 8.791 -0.738) 9.197 1.941 ( 3.276 7.069 -8.932) 11.852 2.202 ( -7.394 5.097 3.405) 9.604 2.382 ( 5.260 6.767 -0.283) 8.575 2.443 ( -1.607 -0.218 1.571) 2.258 2.619 ( -1.392 -6.183 0.913) 6.403 2.719 ( 2.153 3.682 5.198) 6.724 2.815 ( 3.589 0.011 -3.707) 5.160 3.084 ( 3.405 -7.487 4.440) 9.347 3.162 ( -1.410 -3.252 -5.235) 6.322 3.322 ( 3.462 4.582 1.175) 5.862 3.346 ( -4.657 5.576 2.145) 7.575 3.558 ( 0.489 0.838 0.429) 1.061 3.623 ( -11.283 6.806 3.289) 13.581 3.962 ( -12.980 7.748 -1.834) 15.228 4.223 ( 8.047 -1.712 1.917) 8.448 4.501 ( 1.730 -3.940 -0.317) 4.315 4.654 ( -5.573 -1.300 -1.344) 5.878 4.802 ( -4.023 -10.393 -1.812) 11.291 5.297 ( 7.241 -1.317 1.861) 7.591 5.522 ( 3.083 -0.724 -4.250) 5.300 5.696 ( -0.638 -0.064 5.319) 5.357 5.842 ( 1.710 -4.657 -7.788) 9.234 6.063 ( 0.998 3.069 2.042) 3.819 6.361 ( -5.367 -2.873 0.554) 6.112 6.634 ( 1.316 4.300 -0.840) 4.575 6.680 ( 8.666 4.173 2.013) 9.827 6.829 ( -0.391 1.956 1.109) 2.282 7.174 ( -6.452 2.819 -1.064) 7.121 7.273 ( 0.015 -1.335 0.141) 1.343 7.320 ( 0.692 2.081 -0.528) 2.256 7.410 ( -1.094 -0.232 1.388) 1.783 7.477 ( -1.047 1.648 -0.430) 1.999 8.626 ( 1.309 -1.077 -0.465) 1.758 8.716 ( -1.513 -0.482 -0.506) 1.667 8.897 ( 1.175 -1.532 2.495) 3.155 8.959 ( 0.333 -0.968 -1.597) 1.897 10.282 ( 1.405 -1.886 0.271) 2.367 10.359 ( -0.613 -3.708 -0.446) 3.785 10.555 ( 2.926 0.181 0.892) 3.064 10.748 ( -1.934 -0.492 -0.839) 2.165 16.059 ( -0.368 3.520 -0.725) 3.612 16.130 ( -2.710 3.216 0.161) 4.208 16.723 ( -0.748 -1.203 6.358) 6.514 16.744 ( 3.083 -2.275 -5.856) 6.998 17.695 ( 3.631 -2.409 -0.928) 4.454 17.829 ( -0.608 -3.391 1.115) 3.621 18.358 ( 1.538 7.037 1.754) 7.414 18.373 ( 3.028 6.783 -1.888) 7.664 18.586 ( -5.784 -4.577 0.501) 7.393 18.691 ( -5.567 -7.682 -0.360) 9.494 19.175 ( -0.175 3.074 4.296) 5.286 19.197 ( 3.084 4.043 -4.396) 6.722 ======================= Grid point 266 (116/138) ======================= q-point: (-0.27 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( 11.316 -2.044 -2.646) 11.800 1.587 ( 1.424 9.345 -0.257) 9.456 1.784 ( 3.236 11.373 -11.025) 16.167 1.981 ( -10.632 10.775 4.327) 15.743 2.285 ( 5.228 7.147 5.462) 10.404 2.500 ( -3.195 -3.769 2.586) 5.577 2.599 ( 0.583 10.504 0.751) 10.547 2.677 ( -3.094 0.112 -4.430) 5.404 2.802 ( -0.444 2.329 5.860) 6.321 3.096 ( -10.239 4.674 -0.503) 11.267 3.220 ( -1.955 -0.927 1.018) 2.391 3.236 ( 0.954 3.384 0.076) 3.517 3.271 ( 4.106 -0.846 -5.770) 7.132 3.455 ( -3.744 4.309 4.594) 7.327 3.652 ( -0.478 -7.419 1.752) 7.638 3.807 ( -6.767 -1.865 -1.218) 7.124 4.328 ( 8.848 -1.632 1.836) 9.183 4.606 ( 3.409 -2.159 -5.115) 6.515 4.648 ( -3.342 -7.480 3.737) 9.005 4.940 ( -5.579 -10.535 -3.363) 12.386 5.333 ( 2.488 1.978 0.707) 3.256 5.492 ( -1.802 3.537 -4.940) 6.337 5.764 ( 3.521 -4.195 6.284) 8.336 5.916 ( 1.594 -3.909 -5.976) 7.317 6.077 ( 5.912 -0.905 2.455) 6.465 6.354 ( -5.013 -1.008 0.428) 5.131 6.575 ( 2.549 4.567 0.559) 5.260 6.661 ( 5.544 5.376 0.358) 7.731 6.764 ( -3.095 4.267 1.184) 5.402 6.992 ( -10.400 8.666 -1.377) 13.607 7.295 ( 0.080 -0.722 -0.235) 0.763 7.304 ( 0.140 -0.146 -0.319) 0.378 7.424 ( 0.249 -0.835 1.329) 1.589 7.447 ( 0.035 0.456 -0.342) 0.571 8.663 ( 1.597 -1.679 0.138) 2.321 8.716 ( -1.127 -0.899 -0.174) 1.452 8.930 ( 1.023 0.008 3.652) 3.792 8.971 ( 1.059 -0.427 -3.423) 3.609 10.339 ( 2.894 -2.143 0.834) 3.696 10.431 ( -1.224 -4.819 -1.086) 5.089 10.581 ( 3.828 0.628 1.051) 4.019 10.729 ( -2.832 -0.078 -1.270) 3.105 15.974 ( -0.541 5.197 -0.505) 5.250 16.034 ( -3.549 4.472 -0.237) 5.714 16.758 ( -0.080 -0.643 7.083) 7.112 16.786 ( 3.322 -1.252 -6.551) 7.451 17.772 ( 7.549 -1.547 -2.574) 8.124 17.889 ( 0.719 -2.529 2.891) 3.908 18.175 ( -0.859 11.043 -0.350) 11.082 18.221 ( -1.718 9.051 -0.204) 9.215 18.716 ( -2.811 -10.417 3.036) 11.208 18.824 ( -5.091 -11.580 -2.125) 12.827 19.114 ( 0.300 4.453 -0.828) 4.540 19.127 ( -0.611 4.377 0.459) 4.443 ======================= Grid point 267 (117/138) ======================= q-point: (-0.18 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( 2.448 11.971 9.345) 15.383 1.503 ( -4.091 8.500 -14.498) 17.297 1.560 ( 9.664 14.164 -8.778) 19.263 1.702 ( -12.162 14.071 9.150) 20.728 2.272 ( 5.941 2.228 6.943) 9.406 2.389 ( -5.128 4.743 -0.930) 7.047 2.521 ( -3.606 4.559 7.612) 9.578 2.574 ( -3.059 3.696 -9.464) 10.611 2.795 ( 7.113 2.400 4.496) 8.750 2.962 ( -8.501 1.530 -2.598) 9.020 3.154 ( 1.210 4.362 4.942) 6.702 3.197 ( 0.151 4.130 -3.847) 5.646 3.308 ( 2.702 0.101 -6.241) 6.802 3.362 ( -5.408 3.113 3.758) 7.284 3.813 ( 1.006 -8.818 4.492) 9.947 3.870 ( -2.169 -8.834 -4.153) 10.000 4.459 ( 8.812 -4.412 2.904) 10.274 4.618 ( -5.937 -5.121 -5.435) 9.540 4.866 ( 9.245 -9.693 4.714) 14.200 5.048 ( -7.377 -9.570 -3.711) 12.640 5.319 ( 1.711 0.843 0.104) 1.911 5.389 ( -4.551 2.434 -1.839) 5.478 5.880 ( 4.578 -1.413 5.946) 7.636 5.957 ( 0.513 -1.635 -4.931) 5.220 6.172 ( 7.773 -0.842 0.790) 7.858 6.301 ( -4.292 3.011 0.448) 5.262 6.521 ( 2.608 4.292 0.502) 5.048 6.593 ( -1.167 4.794 -1.060) 5.047 6.655 ( -1.586 5.370 1.327) 5.754 6.728 ( -9.203 9.980 -0.871) 13.603 7.303 ( 0.492 -0.742 0.374) 0.966 7.320 ( -0.907 -1.509 -0.916) 1.985 7.443 ( 1.666 -0.469 0.460) 1.791 7.459 ( 0.061 -0.917 0.183) 0.937 8.708 ( 1.349 -1.836 0.418) 2.316 8.729 ( -0.820 -1.726 -0.205) 1.921 8.941 ( 0.359 0.668 4.957) 5.015 8.966 ( 1.034 0.472 -4.853) 4.985 10.403 ( 4.222 -1.085 1.409) 4.581 10.473 ( -2.573 -2.051 -1.464) 3.601 10.603 ( 4.024 1.254 1.163) 4.373 10.691 ( -4.618 0.491 -1.962) 5.042 15.882 ( 0.633 5.071 0.294) 5.119 15.923 ( -3.566 4.397 -0.615) 5.695 16.777 ( 0.048 1.047 5.678) 5.774 16.794 ( 2.245 1.130 -5.576) 6.116 17.858 ( 11.630 0.383 -3.347) 12.109 17.930 ( 4.729 2.644 2.463) 5.951 18.008 ( -5.460 4.306 1.667) 7.151 18.058 ( -7.573 3.980 -0.998) 8.613 18.872 ( 0.710 -5.841 4.821) 7.607 18.951 ( -3.854 -5.859 -4.520) 8.343 19.045 ( 0.056 1.154 -1.790) 2.131 19.054 ( -2.621 0.525 2.029) 3.356 ======================= Grid point 268 (118/138) ======================= q-point: (-0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 127 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( -5.907 8.653 -15.505) 18.713 1.255 ( 5.907 8.653 15.505) 18.713 1.352 ( 8.808 13.544 -8.987) 18.488 1.352 ( -8.808 13.544 8.987) 18.488 2.308 ( -3.530 4.075 -11.853) 13.021 2.308 ( 3.530 4.075 11.853) 13.021 2.436 ( 0.182 3.803 -6.784) 7.779 2.436 ( -0.182 3.803 6.784) 7.779 2.839 ( -7.515 3.234 -2.599) 8.584 2.839 ( 7.515 3.234 2.599) 8.584 3.107 ( 0.530 3.558 -3.696) 5.158 3.107 ( -0.530 3.558 3.696) 5.158 3.299 ( 1.232 0.869 -7.651) 7.798 3.299 ( -1.232 0.869 7.651) 7.798 3.982 ( -0.630 -6.513 -9.442) 11.488 3.982 ( 0.630 -6.513 9.442) 11.488 4.658 ( -7.439 -8.374 -6.719) 13.061 4.658 ( 7.439 -8.374 6.719) 13.061 5.116 ( -8.326 -7.366 -3.658) 11.703 5.116 ( 8.326 -7.366 3.658) 11.703 5.353 ( 0.913 -2.531 -5.724) 6.325 5.353 ( -0.913 -2.531 5.724) 6.325 5.911 ( -4.061 4.547 -5.834) 8.438 5.911 ( 4.061 4.547 5.834) 8.438 6.194 ( 0.668 3.814 -2.604) 4.667 6.194 ( -0.668 3.814 2.604) 4.667 6.468 ( -4.006 5.748 -1.066) 7.087 6.468 ( 4.006 5.748 1.066) 7.087 6.575 ( 0.171 2.657 -1.239) 2.937 6.575 ( -0.171 2.657 1.239) 2.937 7.333 ( -1.081 -1.365 -1.003) 2.009 7.333 ( 1.081 -1.365 1.003) 2.009 7.468 ( -0.881 -0.642 -0.905) 1.416 7.468 ( 0.881 -0.642 0.905) 1.416 8.755 ( -1.097 -2.041 -0.357) 2.345 8.755 ( 1.097 -2.041 0.357) 2.345 8.957 ( 1.056 -1.196 -6.146) 6.349 8.957 ( -1.056 -1.196 6.146) 6.349 10.451 ( -2.804 0.436 -3.121) 4.218 10.451 ( 2.804 0.436 3.121) 4.218 10.612 ( -3.226 2.831 -4.032) 5.889 10.612 ( 3.226 2.831 4.032) 5.889 15.824 ( -0.979 3.335 -2.500) 4.281 15.824 ( 0.979 3.335 2.500) 4.281 16.749 ( 1.016 3.697 -4.363) 5.808 16.749 ( -1.016 3.697 4.363) 5.808 17.859 ( -0.372 5.635 -1.828) 5.936 17.859 ( 0.372 5.635 1.828) 5.936 18.002 ( 3.595 -2.806 -5.242) 6.948 18.002 ( -3.595 -2.806 5.242) 6.948 18.886 ( 1.019 4.782 -6.030) 7.763 18.886 ( -1.019 4.782 6.030) 7.763 19.140 ( -1.451 -8.845 -4.807) 10.170 19.140 ( 1.451 -8.845 4.807) 10.170 ======================= Grid point 272 (119/138) ======================= q-point: ( 0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( -0.157 -0.000 -24.429) 24.429 1.129 ( 13.366 0.000 -17.071) 21.681 1.448 ( 13.624 0.000 12.247) 18.319 1.797 ( 16.404 0.000 -17.411) 23.921 1.998 ( 20.670 0.000 13.094) 24.468 2.432 ( 0.346 0.000 3.572) 3.589 2.454 ( 5.818 0.000 2.622) 6.382 2.638 ( -0.776 -0.000 3.152) 3.246 2.691 ( 1.327 0.000 3.209) 3.473 2.939 ( -0.712 -0.000 3.446) 3.519 3.057 ( -1.757 -0.000 4.048) 4.413 3.119 ( 10.541 0.000 14.898) 18.250 3.230 ( 7.671 0.000 -16.669) 18.349 3.388 ( 1.138 0.000 0.748) 1.361 3.833 ( -2.554 -0.000 -8.743) 9.108 4.134 ( -7.840 -0.000 9.568) 12.370 4.568 ( -5.694 -0.000 -3.544) 6.707 4.844 ( -10.353 -0.000 -4.692) 11.367 5.168 ( -10.133 -0.000 4.364) 11.033 5.207 ( -1.920 -0.000 -3.691) 4.160 5.261 ( -0.685 -0.000 10.463) 10.485 5.406 ( -1.178 -0.000 -4.870) 5.010 5.769 ( -5.398 -0.000 -3.944) 6.685 5.842 ( -1.593 -0.000 -2.332) 2.824 6.060 ( 12.815 0.000 4.037) 13.436 6.206 ( -1.858 -0.000 -1.445) 2.354 6.530 ( 13.388 0.000 -1.168) 13.439 6.535 ( 6.886 0.000 1.350) 7.018 6.590 ( 7.325 0.000 0.799) 7.369 6.764 ( 7.162 0.000 -0.969) 7.227 7.330 ( -5.892 -0.000 0.778) 5.943 7.338 ( -0.219 -0.000 0.181) 0.285 7.397 ( -4.969 -0.000 -0.975) 5.064 7.405 ( -0.069 -0.000 0.059) 0.091 8.708 ( -2.367 -0.000 1.741) 2.938 8.802 ( -0.647 -0.000 -1.357) 1.503 8.876 ( -5.694 -0.000 -4.235) 7.096 8.914 ( -4.449 -0.000 2.042) 4.896 10.357 ( 2.213 0.000 0.956) 2.410 10.494 ( -1.281 -0.000 2.117) 2.475 10.510 ( 1.405 0.000 0.014) 1.405 10.882 ( 1.574 0.000 4.336) 4.613 15.824 ( 6.231 0.000 4.217) 7.523 15.967 ( 5.733 0.000 -2.118) 6.112 16.556 ( -1.507 -0.000 -3.883) 4.165 16.588 ( -3.814 -0.000 2.900) 4.791 17.452 ( -13.071 -0.000 4.500) 13.824 17.569 ( -7.202 -0.000 -1.888) 7.446 18.038 ( -1.485 -0.000 2.385) 2.810 18.231 ( 1.472 0.000 -3.631) 3.918 18.924 ( 10.511 0.000 -3.085) 10.954 18.989 ( 8.190 0.000 4.082) 9.151 19.313 ( 2.944 0.000 -5.576) 6.305 19.598 ( 9.759 0.000 1.456) 9.867 ======================= Grid point 273 (120/138) ======================= q-point: ( 0.27 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( 3.261 -11.716 -12.073) 17.137 1.250 ( 11.771 -5.550 -9.710) 16.237 1.565 ( 9.264 3.111 5.297) 11.116 1.935 ( 8.262 -6.101 -8.426) 13.285 2.139 ( 19.563 5.812 8.559) 22.130 2.385 ( -1.343 3.917 2.112) 4.648 2.586 ( 4.706 -6.597 -1.704) 8.281 2.671 ( 1.963 0.502 3.848) 4.349 2.733 ( 4.093 -3.330 3.389) 6.270 2.976 ( 1.707 4.659 6.213) 7.951 3.028 ( 3.627 -4.599 0.924) 5.929 3.252 ( 11.565 -1.143 -12.802) 17.290 3.346 ( 5.698 -6.773 4.516) 9.937 3.410 ( -0.340 -2.735 -3.711) 4.623 3.793 ( 1.037 1.832 -0.343) 2.133 4.087 ( -8.019 0.139 8.421) 11.629 4.462 ( -3.505 5.500 -1.482) 6.688 4.676 ( -9.919 6.794 -2.277) 12.237 5.118 ( -9.280 -1.007 -0.088) 9.335 5.136 ( -11.768 -1.825 -2.180) 12.107 5.267 ( 5.232 6.265 9.047) 12.185 5.388 ( -0.683 -0.778 -2.178) 2.412 5.605 ( -6.932 5.622 -4.102) 9.823 5.885 ( -4.878 -5.088 -1.456) 7.198 6.145 ( 3.865 1.652 -0.432) 4.225 6.243 ( 8.701 -1.106 0.791) 8.806 6.566 ( 5.672 -0.994 1.171) 5.877 6.656 ( 7.244 0.239 1.160) 7.341 6.782 ( 11.384 -7.838 1.363) 13.889 6.813 ( 7.561 -2.169 -1.719) 8.052 7.267 ( -6.362 1.176 0.066) 6.470 7.321 ( -2.263 0.768 0.206) 2.399 7.362 ( -3.028 -0.755 -1.171) 3.333 7.417 ( 0.434 -0.932 0.580) 1.180 8.689 ( -1.779 0.663 1.799) 2.615 8.787 ( -1.771 -0.323 -2.358) 2.966 8.812 ( -1.862 1.791 -3.783) 4.581 8.903 ( -3.073 -1.611 2.641) 4.360 10.346 ( 1.889 3.022 0.652) 3.623 10.502 ( -0.619 -0.520 0.429) 0.915 10.516 ( 0.797 -0.120 0.761) 1.108 10.879 ( -1.898 1.220 0.709) 2.365 15.893 ( 5.909 -0.509 3.268) 6.772 16.015 ( 4.680 -0.913 -0.618) 4.808 16.555 ( -2.172 -2.458 -4.636) 5.678 16.604 ( -4.086 -4.060 3.781) 6.890 17.379 ( -10.821 -2.222 4.419) 11.897 17.526 ( -7.794 -3.210 -2.708) 8.853 18.030 ( -2.105 -0.224 2.082) 2.969 18.208 ( -0.177 1.626 -4.137) 4.449 19.019 ( 10.248 -0.986 -1.597) 10.418 19.083 ( 8.319 -1.042 3.092) 8.936 19.293 ( 6.998 4.632 -3.760) 9.196 19.626 ( 9.394 6.538 -0.127) 11.446 ======================= Grid point 274 (121/138) ======================= q-point: ( 0.36 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( -2.084 -15.721 -10.709) 19.135 1.468 ( 5.890 -3.798 11.126) 13.149 1.530 ( 11.210 2.115 -8.477) 14.212 2.054 ( 6.425 -1.841 1.355) 6.820 2.188 ( 6.519 4.496 4.336) 9.028 2.344 ( 2.549 2.406 3.081) 4.667 2.657 ( -0.165 0.186 0.701) 0.743 2.727 ( 5.004 -4.877 -5.371) 8.813 2.849 ( 4.556 -2.480 2.626) 5.814 2.987 ( 4.262 -1.242 1.467) 4.676 3.108 ( 1.467 -2.581 -2.337) 3.778 3.336 ( -3.622 4.051 -3.341) 6.379 3.420 ( 15.795 -6.936 -7.546) 18.829 3.572 ( 8.104 -8.717 1.348) 11.978 3.777 ( 2.105 2.960 1.478) 3.922 4.045 ( -4.715 1.711 7.780) 9.256 4.337 ( -0.279 7.668 -0.736) 7.708 4.492 ( -6.024 3.431 1.657) 7.128 4.999 ( -12.509 2.997 -1.805) 12.989 5.026 ( -12.467 3.906 0.373) 13.070 5.229 ( 2.772 3.782 5.141) 6.958 5.390 ( -4.474 -1.897 -2.600) 5.511 5.522 ( -1.031 -2.202 -1.999) 3.148 5.897 ( -4.589 -1.203 0.108) 4.745 6.157 ( 3.147 -0.213 -0.256) 3.165 6.301 ( 8.261 2.772 -0.059) 8.713 6.618 ( 3.476 0.840 -0.795) 3.664 6.730 ( 5.010 -2.763 1.167) 5.840 6.845 ( 6.681 0.460 -0.242) 6.701 7.081 ( 10.031 -9.720 1.826) 14.086 7.193 ( -6.599 0.258 -1.076) 6.691 7.287 ( -3.938 0.241 0.068) 3.946 7.360 ( -0.166 -1.022 -0.927) 1.390 7.439 ( 0.873 -0.512 0.806) 1.294 8.668 ( -1.069 0.926 0.692) 1.575 8.765 ( 0.138 1.664 -0.754) 1.832 8.772 ( -2.240 -0.845 -3.585) 4.311 8.920 ( -2.705 -1.712 2.693) 4.184 10.307 ( 1.238 2.983 0.261) 3.241 10.498 ( -0.726 0.404 0.185) 0.851 10.530 ( -0.025 -0.355 -0.038) 0.357 10.814 ( -3.345 3.215 -0.066) 4.640 15.969 ( 5.407 -1.823 1.318) 5.856 16.074 ( 3.190 -1.855 1.237) 3.892 16.569 ( -1.392 -2.877 -6.152) 6.933 16.652 ( -5.044 -3.821 4.841) 7.967 17.379 ( -7.903 -5.515 3.987) 10.429 17.533 ( -6.903 -5.879 -3.004) 9.552 18.031 ( -1.856 -1.413 1.458) 2.751 18.159 ( -1.407 1.340 -3.758) 4.231 19.098 ( 6.858 0.756 -0.578) 6.923 19.177 ( 7.469 -0.622 2.302) 7.840 19.253 ( 8.898 7.282 -0.894) 11.532 19.540 ( 7.879 10.994 -1.303) 13.589 ======================= Grid point 275 (122/138) ======================= q-point: ( 0.45 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( -0.775 10.960 -2.167) 11.199 1.594 ( -4.202 -14.874 -9.913) 18.362 1.858 ( 13.904 -13.593 7.683) 20.908 2.102 ( 1.321 2.416 10.484) 10.840 2.192 ( 1.693 -3.382 -6.068) 7.150 2.340 ( 10.012 5.754 6.682) 13.342 2.622 ( -4.068 1.760 -3.209) 5.471 2.810 ( 3.074 -0.829 -6.377) 7.128 2.921 ( 5.445 -2.710 -5.440) 8.160 3.073 ( 3.360 -3.534 -2.065) 5.295 3.149 ( -0.568 -0.219 2.349) 2.426 3.205 ( -3.361 3.261 -0.052) 4.683 3.615 ( 8.965 5.184 0.918) 10.397 3.731 ( 11.023 -5.482 -0.077) 12.311 3.795 ( 2.110 -2.407 1.506) 3.538 4.033 ( -2.477 -3.112 5.518) 6.802 4.179 ( 0.416 7.706 -2.660) 8.162 4.481 ( 1.686 -0.831 0.099) 1.882 4.781 ( -17.992 6.277 -0.688) 19.068 4.827 ( -12.948 5.423 3.048) 14.365 5.225 ( 4.472 1.534 1.452) 4.945 5.388 ( -2.486 -3.267 -3.356) 5.303 5.591 ( 0.111 -4.850 -1.710) 5.144 5.850 ( -4.586 2.249 1.592) 5.351 6.188 ( 3.849 1.010 1.466) 4.241 6.310 ( 4.092 1.842 0.096) 4.489 6.628 ( 4.416 0.470 -0.835) 4.518 6.810 ( 3.136 -1.287 -0.304) 3.404 6.889 ( 6.465 1.310 0.706) 6.634 7.155 ( -5.767 -2.676 -1.579) 6.551 7.235 ( -3.160 0.824 -0.400) 3.290 7.296 ( 4.826 -5.705 1.100) 7.553 7.387 ( 1.194 -1.587 -0.554) 2.062 7.457 ( 1.122 -0.453 1.045) 1.599 8.641 ( -0.506 1.418 -0.034) 1.506 8.744 ( -0.416 0.554 -3.683) 3.748 8.767 ( -1.326 -1.482 1.209) 2.328 8.926 ( -2.853 -0.906 2.020) 3.611 10.270 ( 0.621 2.136 -0.072) 2.226 10.454 ( -3.005 3.343 0.045) 4.496 10.533 ( 1.236 0.094 0.059) 1.241 10.742 ( -3.309 1.116 -0.051) 3.492 16.052 ( 4.350 -2.259 0.452) 4.923 16.136 ( 1.611 -2.068 2.046) 3.325 16.593 ( 0.433 -2.997 -7.421) 8.016 16.675 ( -5.349 -2.177 5.754) 8.152 17.449 ( -5.077 -7.089 3.648) 9.452 17.586 ( -5.271 -7.108 -3.191) 9.407 18.068 ( -1.206 -4.460 0.431) 4.640 18.132 ( -1.891 -1.393 -2.134) 3.173 19.079 ( 3.006 6.695 -0.658) 7.368 19.156 ( 3.889 9.998 0.829) 10.760 19.251 ( 8.153 1.714 1.852) 8.534 19.412 ( 7.142 9.147 -1.787) 11.742 ======================= Grid point 276 (123/138) ======================= q-point: ( 0.55 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( 5.861 5.489 -3.135) 8.620 1.739 ( -9.187 -10.659 -7.318) 15.861 2.106 ( -0.894 -3.798 4.232) 5.756 2.191 ( 8.269 -2.790 9.657) 13.017 2.250 ( 4.067 -1.173 -0.511) 4.264 2.433 ( 15.915 -5.402 1.017) 16.837 2.521 ( -6.970 1.835 -3.062) 7.831 2.766 ( -1.310 3.894 -2.476) 4.797 2.980 ( -1.753 -0.143 -8.889) 9.061 3.022 ( 10.676 6.661 -4.773) 13.459 3.127 ( -4.116 0.080 4.168) 5.858 3.283 ( 5.994 -4.628 -2.060) 7.848 3.555 ( 3.454 5.495 9.636) 11.618 3.727 ( -0.085 8.643 4.601) 9.792 3.887 ( -2.467 2.115 -1.743) 3.687 4.106 ( 1.961 -4.510 4.300) 6.532 4.140 ( 1.701 -1.890 -5.631) 6.179 4.452 ( -5.211 2.757 -1.416) 6.063 4.542 ( -14.467 2.000 2.116) 14.757 4.686 ( -6.753 0.694 -0.463) 6.804 5.261 ( 7.021 0.254 1.199) 7.127 5.453 ( 4.337 -4.101 -2.269) 6.385 5.642 ( -3.738 -3.105 -3.064) 5.744 5.780 ( -3.422 1.278 1.993) 4.161 6.183 ( 2.626 3.172 1.004) 4.238 6.307 ( 0.208 0.903 -0.270) 0.965 6.682 ( 5.795 -1.036 1.014) 5.973 6.817 ( 2.995 2.756 0.246) 4.078 6.908 ( 3.856 2.112 0.208) 4.401 7.164 ( -4.662 -3.516 -2.526) 6.362 7.204 ( -1.883 -0.475 1.122) 2.243 7.378 ( -0.074 -1.405 -1.592) 2.125 7.417 ( 2.672 0.534 0.564) 2.783 7.486 ( 0.604 -1.207 1.489) 2.010 8.618 ( 0.120 0.764 0.073) 0.776 8.713 ( -1.778 0.387 -3.114) 3.607 8.807 ( 0.335 -2.717 1.904) 3.334 8.921 ( -2.359 -0.940 0.787) 2.659 10.248 ( 0.476 0.644 -0.185) 0.822 10.358 ( -3.090 3.449 0.005) 4.631 10.551 ( 2.108 -0.306 0.719) 2.248 10.717 ( -2.883 -0.904 -0.486) 3.060 16.110 ( 2.571 -0.612 0.106) 2.645 16.175 ( -0.115 -0.689 1.474) 1.631 16.635 ( 2.287 -3.229 -7.858) 8.798 16.683 ( -4.476 -1.620 6.826) 8.322 17.546 ( -2.058 -6.228 2.687) 7.088 17.658 ( -3.647 -6.543 -2.795) 7.995 18.175 ( -0.317 -8.426 -1.909) 8.645 18.176 ( -1.742 -6.138 1.203) 6.493 18.920 ( 1.084 12.680 -0.440) 12.734 18.965 ( 0.279 13.508 0.415) 13.517 19.276 ( 4.816 2.798 3.200) 6.424 19.345 ( 5.882 5.094 -2.943) 8.319 ======================= Grid point 277 (124/138) ======================= q-point: (-0.36 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( 14.312 -4.514 -1.944) 15.132 1.760 ( -11.722 -4.608 -3.537) 13.082 2.099 ( 4.126 7.125 -1.522) 8.373 2.230 ( -0.685 3.349 2.856) 4.455 2.333 ( 1.928 -4.107 1.067) 4.661 2.482 ( -3.889 -5.407 -1.187) 6.765 2.628 ( 7.490 7.182 -1.187) 10.445 2.704 ( 2.307 -4.796 -2.007) 5.688 2.968 ( 8.898 1.511 6.155) 10.924 3.011 ( 2.416 1.674 -4.483) 5.361 3.108 ( -1.140 -1.320 -1.433) 2.257 3.362 ( 3.246 0.165 -1.188) 3.461 3.504 ( 0.088 9.979 4.472) 10.935 3.578 ( -4.053 3.267 5.144) 7.319 3.720 ( -4.905 9.759 1.627) 11.043 3.983 ( -12.744 7.597 -4.189) 15.417 4.249 ( 6.607 -3.106 -0.410) 7.312 4.406 ( -5.146 -4.358 1.286) 6.865 4.556 ( -5.127 -8.953 3.636) 10.939 4.635 ( -2.735 0.297 -4.914) 5.632 5.349 ( 8.288 -1.715 2.316) 8.775 5.533 ( 3.065 0.420 -0.952) 3.237 5.659 ( -1.581 -5.054 -2.080) 5.689 5.764 ( -2.268 -1.329 -1.726) 3.145 6.143 ( 2.444 3.646 0.955) 4.492 6.280 ( -3.966 -0.193 -0.704) 4.032 6.715 ( 3.966 2.742 -0.581) 4.856 6.825 ( 5.116 1.022 4.092) 6.631 6.880 ( 2.631 3.873 -0.415) 4.701 7.150 ( -4.752 0.113 -3.009) 5.626 7.233 ( -0.018 -2.793 1.902) 3.380 7.355 ( -2.430 1.558 -1.708) 3.354 7.418 ( 1.917 1.469 0.967) 2.601 7.491 ( -1.081 1.060 0.453) 1.581 8.621 ( 1.129 -0.531 -0.162) 1.258 8.689 ( -2.026 -0.441 -1.530) 2.577 8.870 ( 0.904 -2.967 2.134) 3.765 8.929 ( -1.160 -1.642 -0.698) 2.128 10.259 ( 0.878 -1.380 -0.102) 1.638 10.310 ( -1.851 -0.569 -0.016) 1.937 10.583 ( 3.077 -0.447 1.128) 3.308 10.709 ( -2.890 -1.125 -0.958) 3.245 16.112 ( 1.154 2.173 -0.339) 2.484 16.159 ( -1.730 2.005 0.614) 2.719 16.692 ( 2.367 -3.155 -5.041) 6.400 16.706 ( -2.093 -2.325 4.970) 5.873 17.647 ( 1.164 -5.243 1.042) 5.471 17.732 ( -2.516 -5.765 -1.183) 6.400 18.310 ( 0.332 -9.584 1.201) 9.665 18.337 ( -0.099 -9.947 -1.185) 10.018 18.684 ( -0.974 13.921 -0.009) 13.955 18.717 ( -2.300 13.317 -0.217) 13.516 19.258 ( 1.885 3.885 4.565) 6.284 19.292 ( 3.764 4.782 -4.418) 7.520 ======================= Grid point 278 (125/138) ======================= q-point: (-0.27 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( 15.568 -6.763 -1.735) 17.062 1.696 ( -8.895 0.701 0.253) 8.926 1.971 ( 6.630 10.287 -7.158) 14.178 2.077 ( -9.454 9.571 5.130) 14.398 2.422 ( 2.511 -2.963 -0.116) 3.886 2.472 ( -1.237 4.061 0.077) 4.246 2.627 ( 6.060 -0.216 1.429) 6.230 2.768 ( -4.982 0.496 -3.333) 6.015 2.877 ( 8.645 8.763 3.554) 12.813 3.044 ( -7.414 -0.038 -2.024) 7.685 3.178 ( 2.978 -3.144 1.220) 4.499 3.257 ( -5.839 5.581 -0.098) 8.078 3.391 ( 5.667 5.189 0.271) 7.689 3.507 ( -6.662 4.085 1.425) 7.944 3.608 ( 4.430 1.203 4.753) 6.608 3.751 ( -8.939 3.777 -3.556) 10.335 4.374 ( 8.374 -3.126 0.072) 8.938 4.490 ( -5.778 -7.154 4.172) 10.098 4.595 ( 3.193 -1.231 -4.722) 5.831 4.686 ( -7.284 -9.579 -0.714) 12.055 5.424 ( 4.973 2.341 4.164) 6.896 5.508 ( -1.025 1.907 -5.566) 5.972 5.739 ( 0.204 -3.477 7.929) 8.661 5.796 ( -0.085 -5.991 -8.936) 10.758 6.137 ( 5.212 0.555 2.368) 5.752 6.252 ( -6.473 -2.120 -1.313) 6.937 6.692 ( 5.026 3.972 1.174) 6.513 6.788 ( -4.089 3.553 -1.406) 5.596 6.865 ( 9.672 6.087 3.098) 11.840 7.037 ( -8.262 5.894 -2.244) 10.394 7.283 ( 0.661 -1.277 1.391) 2.000 7.309 ( -0.987 0.678 -1.477) 1.901 7.418 ( 0.798 0.078 1.908) 2.069 7.450 ( -1.447 1.192 -1.241) 2.249 8.652 ( 1.806 -1.375 -0.154) 2.275 8.684 ( -1.865 -1.159 -0.316) 2.218 8.928 ( 0.606 -1.926 2.582) 3.278 8.949 ( -0.082 -1.596 -2.159) 2.686 10.310 ( 1.600 -3.152 0.355) 3.553 10.339 ( -1.344 -3.853 -0.450) 4.105 10.623 ( 3.841 -0.178 1.284) 4.053 10.694 ( -3.380 -0.532 -1.243) 3.640 16.060 ( 0.991 4.408 -0.595) 4.557 16.086 ( -2.380 4.236 0.379) 4.874 16.746 ( -1.343 -2.342 6.384) 6.931 16.754 ( 2.362 -2.717 -6.176) 7.149 17.756 ( 3.946 -4.766 -1.073) 6.280 17.807 ( -2.683 -5.388 1.167) 6.131 18.393 ( 2.456 10.855 -0.331) 11.135 18.420 ( 1.172 13.453 -0.314) 13.508 18.518 ( -1.353 -11.102 2.347) 11.428 18.583 ( -5.501 -8.559 -1.772) 10.328 19.203 ( -0.263 4.853 4.664) 6.736 19.214 ( 1.978 5.258 -4.664) 7.302 ======================= Grid point 279 (126/138) ======================= q-point: (-0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 127 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( -0.750 6.328 -6.970) 9.444 1.592 ( 0.750 6.328 6.970) 9.444 1.833 ( 4.694 10.025 -9.587) 14.644 1.833 ( -4.694 10.025 9.587) 14.644 2.414 ( -4.263 4.700 -4.312) 7.671 2.414 ( 4.263 4.700 4.312) 7.671 2.606 ( 1.899 5.297 -3.767) 6.772 2.606 ( -1.899 5.297 3.767) 6.772 2.911 ( -6.206 2.340 -6.685) 9.417 2.911 ( 6.206 2.340 6.685) 9.417 3.216 ( -0.619 -0.211 -2.058) 2.159 3.216 ( 0.619 -0.211 2.058) 2.159 3.373 ( -0.654 3.611 -0.965) 3.795 3.373 ( 0.654 3.611 0.965) 3.795 3.706 ( -1.965 -5.385 -4.355) 7.199 3.706 ( 1.965 -5.385 4.355) 7.199 4.487 ( -6.823 -2.040 -2.701) 7.616 4.487 ( 6.823 -2.040 2.701) 7.616 4.781 ( -8.666 -10.395 -4.097) 14.140 4.781 ( 8.666 -10.395 4.097) 14.140 5.405 ( -3.640 4.408 -4.192) 7.089 5.405 ( 3.640 4.408 4.192) 7.089 5.863 ( -2.337 -5.266 -7.217) 9.235 5.863 ( 2.337 -5.266 7.217) 9.235 6.226 ( -8.042 -2.268 -2.229) 8.647 6.226 ( 8.042 -2.268 2.229) 8.647 6.663 ( -4.965 5.475 -2.346) 7.755 6.663 ( 4.965 5.475 2.346) 7.755 6.816 ( -6.435 8.933 -3.094) 11.436 6.816 ( 6.435 8.933 3.094) 11.436 7.298 ( -0.289 -0.233 -0.374) 0.527 7.298 ( 0.289 -0.233 0.374) 0.527 7.439 ( -0.249 -0.931 -1.108) 1.468 7.439 ( 0.249 -0.931 1.108) 1.468 8.692 ( -1.437 -1.486 -0.303) 2.089 8.692 ( 1.437 -1.486 0.303) 2.089 8.960 ( 0.262 -0.376 -3.818) 3.845 8.960 ( -0.262 -0.376 3.818) 3.845 10.392 ( -1.114 -3.714 -2.328) 4.522 10.392 ( 1.114 -3.714 2.328) 4.522 10.659 ( -2.529 0.438 -2.726) 3.745 10.659 ( 2.529 0.438 2.726) 3.745 15.984 ( 0.467 5.217 -2.558) 5.829 15.984 ( -0.467 5.217 2.558) 5.829 16.787 ( 1.649 -1.263 -6.767) 7.079 16.787 ( -1.649 -1.263 6.767) 7.079 17.870 ( 3.475 -4.528 -5.705) 8.070 17.870 ( -3.475 -4.528 5.705) 8.070 18.181 ( -0.896 12.398 -0.581) 12.444 18.181 ( 0.896 12.398 0.581) 12.444 18.737 ( -2.081 -11.258 -3.888) 12.091 18.737 ( 2.081 -11.258 3.888) 12.091 19.120 ( 1.971 5.325 -5.173) 7.681 19.120 ( -1.971 5.325 5.173) 7.681 ======================= Grid point 285 (127/138) ======================= q-point: ( 0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.054 ( 8.042 0.000 -2.760) 8.502 1.288 ( 10.900 0.000 -1.195) 10.965 1.736 ( 13.873 0.000 2.470) 14.091 1.873 ( 4.615 0.000 -14.781) 15.484 2.348 ( 4.545 0.000 5.449) 7.095 2.501 ( -0.500 -0.000 -1.042) 1.156 2.510 ( 10.726 0.000 5.374) 11.997 2.638 ( -1.294 -0.000 2.849) 3.129 2.793 ( 5.294 0.000 3.569) 6.385 3.035 ( 7.385 0.000 1.869) 7.618 3.117 ( 8.917 0.000 2.238) 9.194 3.260 ( -2.344 -0.000 -3.621) 4.313 3.301 ( 13.005 0.000 -15.162) 19.975 3.407 ( 5.817 0.000 0.466) 5.836 3.873 ( 8.811 0.000 7.359) 11.480 4.012 ( -12.009 -0.000 7.103) 13.953 4.475 ( -3.618 -0.000 -0.734) 3.691 4.641 ( -10.507 -0.000 -3.969) 11.232 4.991 ( -13.208 -0.000 -3.875) 13.765 5.031 ( -8.148 -0.000 1.948) 8.377 5.327 ( -5.934 -0.000 -2.384) 6.395 5.447 ( 7.234 0.000 11.677) 13.736 5.611 ( -10.315 -0.000 -3.253) 10.816 5.744 ( -4.239 -0.000 -3.742) 5.654 6.154 ( -0.522 -0.000 -5.139) 5.166 6.355 ( 13.609 0.000 7.828) 15.700 6.661 ( 7.651 0.000 -1.326) 7.765 6.730 ( 7.288 0.000 1.937) 7.541 6.766 ( 13.238 0.000 0.833) 13.264 6.838 ( 1.511 0.000 -2.753) 3.140 7.241 ( -3.904 -0.000 1.869) 4.328 7.280 ( -6.382 -0.000 -1.800) 6.631 7.349 ( 0.447 0.000 -0.289) 0.533 7.405 ( -0.266 -0.000 0.023) 0.267 8.690 ( -1.323 -0.000 2.567) 2.888 8.751 ( -1.668 -0.000 -4.319) 4.630 8.817 ( -0.544 -0.000 -1.261) 1.374 8.865 ( -2.764 -0.000 1.575) 3.181 10.395 ( 1.737 0.000 -0.377) 1.778 10.481 ( -1.610 -0.000 1.713) 2.351 10.549 ( 2.266 0.000 2.149) 3.123 10.859 ( -2.824 -0.000 -3.119) 4.208 15.950 ( 4.710 0.000 3.970) 6.160 16.040 ( 3.884 0.000 -1.017) 4.015 16.508 ( -0.634 -0.000 -5.110) 5.149 16.542 ( -3.798 -0.000 4.038) 5.544 17.288 ( -9.716 -0.000 6.059) 11.450 17.418 ( -7.378 -0.000 -4.783) 8.793 18.014 ( -2.702 -0.000 2.537) 3.706 18.203 ( -1.259 -0.000 -4.984) 5.141 19.099 ( 10.919 0.000 -1.472) 11.018 19.161 ( 8.762 0.000 3.797) 9.550 19.390 ( 8.352 0.000 -1.908) 8.568 19.760 ( 8.666 0.000 -2.109) 8.919 ======================= Grid point 286 (128/138) ======================= q-point: ( 0.36 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( 6.904 -5.123 3.248) 9.190 1.454 ( 9.291 -7.533 9.112) 15.036 1.696 ( 7.618 8.801 -9.934) 15.303 1.996 ( 6.090 -7.397 -7.342) 12.072 2.298 ( -3.406 5.027 1.099) 6.171 2.512 ( 9.884 3.781 8.648) 13.667 2.579 ( -1.593 -4.098 -0.746) 4.460 2.706 ( 0.016 -2.507 1.955) 3.179 2.837 ( 2.512 -1.330 0.374) 2.867 3.054 ( -1.083 2.284 -8.295) 8.672 3.118 ( 9.026 2.718 3.195) 9.954 3.351 ( 5.528 -2.482 -8.556) 10.485 3.434 ( 16.270 -4.998 -6.063) 18.068 3.497 ( 10.314 -4.114 2.613) 11.408 3.878 ( -2.625 3.584 6.165) 7.599 4.035 ( 2.263 -2.092 8.169) 8.731 4.414 ( -2.339 3.319 -0.436) 4.083 4.509 ( -8.223 3.301 -0.469) 8.873 4.865 ( -14.011 0.020 -4.010) 14.573 4.969 ( -9.486 0.759 -0.068) 9.516 5.278 ( -8.170 -2.215 -1.187) 8.547 5.413 ( -2.290 7.510 2.393) 8.208 5.517 ( 1.589 1.864 4.923) 5.498 5.773 ( -5.093 -5.471 -2.813) 7.986 6.159 ( 2.745 -1.634 -3.421) 4.680 6.472 ( 11.722 3.387 4.191) 12.901 6.658 ( 4.631 2.003 -1.301) 5.211 6.762 ( 3.170 1.508 0.765) 3.593 6.862 ( 1.634 -2.570 -0.333) 3.064 6.997 ( 9.915 -9.771 0.671) 13.936 7.170 ( -4.876 3.126 -0.314) 5.801 7.253 ( -2.819 -0.766 0.016) 2.921 7.350 ( 0.498 -0.095 -0.477) 0.696 7.422 ( -0.226 -1.777 0.072) 1.793 8.679 ( -0.800 0.891 1.968) 2.304 8.735 ( -0.883 -0.506 -3.545) 3.688 8.792 ( -0.138 1.556 -0.694) 1.709 8.871 ( -2.276 -1.929 1.450) 3.317 10.380 ( 1.732 2.770 0.085) 3.268 10.484 ( -1.673 -0.921 0.806) 2.073 10.551 ( 2.265 1.981 1.355) 3.301 10.817 ( -3.568 1.041 -3.014) 4.786 15.999 ( 4.374 -0.445 1.752) 4.733 16.076 ( 2.295 -1.034 0.660) 2.602 16.502 ( 0.061 -1.646 -5.806) 6.035 16.559 ( -4.174 -3.407 4.656) 7.121 17.256 ( -7.244 -2.796 5.751) 9.663 17.377 ( -6.223 -3.770 -4.876) 8.759 18.004 ( -2.331 -0.443 2.680) 3.580 18.158 ( -1.889 1.476 -5.292) 5.810 19.179 ( 8.951 0.760 -0.664) 9.008 19.245 ( 7.385 0.012 3.290) 8.085 19.430 ( 9.342 3.888 0.836) 10.153 19.756 ( 6.697 6.835 -3.581) 10.217 ======================= Grid point 287 (129/138) ======================= q-point: ( 0.45 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( 0.409 -6.905 0.537) 6.938 1.497 ( 0.278 9.432 -3.581) 10.093 1.794 ( 13.470 -10.634 7.262) 18.635 2.126 ( 4.274 -4.707 -7.062) 9.502 2.189 ( -1.950 4.103 3.596) 5.793 2.512 ( 2.830 3.730 4.124) 6.240 2.639 ( 1.330 1.593 3.762) 4.296 2.765 ( 0.472 -6.380 -2.127) 6.742 2.855 ( -1.264 -0.998 -7.819) 7.983 3.025 ( -1.332 -2.461 -3.224) 4.269 3.159 ( 6.776 0.660 1.597) 6.993 3.337 ( 8.460 6.900 -1.563) 11.028 3.643 ( 11.511 -7.301 -3.796) 14.150 3.737 ( 9.338 -8.031 1.043) 12.360 3.812 ( -1.322 3.221 2.341) 4.196 4.051 ( 2.387 4.801 5.904) 7.975 4.297 ( -3.510 5.430 -2.424) 6.905 4.472 ( 0.949 -1.190 1.434) 2.091 4.699 ( -16.581 3.700 -1.869) 17.092 4.812 ( -13.193 5.210 1.068) 14.225 5.263 ( -4.840 -4.750 -3.938) 7.842 5.345 ( 3.586 3.035 4.951) 6.826 5.532 ( 0.986 -1.446 1.019) 2.025 5.789 ( -6.638 -2.385 -1.063) 7.134 6.228 ( 5.436 -1.988 0.010) 5.788 6.442 ( 5.946 7.643 0.023) 9.683 6.674 ( 4.208 0.579 -0.886) 4.339 6.802 ( 2.901 -2.659 0.473) 3.963 6.921 ( 1.244 -1.960 1.029) 2.539 7.074 ( -6.178 0.707 -1.245) 6.342 7.227 ( 5.535 -6.506 0.251) 8.545 7.234 ( -0.869 0.416 0.574) 1.121 7.368 ( 1.086 -1.522 -0.062) 1.871 7.451 ( 0.158 -1.463 -0.020) 1.472 8.661 ( -0.390 1.215 0.959) 1.597 8.720 ( -1.439 0.048 -2.817) 3.163 8.774 ( 1.137 0.696 0.052) 1.334 8.886 ( -2.752 -1.464 1.395) 3.416 10.339 ( 2.225 3.809 0.201) 4.416 10.471 ( -2.377 1.130 0.382) 2.659 10.548 ( 2.011 0.621 0.066) 2.106 10.741 ( -4.321 2.477 -1.256) 5.137 16.057 ( 4.279 -1.561 -0.070) 4.555 16.119 ( 0.758 -1.868 2.430) 3.157 16.526 ( 1.314 -2.705 -7.019) 7.636 16.596 ( -5.089 -3.374 5.396) 8.149 17.301 ( -4.513 -6.185 4.984) 9.136 17.408 ( -4.689 -6.634 -4.322) 9.202 18.010 ( -1.468 -1.570 1.935) 2.892 18.102 ( -2.105 0.794 -3.980) 4.572 19.205 ( 5.757 3.856 0.118) 6.930 19.286 ( 3.619 2.611 1.611) 4.744 19.422 ( 9.241 6.413 2.313) 11.484 19.634 ( 4.621 10.529 -3.592) 12.046 ======================= Grid point 288 (130/138) ======================= q-point: ( 0.55 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( 3.236 7.747 -4.471) 9.512 1.460 ( -6.066 -8.358 -2.817) 10.705 2.062 ( 2.793 -4.318 6.468) 8.263 2.177 ( 3.110 -6.404 -2.111) 7.426 2.253 ( 7.415 -3.482 8.467) 11.782 2.478 ( -1.650 1.366 -1.441) 2.582 2.591 ( 6.380 5.334 -3.101) 8.876 2.826 ( 1.356 2.508 3.589) 4.583 2.860 ( -5.988 -6.405 -7.780) 11.722 3.024 ( -4.944 -1.681 -2.805) 5.927 3.231 ( 9.416 2.015 -0.014) 9.629 3.325 ( 13.146 2.050 -0.993) 13.342 3.696 ( -1.379 4.478 3.010) 5.569 3.831 ( -0.596 0.321 0.646) 0.936 3.890 ( 6.238 -2.058 0.703) 6.606 4.009 ( -1.211 0.897 2.394) 2.829 4.214 ( 3.869 2.361 -0.574) 4.569 4.444 ( -9.855 4.797 -1.531) 11.067 4.478 ( -9.889 3.015 -1.096) 10.396 4.644 ( -8.611 1.822 1.486) 8.926 5.349 ( 8.407 -0.299 -2.604) 8.806 5.371 ( 2.141 -5.489 2.336) 6.339 5.576 ( -1.027 -2.468 -1.313) 2.978 5.734 ( -9.290 -0.025 1.368) 9.391 6.276 ( 5.125 2.648 0.444) 5.786 6.365 ( 1.583 4.537 -0.258) 4.812 6.720 ( 6.494 -0.893 0.429) 6.569 6.864 ( 3.542 -0.448 -0.288) 3.582 6.939 ( -2.116 -0.155 0.979) 2.336 7.035 ( -6.634 -3.249 -1.394) 7.517 7.217 ( 1.937 0.953 0.976) 2.369 7.331 ( -0.319 -2.560 -2.415) 3.534 7.427 ( 2.563 -2.583 1.601) 3.975 7.476 ( 0.402 -1.139 0.248) 1.233 8.639 ( 0.177 1.280 0.553) 1.406 8.693 ( -1.879 0.362 -2.560) 3.196 8.790 ( 1.867 -0.861 0.975) 2.276 8.883 ( -3.044 -0.960 0.781) 3.286 10.294 ( 2.191 3.371 -0.017) 4.020 10.398 ( -3.448 4.029 0.068) 5.303 10.564 ( 2.362 -0.305 0.183) 2.389 10.678 ( -3.726 0.135 -0.440) 3.754 16.117 ( 3.349 -1.412 -0.881) 3.740 16.160 ( -0.515 -1.487 2.726) 3.148 16.573 ( 2.706 -3.340 -7.744) 8.857 16.623 ( -5.049 -2.774 6.388) 8.602 17.413 ( -2.116 -7.789 4.226) 9.110 17.489 ( -3.259 -7.828 -3.963) 9.360 18.055 ( -0.534 -4.386 0.457) 4.442 18.088 ( -1.672 -2.480 -1.572) 3.379 19.130 ( 2.852 9.422 0.401) 9.852 19.190 ( 0.285 10.666 -0.024) 10.670 19.398 ( 6.345 4.995 2.873) 8.571 19.491 ( 3.447 7.985 -2.919) 9.174 ======================= Grid point 289 (131/138) ======================= q-point: ( 0.64 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( 11.141 -1.047 -1.595) 11.304 1.509 ( -12.726 -7.420 -2.711) 14.979 2.159 ( 4.329 -3.225 3.251) 6.302 2.257 ( -2.484 -2.922 -1.891) 4.276 2.361 ( 2.061 2.308 7.185) 7.823 2.408 ( -1.143 2.539 -4.979) 5.705 2.661 ( 9.423 -3.882 -2.020) 10.389 2.775 ( -1.859 4.616 3.764) 6.240 2.893 ( 2.264 -5.167 -4.321) 7.106 3.016 ( -7.990 -3.986 0.172) 8.931 3.250 ( 14.927 6.475 0.108) 16.272 3.407 ( 5.041 0.796 -4.124) 6.561 3.623 ( -2.930 4.317 6.563) 8.385 3.679 ( -5.648 10.228 0.218) 11.686 3.871 ( 2.138 7.322 2.118) 7.917 3.969 ( -6.377 2.692 -3.325) 7.679 4.235 ( 0.399 -0.801 -1.187) 1.487 4.300 ( -8.614 -0.616 0.786) 8.672 4.449 ( 3.881 -3.396 5.933) 7.861 4.587 ( -5.112 -1.183 -5.364) 7.504 5.405 ( 8.067 -0.095 1.673) 8.240 5.534 ( -1.071 -5.356 -5.485) 7.741 5.566 ( 3.259 -0.678 1.890) 3.828 5.692 ( -7.681 -2.957 1.657) 8.396 6.242 ( 3.550 4.693 0.047) 5.885 6.292 ( -1.808 3.960 -0.542) 4.387 6.787 ( 5.668 0.876 0.439) 5.752 6.863 ( -0.819 1.892 -0.530) 2.129 6.941 ( 2.350 -1.217 3.683) 4.535 7.049 ( -5.911 -4.325 -3.501) 8.118 7.239 ( 3.937 0.217 2.103) 4.468 7.325 ( -3.629 -0.194 -2.601) 4.469 7.469 ( 2.322 0.607 0.297) 2.418 7.494 ( -0.690 -0.261 0.820) 1.103 8.630 ( 1.043 0.423 0.637) 1.293 8.663 ( -1.923 0.206 -1.800) 2.642 8.839 ( 1.863 -2.312 1.390) 3.279 8.882 ( -2.374 -1.680 -0.386) 2.934 10.268 ( 1.855 1.455 -0.138) 2.362 10.307 ( -2.774 2.460 0.097) 3.709 10.600 ( 2.963 -0.870 0.797) 3.189 10.659 ( -3.270 -1.150 -0.759) 3.549 16.147 ( 2.049 0.433 -0.846) 2.258 16.170 ( -1.427 0.338 1.480) 2.084 16.636 ( 3.461 -3.545 -7.716) 9.169 16.654 ( -4.044 -2.925 7.306) 8.848 17.548 ( 0.230 -7.264 2.926) 7.834 17.589 ( -2.229 -7.391 -2.973) 8.273 18.160 ( 0.020 -7.345 -1.113) 7.429 18.162 ( -0.807 -8.208 0.818) 8.288 18.937 ( 1.130 14.198 0.152) 14.244 18.958 ( -0.976 14.668 -0.135) 14.701 19.364 ( 2.318 4.636 3.920) 6.499 19.393 ( 1.970 5.383 -3.822) 6.890 ======================= Grid point 290 (132/138) ======================= q-point: (-0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 127 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( -15.187 -6.810 -1.312) 16.695 1.499 ( 15.187 -6.810 1.312) 16.695 2.179 ( 3.796 7.181 -7.763) 11.236 2.179 ( -3.796 7.181 7.763) 11.236 2.401 ( -3.816 -3.872 -0.085) 5.437 2.401 ( 3.816 -3.872 0.085) 5.437 2.717 ( 0.604 0.855 -8.886) 8.948 2.717 ( -0.604 0.855 8.886) 8.948 3.014 ( 4.404 -1.308 -3.857) 5.999 3.014 ( -4.404 -1.308 3.857) 5.999 3.272 ( -6.015 5.969 -5.774) 10.254 3.272 ( 6.015 5.969 5.774) 10.254 3.526 ( 4.215 5.029 -6.102) 8.961 3.526 ( -4.215 5.029 6.102) 8.961 3.773 ( -5.433 8.557 -7.318) 12.502 3.773 ( 5.433 8.557 7.318) 12.502 4.327 ( 1.642 -6.963 -4.776) 8.602 4.327 ( -1.642 -6.963 4.776) 8.602 4.563 ( -1.542 -2.533 -6.000) 6.693 4.563 ( 1.542 -2.533 6.000) 6.693 5.490 ( -2.308 -0.548 -4.154) 4.784 5.490 ( 2.308 -0.548 4.154) 4.784 5.692 ( 3.745 -3.606 -8.249) 9.751 5.692 ( -3.745 -3.606 8.249) 9.751 6.205 ( -3.639 2.457 -1.108) 4.529 6.205 ( 3.639 2.457 1.108) 4.529 6.796 ( -4.395 2.568 -0.902) 5.169 6.796 ( 4.395 2.568 0.902) 5.169 7.019 ( -6.973 0.746 -5.053) 8.644 7.019 ( 6.973 0.746 5.053) 8.644 7.284 ( -3.402 -0.493 -2.535) 4.271 7.284 ( 3.402 -0.493 2.535) 4.271 7.463 ( -1.302 2.115 -1.153) 2.738 7.463 ( 1.302 2.115 1.153) 2.738 8.648 ( -1.049 -0.773 -1.226) 1.789 8.648 ( 1.049 -0.773 1.226) 1.789 8.901 ( -1.119 -2.532 -1.693) 3.245 8.901 ( 1.119 -2.532 1.693) 3.245 10.280 ( -1.554 -1.304 0.066) 2.030 10.280 ( 1.554 -1.304 -0.066) 2.030 10.647 ( -1.978 -0.979 -2.458) 3.304 10.647 ( 1.978 -0.979 2.458) 3.304 16.133 ( 0.626 2.681 -1.607) 3.188 16.133 ( -0.626 2.681 1.607) 3.188 16.701 ( 3.108 -3.204 -7.743) 8.937 16.701 ( -3.108 -3.204 7.743) 8.937 17.683 ( 1.092 -6.305 -5.528) 8.456 17.683 ( -1.092 -6.305 5.528) 8.456 18.325 ( 0.264 -10.926 -2.425) 11.195 18.325 ( -0.264 -10.926 2.425) 11.195 18.684 ( 0.297 15.356 -1.923) 15.478 18.684 ( -0.297 15.356 1.923) 15.478 19.301 ( 0.660 4.982 -4.857) 6.989 19.301 ( -0.660 4.982 4.857) 6.989 ======================= Grid point 298 (133/138) ======================= q-point: ( 0.36 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.309 ( 13.824 0.000 18.383) 23.001 1.457 ( 5.391 0.000 9.356) 10.798 1.816 ( 1.239 0.000 -15.882) 15.931 1.942 ( 11.131 0.000 -6.835) 13.062 2.330 ( -3.515 -0.000 -0.008) 3.515 2.489 ( 0.034 0.000 1.363) 1.364 2.599 ( -4.255 -0.000 -3.643) 5.601 2.711 ( 4.178 0.000 3.069) 5.184 2.850 ( 0.874 0.000 2.633) 2.774 2.990 ( -8.886 -0.000 -4.743) 10.073 3.267 ( 7.703 0.000 -1.384) 7.826 3.381 ( 20.265 0.000 -6.652) 21.329 3.511 ( 17.575 0.000 -3.157) 17.856 3.600 ( 12.860 0.000 1.596) 12.958 3.826 ( -14.029 -0.000 5.895) 15.218 4.133 ( 11.990 0.000 9.828) 15.503 4.418 ( -12.615 -0.000 -2.606) 12.881 4.448 ( 0.808 0.000 1.595) 1.788 4.762 ( -9.720 -0.000 -3.066) 10.192 4.904 ( -7.191 -0.000 -1.668) 7.382 5.168 ( -11.045 -0.000 -0.162) 11.046 5.371 ( -14.277 -0.000 -3.828) 14.781 5.621 ( 3.622 0.000 10.457) 11.067 5.686 ( -0.098 -0.000 -2.900) 2.902 6.160 ( 5.309 0.000 -3.837) 6.550 6.589 ( 7.483 0.000 6.684) 10.034 6.720 ( -3.189 -0.000 -4.712) 5.690 6.821 ( 4.372 0.000 -1.893) 4.764 6.845 ( 3.731 0.000 3.432) 5.070 6.964 ( 7.779 0.000 0.068) 7.779 7.166 ( -3.733 -0.000 -2.516) 4.502 7.237 ( 1.015 0.000 2.191) 2.415 7.356 ( 0.502 0.000 -0.490) 0.701 7.391 ( -1.273 -0.000 -0.329) 1.315 8.692 ( -0.565 -0.000 2.778) 2.835 8.718 ( 0.316 0.000 -3.279) 3.294 8.806 ( -0.087 -0.000 -0.852) 0.857 8.835 ( -1.782 -0.000 0.886) 1.990 10.414 ( 1.171 0.000 -0.872) 1.460 10.462 ( -1.650 -0.000 1.342) 2.127 10.607 ( 2.091 0.000 3.638) 4.196 10.784 ( -2.268 -0.000 -5.427) 5.882 16.030 ( 2.911 0.000 1.160) 3.134 16.084 ( 1.293 0.000 0.500) 1.386 16.477 ( 1.389 0.000 -6.488) 6.635 16.511 ( -3.501 -0.000 5.708) 6.696 17.195 ( -6.017 -0.000 7.006) 9.236 17.278 ( -4.528 -0.000 -6.265) 7.729 17.992 ( -1.824 -0.000 3.825) 4.238 18.136 ( -2.119 -0.000 -6.410) 6.751 19.261 ( 8.342 0.000 -0.566) 8.361 19.315 ( 5.928 0.000 3.087) 6.684 19.550 ( 9.044 0.000 3.764) 9.796 19.851 ( 4.491 0.000 -5.715) 7.269 ======================= Grid point 299 (134/138) ======================= q-point: ( 0.45 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.378 ( 6.756 5.148 13.526) 15.972 1.612 ( 0.501 2.289 3.059) 3.853 1.769 ( 9.935 -4.702 -0.376) 10.998 2.050 ( 4.966 -4.807 -10.020) 12.173 2.250 ( -1.512 3.994 0.927) 4.370 2.527 ( -8.412 -2.065 -7.473) 11.439 2.582 ( 1.525 -4.419 2.659) 5.378 2.718 ( -0.927 0.647 -0.946) 1.474 2.850 ( 1.564 0.779 0.874) 1.954 2.949 ( -3.678 -2.829 -0.535) 4.671 3.288 ( 10.032 4.109 -0.566) 10.856 3.532 ( 16.591 3.304 -5.461) 17.776 3.628 ( 1.294 -0.220 1.960) 2.359 3.716 ( 12.964 -4.891 0.095) 13.856 3.791 ( -2.442 -2.839 2.954) 4.769 4.189 ( -4.645 2.067 3.516) 6.181 4.304 ( 2.273 4.461 -0.512) 5.033 4.484 ( 2.951 -0.182 3.001) 4.212 4.655 ( -7.395 3.252 -1.984) 8.318 4.792 ( -11.098 4.324 -1.240) 11.975 5.118 ( -6.998 -4.774 -0.448) 8.483 5.281 ( -9.853 -5.100 -2.778) 11.437 5.623 ( 2.488 4.495 7.128) 8.787 5.706 ( -1.003 -1.790 -2.353) 3.121 6.236 ( 7.994 -2.547 -0.676) 8.417 6.579 ( -4.933 4.052 -1.902) 6.661 6.716 ( 5.757 -0.414 2.479) 6.282 6.801 ( 3.634 2.179 -1.644) 4.544 6.900 ( 1.025 -1.343 3.658) 4.029 7.030 ( -4.490 -0.955 -3.830) 5.978 7.179 ( 5.671 -3.636 0.680) 6.771 7.250 ( 0.653 0.484 1.370) 1.593 7.356 ( 0.582 -0.562 -0.214) 0.836 7.408 ( -1.171 -2.513 -0.675) 2.854 8.684 ( -0.155 1.158 1.852) 2.190 8.710 ( -0.151 0.399 -2.335) 2.373 8.794 ( 0.799 0.608 -0.288) 1.045 8.842 ( -1.920 -1.463 0.565) 2.479 10.407 ( 1.524 1.656 -0.252) 2.265 10.458 ( -1.804 -0.327 0.605) 1.931 10.605 ( 2.571 2.741 2.289) 4.400 10.737 ( -3.130 1.593 -3.571) 5.009 16.065 ( 2.891 -1.080 -0.395) 3.111 16.102 ( -0.067 -1.158 1.762) 2.110 16.484 ( 2.412 -1.440 -6.873) 7.425 16.522 ( -4.080 -2.308 5.960) 7.582 17.201 ( -3.707 -3.260 6.267) 7.978 17.263 ( -2.991 -4.048 -5.669) 7.581 17.995 ( -0.923 -0.228 4.031) 4.142 18.087 ( -1.998 1.001 -5.902) 6.310 19.307 ( 5.976 1.895 -0.145) 6.272 19.353 ( 3.124 1.268 1.769) 3.807 19.602 ( 7.812 4.198 5.374) 10.370 19.800 ( 1.905 6.431 -6.317) 9.214 ======================= Grid point 300 (135/138) ======================= q-point: ( 0.55 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.382 ( 1.013 2.407 9.136) 9.502 1.456 ( -0.029 8.087 -9.890) 12.775 2.019 ( 4.309 -7.269 11.823) 14.533 2.102 ( 0.851 -2.781 -9.738) 10.163 2.264 ( 6.414 -3.346 7.110) 10.143 2.460 ( -6.734 -1.608 -8.528) 10.984 2.646 ( -0.979 -1.195 2.263) 2.740 2.698 ( -1.793 -1.451 -5.626) 6.080 2.885 ( 3.060 -0.155 5.570) 6.357 2.964 ( -3.067 -1.299 -2.666) 4.267 3.329 ( 11.495 1.177 0.038) 11.555 3.480 ( -0.393 4.655 0.124) 4.673 3.703 ( 6.506 -0.698 -2.213) 6.908 3.818 ( -1.276 -0.071 1.779) 2.190 3.895 ( 7.750 -4.392 0.917) 8.956 4.074 ( -10.725 1.920 0.704) 10.918 4.275 ( 9.240 5.209 -0.503) 10.619 4.462 ( -7.754 6.641 -2.379) 10.483 4.508 ( 0.775 4.151 0.462) 4.248 4.615 ( -10.095 3.560 1.775) 10.850 5.237 ( 3.930 -9.534 -0.519) 10.325 5.340 ( -5.604 -8.114 -0.201) 9.864 5.588 ( 4.036 3.900 2.877) 6.307 5.680 ( -4.987 1.451 -1.688) 5.461 6.342 ( 6.834 -0.663 1.480) 7.024 6.453 ( -3.603 4.577 -1.923) 6.134 6.765 ( 5.627 -0.056 1.071) 5.728 6.833 ( 0.004 -3.447 -1.305) 3.686 6.919 ( -0.583 0.533 2.058) 2.204 6.971 ( -4.522 0.707 -1.641) 4.862 7.251 ( 1.612 0.225 1.450) 2.179 7.277 ( 0.558 -2.733 -1.618) 3.225 7.401 ( 2.107 -2.893 1.530) 3.892 7.440 ( -1.102 -2.502 -1.096) 2.945 8.667 ( 0.222 1.324 1.366) 1.915 8.686 ( -0.815 0.948 -1.937) 2.306 8.803 ( 2.158 -0.125 0.041) 2.162 8.844 ( -2.661 -0.870 0.433) 2.833 10.382 ( 2.619 3.314 0.043) 4.224 10.428 ( -2.723 2.212 0.160) 3.512 10.595 ( 3.089 1.430 0.658) 3.467 10.661 ( -3.918 1.979 -1.182) 4.545 16.112 ( 2.820 -1.747 -1.827) 3.787 16.132 ( -1.242 -1.870 2.848) 3.626 16.523 ( 3.429 -2.663 -7.249) 8.450 16.550 ( -4.607 -2.897 6.445) 8.436 17.285 ( -1.254 -6.584 5.303) 8.547 17.323 ( -1.798 -6.815 -5.005) 8.644 18.012 ( -0.004 -1.097 2.857) 3.060 18.046 ( -1.450 -0.149 -3.699) 3.976 19.288 ( 3.488 5.292 0.402) 6.351 19.321 ( -0.131 4.845 0.304) 4.856 19.571 ( 5.278 7.260 4.311) 9.957 19.647 ( -0.137 9.021 -4.708) 10.176 ======================= Grid point 301 (136/138) ======================= q-point: ( 0.64 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 127 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( 2.626 0.730 -5.415) 6.062 1.362 ( -2.626 0.730 5.415) 6.062 2.141 ( 0.539 -4.034 -8.803) 9.698 2.141 ( -0.539 -4.034 8.803) 9.698 2.420 ( -3.399 -1.036 -7.326) 8.142 2.420 ( 3.399 -1.036 7.326) 8.142 2.690 ( -7.795 -2.972 -2.492) 8.707 2.690 ( 7.795 -2.972 2.492) 8.707 2.917 ( -4.334 0.864 -5.459) 7.023 2.917 ( 4.334 0.864 5.459) 7.023 3.410 ( -2.333 0.822 -6.007) 6.496 3.410 ( 2.333 0.822 6.007) 6.496 3.734 ( -8.636 3.851 -0.958) 9.505 3.734 ( 8.636 3.851 0.958) 9.505 3.980 ( -2.237 2.076 -1.967) 3.631 3.980 ( 2.237 2.076 1.967) 3.631 4.269 ( -5.940 3.526 -0.275) 6.913 4.269 ( 5.940 3.526 0.275) 6.913 4.502 ( -7.064 1.080 -3.446) 7.933 4.502 ( 7.064 1.080 3.446) 7.933 5.431 ( 2.799 -5.967 -7.387) 9.900 5.431 ( -2.799 -5.967 7.387) 9.900 5.588 ( -6.215 0.816 0.737) 6.311 5.588 ( 6.215 0.816 -0.737) 6.311 6.351 ( -2.004 4.201 -1.106) 4.784 6.351 ( 2.004 4.201 1.106) 4.784 6.847 ( -6.602 -1.098 -1.351) 6.828 6.847 ( 6.602 -1.098 1.351) 6.828 6.933 ( -4.514 -1.660 0.036) 4.810 6.933 ( 4.514 -1.660 -0.036) 4.810 7.282 ( -2.995 -0.418 -2.633) 4.010 7.282 ( 2.995 -0.418 2.633) 4.010 7.468 ( -0.798 -2.070 -1.225) 2.534 7.468 ( 0.798 -2.070 1.225) 2.534 8.655 ( -1.049 0.955 -1.421) 2.008 8.655 ( 1.049 0.955 1.421) 2.008 8.834 ( -2.776 -0.942 -0.244) 2.942 8.834 ( 2.776 -0.942 0.244) 2.942 10.341 ( -1.576 4.019 -1.093) 4.453 10.341 ( 1.576 4.019 1.093) 4.453 10.615 ( -2.642 -0.325 -0.821) 2.785 10.615 ( 2.642 -0.325 0.821) 2.785 16.154 ( 1.967 -1.170 -2.614) 3.474 16.154 ( -1.967 -1.170 2.614) 3.474 16.586 ( 4.226 -3.253 -7.338) 9.071 16.586 ( -4.226 -3.253 7.338) 9.071 17.428 ( 0.366 -8.007 -5.952) 9.983 17.428 ( -0.366 -8.007 5.952) 9.983 18.059 ( 0.934 -3.649 -3.497) 5.140 18.059 ( -0.934 -3.649 3.497) 5.140 19.174 ( -1.600 10.861 -0.753) 11.004 19.174 ( 1.600 10.861 0.753) 11.004 19.488 ( -1.311 6.681 -3.611) 7.706 19.488 ( 1.311 6.681 3.611) 7.706 ======================= Grid point 311 (137/138) ======================= q-point: ( 0.45 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( 1.562 0.000 12.222) 12.321 1.630 ( 4.103 0.000 8.565) 9.497 1.794 ( 8.864 0.000 1.756) 9.036 1.995 ( 1.705 0.000 -16.300) 16.389 2.283 ( -0.851 -0.000 0.354) 0.921 2.376 ( -9.749 -0.000 -6.982) 11.992 2.589 ( 5.156 0.000 2.634) 5.790 2.695 ( -4.241 -0.000 -1.873) 4.636 2.878 ( 1.672 0.000 -2.821) 3.279 2.886 ( -2.951 -0.000 3.702) 4.734 3.413 ( 10.997 0.000 -3.310) 11.484 3.600 ( -13.287 -0.000 5.927) 14.549 3.689 ( 17.034 0.000 -3.786) 17.450 3.775 ( 3.998 0.000 2.102) 4.517 3.788 ( 13.047 0.000 -1.227) 13.104 4.073 ( -18.258 -0.000 0.150) 18.259 4.478 ( 14.433 0.000 5.207) 15.343 4.530 ( 5.996 0.000 2.765) 6.603 4.633 ( -4.171 -0.000 -2.353) 4.789 4.740 ( -11.205 -0.000 -3.303) 11.682 5.011 ( -4.327 -0.000 1.024) 4.447 5.104 ( -12.115 -0.000 -3.437) 12.593 5.689 ( 2.006 0.000 -3.248) 3.818 5.692 ( -1.019 -0.000 6.062) 6.147 6.295 ( 10.953 0.000 0.813) 10.983 6.510 ( -11.505 -0.000 -3.130) 11.923 6.780 ( 6.884 0.000 3.896) 7.910 6.883 ( -2.460 -0.000 2.209) 3.307 6.902 ( 4.728 0.000 -2.364) 5.286 6.961 ( -3.574 -0.000 -2.330) 4.266 7.199 ( 5.599 0.000 0.034) 5.600 7.259 ( -1.012 -0.000 1.243) 1.603 7.357 ( 0.024 0.000 -0.634) 0.634 7.362 ( -1.283 -0.000 -0.246) 1.307 8.702 ( -0.410 -0.000 2.714) 2.745 8.709 ( 0.667 0.000 -2.708) 2.789 8.804 ( 0.436 0.000 -0.590) 0.734 8.814 ( -1.110 -0.000 0.520) 1.225 10.428 ( 1.161 0.000 -0.976) 1.517 10.443 ( -1.426 -0.000 1.090) 1.795 10.663 ( 1.515 0.000 4.563) 4.808 10.719 ( -1.494 -0.000 -5.279) 5.486 16.072 ( 2.021 0.000 -0.753) 2.157 16.092 ( -0.913 -0.000 1.299) 1.587 16.474 ( 3.164 0.000 -7.095) 7.768 16.490 ( -3.630 -0.000 6.739) 7.654 17.166 ( -2.685 -0.000 7.046) 7.540 17.192 ( -0.757 -0.000 -6.698) 6.740 18.006 ( 0.053 0.000 5.519) 5.519 18.060 ( -1.636 -0.000 -6.607) 6.807 19.366 ( 4.052 0.000 -0.419) 4.074 19.388 ( 0.993 0.000 1.225) 1.577 19.723 ( 6.154 0.000 7.696) 9.854 19.837 ( -1.033 -0.000 -8.004) 8.070 ======================= Grid point 312 (138/138) ======================= q-point: ( 0.55 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 127 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( -2.458 7.574 -13.112) 15.341 1.544 ( 2.458 7.574 13.112) 15.341 1.983 ( -4.037 -5.845 -16.364) 17.839 1.983 ( 4.037 -5.845 16.364) 17.839 2.307 ( -7.449 -1.379 -5.320) 9.257 2.307 ( 7.449 -1.379 5.320) 9.257 2.655 ( -3.268 -0.807 -3.350) 4.749 2.655 ( 3.268 -0.807 3.350) 4.749 2.899 ( -0.696 -1.917 -2.954) 3.590 2.899 ( 0.696 -1.917 2.954) 3.590 3.471 ( -12.369 3.034 3.099) 13.107 3.471 ( 12.369 3.034 -3.099) 13.107 3.788 ( 6.847 -0.304 -3.387) 7.645 3.788 ( -6.847 -0.304 3.387) 7.645 3.930 ( -15.078 -1.858 -0.466) 15.199 3.930 ( 15.078 -1.858 0.466) 15.199 4.510 ( -9.939 7.393 -2.519) 12.640 4.510 ( 9.939 7.393 2.519) 12.640 4.597 ( -3.779 2.405 -2.649) 5.204 4.597 ( 3.779 2.405 2.649) 5.204 5.111 ( -4.249 -9.027 -3.583) 10.601 5.111 ( 4.249 -9.027 3.583) 10.601 5.680 ( -0.283 1.775 -4.026) 4.409 5.680 ( 0.283 1.775 4.026) 4.409 6.408 ( -10.223 -0.650 -2.668) 10.585 6.408 ( 10.223 -0.650 2.668) 10.585 6.818 ( -1.706 1.946 -2.775) 3.794 6.818 ( 1.706 1.946 2.775) 3.794 6.939 ( -1.601 -0.334 -4.690) 4.967 6.939 ( 1.601 -0.334 4.690) 4.967 7.250 ( 1.091 -0.955 -0.795) 1.654 7.250 ( -1.091 -0.955 0.795) 1.654 7.377 ( -1.520 -2.218 -0.987) 2.864 7.377 ( 1.520 -2.218 0.987) 2.864 8.695 ( 0.207 1.088 -2.347) 2.595 8.695 ( -0.207 1.088 2.347) 2.595 8.814 ( -1.179 -0.548 -0.026) 1.301 8.814 ( 1.179 -0.548 0.026) 1.301 10.432 ( 0.159 0.566 -0.972) 1.136 10.432 ( -0.159 0.566 0.972) 1.136 10.667 ( -1.869 2.421 -3.917) 4.970 10.667 ( 1.869 2.421 3.917) 4.970 16.097 ( 1.585 -1.331 -1.990) 2.871 16.097 ( -1.585 -1.331 1.990) 2.871 16.495 ( 3.762 -1.590 -7.036) 8.136 16.495 ( -3.762 -1.590 7.036) 8.136 17.205 ( 0.832 -3.766 -6.769) 7.791 17.205 ( -0.832 -3.766 6.769) 7.791 18.025 ( -0.630 0.339 -5.743) 5.788 18.025 ( 0.630 0.339 5.743) 5.788 19.372 ( -0.456 1.986 -0.028) 2.038 19.372 ( 0.456 1.986 0.028) 2.038 19.743 ( -3.455 5.351 -7.233) 9.638 19.743 ( 3.455 5.351 7.233) 9.638 =================== 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 3/26136 10.0 339.128 379.003 357.740 0.000 43.687 0.000 3/26136 20.0 96.274 83.259 97.829 0.000 16.223 0.000 3/26136 30.0 48.623 41.384 52.248 0.000 7.908 0.000 3/26136 40.0 32.201 27.002 35.383 0.000 5.002 0.000 3/26136 50.0 23.949 19.817 26.330 0.000 3.542 0.000 3/26136 60.0 18.932 15.504 20.634 0.000 2.681 0.000 3/26136 70.0 15.556 12.642 16.762 0.000 2.130 0.000 3/26136 80.0 13.146 10.621 14.002 0.000 1.755 0.000 3/26136 90.0 11.352 9.131 11.966 0.000 1.488 0.000 3/26136 100.0 9.974 7.993 10.418 0.000 1.290 0.000 3/26136 110.0 8.887 7.101 9.210 0.000 1.137 0.000 3/26136 120.0 8.011 6.385 8.247 0.000 1.017 0.000 3/26136 130.0 7.290 5.799 7.462 0.000 0.919 0.000 3/26136 140.0 6.688 5.312 6.812 0.000 0.837 0.000 3/26136 150.0 6.178 4.900 6.265 0.000 0.769 0.000 3/26136 160.0 5.740 4.548 5.800 0.000 0.711 0.000 3/26136 170.0 5.361 4.244 5.399 0.000 0.661 0.000 3/26136 180.0 5.029 3.978 5.050 0.000 0.617 0.000 3/26136 190.0 4.737 3.745 4.744 0.000 0.578 0.000 3/26136 200.0 4.477 3.538 4.473 0.000 0.544 0.000 3/26136 210.0 4.244 3.353 4.232 0.000 0.514 0.000 3/26136 220.0 4.035 3.187 4.016 0.000 0.487 0.000 3/26136 230.0 3.846 3.037 3.821 0.000 0.462 0.000 3/26136 240.0 3.674 2.901 3.644 0.000 0.440 0.000 3/26136 250.0 3.517 2.777 3.484 0.000 0.420 0.000 3/26136 260.0 3.373 2.663 3.337 0.000 0.401 0.000 3/26136 270.0 3.241 2.559 3.202 0.000 0.385 0.000 3/26136 280.0 3.119 2.463 3.078 0.000 0.369 0.000 3/26136 290.0 3.006 2.374 2.963 0.000 0.355 0.000 3/26136 300.0 2.901 2.291 2.857 0.000 0.342 0.000 3/26136 310.0 2.804 2.214 2.759 0.000 0.329 0.000 3/26136 320.0 2.713 2.143 2.667 0.000 0.318 0.000 3/26136 330.0 2.627 2.076 2.581 0.000 0.307 0.000 3/26136 340.0 2.548 2.013 2.500 0.000 0.297 0.000 3/26136 350.0 2.472 1.954 2.425 0.000 0.288 0.000 3/26136 360.0 2.402 1.898 2.354 0.000 0.279 0.000 3/26136 370.0 2.335 1.846 2.287 0.000 0.271 0.000 3/26136 380.0 2.272 1.796 2.224 0.000 0.263 0.000 3/26136 390.0 2.213 1.750 2.165 0.000 0.256 0.000 3/26136 400.0 2.156 1.705 2.108 0.000 0.249 0.000 3/26136 410.0 2.102 1.663 2.055 0.000 0.242 0.000 3/26136 420.0 2.052 1.623 2.004 0.000 0.236 0.000 3/26136 430.0 2.003 1.585 1.956 0.000 0.230 0.000 3/26136 440.0 1.957 1.549 1.910 0.000 0.225 0.000 3/26136 450.0 1.913 1.514 1.866 0.000 0.219 0.000 3/26136 460.0 1.871 1.481 1.824 0.000 0.214 0.000 3/26136 470.0 1.830 1.449 1.784 0.000 0.209 0.000 3/26136 480.0 1.792 1.419 1.746 0.000 0.205 0.000 3/26136 490.0 1.755 1.390 1.709 0.000 0.200 0.000 3/26136 500.0 1.720 1.362 1.674 0.000 0.196 0.000 3/26136 510.0 1.686 1.336 1.641 0.000 0.192 0.000 3/26136 520.0 1.653 1.310 1.609 0.000 0.188 0.000 3/26136 530.0 1.622 1.285 1.578 0.000 0.184 0.000 3/26136 540.0 1.592 1.262 1.548 0.000 0.181 0.000 3/26136 550.0 1.563 1.239 1.519 0.000 0.177 0.000 3/26136 560.0 1.535 1.217 1.491 0.000 0.174 0.000 3/26136 570.0 1.508 1.196 1.465 0.000 0.171 0.000 3/26136 580.0 1.482 1.175 1.439 0.000 0.168 0.000 3/26136 590.0 1.456 1.155 1.414 0.000 0.165 0.000 3/26136 600.0 1.432 1.136 1.390 0.000 0.162 0.000 3/26136 610.0 1.409 1.118 1.367 0.000 0.159 0.000 3/26136 620.0 1.386 1.100 1.345 0.000 0.156 0.000 3/26136 630.0 1.364 1.083 1.323 0.000 0.154 0.000 3/26136 640.0 1.343 1.066 1.302 0.000 0.151 0.000 3/26136 650.0 1.322 1.050 1.282 0.000 0.149 0.000 3/26136 660.0 1.302 1.034 1.263 0.000 0.147 0.000 3/26136 670.0 1.283 1.019 1.244 0.000 0.144 0.000 3/26136 680.0 1.264 1.004 1.225 0.000 0.142 0.000 3/26136 690.0 1.246 0.989 1.207 0.000 0.140 0.000 3/26136 700.0 1.228 0.975 1.190 0.000 0.138 0.000 3/26136 710.0 1.211 0.962 1.173 0.000 0.136 0.000 3/26136 720.0 1.194 0.949 1.156 0.000 0.134 0.000 3/26136 730.0 1.178 0.936 1.141 0.000 0.132 0.000 3/26136 740.0 1.162 0.923 1.125 0.000 0.130 0.000 3/26136 750.0 1.146 0.911 1.110 0.000 0.128 0.000 3/26136 760.0 1.131 0.899 1.095 0.000 0.127 0.000 3/26136 770.0 1.117 0.888 1.081 0.000 0.125 0.000 3/26136 780.0 1.103 0.877 1.067 0.000 0.123 0.000 3/26136 790.0 1.089 0.866 1.053 0.000 0.122 0.000 3/26136 800.0 1.075 0.855 1.040 0.000 0.120 0.000 3/26136 810.0 1.062 0.845 1.027 0.000 0.119 0.000 3/26136 820.0 1.049 0.834 1.015 0.000 0.117 0.000 3/26136 830.0 1.037 0.825 1.002 0.000 0.116 0.000 3/26136 840.0 1.024 0.815 0.990 0.000 0.114 0.000 3/26136 850.0 1.012 0.805 0.979 0.000 0.113 0.000 3/26136 860.0 1.001 0.796 0.967 0.000 0.112 0.000 3/26136 870.0 0.989 0.787 0.956 0.000 0.110 0.000 3/26136 880.0 0.978 0.778 0.945 0.000 0.109 0.000 3/26136 890.0 0.967 0.770 0.935 0.000 0.108 0.000 3/26136 900.0 0.957 0.761 0.924 0.000 0.106 0.000 3/26136 910.0 0.946 0.753 0.914 0.000 0.105 0.000 3/26136 920.0 0.936 0.745 0.904 0.000 0.104 0.000 3/26136 930.0 0.926 0.737 0.894 0.000 0.103 0.000 3/26136 940.0 0.916 0.729 0.885 0.000 0.102 0.000 3/26136 950.0 0.907 0.722 0.876 0.000 0.101 0.000 3/26136 960.0 0.897 0.715 0.866 0.000 0.100 0.000 3/26136 970.0 0.888 0.707 0.857 0.000 0.099 0.000 3/26136 980.0 0.879 0.700 0.849 0.000 0.098 0.000 3/26136 990.0 0.870 0.693 0.840 0.000 0.097 0.000 3/26136 1000.0 0.862 0.686 0.832 0.000 0.096 0.000 3/26136 Thermal conductivity related properties were written into "kappa-m11114.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:37:20]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|