----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 20:33:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] 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: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.127063525278436 -4.319345550000000 0.000000000000000 b 4.127063525278436 4.319345550000000 0.000000000000000 c -0.628663890873173 0.000000000000000 6.346486267863829 Atomic positions (fractional): *1 Ba 0.19321766903497 0.80678233096503 0.25000000000000 137.327 2 Ba 0.80678233096503 0.19321766903497 0.75000000000000 137.327 *3 H 0.33398520715938 0.97468926262234 0.76886271383459 1.008 4 H 0.02531073737766 0.66601479284062 0.73113728616541 1.008 5 H 0.66601479284062 0.02531073737766 0.23113728616541 1.008 6 H 0.97468926262234 0.33398520715938 0.26886271383459 1.008 *7 H 0.25905524616700 0.34485576067795 0.56529031260333 1.008 8 H 0.65514423932205 0.74094475383300 0.93470968739667 1.008 9 H 0.74094475383300 0.65514423932205 0.43470968739666 1.008 10 H 0.34485576067795 0.25905524616700 0.06529031260333 1.008 *11 O 0.22271063551362 0.03707373541839 0.64437570602966 15.999 12 O 0.96292626458161 0.77728936448638 0.85562429397034 15.999 13 O 0.77728936448638 0.96292626458161 0.35562429397034 15.999 14 O 0.03707373541839 0.22271063551362 0.14437570602966 15.999 *15 O 0.36628339193817 0.20953414114297 0.56071111407332 15.999 16 O 0.79046585885703 0.63371660806183 0.93928888592668 15.999 17 O 0.63371660806183 0.79046585885703 0.43928888592668 15.999 18 O 0.20953414114297 0.36628339193817 0.06071111407332 15.999 *19 O 0.52520087306990 0.09870748393493 0.07532970946080 15.999 20 O 0.90129251606506 0.47479912693010 0.42467029053920 15.999 21 O 0.47479912693010 0.90129251606506 0.92467029053920 15.999 22 O 0.09870748393494 0.52520087306990 0.57532970946080 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 8.254127050556871 0.000000000000000 0.000000000000000 b 0.000000000000000 8.638691099999999 0.000000000000000 c -0.628663890873173 0.000000000000000 6.346486267863829 Atomic positions (fractional): *1 Ba 0.50000000000000 0.30678233096503 0.25000000000000 137.327 > 1 2 Ba 0.50000000000000 0.69321766903497 0.75000000000000 137.327 > 2 3 Ba 0.00000000000000 0.80678233096503 0.25000000000000 137.327 > 1 4 Ba 0.00000000000000 0.19321766903497 0.75000000000000 137.327 > 2 *5 H 0.65433723489086 0.32035202773148 0.76886271383459 1.008 > 3 6 H 0.34566276510914 0.32035202773148 0.73113728616541 1.008 > 4 7 H 0.34566276510914 0.67964797226852 0.23113728616541 1.008 > 5 8 H 0.65433723489086 0.67964797226852 0.26886271383459 1.008 > 6 *9 H 0.30195550342247 0.04290025725547 0.56529031260333 1.008 > 7 10 H 0.69804449657753 0.04290025725547 0.93470968739667 1.008 > 8 11 H 0.69804449657753 0.95709974274453 0.43470968739666 1.008 > 9 12 H 0.30195550342247 0.95709974274453 0.06529031260333 1.008 > 10 13 H 0.15433723489086 0.82035202773148 0.76886271383459 1.008 > 3 14 H 0.84566276510914 0.82035202773148 0.73113728616541 1.008 > 4 15 H 0.84566276510914 0.17964797226852 0.23113728616541 1.008 > 5 16 H 0.15433723489086 0.17964797226852 0.26886271383459 1.008 > 6 17 H 0.80195550342247 0.54290025725547 0.56529031260333 1.008 > 7 18 H 0.19804449657753 0.54290025725547 0.93470968739667 1.008 > 8 19 H 0.19804449657753 0.45709974274453 0.43470968739666 1.008 > 9 20 H 0.80195550342247 0.45709974274453 0.06529031260333 1.008 > 10 *21 O 0.12989218546601 0.90718154995238 0.64437570602966 15.999 > 11 22 O 0.87010781453399 0.90718154995238 0.85562429397034 15.999 > 12 23 O 0.87010781453399 0.09281845004762 0.35562429397034 15.999 > 13 24 O 0.12989218546601 0.09281845004762 0.14437570602966 15.999 > 14 *25 O 0.28790876654057 0.92162537460240 0.56071111407332 15.999 > 15 26 O 0.71209123345943 0.92162537460240 0.93928888592668 15.999 > 16 27 O 0.71209123345943 0.07837462539760 0.43928888592668 15.999 > 17 28 O 0.28790876654057 0.07837462539760 0.06071111407332 15.999 > 18 *29 O 0.31195417850242 0.78675330543252 0.07532970946080 15.999 > 19 30 O 0.68804582149758 0.78675330543252 0.42467029053920 15.999 > 20 31 O 0.68804582149758 0.21324669456748 0.92467029053920 15.999 > 21 32 O 0.31195417850242 0.21324669456748 0.57532970946080 15.999 > 22 33 O 0.62989218546601 0.40718154995238 0.64437570602966 15.999 > 11 34 O 0.37010781453399 0.40718154995238 0.85562429397034 15.999 > 12 35 O 0.37010781453399 0.59281845004762 0.35562429397034 15.999 > 13 36 O 0.62989218546601 0.59281845004762 0.14437570602966 15.999 > 14 37 O 0.78790876654057 0.42162537460240 0.56071111407332 15.999 > 15 38 O 0.21209123345943 0.42162537460240 0.93928888592668 15.999 > 16 39 O 0.21209123345943 0.57837462539760 0.43928888592668 15.999 > 17 40 O 0.78790876654057 0.57837462539760 0.06071111407332 15.999 > 18 41 O 0.81195417850242 0.28675330543252 0.07532970946080 15.999 > 19 42 O 0.18804582149758 0.28675330543252 0.42467029053920 15.999 > 20 43 O 0.18804582149758 0.71324669456748 0.92467029053920 15.999 > 21 44 O 0.81195417850242 0.71324669456748 0.57532970946080 15.999 > 22 -------------------------------- super cell -------------------------------- Lattice vectors: a 8.254127050556871 0.000000000000000 0.000000000000000 b 0.000000000000000 8.638691099999999 0.000000000000000 c -1.257327781746346 0.000000000000000 12.692972535727659 Atomic positions (fractional): *1 Ba 0.50000000000000 0.30678233096503 0.12500000000000 137.327 > 1 2 Ba 0.50000000000000 0.30678233096503 0.62500000000000 137.327 > 1 3 Ba 0.50000000000000 0.69321766903497 0.37500000000000 137.327 > 2 4 Ba 0.50000000000000 0.69321766903497 0.87500000000000 137.327 > 2 5 Ba 0.00000000000000 0.80678233096503 0.12500000000000 137.327 > 1 6 Ba 0.00000000000000 0.80678233096503 0.62500000000000 137.327 > 1 7 Ba 0.00000000000000 0.19321766903497 0.37500000000000 137.327 > 2 8 Ba 0.00000000000000 0.19321766903497 0.87500000000000 137.327 > 2 *9 H 0.65433723489086 0.32035202773148 0.38443135691730 1.008 > 3 10 H 0.65433723489086 0.32035202773148 0.88443135691730 1.008 > 3 11 H 0.34566276510914 0.32035202773148 0.36556864308270 1.008 > 4 12 H 0.34566276510914 0.32035202773148 0.86556864308270 1.008 > 4 13 H 0.34566276510914 0.67964797226852 0.11556864308270 1.008 > 5 14 H 0.34566276510914 0.67964797226852 0.61556864308270 1.008 > 5 15 H 0.65433723489086 0.67964797226852 0.13443135691730 1.008 > 6 16 H 0.65433723489086 0.67964797226852 0.63443135691730 1.008 > 6 *17 H 0.30195550342247 0.04290025725547 0.28264515630167 1.008 > 7 18 H 0.30195550342247 0.04290025725547 0.78264515630167 1.008 > 7 19 H 0.69804449657753 0.04290025725547 0.46735484369833 1.008 > 8 20 H 0.69804449657753 0.04290025725547 0.96735484369833 1.008 > 8 21 H 0.69804449657753 0.95709974274453 0.21735484369833 1.008 > 9 22 H 0.69804449657753 0.95709974274453 0.71735484369833 1.008 > 9 23 H 0.30195550342247 0.95709974274453 0.03264515630167 1.008 > 10 24 H 0.30195550342247 0.95709974274453 0.53264515630167 1.008 > 10 25 H 0.15433723489086 0.82035202773148 0.38443135691730 1.008 > 3 26 H 0.15433723489086 0.82035202773148 0.88443135691730 1.008 > 3 27 H 0.84566276510914 0.82035202773148 0.36556864308270 1.008 > 4 28 H 0.84566276510914 0.82035202773148 0.86556864308270 1.008 > 4 29 H 0.84566276510914 0.17964797226852 0.11556864308270 1.008 > 5 30 H 0.84566276510914 0.17964797226852 0.61556864308270 1.008 > 5 31 H 0.15433723489086 0.17964797226852 0.13443135691730 1.008 > 6 32 H 0.15433723489086 0.17964797226852 0.63443135691730 1.008 > 6 33 H 0.80195550342247 0.54290025725547 0.28264515630167 1.008 > 7 34 H 0.80195550342247 0.54290025725547 0.78264515630167 1.008 > 7 35 H 0.19804449657753 0.54290025725547 0.46735484369833 1.008 > 8 36 H 0.19804449657753 0.54290025725547 0.96735484369833 1.008 > 8 37 H 0.19804449657753 0.45709974274453 0.21735484369833 1.008 > 9 38 H 0.19804449657753 0.45709974274453 0.71735484369833 1.008 > 9 39 H 0.80195550342247 0.45709974274453 0.03264515630167 1.008 > 10 40 H 0.80195550342247 0.45709974274453 0.53264515630167 1.008 > 10 *41 O 0.12989218546601 0.90718154995238 0.32218785301483 15.999 > 11 42 O 0.12989218546601 0.90718154995238 0.82218785301483 15.999 > 11 43 O 0.87010781453399 0.90718154995238 0.42781214698517 15.999 > 12 44 O 0.87010781453399 0.90718154995238 0.92781214698517 15.999 > 12 45 O 0.87010781453399 0.09281845004762 0.17781214698517 15.999 > 13 46 O 0.87010781453399 0.09281845004762 0.67781214698517 15.999 > 13 47 O 0.12989218546601 0.09281845004762 0.07218785301483 15.999 > 14 48 O 0.12989218546601 0.09281845004762 0.57218785301483 15.999 > 14 *49 O 0.28790876654057 0.92162537460240 0.28035555703666 15.999 > 15 50 O 0.28790876654057 0.92162537460240 0.78035555703666 15.999 > 15 51 O 0.71209123345943 0.92162537460240 0.46964444296334 15.999 > 16 52 O 0.71209123345943 0.92162537460240 0.96964444296334 15.999 > 16 53 O 0.71209123345943 0.07837462539760 0.21964444296334 15.999 > 17 54 O 0.71209123345943 0.07837462539760 0.71964444296334 15.999 > 17 55 O 0.28790876654057 0.07837462539760 0.03035555703666 15.999 > 18 56 O 0.28790876654057 0.07837462539760 0.53035555703666 15.999 > 18 *57 O 0.31195417850242 0.78675330543252 0.03766485473040 15.999 > 19 58 O 0.31195417850242 0.78675330543252 0.53766485473040 15.999 > 19 59 O 0.68804582149758 0.78675330543252 0.21233514526960 15.999 > 20 60 O 0.68804582149758 0.78675330543252 0.71233514526960 15.999 > 20 61 O 0.68804582149758 0.21324669456748 0.46233514526960 15.999 > 21 62 O 0.68804582149758 0.21324669456748 0.96233514526960 15.999 > 21 63 O 0.31195417850242 0.21324669456748 0.28766485473040 15.999 > 22 64 O 0.31195417850242 0.21324669456748 0.78766485473040 15.999 > 22 65 O 0.62989218546601 0.40718154995238 0.32218785301483 15.999 > 11 66 O 0.62989218546601 0.40718154995238 0.82218785301483 15.999 > 11 67 O 0.37010781453399 0.40718154995238 0.42781214698517 15.999 > 12 68 O 0.37010781453399 0.40718154995238 0.92781214698517 15.999 > 12 69 O 0.37010781453399 0.59281845004762 0.17781214698517 15.999 > 13 70 O 0.37010781453399 0.59281845004762 0.67781214698517 15.999 > 13 71 O 0.62989218546601 0.59281845004762 0.07218785301483 15.999 > 14 72 O 0.62989218546601 0.59281845004762 0.57218785301483 15.999 > 14 73 O 0.78790876654057 0.42162537460240 0.28035555703666 15.999 > 15 74 O 0.78790876654057 0.42162537460240 0.78035555703666 15.999 > 15 75 O 0.21209123345943 0.42162537460240 0.46964444296334 15.999 > 16 76 O 0.21209123345943 0.42162537460240 0.96964444296334 15.999 > 16 77 O 0.21209123345943 0.57837462539760 0.21964444296334 15.999 > 17 78 O 0.21209123345943 0.57837462539760 0.71964444296334 15.999 > 17 79 O 0.78790876654057 0.57837462539760 0.03035555703666 15.999 > 18 80 O 0.78790876654057 0.57837462539760 0.53035555703666 15.999 > 18 81 O 0.81195417850242 0.28675330543252 0.03766485473040 15.999 > 19 82 O 0.81195417850242 0.28675330543252 0.53766485473040 15.999 > 19 83 O 0.18804582149758 0.28675330543252 0.21233514526960 15.999 > 20 84 O 0.18804582149758 0.28675330543252 0.71233514526960 15.999 > 20 85 O 0.18804582149758 0.71324669456748 0.46233514526960 15.999 > 21 86 O 0.18804582149758 0.71324669456748 0.96233514526960 15.999 > 21 87 O 0.81195417850242 0.71324669456748 0.28766485473040 15.999 > 22 88 O 0.81195417850242 0.71324669456748 0.78766485473040 15.999 > 22 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8647565 0.0000000 -0.0832157 0.0000000 2.9010745 0.0000000 -0.0832135 0.0000000 2.7961447 -------------------------- Born effective charges -------------------------- 1 Ba 2.7866278 0.0000000 -0.0964633 0.0000000 2.3864500 0.0000000 -0.0985644 0.0000000 2.7492389 2 Ba 2.7866278 0.0000000 -0.0964633 0.0000000 2.3864500 0.0000000 -0.0985644 0.0000000 2.7492389 3 H 0.2772768 -0.2133842 0.1819032 -0.1705102 1.0502126 -0.8977778 0.1632168 -1.0069358 1.3579686 4 H 0.2772768 0.2133842 0.1819032 0.1705102 1.0502126 0.8977778 0.1632168 1.0069358 1.3579686 5 H 0.2772768 -0.2133842 0.1819032 -0.1705102 1.0502126 -0.8977778 0.1632168 -1.0069358 1.3579686 6 H 0.2772768 0.2133842 0.1819032 0.1705102 1.0502126 0.8977778 0.1632168 1.0069358 1.3579686 7 H 0.2169547 0.2475611 -0.0105763 0.1398169 1.9434620 0.0059365 -0.0086881 -0.1853230 0.2634670 8 H 0.2169547 -0.2475611 -0.0105763 -0.1398169 1.9434620 -0.0059365 -0.0086881 0.1853230 0.2634670 9 H 0.2169547 0.2475611 -0.0105763 0.1398169 1.9434620 0.0059365 -0.0086881 -0.1853230 0.2634670 10 H 0.2169547 -0.2475611 -0.0105763 -0.1398169 1.9434620 -0.0059365 -0.0086881 0.1853230 0.2634670 11 O -0.4095075 0.2226297 -0.0944165 0.1593733 -1.1453139 0.3260225 -0.2019917 0.3397670 -1.2575046 12 O -0.4095075 -0.2226297 -0.0944165 -0.1593733 -1.1453139 -0.3260225 -0.2019917 -0.3397670 -1.2575046 13 O -0.4095075 0.2226297 -0.0944165 0.1593733 -1.1453139 0.3260225 -0.2019917 0.3397670 -1.2575046 14 O -0.4095075 -0.2226297 -0.0944165 -0.1593733 -1.1453139 -0.3260225 -0.2019917 -0.3397670 -1.2575046 15 O -0.6143664 -0.0327301 -0.2274977 -0.0405006 -1.4815199 0.0856235 -0.0835877 0.1655059 -0.5803768 16 O -0.6143664 0.0327301 -0.2274977 0.0405006 -1.4815199 -0.0856235 -0.0835877 -0.1655059 -0.5803768 17 O -0.6143664 -0.0327301 -0.2274977 -0.0405006 -1.4815199 0.0856235 -0.0835877 0.1655059 -0.5803768 18 O -0.6143664 0.0327301 -0.2274977 0.0405006 -1.4815199 -0.0856235 -0.0835877 -0.1655059 -0.5803768 19 O -0.8636714 0.2871423 0.1988188 0.2180286 -1.5600658 0.3584991 0.1803329 0.3266346 -1.1581738 20 O -0.8636714 -0.2871423 0.1988188 -0.2180286 -1.5600658 -0.3584991 0.1803329 -0.3266346 -1.1581738 21 O -0.8636714 0.2871423 0.1988188 0.2180286 -1.5600658 0.3584991 0.1803329 0.3266346 -1.1581738 22 O -0.8636714 -0.2871423 0.1988188 -0.2180286 -1.5600658 -0.3584991 0.1803329 -0.3266346 -1.1581738 ---------------------------------------------------------------------------- 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: 264/264 Permutation basis: 10686/10686 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2278 Number of blocks in projector: 2278 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: 486 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 276 Use standard eigh solver. Tree of FC basis block matrices: - (2278, 2229), data: False |-- (276, 270), data: True |-- (276, 270), data: True |-- (276, 270), data: True |-- (482, 472), data: True |-- (482, 472), data: True |-- (486, 475), data: True ----- Solver_atoms: 1 -- 88 / 88 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.589 Solver_block: 200 / 720 - Time: 0.522 Solver_block: 300 / 720 - Time: 0.522 Solver_block: 400 / 720 - Time: 0.529 Solver_block: 500 / 720 - Time: 0.530 Solver_block: 600 / 720 - Time: 0.532 Solver_block: 700 / 720 - Time: 0.523 Solver_block: 720 / 720 - Time: 0.197 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.027 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 264/264 Permutation basis: 10686/10686 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2278 Number of blocks in projector: 2278 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: 486 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 276 Use standard eigh solver. Tree of FC basis block matrices: - (2278, 2229), data: False |-- (276, 270), data: True |-- (276, 270), data: True |-- (276, 270), data: True |-- (482, 472), data: True |-- (482, 472), data: True |-- (486, 475), 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 20:33:47]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:33:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.127063525278436 -4.319345550000000 0.000000000000000 b 4.127063525278436 4.319345550000000 0.000000000000000 c -0.628663890873173 0.000000000000000 6.346486267863829 Atomic positions (fractional): 1 Ba 0.19321766903497 0.80678233096503 0.25000000000000 137.327 2 Ba 0.80678233096503 0.19321766903497 0.75000000000000 137.327 3 H 0.33398520715938 0.97468926262234 0.76886271383459 1.008 4 H 0.02531073737766 0.66601479284062 0.73113728616541 1.008 5 H 0.66601479284062 0.02531073737766 0.23113728616541 1.008 6 H 0.97468926262234 0.33398520715938 0.26886271383459 1.008 7 H 0.25905524616700 0.34485576067795 0.56529031260333 1.008 8 H 0.65514423932205 0.74094475383300 0.93470968739667 1.008 9 H 0.74094475383300 0.65514423932205 0.43470968739666 1.008 10 H 0.34485576067795 0.25905524616700 0.06529031260333 1.008 11 O 0.22271063551362 0.03707373541839 0.64437570602966 15.999 12 O 0.96292626458161 0.77728936448638 0.85562429397034 15.999 13 O 0.77728936448638 0.96292626458161 0.35562429397034 15.999 14 O 0.03707373541839 0.22271063551362 0.14437570602966 15.999 15 O 0.36628339193817 0.20953414114297 0.56071111407332 15.999 16 O 0.79046585885703 0.63371660806183 0.93928888592668 15.999 17 O 0.63371660806183 0.79046585885703 0.43928888592668 15.999 18 O 0.20953414114297 0.36628339193817 0.06071111407332 15.999 19 O 0.52520087306990 0.09870748393493 0.07532970946080 15.999 20 O 0.90129251606506 0.47479912693010 0.42467029053920 15.999 21 O 0.47479912693010 0.90129251606506 0.92467029053920 15.999 22 O 0.09870748393494 0.52520087306990 0.57532970946080 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.254127050556871 0.000000000000000 0.000000000000000 b 0.000000000000000 8.638691099999999 0.000000000000000 c -1.257327781746346 0.000000000000000 12.692972535727659 Atomic positions (fractional): 1 Ba 0.50000000000000 0.30678233096503 0.12500000000000 137.327 > 1 2 Ba 0.50000000000000 0.30678233096503 0.62500000000000 137.327 > 1 3 Ba 0.50000000000000 0.69321766903497 0.37500000000000 137.327 > 3 4 Ba 0.50000000000000 0.69321766903497 0.87500000000000 137.327 > 3 5 Ba 0.00000000000000 0.80678233096503 0.12500000000000 137.327 > 1 6 Ba 0.00000000000000 0.80678233096503 0.62500000000000 137.327 > 1 7 Ba 0.00000000000000 0.19321766903497 0.37500000000000 137.327 > 3 8 Ba 0.00000000000000 0.19321766903497 0.87500000000000 137.327 > 3 9 H 0.65433723489086 0.32035202773148 0.38443135691730 1.008 > 9 10 H 0.65433723489086 0.32035202773148 0.88443135691730 1.008 > 9 11 H 0.34566276510914 0.32035202773148 0.36556864308270 1.008 > 11 12 H 0.34566276510914 0.32035202773148 0.86556864308270 1.008 > 11 13 H 0.34566276510914 0.67964797226852 0.11556864308270 1.008 > 13 14 H 0.34566276510914 0.67964797226852 0.61556864308270 1.008 > 13 15 H 0.65433723489086 0.67964797226852 0.13443135691730 1.008 > 15 16 H 0.65433723489086 0.67964797226852 0.63443135691730 1.008 > 15 17 H 0.30195550342247 0.04290025725547 0.28264515630167 1.008 > 17 18 H 0.30195550342247 0.04290025725547 0.78264515630167 1.008 > 17 19 H 0.69804449657753 0.04290025725547 0.46735484369833 1.008 > 19 20 H 0.69804449657753 0.04290025725547 0.96735484369833 1.008 > 19 21 H 0.69804449657753 0.95709974274453 0.21735484369833 1.008 > 21 22 H 0.69804449657753 0.95709974274453 0.71735484369833 1.008 > 21 23 H 0.30195550342247 0.95709974274453 0.03264515630167 1.008 > 23 24 H 0.30195550342247 0.95709974274453 0.53264515630167 1.008 > 23 25 H 0.15433723489086 0.82035202773148 0.38443135691730 1.008 > 9 26 H 0.15433723489086 0.82035202773148 0.88443135691730 1.008 > 9 27 H 0.84566276510914 0.82035202773148 0.36556864308270 1.008 > 11 28 H 0.84566276510914 0.82035202773148 0.86556864308270 1.008 > 11 29 H 0.84566276510914 0.17964797226852 0.11556864308270 1.008 > 13 30 H 0.84566276510914 0.17964797226852 0.61556864308270 1.008 > 13 31 H 0.15433723489086 0.17964797226852 0.13443135691730 1.008 > 15 32 H 0.15433723489086 0.17964797226852 0.63443135691730 1.008 > 15 33 H 0.80195550342247 0.54290025725547 0.28264515630167 1.008 > 17 34 H 0.80195550342247 0.54290025725547 0.78264515630167 1.008 > 17 35 H 0.19804449657753 0.54290025725547 0.46735484369833 1.008 > 19 36 H 0.19804449657753 0.54290025725547 0.96735484369833 1.008 > 19 37 H 0.19804449657753 0.45709974274453 0.21735484369833 1.008 > 21 38 H 0.19804449657753 0.45709974274453 0.71735484369833 1.008 > 21 39 H 0.80195550342247 0.45709974274453 0.03264515630167 1.008 > 23 40 H 0.80195550342247 0.45709974274453 0.53264515630167 1.008 > 23 41 O 0.12989218546601 0.90718154995238 0.32218785301483 15.999 > 41 42 O 0.12989218546601 0.90718154995238 0.82218785301483 15.999 > 41 43 O 0.87010781453399 0.90718154995238 0.42781214698517 15.999 > 43 44 O 0.87010781453399 0.90718154995238 0.92781214698517 15.999 > 43 45 O 0.87010781453399 0.09281845004762 0.17781214698517 15.999 > 45 46 O 0.87010781453399 0.09281845004762 0.67781214698517 15.999 > 45 47 O 0.12989218546601 0.09281845004762 0.07218785301483 15.999 > 47 48 O 0.12989218546601 0.09281845004762 0.57218785301483 15.999 > 47 49 O 0.28790876654057 0.92162537460240 0.28035555703666 15.999 > 49 50 O 0.28790876654057 0.92162537460240 0.78035555703666 15.999 > 49 51 O 0.71209123345943 0.92162537460240 0.46964444296334 15.999 > 51 52 O 0.71209123345943 0.92162537460240 0.96964444296334 15.999 > 51 53 O 0.71209123345943 0.07837462539760 0.21964444296334 15.999 > 53 54 O 0.71209123345943 0.07837462539760 0.71964444296334 15.999 > 53 55 O 0.28790876654057 0.07837462539760 0.03035555703666 15.999 > 55 56 O 0.28790876654057 0.07837462539760 0.53035555703666 15.999 > 55 57 O 0.31195417850242 0.78675330543252 0.03766485473040 15.999 > 57 58 O 0.31195417850242 0.78675330543252 0.53766485473040 15.999 > 57 59 O 0.68804582149758 0.78675330543252 0.21233514526960 15.999 > 59 60 O 0.68804582149758 0.78675330543252 0.71233514526960 15.999 > 59 61 O 0.68804582149758 0.21324669456748 0.46233514526960 15.999 > 61 62 O 0.68804582149758 0.21324669456748 0.96233514526960 15.999 > 61 63 O 0.31195417850242 0.21324669456748 0.28766485473040 15.999 > 63 64 O 0.31195417850242 0.21324669456748 0.78766485473040 15.999 > 63 65 O 0.62989218546601 0.40718154995238 0.32218785301483 15.999 > 41 66 O 0.62989218546601 0.40718154995238 0.82218785301483 15.999 > 41 67 O 0.37010781453399 0.40718154995238 0.42781214698517 15.999 > 43 68 O 0.37010781453399 0.40718154995238 0.92781214698517 15.999 > 43 69 O 0.37010781453399 0.59281845004762 0.17781214698517 15.999 > 45 70 O 0.37010781453399 0.59281845004762 0.67781214698517 15.999 > 45 71 O 0.62989218546601 0.59281845004762 0.07218785301483 15.999 > 47 72 O 0.62989218546601 0.59281845004762 0.57218785301483 15.999 > 47 73 O 0.78790876654057 0.42162537460240 0.28035555703666 15.999 > 49 74 O 0.78790876654057 0.42162537460240 0.78035555703666 15.999 > 49 75 O 0.21209123345943 0.42162537460240 0.46964444296334 15.999 > 51 76 O 0.21209123345943 0.42162537460240 0.96964444296334 15.999 > 51 77 O 0.21209123345943 0.57837462539760 0.21964444296334 15.999 > 53 78 O 0.21209123345943 0.57837462539760 0.71964444296334 15.999 > 53 79 O 0.78790876654057 0.57837462539760 0.03035555703666 15.999 > 55 80 O 0.78790876654057 0.57837462539760 0.53035555703666 15.999 > 55 81 O 0.81195417850242 0.28675330543252 0.03766485473040 15.999 > 57 82 O 0.81195417850242 0.28675330543252 0.53766485473040 15.999 > 57 83 O 0.18804582149758 0.28675330543252 0.21233514526960 15.999 > 59 84 O 0.18804582149758 0.28675330543252 0.71233514526960 15.999 > 59 85 O 0.18804582149758 0.71324669456748 0.46233514526960 15.999 > 61 86 O 0.18804582149758 0.71324669456748 0.96233514526960 15.999 > 61 87 O 0.81195417850242 0.71324669456748 0.28766485473040 15.999 > 63 88 O 0.81195417850242 0.71324669456748 0.78766485473040 15.999 > 63 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8647565 0.0000000 -0.0832157 0.0000000 2.9010745 0.0000000 -0.0832135 0.0000000 2.7961447 -------------------------- Born effective charges -------------------------- 1 Ba 2.7866278 0.0000000 -0.0964633 0.0000000 2.3864500 0.0000000 -0.0985644 0.0000000 2.7492389 2 Ba 2.7866278 0.0000000 -0.0964633 0.0000000 2.3864500 0.0000000 -0.0985644 0.0000000 2.7492389 3 H 0.2772768 -0.2133842 0.1819032 -0.1705102 1.0502126 -0.8977778 0.1632168 -1.0069358 1.3579686 4 H 0.2772768 0.2133842 0.1819032 0.1705102 1.0502126 0.8977778 0.1632168 1.0069358 1.3579686 5 H 0.2772768 -0.2133842 0.1819032 -0.1705102 1.0502126 -0.8977778 0.1632168 -1.0069358 1.3579686 6 H 0.2772768 0.2133842 0.1819032 0.1705102 1.0502126 0.8977778 0.1632168 1.0069358 1.3579686 7 H 0.2169547 0.2475611 -0.0105763 0.1398169 1.9434620 0.0059365 -0.0086881 -0.1853230 0.2634670 8 H 0.2169547 -0.2475611 -0.0105763 -0.1398169 1.9434620 -0.0059365 -0.0086881 0.1853230 0.2634670 9 H 0.2169547 0.2475611 -0.0105763 0.1398169 1.9434620 0.0059365 -0.0086881 -0.1853230 0.2634670 10 H 0.2169547 -0.2475611 -0.0105763 -0.1398169 1.9434620 -0.0059365 -0.0086881 0.1853230 0.2634670 11 O -0.4095075 0.2226297 -0.0944165 0.1593733 -1.1453139 0.3260225 -0.2019917 0.3397670 -1.2575046 12 O -0.4095075 -0.2226297 -0.0944165 -0.1593733 -1.1453139 -0.3260225 -0.2019917 -0.3397670 -1.2575046 13 O -0.4095075 0.2226297 -0.0944165 0.1593733 -1.1453139 0.3260225 -0.2019917 0.3397670 -1.2575046 14 O -0.4095075 -0.2226297 -0.0944165 -0.1593733 -1.1453139 -0.3260225 -0.2019917 -0.3397670 -1.2575046 15 O -0.6143664 -0.0327301 -0.2274977 -0.0405006 -1.4815199 0.0856235 -0.0835877 0.1655059 -0.5803768 16 O -0.6143664 0.0327301 -0.2274977 0.0405006 -1.4815199 -0.0856235 -0.0835877 -0.1655059 -0.5803768 17 O -0.6143664 -0.0327301 -0.2274977 -0.0405006 -1.4815199 0.0856235 -0.0835877 0.1655059 -0.5803768 18 O -0.6143664 0.0327301 -0.2274977 0.0405006 -1.4815199 -0.0856235 -0.0835877 -0.1655059 -0.5803768 19 O -0.8636714 0.2871423 0.1988188 0.2180286 -1.5600658 0.3584991 0.1803329 0.3266346 -1.1581738 20 O -0.8636714 -0.2871423 0.1988188 -0.2180286 -1.5600658 -0.3584991 0.1803329 -0.3266346 -1.1581738 21 O -0.8636714 0.2871423 0.1988188 0.2180286 -1.5600658 0.3584991 0.1803329 0.3266346 -1.1581738 22 O -0.8636714 -0.2871423 0.1988188 -0.2180286 -1.5600658 -0.3584991 0.1803329 -0.3266346 -1.1581738 ---------------------------------------------------------------------------- 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] [-0.0010 0.0000 0.0100] [ 0.0010 0.0000 -0.0100] Computing fc3[ 9, 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] [-0.0010 0.0000 0.0100] [ 0.0010 0.0000 -0.0100] Computing fc3[ 17, 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] [-0.0010 0.0000 0.0100] [ 0.0010 0.0000 -0.0100] Computing fc3[ 41, 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] [-0.0010 0.0000 0.0100] [ 0.0010 0.0000 -0.0100] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0010 0.0000 0.0100] [ 0.0010 0.0000 -0.0100] Computing fc3[ 57, 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] [-0.0010 0.0000 0.0100] [ 0.0010 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000005 (zzz) 0.00000005 (zzz) 0.00000005 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000007 (zx) 0.00000007 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:34:05]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:34:06]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.127063525278436 -4.319345550000000 0.000000000000000 b 4.127063525278436 4.319345550000000 0.000000000000000 c -0.628663890873173 0.000000000000000 6.346486267863829 Atomic positions (fractional): 1 Ba 0.19321766903497 0.80678233096503 0.25000000000000 137.327 2 Ba 0.80678233096503 0.19321766903497 0.75000000000000 137.327 3 H 0.33398520715938 0.97468926262234 0.76886271383459 1.008 4 H 0.02531073737766 0.66601479284062 0.73113728616541 1.008 5 H 0.66601479284062 0.02531073737766 0.23113728616541 1.008 6 H 0.97468926262234 0.33398520715938 0.26886271383459 1.008 7 H 0.25905524616700 0.34485576067795 0.56529031260333 1.008 8 H 0.65514423932205 0.74094475383300 0.93470968739667 1.008 9 H 0.74094475383300 0.65514423932205 0.43470968739666 1.008 10 H 0.34485576067795 0.25905524616700 0.06529031260333 1.008 11 O 0.22271063551362 0.03707373541839 0.64437570602966 15.999 12 O 0.96292626458161 0.77728936448638 0.85562429397034 15.999 13 O 0.77728936448638 0.96292626458161 0.35562429397034 15.999 14 O 0.03707373541839 0.22271063551362 0.14437570602966 15.999 15 O 0.36628339193817 0.20953414114297 0.56071111407332 15.999 16 O 0.79046585885703 0.63371660806183 0.93928888592668 15.999 17 O 0.63371660806183 0.79046585885703 0.43928888592668 15.999 18 O 0.20953414114297 0.36628339193817 0.06071111407332 15.999 19 O 0.52520087306990 0.09870748393493 0.07532970946080 15.999 20 O 0.90129251606506 0.47479912693010 0.42467029053920 15.999 21 O 0.47479912693010 0.90129251606506 0.92467029053920 15.999 22 O 0.09870748393494 0.52520087306990 0.57532970946080 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.254127050556871 0.000000000000000 0.000000000000000 b 0.000000000000000 8.638691099999999 0.000000000000000 c -1.257327781746346 0.000000000000000 12.692972535727659 Atomic positions (fractional): 1 Ba 0.50000000000000 0.30678233096503 0.12500000000000 137.327 > 1 2 Ba 0.50000000000000 0.30678233096503 0.62500000000000 137.327 > 1 3 Ba 0.50000000000000 0.69321766903497 0.37500000000000 137.327 > 3 4 Ba 0.50000000000000 0.69321766903497 0.87500000000000 137.327 > 3 5 Ba 0.00000000000000 0.80678233096503 0.12500000000000 137.327 > 1 6 Ba 0.00000000000000 0.80678233096503 0.62500000000000 137.327 > 1 7 Ba 0.00000000000000 0.19321766903497 0.37500000000000 137.327 > 3 8 Ba 0.00000000000000 0.19321766903497 0.87500000000000 137.327 > 3 9 H 0.65433723489086 0.32035202773148 0.38443135691730 1.008 > 9 10 H 0.65433723489086 0.32035202773148 0.88443135691730 1.008 > 9 11 H 0.34566276510914 0.32035202773148 0.36556864308270 1.008 > 11 12 H 0.34566276510914 0.32035202773148 0.86556864308270 1.008 > 11 13 H 0.34566276510914 0.67964797226852 0.11556864308270 1.008 > 13 14 H 0.34566276510914 0.67964797226852 0.61556864308270 1.008 > 13 15 H 0.65433723489086 0.67964797226852 0.13443135691730 1.008 > 15 16 H 0.65433723489086 0.67964797226852 0.63443135691730 1.008 > 15 17 H 0.30195550342247 0.04290025725547 0.28264515630167 1.008 > 17 18 H 0.30195550342247 0.04290025725547 0.78264515630167 1.008 > 17 19 H 0.69804449657753 0.04290025725547 0.46735484369833 1.008 > 19 20 H 0.69804449657753 0.04290025725547 0.96735484369833 1.008 > 19 21 H 0.69804449657753 0.95709974274453 0.21735484369833 1.008 > 21 22 H 0.69804449657753 0.95709974274453 0.71735484369833 1.008 > 21 23 H 0.30195550342247 0.95709974274453 0.03264515630167 1.008 > 23 24 H 0.30195550342247 0.95709974274453 0.53264515630167 1.008 > 23 25 H 0.15433723489086 0.82035202773148 0.38443135691730 1.008 > 9 26 H 0.15433723489086 0.82035202773148 0.88443135691730 1.008 > 9 27 H 0.84566276510914 0.82035202773148 0.36556864308270 1.008 > 11 28 H 0.84566276510914 0.82035202773148 0.86556864308270 1.008 > 11 29 H 0.84566276510914 0.17964797226852 0.11556864308270 1.008 > 13 30 H 0.84566276510914 0.17964797226852 0.61556864308270 1.008 > 13 31 H 0.15433723489086 0.17964797226852 0.13443135691730 1.008 > 15 32 H 0.15433723489086 0.17964797226852 0.63443135691730 1.008 > 15 33 H 0.80195550342247 0.54290025725547 0.28264515630167 1.008 > 17 34 H 0.80195550342247 0.54290025725547 0.78264515630167 1.008 > 17 35 H 0.19804449657753 0.54290025725547 0.46735484369833 1.008 > 19 36 H 0.19804449657753 0.54290025725547 0.96735484369833 1.008 > 19 37 H 0.19804449657753 0.45709974274453 0.21735484369833 1.008 > 21 38 H 0.19804449657753 0.45709974274453 0.71735484369833 1.008 > 21 39 H 0.80195550342247 0.45709974274453 0.03264515630167 1.008 > 23 40 H 0.80195550342247 0.45709974274453 0.53264515630167 1.008 > 23 41 O 0.12989218546601 0.90718154995238 0.32218785301483 15.999 > 41 42 O 0.12989218546601 0.90718154995238 0.82218785301483 15.999 > 41 43 O 0.87010781453399 0.90718154995238 0.42781214698517 15.999 > 43 44 O 0.87010781453399 0.90718154995238 0.92781214698517 15.999 > 43 45 O 0.87010781453399 0.09281845004762 0.17781214698517 15.999 > 45 46 O 0.87010781453399 0.09281845004762 0.67781214698517 15.999 > 45 47 O 0.12989218546601 0.09281845004762 0.07218785301483 15.999 > 47 48 O 0.12989218546601 0.09281845004762 0.57218785301483 15.999 > 47 49 O 0.28790876654057 0.92162537460240 0.28035555703666 15.999 > 49 50 O 0.28790876654057 0.92162537460240 0.78035555703666 15.999 > 49 51 O 0.71209123345943 0.92162537460240 0.46964444296334 15.999 > 51 52 O 0.71209123345943 0.92162537460240 0.96964444296334 15.999 > 51 53 O 0.71209123345943 0.07837462539760 0.21964444296334 15.999 > 53 54 O 0.71209123345943 0.07837462539760 0.71964444296334 15.999 > 53 55 O 0.28790876654057 0.07837462539760 0.03035555703666 15.999 > 55 56 O 0.28790876654057 0.07837462539760 0.53035555703666 15.999 > 55 57 O 0.31195417850242 0.78675330543252 0.03766485473040 15.999 > 57 58 O 0.31195417850242 0.78675330543252 0.53766485473040 15.999 > 57 59 O 0.68804582149758 0.78675330543252 0.21233514526960 15.999 > 59 60 O 0.68804582149758 0.78675330543252 0.71233514526960 15.999 > 59 61 O 0.68804582149758 0.21324669456748 0.46233514526960 15.999 > 61 62 O 0.68804582149758 0.21324669456748 0.96233514526960 15.999 > 61 63 O 0.31195417850242 0.21324669456748 0.28766485473040 15.999 > 63 64 O 0.31195417850242 0.21324669456748 0.78766485473040 15.999 > 63 65 O 0.62989218546601 0.40718154995238 0.32218785301483 15.999 > 41 66 O 0.62989218546601 0.40718154995238 0.82218785301483 15.999 > 41 67 O 0.37010781453399 0.40718154995238 0.42781214698517 15.999 > 43 68 O 0.37010781453399 0.40718154995238 0.92781214698517 15.999 > 43 69 O 0.37010781453399 0.59281845004762 0.17781214698517 15.999 > 45 70 O 0.37010781453399 0.59281845004762 0.67781214698517 15.999 > 45 71 O 0.62989218546601 0.59281845004762 0.07218785301483 15.999 > 47 72 O 0.62989218546601 0.59281845004762 0.57218785301483 15.999 > 47 73 O 0.78790876654057 0.42162537460240 0.28035555703666 15.999 > 49 74 O 0.78790876654057 0.42162537460240 0.78035555703666 15.999 > 49 75 O 0.21209123345943 0.42162537460240 0.46964444296334 15.999 > 51 76 O 0.21209123345943 0.42162537460240 0.96964444296334 15.999 > 51 77 O 0.21209123345943 0.57837462539760 0.21964444296334 15.999 > 53 78 O 0.21209123345943 0.57837462539760 0.71964444296334 15.999 > 53 79 O 0.78790876654057 0.57837462539760 0.03035555703666 15.999 > 55 80 O 0.78790876654057 0.57837462539760 0.53035555703666 15.999 > 55 81 O 0.81195417850242 0.28675330543252 0.03766485473040 15.999 > 57 82 O 0.81195417850242 0.28675330543252 0.53766485473040 15.999 > 57 83 O 0.18804582149758 0.28675330543252 0.21233514526960 15.999 > 59 84 O 0.18804582149758 0.28675330543252 0.71233514526960 15.999 > 59 85 O 0.18804582149758 0.71324669456748 0.46233514526960 15.999 > 61 86 O 0.18804582149758 0.71324669456748 0.96233514526960 15.999 > 61 87 O 0.81195417850242 0.71324669456748 0.28766485473040 15.999 > 63 88 O 0.81195417850242 0.71324669456748 0.78766485473040 15.999 > 63 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.8647565 0.0000000 -0.0832157 0.0000000 2.9010745 0.0000000 -0.0832135 0.0000000 2.7961447 -------------------------- Born effective charges -------------------------- 1 Ba 2.7866278 0.0000000 -0.0964633 0.0000000 2.3864500 0.0000000 -0.0985644 0.0000000 2.7492389 2 Ba 2.7866278 0.0000000 -0.0964633 0.0000000 2.3864500 0.0000000 -0.0985644 0.0000000 2.7492389 3 H 0.2772768 -0.2133842 0.1819032 -0.1705102 1.0502126 -0.8977778 0.1632168 -1.0069358 1.3579686 4 H 0.2772768 0.2133842 0.1819032 0.1705102 1.0502126 0.8977778 0.1632168 1.0069358 1.3579686 5 H 0.2772768 -0.2133842 0.1819032 -0.1705102 1.0502126 -0.8977778 0.1632168 -1.0069358 1.3579686 6 H 0.2772768 0.2133842 0.1819032 0.1705102 1.0502126 0.8977778 0.1632168 1.0069358 1.3579686 7 H 0.2169547 0.2475611 -0.0105763 0.1398169 1.9434620 0.0059365 -0.0086881 -0.1853230 0.2634670 8 H 0.2169547 -0.2475611 -0.0105763 -0.1398169 1.9434620 -0.0059365 -0.0086881 0.1853230 0.2634670 9 H 0.2169547 0.2475611 -0.0105763 0.1398169 1.9434620 0.0059365 -0.0086881 -0.1853230 0.2634670 10 H 0.2169547 -0.2475611 -0.0105763 -0.1398169 1.9434620 -0.0059365 -0.0086881 0.1853230 0.2634670 11 O -0.4095075 0.2226297 -0.0944165 0.1593733 -1.1453139 0.3260225 -0.2019917 0.3397670 -1.2575046 12 O -0.4095075 -0.2226297 -0.0944165 -0.1593733 -1.1453139 -0.3260225 -0.2019917 -0.3397670 -1.2575046 13 O -0.4095075 0.2226297 -0.0944165 0.1593733 -1.1453139 0.3260225 -0.2019917 0.3397670 -1.2575046 14 O -0.4095075 -0.2226297 -0.0944165 -0.1593733 -1.1453139 -0.3260225 -0.2019917 -0.3397670 -1.2575046 15 O -0.6143664 -0.0327301 -0.2274977 -0.0405006 -1.4815199 0.0856235 -0.0835877 0.1655059 -0.5803768 16 O -0.6143664 0.0327301 -0.2274977 0.0405006 -1.4815199 -0.0856235 -0.0835877 -0.1655059 -0.5803768 17 O -0.6143664 -0.0327301 -0.2274977 -0.0405006 -1.4815199 0.0856235 -0.0835877 0.1655059 -0.5803768 18 O -0.6143664 0.0327301 -0.2274977 0.0405006 -1.4815199 -0.0856235 -0.0835877 -0.1655059 -0.5803768 19 O -0.8636714 0.2871423 0.1988188 0.2180286 -1.5600658 0.3584991 0.1803329 0.3266346 -1.1581738 20 O -0.8636714 -0.2871423 0.1988188 -0.2180286 -1.5600658 -0.3584991 0.1803329 -0.3266346 -1.1581738 21 O -0.8636714 0.2871423 0.1988188 0.2180286 -1.5600658 0.3584991 0.1803329 0.3266346 -1.1581738 22 O -0.8636714 -0.2871423 0.1988188 -0.2180286 -1.5600658 -0.3584991 0.1803329 -0.3266346 -1.1581738 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000005 (zzz) 0.00000005 (zzz) 0.00000005 (zzz) 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 ... [ 8 8 8 ] 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: 0.68, Number of G-points: 297, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/150) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 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 1.273 ( 0.000 0.000 0.000) 0.000 2.371 ( 0.000 0.000 0.000) 0.000 2.417 ( 0.000 0.000 0.000) 0.000 2.449 ( 0.000 0.000 0.000) 0.000 2.948 ( 0.000 0.000 0.000) 0.000 3.238 ( 0.000 0.000 0.000) 0.000 3.543 ( 0.000 0.000 0.000) 0.000 3.697 ( 0.000 0.000 0.000) 0.000 3.816 ( 0.000 0.000 0.000) 0.000 3.960 ( 0.000 0.000 0.000) 0.000 4.382 ( 0.000 0.000 0.000) 0.000 4.414 ( 0.000 0.000 0.000) 0.000 4.953 ( 0.000 0.000 0.000) 0.000 5.425 ( 0.000 0.000 0.000) 0.000 5.477 ( 0.000 0.000 0.000) 0.000 5.490 ( 0.000 0.000 0.000) 0.000 6.187 ( 0.000 0.000 0.000) 0.000 6.238 ( 0.000 0.000 0.000) 0.000 6.328 ( 0.000 0.000 0.000) 0.000 6.965 ( 0.000 0.000 0.000) 0.000 7.082 ( 0.000 0.000 0.000) 0.000 7.322 ( 0.000 0.000 0.000) 0.000 7.537 ( 0.000 0.000 0.000) 0.000 8.519 ( 0.000 0.000 0.000) 0.000 8.523 ( 0.000 0.000 0.000) 0.000 9.796 ( 0.000 0.000 0.000) 0.000 10.814 ( 0.000 0.000 0.000) 0.000 11.112 ( 0.000 0.000 0.000) 0.000 12.115 ( 0.000 0.000 0.000) 0.000 13.463 ( 0.000 0.000 0.000) 0.000 14.551 ( 0.000 0.000 0.000) 0.000 15.030 ( 0.000 0.000 0.000) 0.000 15.783 ( 0.000 0.000 0.000) 0.000 27.096 ( 0.000 0.000 0.000) 0.000 27.361 ( 0.000 0.000 0.000) 0.000 27.615 ( 0.000 0.000 0.000) 0.000 27.643 ( 0.000 0.000 0.000) 0.000 27.673 ( 0.000 0.000 0.000) 0.000 28.111 ( 0.000 0.000 0.000) 0.000 31.249 ( 0.000 0.000 0.000) 0.000 31.944 ( 0.000 0.000 0.000) 0.000 32.401 ( 0.000 0.000 0.000) 0.000 32.528 ( 0.000 0.000 0.000) 0.000 35.079 ( 0.000 0.000 0.000) 0.000 35.221 ( 0.000 0.000 0.000) 0.000 36.082 ( 0.000 0.000 0.000) 0.000 36.257 ( 0.000 0.000 0.000) 0.000 44.065 ( 0.000 0.000 0.000) 0.000 44.196 ( 0.000 0.000 0.000) 0.000 44.617 ( 0.000 0.000 0.000) 0.000 45.355 ( 0.000 0.000 0.000) 0.000 46.388 ( 0.000 0.000 0.000) 0.000 46.646 ( 0.000 0.000 0.000) 0.000 47.307 ( 0.000 0.000 0.000) 0.000 47.666 ( 0.000 0.000 0.000) 0.000 50.123 ( 0.000 0.000 0.000) 0.000 51.765 ( 0.000 0.000 0.000) 0.000 52.775 ( 0.000 0.000 0.000) 0.000 57.304 ( 0.000 0.000 0.000) 0.000 69.372 ( 0.000 0.000 0.000) 0.000 70.125 ( 0.000 0.000 0.000) 0.000 74.178 ( 0.000 0.000 0.000) 0.000 74.407 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/150) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.230 ( -3.428 -22.101 1.602) 22.423 0.451 ( 11.113 -17.541 13.652) 24.851 0.912 ( 23.412 -29.928 0.824) 38.007 1.434 ( 10.169 -13.163 -2.162) 16.773 2.391 ( -1.622 2.721 -0.239) 3.177 2.457 ( -1.189 -3.979 1.315) 4.356 2.535 ( 3.634 -6.902 -0.518) 7.817 3.070 ( 0.619 -14.674 1.402) 14.753 3.420 ( 7.076 22.072 17.540) 29.067 3.539 ( -1.306 0.041 2.113) 2.484 3.727 ( 3.946 2.111 4.319) 6.220 3.859 ( 9.366 7.434 8.329) 14.573 4.106 ( 4.965 -0.757 0.593) 5.057 4.397 ( -1.871 -1.075 1.682) 2.736 4.679 ( 12.566 15.707 -7.480) 21.461 4.940 ( 1.787 3.711 -0.138) 4.121 5.430 ( -0.369 -0.338 0.374) 0.624 5.491 ( 1.369 1.186 -0.850) 2.001 5.809 ( -0.532 3.547 5.090) 6.226 6.162 ( -3.160 0.619 -1.837) 3.707 6.311 ( -1.813 -1.351 1.568) 2.752 6.437 ( -5.474 -8.973 -0.598) 10.528 6.933 ( 0.989 6.053 -0.185) 6.136 7.074 ( 0.925 2.469 1.888) 3.243 7.379 ( 7.287 3.734 -15.215) 17.278 7.541 ( -0.368 -0.915 0.290) 1.028 8.419 ( -2.638 8.414 -3.657) 9.546 8.512 ( -0.802 4.203 1.569) 4.557 9.889 ( 1.822 -8.624 -1.625) 8.963 10.863 ( -0.612 -7.129 -0.533) 7.175 11.907 ( -9.302 9.281 -2.912) 13.459 12.179 ( -18.536 -17.720 -8.271) 26.945 14.532 ( -51.455 -56.447 -35.674) 84.300 14.584 ( -11.319 -16.743 -4.313) 20.665 15.291 ( -14.519 -13.187 45.718) 49.747 15.760 ( 1.645 4.929 -0.195) 5.200 27.103 ( 0.284 -0.660 0.053) 0.721 27.343 ( 0.021 2.269 -0.192) 2.277 27.633 ( -0.274 -1.604 -0.494) 1.701 27.648 ( 0.075 -1.433 0.256) 1.458 27.682 ( -0.505 -0.186 0.818) 0.979 28.093 ( -0.802 1.624 -0.207) 1.823 31.271 ( 0.705 -1.391 3.156) 3.521 31.908 ( -0.826 3.800 -0.914) 3.994 32.419 ( -5.620 -3.589 -4.092) 7.823 32.558 ( 2.710 0.076 3.200) 4.194 35.087 ( 0.520 -0.463 0.658) 0.958 35.240 ( -1.431 -0.893 -0.385) 1.730 36.093 ( -0.141 -1.560 -0.042) 1.567 36.253 ( 0.417 0.928 0.130) 1.026 44.164 ( 6.289 2.731 -1.473) 7.013 44.225 ( 2.768 -0.949 0.334) 2.945 44.697 ( -0.687 0.344 -2.018) 2.159 45.299 ( -2.424 5.177 1.892) 6.021 46.630 ( -0.276 1.352 -2.977) 3.281 46.796 ( -14.693 -15.255 -0.195) 21.181 47.333 ( -1.498 -5.146 -2.459) 5.897 47.658 ( 2.775 4.006 0.325) 4.884 51.721 ( -30.353 -30.065 -36.359) 56.100 52.358 ( -26.228 -53.950 -101.432) 117.843 54.127 (-125.290 -102.037 238.604) 288.168 57.020 ( -4.389 32.422 -4.699) 33.053 69.561 ( 4.944 -17.323 -1.065) 18.046 72.556 (-175.890 -172.061 -4.702) 246.098 74.214 ( 10.744 6.486 -0.675) 12.568 74.427 ( -10.654 -13.389 2.578) 17.304 ======================= Grid point 2 (3/150) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.534 ( 3.143 -19.098 -1.584) 19.420 0.875 ( 10.162 -15.618 12.472) 22.422 1.425 ( 7.814 -12.000 -1.197) 14.370 1.990 ( 18.811 -24.653 -1.252) 31.036 2.284 ( -1.549 6.536 -3.805) 7.720 2.516 ( -1.037 -5.631 2.762) 6.357 2.742 ( 6.704 -9.398 3.403) 12.035 3.167 ( 0.927 16.175 1.980) 16.323 3.365 ( 2.466 -16.423 4.682) 17.255 3.587 ( 2.482 -2.630 4.332) 5.643 3.772 ( 3.856 0.814 2.828) 4.851 3.890 ( 5.141 4.597 2.739) 7.420 4.171 ( -0.289 -2.334 -1.611) 2.850 4.395 ( 0.790 -0.272 1.606) 1.810 4.614 ( 3.513 8.817 -1.577) 9.622 4.899 ( 1.440 5.232 -0.620) 5.462 5.427 ( -0.419 0.088 0.817) 0.922 5.486 ( 0.151 1.717 -0.426) 1.775 5.742 ( -0.856 3.966 1.585) 4.356 6.076 ( -4.228 1.915 -2.131) 5.108 6.329 ( -2.737 -4.885 1.251) 5.737 6.500 ( -3.953 -10.401 -2.187) 11.340 6.839 ( 1.315 8.865 -0.421) 8.972 7.040 ( 1.342 5.216 2.193) 5.815 7.427 ( 5.930 1.204 -7.722) 9.811 7.553 ( -0.814 -1.732 0.848) 2.093 8.209 ( -1.251 14.523 -3.533) 14.999 8.402 ( -4.904 4.597 0.838) 6.773 10.108 ( 1.889 -17.197 2.001) 17.416 10.989 ( -0.888 -11.716 -0.743) 11.773 11.584 ( -5.607 18.425 -2.846) 19.469 12.058 ( -11.569 0.849 -3.817) 12.212 14.509 ( -23.623 -24.057 -12.457) 35.944 14.684 ( -8.819 -18.053 3.121) 20.333 15.335 ( -0.785 -2.412 11.609) 11.883 15.693 ( 1.729 7.707 1.364) 8.016 27.123 ( 0.500 -1.295 0.104) 1.392 27.302 ( -0.122 3.047 -0.270) 3.062 27.635 ( -0.552 -0.436 -0.611) 0.932 27.671 ( 0.027 0.298 -0.312) 0.432 27.706 ( 0.450 -4.003 1.603) 4.335 28.042 ( -1.375 3.043 -0.410) 3.364 31.324 ( 1.203 -3.245 2.659) 4.364 31.814 ( -1.596 6.002 -1.888) 6.491 32.381 ( -3.978 -2.232 -3.369) 5.671 32.601 ( 2.234 -0.062 2.547) 3.388 35.108 ( 0.919 -0.789 1.129) 1.656 35.226 ( -1.068 0.082 -0.528) 1.194 36.121 ( -0.319 -2.692 -0.106) 2.713 36.243 ( 0.713 1.806 0.228) 1.955 44.237 ( 1.762 -3.984 0.122) 4.358 44.310 ( 5.279 -2.540 -0.355) 5.869 44.670 ( 0.603 2.818 -2.031) 3.526 45.146 ( -4.568 8.668 3.051) 10.262 46.596 ( -0.499 1.749 -2.621) 3.190 46.796 ( -8.692 -9.029 2.524) 12.784 47.391 ( -3.186 -7.968 -3.580) 9.298 47.637 ( 4.778 6.897 0.768) 8.425 51.628 ( -27.688 -25.658 -32.594) 49.873 52.670 ( 10.436 -17.332 -24.150) 31.504 54.064 ( -63.143 -52.501 104.093) 132.585 56.301 ( -4.692 52.581 -9.564) 53.650 69.983 ( 6.110 -27.185 0.899) 27.877 72.307 ( -72.362 -55.352 -5.282) 91.258 74.296 ( 16.640 11.304 -1.480) 20.171 74.471 ( -15.787 -19.471 3.902) 25.369 ======================= Grid point 3 (4/150) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.831 ( 4.546 -12.563 -2.774) 13.645 1.232 ( 7.911 -11.836 9.557) 17.147 1.620 ( 1.968 -5.937 0.186) 6.257 2.051 ( -5.065 8.962 -4.536) 11.250 2.551 ( 0.744 -8.134 -2.571) 8.563 2.645 ( 13.147 -12.794 0.657) 18.356 2.943 ( 3.581 2.326 10.749) 11.566 2.998 ( 1.699 1.832 -5.389) 5.940 3.631 ( 2.462 -11.757 5.123) 13.059 3.684 ( 1.562 -5.267 3.695) 6.621 3.812 ( 3.740 2.998 3.387) 5.869 3.885 ( -0.370 1.368 -2.405) 2.791 4.168 ( -1.283 -1.076 -3.925) 4.267 4.415 ( 3.677 5.360 -0.426) 6.514 4.562 ( 0.137 -0.513 3.536) 3.576 4.832 ( -0.144 5.129 -1.729) 5.414 5.418 ( 2.485 3.735 0.091) 4.487 5.434 ( -4.923 -0.836 1.151) 5.125 5.695 ( 0.696 2.531 -1.264) 2.914 6.003 ( -2.272 0.383 -1.965) 3.028 6.358 ( -3.187 -4.793 1.502) 5.948 6.620 ( -2.245 -12.855 -0.406) 13.056 6.732 ( 1.299 7.690 -0.946) 7.856 6.957 ( 0.963 9.510 1.057) 9.617 7.493 ( 4.901 0.271 -4.646) 6.759 7.568 ( -1.169 -2.213 1.516) 2.927 7.995 ( 0.203 11.766 -2.234) 11.978 8.260 ( -5.542 2.991 0.510) 6.318 10.430 ( 3.134 -20.838 3.127) 21.303 11.151 ( -1.654 -5.788 6.964) 9.205 11.224 ( -3.026 14.110 -11.471) 18.435 11.827 ( -7.100 9.361 -0.729) 11.772 14.482 ( -10.426 -9.845 -4.478) 15.023 14.828 ( -7.315 -16.702 4.771) 18.848 15.357 ( 4.868 4.977 -2.565) 7.420 15.610 ( -0.322 4.956 4.154) 6.475 27.154 ( 0.563 -1.773 0.145) 1.866 27.255 ( -0.321 2.801 -0.250) 2.831 27.632 ( -0.420 -0.341 -0.447) 0.702 27.665 ( 0.099 0.564 0.238) 0.620 27.784 ( 0.953 -4.758 0.952) 4.944 27.966 ( -1.560 4.048 -0.591) 4.378 31.406 ( 1.553 -4.398 2.613) 5.346 31.693 ( -1.892 6.146 -2.409) 6.867 32.355 ( -2.077 -1.098 -1.789) 2.953 32.631 ( 1.172 -0.082 1.312) 1.761 35.138 ( 1.100 -0.880 1.241) 1.877 35.204 ( -1.070 0.522 -0.789) 1.428 36.157 ( -0.532 -3.172 -0.184) 3.221 36.223 ( 0.813 2.550 0.270) 2.690 44.316 ( 0.347 -4.134 1.005) 4.269 44.458 ( 6.313 -5.688 -1.551) 8.638 44.632 ( 0.676 3.076 -1.800) 3.627 44.935 ( -5.831 9.549 3.178) 11.631 46.564 ( -0.376 1.060 -1.597) 1.953 46.800 ( -4.578 -4.823 2.034) 6.954 47.447 ( -3.682 -7.308 -2.961) 8.703 47.609 ( 4.701 6.824 1.059) 8.354 51.543 ( -14.675 -12.664 -17.136) 25.872 53.038 ( 13.016 -8.454 -5.334) 16.412 54.114 ( -36.907 -45.877 51.686) 78.347 55.430 ( 0.235 57.020 -14.427) 58.818 70.463 ( 6.880 -22.349 1.881) 23.460 71.986 ( -32.911 -13.430 -4.378) 35.814 74.367 ( 12.184 9.179 -1.402) 15.319 74.517 ( -11.232 -14.103 2.963) 18.271 ======================= Grid point 4 (5/150) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( 0.000 -0.000 0.000) 0.000 1.421 ( 0.000 -0.000 0.000) 0.000 1.668 ( 0.000 -0.000 0.000) 0.000 1.910 ( 0.000 -0.000 -0.000) 0.000 2.584 ( 0.000 -0.000 -0.000) 0.000 2.856 ( 0.000 -0.000 -0.000) 0.000 2.969 ( -0.000 -0.000 0.000) 0.000 3.015 ( 0.000 -0.000 0.000) 0.000 3.750 ( 0.000 -0.000 0.000) 0.000 3.781 ( -0.000 -0.000 0.000) 0.000 3.784 ( 0.000 0.000 -0.000) 0.000 3.858 ( 0.000 -0.000 -0.000) 0.000 4.171 ( 0.000 -0.000 -0.000) 0.000 4.372 ( 0.000 -0.000 0.000) 0.000 4.610 ( 0.000 -0.000 -0.000) 0.000 4.771 ( 0.000 -0.000 0.000) 0.000 5.388 ( 0.000 0.000 -0.000) 0.000 5.418 ( -0.000 -0.000 0.000) 0.000 5.679 ( 0.000 -0.000 0.000) 0.000 5.986 ( 0.000 -0.000 0.000) 0.000 6.370 ( 0.000 -0.000 -0.000) 0.000 6.675 ( 0.000 -0.000 0.000) 0.000 6.777 ( 0.000 0.000 -0.000) 0.000 6.819 ( 0.000 -0.000 -0.000) 0.000 7.529 ( -0.000 -0.000 0.000) 0.000 7.580 ( 0.000 -0.000 -0.000) 0.000 7.905 ( 0.000 -0.000 -0.000) 0.000 8.189 ( 0.000 -0.000 0.000) 0.000 10.748 ( 0.000 -0.000 0.000) 0.000 10.874 ( 0.000 0.000 -0.000) 0.000 11.298 ( 0.000 -0.000 -0.000) 0.000 11.664 ( 0.000 -0.000 -0.000) 0.000 14.470 ( 0.000 -0.000 0.000) 0.000 14.910 ( 0.000 -0.000 -0.000) 0.000 15.346 ( 0.000 -0.000 0.000) 0.000 15.573 ( 0.000 -0.000 -0.000) 0.000 27.181 ( 0.000 -0.000 -0.000) 0.000 27.223 ( 0.000 0.000 -0.000) 0.000 27.631 ( 0.000 -0.000 -0.000) 0.000 27.661 ( 0.000 -0.000 0.000) 0.000 27.857 ( 0.000 -0.000 0.000) 0.000 27.893 ( -0.000 0.000 -0.000) 0.000 31.473 ( 0.000 -0.000 0.000) 0.000 31.610 ( 0.000 -0.000 -0.000) 0.000 32.346 ( 0.000 -0.000 -0.000) 0.000 32.642 ( 0.000 -0.000 0.000) 0.000 35.162 ( 0.000 -0.000 0.000) 0.000 35.184 ( 0.000 -0.000 -0.000) 0.000 36.189 ( 0.000 0.000 0.000) 0.000 36.198 ( 0.000 -0.000 -0.000) 0.000 44.353 ( 0.000 -0.000 0.000) 0.000 44.605 ( 0.000 -0.000 0.000) 0.000 44.609 ( -0.000 0.000 -0.000) 0.000 44.766 ( -0.000 0.000 0.000) 0.000 46.552 ( 0.000 -0.000 0.000) 0.000 46.802 ( 0.000 -0.000 -0.000) 0.000 47.472 ( 0.000 0.000 0.000) 0.000 47.594 ( 0.000 -0.000 -0.000) 0.000 51.510 ( 0.000 -0.000 0.000) 0.000 53.201 ( 0.000 -0.000 -0.000) 0.000 54.363 ( 0.000 0.000 -0.000) 0.000 54.834 ( 0.000 -0.000 0.000) 0.000 70.717 ( 0.000 -0.000 0.000) 0.000 71.795 ( 0.000 -0.000 -0.000) 0.000 74.392 ( 0.000 0.000 -0.000) 0.000 74.538 ( -0.000 -0.000 0.000) 0.000 ======================= Grid point 10 (6/150) ======================= q-point: ( 0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.498 ( 21.697 0.000 -4.659) 22.192 0.584 ( 17.133 0.000 19.227) 25.753 1.191 ( 37.897 0.000 6.595) 38.467 1.494 ( 12.530 0.000 -2.991) 12.882 2.421 ( 0.665 0.000 -0.796) 1.037 2.478 ( 3.062 0.000 5.839) 6.593 2.524 ( 4.525 0.000 0.755) 4.588 2.960 ( 0.668 0.000 1.230) 1.400 3.537 ( 1.426 0.000 4.490) 4.711 3.677 ( -0.586 -0.000 -5.031) 5.065 3.699 ( -4.677 -0.000 18.180) 18.772 3.941 ( 6.720 0.000 -0.299) 6.726 4.154 ( -6.600 -0.000 9.288) 11.394 4.404 ( 1.227 0.000 3.550) 3.756 4.916 ( -1.887 -0.000 -1.594) 2.471 5.194 ( 1.269 0.000 -3.017) 3.273 5.381 ( -5.326 -0.000 1.397) 5.506 5.528 ( 1.808 0.000 -1.586) 2.405 5.876 ( -1.815 -0.000 4.686) 5.026 6.162 ( -3.157 -0.000 4.591) 5.572 6.217 ( -1.318 -0.000 0.794) 1.538 6.272 ( -2.741 -0.000 3.367) 4.342 7.002 ( 0.727 0.000 0.603) 0.944 7.112 ( 1.668 0.000 1.438) 2.203 7.513 ( 1.451 0.000 -15.300) 15.369 7.540 ( 2.351 0.000 -12.669) 12.885 8.321 ( -9.191 -0.000 -1.700) 9.347 8.580 ( 0.340 0.000 0.681) 0.761 9.914 ( 1.362 0.000 -14.566) 14.630 10.792 ( -1.260 -0.000 -1.287) 1.801 11.117 ( 0.133 0.000 0.867) 0.877 12.057 ( -3.494 -0.000 -2.194) 4.126 13.376 ( -5.334 -0.000 -0.908) 5.411 14.470 ( -4.827 -0.000 6.956) 8.467 15.398 ( 11.469 0.000 14.126) 18.196 15.839 ( 3.462 0.000 -0.022) 3.462 27.106 ( 0.622 0.000 0.068) 0.626 27.361 ( 0.011 0.000 -0.654) 0.654 27.616 ( -0.021 -0.000 0.537) 0.538 27.636 ( -0.288 -0.000 0.216) 0.360 27.679 ( 0.173 0.000 0.716) 0.736 28.093 ( -1.143 -0.000 -0.386) 1.207 31.279 ( 0.787 0.000 4.368) 4.438 31.922 ( -1.204 -0.000 -1.664) 2.054 32.297 ( -4.393 -0.000 -3.710) 5.750 32.607 ( 2.993 0.000 2.623) 3.979 35.097 ( 1.030 0.000 1.221) 1.597 35.215 ( -0.346 -0.000 -0.148) 0.376 36.079 ( -0.213 -0.000 -0.062) 0.221 36.269 ( 0.717 0.000 0.183) 0.740 44.194 ( -0.013 -0.000 1.414) 1.414 44.396 ( 2.580 0.000 -8.528) 8.910 44.654 ( 2.140 0.000 -1.906) 2.866 45.293 ( -4.224 -0.000 3.831) 5.702 46.358 ( -2.200 -0.000 2.620) 3.421 46.647 ( -0.709 -0.000 2.989) 3.072 47.272 ( -1.561 -0.000 -4.085) 4.374 47.720 ( 3.329 0.000 2.082) 3.927 50.107 ( -1.435 -0.000 2.643) 3.008 51.742 ( -1.953 -0.000 4.107) 4.548 53.554 ( -0.121 -0.000 118.386) 118.386 57.142 ( -9.045 -0.000 -8.133) 12.164 69.603 ( 6.784 0.000 -4.000) 7.875 70.118 ( -0.504 -0.000 -0.573) 0.763 74.446 ( 2.528 0.000 -1.304) 2.844 74.522 ( 22.523 0.000 -0.678) 22.533 ======================= Grid point 11 (7/150) ======================= q-point: ( 0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.759 ( 23.486 6.981 -0.156) 24.502 0.930 ( 15.480 -7.105 15.333) 22.917 1.578 ( 17.646 4.812 -0.425) 18.296 1.989 ( 23.875 -18.534 2.217) 30.306 2.373 ( 1.892 5.007 -6.122) 8.132 2.486 ( -0.221 1.203 8.198) 8.288 2.693 ( 4.786 -9.287 1.821) 10.605 3.090 ( 0.007 -13.761 2.265) 13.946 3.461 ( -0.189 13.955 3.932) 14.499 3.623 ( 4.569 -1.168 5.255) 7.061 3.747 ( -1.483 -4.467 0.670) 4.754 3.994 ( -2.232 3.600 4.047) 5.858 4.108 ( -0.031 -3.905 -2.155) 4.460 4.441 ( 3.164 -0.432 5.203) 6.105 4.824 ( -0.215 8.622 -2.167) 8.892 5.066 ( 3.051 12.284 -1.076) 12.703 5.347 ( -5.677 -3.766 1.352) 6.945 5.543 ( 2.418 2.187 -2.163) 3.912 5.825 ( 1.102 4.633 1.629) 5.034 6.025 ( -5.162 3.911 0.159) 6.478 6.245 ( -2.637 -1.347 2.891) 4.138 6.295 ( -3.534 -8.881 0.323) 9.564 6.967 ( 1.110 5.898 -0.539) 6.026 7.126 ( 1.903 2.573 2.274) 3.926 7.509 ( 0.704 -0.560 -4.901) 4.982 7.540 ( 3.228 2.207 -6.807) 7.851 8.160 ( -11.640 0.745 -1.754) 11.795 8.530 ( 0.392 7.930 -2.121) 8.218 9.945 ( 1.886 -7.645 -1.961) 8.115 10.825 ( -1.508 -7.606 -1.297) 7.862 11.394 ( -11.580 -23.421 -2.644) 26.261 11.922 ( -4.607 6.616 -3.543) 8.806 13.528 ( -14.652 -32.486 -3.129) 35.775 14.458 ( -4.493 -7.027 6.738) 10.722 15.575 ( 15.143 5.906 4.882) 16.971 15.859 ( 4.533 5.635 0.366) 7.242 27.121 ( 0.804 -0.522 0.109) 0.965 27.340 ( -0.190 2.367 -0.651) 2.462 27.620 ( -0.353 -0.351 -0.174) 0.527 27.657 ( 0.517 -2.758 0.310) 2.824 27.682 ( -0.018 -0.081 1.253) 1.255 28.057 ( -1.471 1.946 -0.525) 2.495 31.313 ( 1.395 -1.659 3.694) 4.283 31.861 ( -1.850 4.462 -2.458) 5.419 32.259 ( -4.260 -3.991 -3.577) 6.846 32.648 ( 2.450 0.605 2.320) 3.428 35.120 ( 1.380 -0.338 1.660) 2.185 35.211 ( -0.639 -0.110 -0.273) 0.703 36.085 ( -0.369 -1.419 -0.159) 1.475 36.275 ( 0.862 0.922 0.193) 1.277 44.214 ( 0.963 -1.853 1.198) 2.407 44.401 ( 5.430 2.037 -3.783) 6.924 44.693 ( 0.677 -0.263 -2.279) 2.392 45.182 ( -5.533 5.697 4.539) 9.147 46.430 ( -6.776 -11.112 -0.643) 13.031 46.649 ( -1.252 -2.462 4.618) 5.381 47.263 ( -1.855 -2.972 -5.660) 6.656 47.775 ( 4.706 2.102 2.526) 5.740 50.501 ( -19.075 -47.835 -10.018) 52.463 51.990 ( -4.735 -38.874 4.701) 39.442 53.714 ( 7.377 6.900 71.637) 72.345 56.767 ( -9.390 27.817 -11.431) 31.506 69.782 ( 8.872 -13.297 -0.186) 15.986 70.579 ( -17.948 -55.470 -1.246) 58.315 74.427 ( 2.885 7.401 -0.844) 7.988 74.869 ( 31.433 9.343 -1.156) 32.813 ======================= Grid point 12 (8/150) ======================= q-point: ( 0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.017 ( 20.443 4.703 0.578) 20.985 1.261 ( 11.498 -6.515 11.844) 17.746 1.727 ( 11.556 4.522 -0.219) 12.411 2.135 ( -0.772 10.165 -6.570) 12.128 2.474 ( -1.154 -1.476 5.419) 5.734 2.692 ( 18.250 -13.071 0.204) 22.449 2.885 ( 1.699 -7.972 1.747) 8.336 3.185 ( 0.668 6.665 1.220) 6.809 3.395 ( -1.075 -9.294 3.042) 9.838 3.733 ( 3.483 -2.218 5.024) 6.503 3.794 ( 0.605 -3.746 -0.467) 3.823 3.881 ( -6.404 1.321 0.559) 6.562 4.158 ( 2.319 -0.314 -2.467) 3.401 4.533 ( 4.726 -2.264 6.436) 8.300 4.674 ( 0.644 12.196 -1.276) 12.279 4.946 ( 1.575 9.532 -2.106) 9.888 5.297 ( -7.113 -2.985 0.668) 7.743 5.532 ( 3.064 4.028 -1.632) 5.318 5.774 ( 1.198 6.574 0.295) 6.689 5.942 ( -3.009 -2.603 -0.797) 4.058 6.244 ( -2.865 -4.075 2.445) 5.549 6.397 ( -2.630 -12.215 0.206) 12.497 6.873 ( 0.806 8.753 -0.570) 8.808 7.095 ( 1.810 6.248 1.773) 6.742 7.520 ( -1.438 -1.627 1.119) 2.443 7.565 ( 4.015 0.944 -6.138) 7.395 7.954 ( -12.129 1.796 -1.427) 12.344 8.392 ( 2.303 11.214 -3.161) 11.876 10.178 ( 1.975 -18.895 2.243) 19.130 10.963 ( -0.373 -13.629 -0.189) 13.635 11.326 ( -9.027 6.940 -2.160) 11.589 11.776 ( -6.095 2.124 -3.644) 7.412 13.767 ( -17.455 -34.297 -2.921) 38.594 14.562 ( -3.034 -13.912 5.542) 15.279 15.670 ( 12.531 12.715 -0.956) 17.877 15.836 ( 9.109 9.624 1.804) 13.374 27.145 ( 0.826 -1.061 0.130) 1.350 27.293 ( -0.421 3.167 -0.450) 3.226 27.619 ( -0.298 -0.444 -0.182) 0.565 27.674 ( 0.081 0.496 0.148) 0.524 27.731 ( 0.966 -4.712 1.199) 4.958 27.995 ( -1.516 3.213 -0.640) 3.610 31.380 ( 1.782 -3.359 3.454) 5.137 31.745 ( -2.308 6.120 -3.054) 7.219 32.264 ( -2.997 -4.795 -2.609) 6.228 32.669 ( 1.733 1.294 1.692) 2.746 35.150 ( 1.452 -0.446 1.708) 2.285 35.197 ( -0.713 0.480 -0.415) 0.954 36.107 ( -0.558 -2.504 -0.271) 2.580 36.268 ( 0.826 1.841 0.161) 2.024 44.276 ( 1.589 -3.394 0.700) 3.812 44.492 ( 6.005 -2.705 -2.732) 7.131 44.674 ( -0.360 2.483 -1.489) 2.918 44.987 ( -6.140 9.225 4.240) 11.865 46.452 ( -6.098 -6.653 -1.455) 9.141 46.707 ( -0.292 -6.012 5.283) 8.009 47.276 ( -2.790 -4.827 -6.278) 8.397 47.799 ( 5.453 5.878 2.984) 8.555 50.778 ( -19.417 -36.814 -11.383) 43.149 52.625 ( -6.825 -56.977 2.809) 57.453 53.792 ( 12.488 15.162 46.947) 50.891 56.113 ( -3.975 42.143 -15.184) 44.971 70.196 ( 6.281 -24.520 0.215) 25.313 71.014 ( -19.194 -45.319 -0.319) 49.217 74.331 ( 0.971 9.548 0.459) 9.608 75.181 ( 37.807 19.994 -1.964) 42.813 ======================= Grid point 13 (9/150) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( 13.300 9.306 3.273) 16.559 1.450 ( 3.527 0.930 5.989) 7.012 1.833 ( 13.289 4.233 -1.255) 14.003 1.955 ( -0.669 9.383 -6.403) 11.379 2.512 ( -0.529 -5.113 5.665) 7.650 2.896 ( -5.286 1.753 0.155) 5.572 2.963 ( 4.101 4.903 -4.420) 7.772 3.132 ( 5.701 4.610 3.594) 8.165 3.514 ( -6.328 -11.419 0.568) 13.068 3.715 ( -6.121 -0.126 -3.970) 7.297 3.829 ( -1.391 -2.043 2.698) 3.659 3.886 ( 3.754 -1.503 1.485) 4.308 4.195 ( 2.775 -0.050 0.645) 2.850 4.487 ( -1.046 10.611 0.251) 10.665 4.649 ( 5.031 0.612 5.207) 7.266 4.828 ( 0.744 7.574 -4.017) 8.606 5.256 ( -5.043 -5.106 -0.249) 7.181 5.524 ( 3.245 3.554 -2.225) 5.302 5.695 ( -0.869 3.116 1.413) 3.530 5.969 ( 0.206 -2.101 1.088) 2.375 6.299 ( -0.690 -7.308 0.510) 7.358 6.572 ( -0.993 -15.194 0.631) 15.240 6.749 ( -0.082 8.489 -0.465) 8.503 7.001 ( 1.914 10.726 1.099) 10.951 7.503 ( -3.051 0.497 2.366) 3.893 7.600 ( 1.755 -0.673 -3.597) 4.059 7.772 ( -9.587 -1.387 -0.995) 9.738 8.317 ( 5.589 6.002 -2.361) 8.534 10.522 ( 2.094 -22.968 1.701) 23.126 11.021 ( -6.236 16.426 -0.034) 17.570 11.199 ( 2.330 -14.970 0.791) 15.171 11.647 ( -4.561 2.746 -3.368) 6.300 13.990 ( -14.423 -30.740 -1.761) 34.001 14.772 ( -0.738 -17.430 3.850) 17.865 15.563 ( 4.322 17.362 -0.613) 17.903 15.886 ( 17.386 13.204 -0.652) 21.841 27.175 ( 0.698 -1.282 0.104) 1.464 27.241 ( -0.544 2.706 -0.243) 2.770 27.625 ( -0.041 -0.664 -0.014) 0.665 27.667 ( -0.005 0.591 0.202) 0.624 27.823 ( 1.376 -4.974 0.787) 5.221 27.921 ( -1.235 3.796 -0.708) 4.055 31.465 ( 1.647 -3.131 2.888) 4.566 31.624 ( -1.925 4.338 -2.794) 5.508 32.296 ( -1.410 -4.579 -1.298) 4.964 32.668 ( 0.961 1.944 0.868) 2.335 35.166 ( -0.320 0.844 -0.150) 0.915 35.189 ( 0.925 -0.334 0.982) 1.389 36.137 ( -0.682 -3.007 -0.318) 3.100 36.247 ( 0.651 2.651 0.102) 2.732 44.348 ( 1.835 -2.331 -0.361) 2.989 44.614 ( -0.585 1.645 0.154) 1.752 44.622 ( 2.032 -0.381 -2.161) 2.990 44.782 ( -3.186 5.312 2.527) 6.690 46.456 ( -4.510 -5.694 -0.507) 7.282 46.817 ( 2.930 -4.982 4.120) 7.098 47.297 ( -4.264 -6.759 -5.857) 9.908 47.778 ( 5.133 8.811 3.367) 10.739 51.019 ( -14.190 -34.840 -6.513) 38.178 53.385 ( 2.048 -48.807 -9.135) 49.697 53.791 ( 7.188 12.259 42.637) 44.943 55.499 ( 9.225 39.761 -20.445) 45.651 70.550 ( -2.885 -16.363 -1.738) 16.706 71.419 ( -3.695 -38.643 2.633) 38.909 74.194 ( -2.746 7.154 1.587) 7.825 75.433 ( 44.088 29.946 -2.830) 53.372 ======================= Grid point 14 (10/150) ======================= q-point: (-0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( 7.391 17.483 5.750) 19.833 1.333 ( -2.027 14.307 -3.636) 14.901 1.813 ( 4.383 12.574 -2.314) 13.516 2.061 ( 12.341 -5.081 -0.548) 13.357 2.610 ( -1.754 -0.569 5.504) 5.805 2.643 ( -9.436 9.846 2.862) 13.935 2.869 ( -0.220 6.683 -6.500) 9.325 3.050 ( -4.631 9.985 -0.670) 11.027 3.504 ( -9.549 -5.148 -4.010) 11.566 3.641 ( -5.934 -2.530 -2.405) 6.885 3.825 ( 0.501 3.339 0.626) 3.434 3.919 ( 1.047 2.232 0.256) 2.479 4.226 ( 1.858 2.049 3.198) 4.228 4.395 ( 2.082 2.094 1.947) 3.537 4.618 ( 0.183 7.604 -1.499) 7.753 4.799 ( 1.166 -0.765 -0.662) 1.543 5.295 ( -1.901 -6.843 -0.111) 7.103 5.515 ( 1.487 2.152 -2.609) 3.695 5.679 ( 0.768 -0.261 2.566) 2.691 6.006 ( 0.771 -2.322 2.455) 3.466 6.419 ( 2.891 -5.388 -1.334) 6.258 6.642 ( -1.903 2.833 -0.632) 3.471 6.776 ( -0.035 -11.456 1.229) 11.522 6.864 ( 2.427 11.313 0.485) 11.580 7.419 ( -6.049 0.614 3.053) 6.803 7.616 ( 1.308 1.919 -2.043) 3.093 7.750 ( -4.887 -11.617 0.173) 12.604 8.367 ( 6.736 0.812 -1.244) 6.898 10.663 ( -3.121 18.354 -3.472) 18.939 10.919 ( 1.228 -23.883 2.319) 24.027 11.323 ( 0.705 6.299 4.930) 8.030 11.695 ( 1.889 -16.797 -3.165) 17.197 14.225 ( -8.881 -26.697 -0.574) 28.141 15.029 ( 2.828 -13.541 1.746) 13.943 15.344 ( -0.174 15.299 1.125) 15.341 15.953 ( 19.913 16.400 -2.763) 25.944 27.178 ( -0.092 2.145 -0.151) 2.152 27.225 ( 0.054 -1.760 0.124) 1.765 27.637 ( 0.267 -0.692 0.333) 0.813 27.659 ( -0.089 0.276 -0.082) 0.301 27.836 ( -0.677 4.327 -0.535) 4.412 27.926 ( 1.306 -4.767 0.385) 4.958 31.453 ( -0.833 4.980 -1.061) 5.160 31.631 ( 0.876 -5.632 1.028) 5.792 32.349 ( 0.109 -4.094 0.071) 4.096 32.645 ( 0.197 2.576 -0.046) 2.584 35.139 ( -0.646 1.275 -0.649) 1.570 35.215 ( 1.055 -0.501 0.922) 1.488 36.170 ( -0.635 -2.930 -0.244) 3.008 36.212 ( 0.410 3.171 0.024) 3.198 44.374 ( 1.447 2.762 -1.665) 3.535 44.484 ( -4.554 9.202 0.924) 10.309 44.579 ( -2.131 -1.556 2.056) 3.346 44.879 ( 4.384 -8.545 -1.872) 9.785 46.483 ( -2.780 -5.599 0.308) 6.259 46.936 ( 6.473 -0.168 2.331) 6.882 47.332 ( -5.547 -9.737 -4.300) 12.003 47.710 ( 3.737 10.502 3.325) 11.632 51.357 ( -6.799 -34.641 1.157) 35.321 53.406 ( 7.815 39.205 3.309) 40.113 54.384 ( -1.446 -65.185 17.387) 67.479 55.296 ( 29.761 23.295 -25.523) 45.605 70.550 ( -6.670 3.997 -2.323) 8.116 72.059 ( 10.751 -40.230 4.414) 41.875 74.060 ( -6.216 1.710 1.837) 6.703 75.666 ( 53.820 38.299 -3.286) 66.138 ======================= Grid point 15 (11/150) ======================= q-point: (-0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.958 ( 3.287 20.852 5.129) 21.723 1.040 ( 0.593 21.565 -7.381) 22.801 1.671 ( 6.625 19.309 -0.735) 20.427 2.084 ( -17.819 24.908 2.887) 30.762 2.310 ( 10.723 -0.125 0.744) 10.750 2.635 ( -0.907 7.178 1.815) 7.459 2.762 ( -5.522 8.795 -3.689) 11.021 2.899 ( -3.346 -12.396 -1.719) 12.954 3.423 ( -6.510 -2.632 -4.029) 8.096 3.538 ( -6.539 4.576 -1.927) 8.211 3.744 ( 1.110 8.192 -1.163) 8.348 3.875 ( -0.622 3.791 1.477) 4.116 4.216 ( 0.793 2.769 1.436) 3.218 4.428 ( 2.278 0.508 1.011) 2.544 4.535 ( -0.971 1.281 -1.403) 2.134 4.830 ( -0.337 -2.761 0.065) 2.782 5.369 ( -0.577 -5.309 0.048) 5.340 5.496 ( -0.186 1.490 -0.715) 1.664 5.720 ( 1.464 -2.177 0.395) 2.653 6.076 ( 1.464 -4.189 1.458) 4.671 6.452 ( 2.499 6.484 -0.870) 7.003 6.669 ( -0.616 -8.036 -1.176) 8.145 6.719 ( 1.475 9.299 3.377) 10.002 6.929 ( -0.580 -7.846 -1.713) 8.052 7.346 ( -4.046 -0.689 3.002) 5.085 7.592 ( 0.475 2.451 -0.747) 2.606 7.931 ( -1.658 -18.632 0.780) 18.722 8.459 ( 4.350 -1.120 -0.453) 4.515 10.344 ( -1.567 19.079 -1.494) 19.202 11.176 ( 0.710 11.704 -1.187) 11.786 11.307 ( 0.840 -24.371 3.688) 24.663 12.025 ( 4.239 -18.618 0.356) 19.098 14.493 ( -2.616 -22.258 0.101) 22.411 15.018 ( 1.682 18.902 2.072) 19.089 15.360 ( -0.110 -16.302 0.516) 16.310 16.011 ( 19.977 16.599 -3.192) 26.168 27.143 ( -0.173 2.066 -0.079) 2.074 27.261 ( 0.076 -2.772 0.095) 2.774 27.647 ( 0.302 0.257 0.562) 0.688 27.661 ( -0.025 -0.950 -0.264) 0.986 27.762 ( -0.337 4.613 -0.508) 4.653 28.010 ( 0.970 -4.111 0.232) 4.230 31.364 ( -0.664 4.745 -1.130) 4.923 31.742 ( 0.821 -6.831 0.952) 6.946 32.415 ( 1.164 -3.553 1.163) 3.916 32.600 ( -0.461 3.176 -0.901) 3.333 35.112 ( -0.415 1.220 -0.487) 1.377 35.236 ( 0.685 -0.507 0.436) 0.958 36.169 ( 0.211 3.278 0.072) 3.285 36.202 ( -0.413 -2.496 -0.197) 2.538 44.285 ( -2.530 8.167 0.674) 8.576 44.330 ( -0.584 5.128 -1.193) 5.297 44.608 ( -0.814 -4.285 1.307) 4.553 45.065 ( 2.621 -9.542 -1.419) 9.997 46.532 ( -1.125 -5.094 0.499) 5.240 47.006 ( 6.183 4.335 0.610) 7.576 47.408 ( -3.758 -11.315 -2.097) 12.105 47.600 ( 1.512 10.653 2.592) 11.068 51.814 ( 1.456 -32.385 8.829) 33.598 52.857 ( -1.344 40.124 1.772) 40.186 55.358 ( 18.972 -44.437 -0.663) 48.322 55.606 ( 26.547 -10.967 -19.321) 34.617 70.278 ( -3.565 21.034 -1.111) 21.363 72.876 ( 14.723 -43.281 3.679) 45.865 73.983 ( -6.158 -4.361 1.122) 7.628 75.994 ( 66.102 39.788 -2.514) 77.194 ======================= Grid point 16 (12/150) ======================= q-point: (-0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.662 ( -0.000 21.757 -0.000) 21.757 0.731 ( -0.000 24.320 -0.000) 24.320 1.301 ( -0.000 42.623 -0.000) 42.623 1.564 ( -0.000 16.527 -0.000) 16.527 2.402 ( -0.000 0.144 -0.000) 0.144 2.516 ( -0.000 4.396 -0.000) 4.396 2.611 ( -0.000 6.157 -0.000) 6.157 3.083 ( 0.000 -13.276 0.000) 13.276 3.307 ( -0.000 16.979 -0.000) 16.979 3.438 ( 0.000 -8.084 0.000) 8.084 3.653 ( -0.000 4.723 -0.000) 4.723 3.812 ( -0.000 3.579 -0.000) 3.579 4.163 ( -0.000 5.304 -0.000) 5.304 4.440 ( -0.000 1.061 -0.000) 1.061 4.533 ( 0.000 -2.193 0.000) 2.193 4.876 ( 0.000 -3.967 0.000) 3.967 5.423 ( 0.000 -2.437 0.000) 2.437 5.473 ( -0.000 0.726 -0.000) 0.726 5.770 ( 0.000 -2.895 0.000) 2.895 6.154 ( 0.000 -3.963 0.000) 3.963 6.374 ( -0.000 5.605 -0.000) 5.605 6.592 ( -0.000 8.524 -0.000) 8.524 6.815 ( 0.000 -9.408 0.000) 9.408 7.011 ( 0.000 -4.831 0.000) 4.831 7.323 ( 0.000 -0.150 0.000) 0.150 7.563 ( -0.000 1.779 -0.000) 1.779 8.199 ( 0.000 -18.717 0.000) 18.717 8.511 ( 0.000 -1.270 0.000) 1.270 10.072 ( -0.000 16.380 -0.000) 16.380 11.006 ( -0.000 11.388 -0.000) 11.388 11.666 ( 0.000 -22.750 0.000) 22.750 12.291 ( 0.000 -11.176 0.000) 11.176 14.767 ( -0.000 15.223 -0.000) 15.223 14.775 ( 0.000 -17.262 0.000) 17.262 15.587 ( 0.000 -13.197 0.000) 13.197 16.019 ( -0.000 10.393 -0.000) 10.393 27.116 ( -0.000 1.398 -0.000) 1.398 27.304 ( 0.000 -2.952 0.000) 2.952 27.645 ( -0.000 0.293 -0.000) 0.293 27.678 ( 0.000 -1.019 0.000) 1.019 27.694 ( -0.000 4.245 -0.000) 4.245 28.069 ( 0.000 -2.892 0.000) 2.892 31.299 ( -0.000 3.393 -0.000) 3.393 31.844 ( 0.000 -6.007 0.000) 6.007 32.482 ( 0.000 -3.159 0.000) 3.159 32.541 ( -0.000 3.667 -0.000) 3.667 35.092 ( -0.000 0.916 -0.000) 0.916 35.251 ( 0.000 -0.562 0.000) 0.562 36.126 ( -0.000 2.761 -0.000) 2.761 36.230 ( 0.000 -1.803 0.000) 1.803 44.155 ( -0.000 6.123 -0.000) 6.123 44.258 ( -0.000 4.045 -0.000) 4.045 44.664 ( 0.000 -3.725 0.000) 3.725 45.216 ( 0.000 -8.386 0.000) 8.386 46.591 ( 0.000 -3.782 0.000) 3.782 46.995 ( -0.000 4.251 -0.000) 4.251 47.461 ( -0.000 9.559 -0.000) 9.559 47.533 ( 0.000 -9.072 0.000) 9.072 52.275 ( -0.000 33.735 -0.000) 33.735 52.328 ( 0.000 -29.478 0.000) 29.478 55.929 ( 0.000 -2.843 0.000) 2.843 56.380 ( 0.000 -57.798 0.000) 57.798 69.881 ( -0.000 27.736 -0.000) 27.736 73.659 ( 0.000 -42.651 0.000) 42.651 74.023 ( 0.000 -7.962 0.000) 7.962 76.321 ( -0.000 19.087 -0.000) 19.087 ======================= Grid point 19 (13/150) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( 15.405 0.000 16.184) 22.344 1.156 ( 19.862 0.000 -1.123) 19.893 1.878 ( 11.262 0.000 -1.254) 11.331 2.299 ( 33.049 0.000 4.482) 33.351 2.412 ( -1.021 -0.000 -5.628) 5.720 2.513 ( -0.723 -0.000 10.064) 10.090 2.694 ( 5.953 0.000 1.831) 6.228 2.997 ( 1.640 0.000 0.902) 1.872 3.588 ( -4.818 -0.000 6.968) 8.472 3.619 ( 0.103 0.000 -2.335) 2.337 3.716 ( 5.854 0.000 2.520) 6.374 3.910 ( -9.761 -0.000 -0.541) 9.776 4.145 ( 5.710 0.000 -1.351) 5.868 4.499 ( 4.607 0.000 5.578) 7.235 4.854 ( -1.684 -0.000 -1.500) 2.255 5.182 ( -7.388 -0.000 1.097) 7.469 5.200 ( -0.925 -0.000 -1.157) 1.481 5.605 ( 3.953 0.000 -3.404) 5.216 5.836 ( -1.383 -0.000 -1.656) 2.158 6.017 ( -4.898 -0.000 -1.286) 5.064 6.168 ( -2.432 -0.000 3.481) 4.246 6.219 ( -2.725 -0.000 8.164) 8.607 7.025 ( 0.711 0.000 -0.594) 0.926 7.177 ( 2.012 0.000 2.213) 2.991 7.486 ( -1.124 -0.000 -1.158) 1.613 7.601 ( 3.221 0.000 -9.132) 9.683 7.978 ( -12.313 -0.000 -1.297) 12.382 8.564 ( -1.081 -0.000 -1.094) 1.538 9.912 ( 0.555 0.000 -5.761) 5.788 10.739 ( -1.803 -0.000 -1.477) 2.331 11.116 ( -0.461 -0.000 1.030) 1.128 11.908 ( -5.443 -0.000 -3.017) 6.223 13.168 ( -7.414 -0.000 -1.938) 7.663 14.350 ( -3.981 -0.000 5.501) 6.790 15.874 ( 17.093 0.000 2.158) 17.229 15.972 ( 4.869 0.000 0.218) 4.874 27.130 ( 0.896 0.000 0.126) 0.904 27.354 ( -0.349 -0.000 -0.892) 0.958 27.620 ( 0.272 0.000 0.396) 0.481 27.636 ( 0.259 0.000 0.558) 0.615 27.684 ( -0.008 -0.000 0.735) 0.735 28.047 ( -1.641 -0.000 -0.586) 1.742 31.329 ( 1.566 0.000 3.771) 4.083 31.866 ( -1.927 -0.000 -2.723) 3.336 32.157 ( -3.852 -0.000 -3.411) 5.145 32.691 ( 2.010 0.000 1.906) 2.770 35.144 ( 1.637 0.000 1.942) 2.540 35.203 ( -0.385 -0.000 -0.099) 0.397 36.068 ( -0.481 -0.000 -0.246) 0.540 36.295 ( 0.861 0.000 0.130) 0.871 44.222 ( 1.795 0.000 1.096) 2.103 44.475 ( 3.838 0.000 -4.489) 5.906 44.699 ( 0.621 0.000 -1.537) 1.658 45.146 ( -5.914 -0.000 5.097) 7.807 46.281 ( -3.125 -0.000 2.850) 4.229 46.598 ( -3.343 -0.000 3.327) 4.716 47.222 ( -0.247 -0.000 -6.051) 6.056 47.871 ( 5.680 0.000 3.948) 6.917 50.043 ( -3.423 -0.000 3.468) 4.873 51.674 ( -3.190 -0.000 4.320) 5.371 54.053 ( 16.025 0.000 42.466) 45.389 56.791 ( -10.612 -0.000 -11.784) 15.858 69.856 ( 9.470 0.000 0.392) 9.478 70.087 ( -1.353 -0.000 -0.993) 1.679 74.537 ( 3.450 0.000 -2.120) 4.049 75.477 ( 38.508 0.000 -0.619) 38.513 ======================= Grid point 20 (14/150) ======================= q-point: ( 0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.360 ( 14.021 2.823 7.232) 16.027 1.418 ( 13.180 -0.786 4.866) 14.072 1.971 ( 6.976 4.611 0.017) 8.362 2.312 ( 3.849 10.739 -5.698) 12.752 2.487 ( -0.057 2.745 9.004) 9.413 2.798 ( 7.670 -6.887 -1.365) 10.398 2.875 ( 18.267 -5.980 5.128) 19.893 3.102 ( 1.233 -8.380 0.875) 8.515 3.448 ( -1.234 7.651 1.530) 7.899 3.670 ( -1.958 -4.505 -1.869) 5.256 3.758 ( -8.939 -0.370 -1.869) 9.140 3.822 ( 5.074 -1.700 3.413) 6.347 4.208 ( 3.181 0.541 -0.548) 3.273 4.590 ( 4.739 -0.164 5.441) 7.218 4.791 ( -0.673 4.988 -0.722) 5.085 5.063 ( -2.627 3.414 -0.875) 4.396 5.164 ( -5.093 -0.090 -0.424) 5.111 5.629 ( 3.110 3.866 -3.202) 5.905 5.846 ( -3.263 -3.633 0.072) 4.884 5.900 ( 1.333 6.379 -1.593) 6.709 6.174 ( -2.934 -0.861 4.679) 5.590 6.203 ( -3.411 -7.739 3.958) 9.338 6.991 ( 0.533 5.732 -0.685) 5.797 7.191 ( 1.843 2.651 2.360) 3.999 7.478 ( -1.215 -1.339 -0.066) 1.809 7.621 ( 1.933 1.654 -5.521) 6.078 7.789 ( -10.826 0.672 -1.478) 10.947 8.515 ( -0.637 4.352 -2.807) 5.218 9.985 ( 0.984 -10.331 -1.172) 10.443 10.779 ( -1.086 -9.311 -0.857) 9.413 11.179 ( -4.132 -6.835 0.145) 7.989 11.765 ( -4.847 6.296 -3.260) 8.588 13.189 ( -8.404 -17.834 -1.978) 19.813 14.362 ( -2.822 -8.005 4.089) 9.422 15.971 ( 5.615 9.095 0.035) 10.689 16.120 ( 15.405 2.616 0.614) 15.637 27.147 ( 0.826 -0.464 0.127) 0.956 27.327 ( -0.473 2.392 -0.644) 2.522 27.616 ( 0.080 0.389 0.160) 0.428 27.679 ( 0.672 -1.874 -0.667) 2.100 27.685 ( 0.122 -1.839 1.866) 2.623 28.008 ( -1.474 1.790 -0.584) 2.391 31.373 ( 1.693 -1.919 3.460) 4.304 31.790 ( -2.144 5.093 -2.969) 6.273 32.141 ( -2.838 -4.904 -2.596) 6.232 32.713 ( 1.439 0.881 1.415) 2.202 35.172 ( 1.541 -0.110 1.824) 2.390 35.195 ( -0.343 0.356 -0.083) 0.501 36.069 ( -0.561 -1.339 -0.328) 1.489 36.300 ( 0.715 0.956 0.067) 1.196 44.272 ( 2.698 -1.771 0.507) 3.266 44.540 ( 4.684 -1.377 -3.351) 5.922 44.687 ( -1.201 1.190 -0.900) 1.915 45.019 ( -5.711 6.098 4.567) 9.521 46.280 ( -3.710 -5.091 1.228) 6.418 46.591 ( -3.323 -6.258 3.692) 7.990 47.219 ( 0.268 -0.339 -5.631) 5.648 47.948 ( 5.558 2.601 3.798) 7.217 50.140 ( -7.440 -19.746 0.062) 21.102 51.875 ( -3.850 -32.856 5.175) 33.484 54.301 ( 18.588 9.297 26.816) 33.928 56.467 ( -6.960 21.229 -11.987) 25.353 70.032 ( 5.846 -9.751 -0.478) 11.379 70.319 ( -1.987 -28.736 0.637) 28.812 74.517 ( 2.914 8.722 -1.608) 9.336 76.005 ( 40.154 9.586 -0.719) 41.288 ======================= Grid point 21 (15/150) ======================= q-point: (-0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( 8.045 6.205 4.235) 11.007 1.569 ( 6.275 1.982 3.819) 7.608 1.967 ( 0.767 3.890 0.179) 3.969 2.245 ( 12.145 11.561 -7.588) 18.405 2.499 ( 2.402 -0.445 8.899) 9.228 2.853 ( -2.650 1.459 -0.408) 3.052 3.124 ( 6.970 4.724 0.273) 8.425 3.220 ( 1.871 -2.819 0.420) 3.409 3.366 ( -0.940 2.159 1.372) 2.726 3.599 ( -7.110 -0.351 -4.564) 8.456 3.751 ( -0.846 -5.405 0.908) 5.545 3.915 ( 2.867 -1.784 1.710) 3.785 4.239 ( 2.169 0.244 0.978) 2.391 4.575 ( -1.671 6.146 1.743) 6.604 4.771 ( 5.231 2.709 2.841) 6.540 4.965 ( -0.025 8.307 -2.103) 8.569 5.107 ( -4.755 -4.706 -0.859) 6.745 5.593 ( 0.043 3.364 -2.949) 4.474 5.752 ( -0.403 5.447 2.261) 5.911 5.956 ( 2.411 -1.887 -1.109) 3.256 6.181 ( -1.727 -5.985 2.814) 6.835 6.332 ( -1.863 -14.804 1.875) 15.038 6.880 ( -0.145 9.308 -0.584) 9.327 7.163 ( 2.468 6.193 2.065) 6.979 7.472 ( -2.918 1.126 1.605) 3.516 7.540 ( -6.458 -0.155 -3.558) 7.375 7.696 ( -0.450 0.794 -2.081) 2.272 8.446 ( 1.639 4.184 -2.753) 5.270 10.225 ( 0.753 -19.993 0.889) 20.027 10.979 ( 1.275 -17.955 0.629) 18.011 11.108 ( -4.873 7.004 0.224) 8.536 11.617 ( -3.966 3.974 -3.409) 6.569 13.387 ( -7.998 -26.251 -1.357) 27.476 14.509 ( -1.362 -15.669 2.539) 15.931 15.861 ( 3.223 15.097 0.116) 15.438 16.283 ( 14.530 6.319 -0.409) 15.850 27.169 ( 0.637 -0.956 0.097) 1.153 27.277 ( -0.464 3.242 -0.324) 3.291 27.616 ( 0.057 -0.325 0.069) 0.337 27.675 ( -0.044 0.541 0.222) 0.586 27.767 ( 1.047 -5.363 0.618) 5.499 27.953 ( -1.046 3.025 -0.521) 3.243 31.444 ( 1.667 -3.635 3.039) 5.023 31.668 ( -2.009 6.250 -2.885) 7.171 32.189 ( -1.561 -6.323 -1.494) 6.682 32.713 ( 0.882 1.789 0.850) 2.168 35.176 ( -0.267 1.079 -0.083) 1.114 35.203 ( 1.122 -0.313 1.257) 1.714 36.088 ( -0.535 -2.369 -0.319) 2.449 36.289 ( 0.483 1.900 0.023) 1.961 44.348 ( 3.058 -2.500 -0.327) 3.963 44.625 ( -2.530 2.834 0.180) 3.803 44.644 ( 4.277 -2.952 -3.109) 6.056 44.830 ( -4.635 8.595 3.664) 10.430 46.305 ( -3.388 -5.834 0.233) 6.751 46.700 ( -1.155 -12.451 3.571) 13.005 47.214 ( -0.198 0.156 -4.721) 4.727 47.965 ( 4.314 6.235 2.916) 8.123 50.359 ( -8.225 -27.965 -2.206) 29.233 52.475 ( -3.687 -55.336 5.349) 55.716 54.395 ( 15.697 20.689 17.013) 31.046 56.031 ( 1.618 26.444 -12.298) 29.208 70.265 ( -1.165 -15.730 -1.596) 15.854 70.808 ( 1.164 -39.373 2.215) 39.452 74.378 ( 1.557 14.439 -0.459) 14.530 76.417 ( 38.455 15.278 -1.022) 41.391 ======================= Grid point 22 (16/150) ======================= q-point: (-0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( 1.560 11.858 2.467) 12.211 1.552 ( 2.707 10.416 1.277) 10.837 1.917 ( 0.047 2.091 -0.478) 2.146 2.337 ( 15.647 4.851 -8.429) 18.423 2.576 ( 1.220 -2.528 10.327) 10.701 2.690 ( -5.296 11.174 0.761) 12.389 3.020 ( -0.056 14.983 -1.758) 15.086 3.154 ( -2.990 12.158 -1.973) 12.675 3.308 ( -5.788 -3.835 -0.913) 7.003 3.540 ( -3.138 -2.334 -1.530) 4.200 3.818 ( 0.075 -3.480 0.993) 3.619 3.955 ( 0.845 0.612 -0.038) 1.044 4.268 ( 1.151 0.145 1.622) 1.994 4.476 ( 0.554 4.661 0.890) 4.778 4.759 ( 0.986 8.889 1.913) 9.146 4.850 ( 1.093 5.570 -2.409) 6.166 5.162 ( -1.189 -8.294 -0.323) 8.385 5.541 ( -0.824 1.909 -1.616) 2.633 5.713 ( 1.171 2.065 1.615) 2.871 5.988 ( 0.358 -1.023 1.246) 1.652 6.305 ( 0.487 -10.941 -0.124) 10.953 6.559 ( -0.086 -16.868 0.362) 16.872 6.733 ( -0.546 9.639 -0.229) 9.657 7.087 ( 3.377 11.622 1.400) 12.183 7.334 ( -6.839 1.150 0.294) 6.941 7.552 ( -1.479 -6.687 -0.824) 6.898 7.673 ( 0.398 2.538 -0.914) 2.727 8.446 ( 2.545 0.478 -1.179) 2.845 10.563 ( 0.587 -24.598 0.032) 24.605 10.876 ( -2.671 15.479 -0.113) 15.708 11.312 ( 3.724 -19.546 5.135) 20.549 11.507 ( -3.780 1.484 -5.203) 6.599 13.693 ( -4.863 -29.506 -0.565) 29.909 14.765 ( -0.222 -20.304 1.082) 20.334 15.641 ( 1.229 19.723 0.245) 19.762 16.369 ( 10.411 8.313 -0.725) 13.342 27.194 ( 0.475 -1.267 0.030) 1.353 27.224 ( -0.436 2.899 -0.095) 2.933 27.627 ( 0.084 -0.877 0.078) 0.885 27.666 ( -0.035 0.623 0.089) 0.630 27.862 ( 0.873 -5.090 0.444) 5.183 27.891 ( -0.589 3.311 -0.472) 3.396 31.515 ( 1.078 1.858 2.163) 3.049 31.568 ( -1.176 -1.051 -2.133) 2.652 32.265 ( -0.472 -6.366 -0.478) 6.401 32.691 ( 0.375 2.671 0.297) 2.713 35.152 ( -0.249 1.454 -0.196) 1.488 35.223 ( 0.649 -0.372 0.654) 0.994 36.119 ( -0.346 -2.895 -0.187) 2.921 36.261 ( 0.231 2.717 0.003) 2.727 44.426 ( 3.422 -0.956 -1.623) 3.906 44.535 ( -3.539 2.216 1.438) 4.416 44.588 ( -2.001 11.048 0.555) 11.242 44.813 ( 1.945 -6.974 -0.475) 7.256 46.355 ( -1.850 -6.568 0.156) 6.825 46.908 ( 1.567 -14.437 2.916) 14.812 47.189 ( -1.580 0.796 -3.623) 4.032 47.906 ( 2.281 9.196 1.659) 9.619 50.717 ( -4.877 -35.976 -1.196) 36.324 53.345 ( -1.003 -68.005 1.275) 68.024 54.147 ( 5.253 38.879 10.549) 40.626 55.827 ( 10.854 11.994 -9.525) 18.772 70.418 ( -2.937 -9.543 -1.201) 10.056 71.482 ( 2.738 -48.043 1.895) 48.158 74.167 ( -0.129 15.199 0.309) 15.203 76.724 ( 30.612 15.245 -0.936) 34.211 ======================= Grid point 23 (17/150) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -0.000 16.322 -0.000) 16.322 1.365 ( -0.000 18.150 -0.000) 18.150 1.902 ( -0.000 2.795 -0.000) 2.795 2.321 ( -0.000 24.463 -0.000) 24.463 2.515 ( -0.000 1.054 -0.000) 1.054 2.618 ( -0.000 2.139 -0.000) 2.139 2.770 ( -0.000 6.445 -0.000) 6.445 2.919 ( -0.000 14.318 -0.000) 14.318 3.311 ( 0.000 -3.260 0.000) 3.260 3.534 ( -0.000 0.170 -0.000) 0.170 3.835 ( -0.000 2.079 -0.000) 2.079 3.928 ( -0.000 3.331 -0.000) 3.331 4.263 ( -0.000 1.979 -0.000) 1.979 4.453 ( -0.000 0.728 -0.000) 0.728 4.611 ( -0.000 9.590 -0.000) 9.590 4.814 ( -0.000 0.897 -0.000) 0.897 5.273 ( 0.000 -7.395 0.000) 7.395 5.512 ( -0.000 1.266 -0.000) 1.266 5.713 ( 0.000 -0.388 0.000) 0.388 6.025 ( 0.000 -3.605 0.000) 3.605 6.484 ( 0.000 -12.421 0.000) 12.421 6.592 ( -0.000 8.892 -0.000) 8.892 6.778 ( 0.000 -12.613 0.000) 12.613 6.922 ( -0.000 13.752 -0.000) 13.752 7.295 ( 0.000 -1.818 0.000) 1.818 7.634 ( -0.000 2.928 -0.000) 2.928 7.681 ( 0.000 -13.199 0.000) 13.199 8.475 ( 0.000 -1.017 0.000) 1.017 10.604 ( -0.000 18.572 -0.000) 18.572 10.941 ( 0.000 -26.221 0.000) 26.221 11.344 ( -0.000 10.062 -0.000) 10.062 11.724 ( 0.000 -25.042 0.000) 25.042 14.082 ( 0.000 -28.918 0.000) 28.918 15.070 ( 0.000 -21.037 0.000) 21.037 15.343 ( -0.000 21.950 -0.000) 21.950 16.330 ( -0.000 9.596 -0.000) 9.596 27.176 ( -0.000 2.747 -0.000) 2.747 27.226 ( 0.000 -2.224 0.000) 2.224 27.643 ( 0.000 -1.212 0.000) 1.212 27.657 ( -0.000 0.571 -0.000) 0.571 27.825 ( -0.000 4.425 -0.000) 4.425 27.950 ( 0.000 -5.175 0.000) 5.175 31.436 ( -0.000 5.902 -0.000) 5.902 31.648 ( 0.000 -6.815 0.000) 6.815 32.351 ( 0.000 -5.739 0.000) 5.739 32.649 ( -0.000 3.429 -0.000) 3.429 35.128 ( -0.000 1.482 -0.000) 1.482 35.234 ( 0.000 -0.477 0.000) 0.477 36.159 ( 0.000 -2.912 0.000) 2.912 36.219 ( -0.000 3.242 -0.000) 3.242 44.402 ( -0.000 8.461 -0.000) 8.461 44.413 ( -0.000 8.167 -0.000) 8.167 44.535 ( 0.000 -4.646 0.000) 4.646 44.948 ( 0.000 -9.033 0.000) 9.033 46.437 ( 0.000 -6.488 0.000) 6.488 47.123 ( -0.000 4.018 -0.000) 4.018 47.163 ( 0.000 -15.844 0.000) 15.844 47.777 ( -0.000 10.962 -0.000) 10.962 51.244 ( 0.000 -40.961 0.000) 40.961 53.534 ( -0.000 48.206 -0.000) 48.206 54.383 ( 0.000 -73.898 0.000) 73.898 55.866 ( -0.000 0.069 -0.000) 0.069 70.436 ( -0.000 4.429 -0.000) 4.429 72.243 ( 0.000 -52.023 0.000) 52.023 73.980 ( -0.000 8.518 -0.000) 8.518 76.802 ( -0.000 13.286 -0.000) 13.286 ======================= Grid point 28 (18/150) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 6.524 0.000 -1.136) 6.622 1.576 ( 10.175 0.000 10.097) 14.335 2.045 ( 0.134 0.000 1.224) 1.231 2.453 ( 5.649 0.000 -1.544) 5.856 2.545 ( 0.874 0.000 4.738) 4.818 2.824 ( 4.014 0.000 -0.205) 4.019 3.023 ( 3.911 0.000 1.197) 4.090 3.231 ( 19.420 0.000 4.060) 19.840 3.471 ( -3.581 -0.000 2.795) 4.543 3.619 ( -7.089 -0.000 -4.762) 8.540 3.619 ( 0.987 0.000 -4.157) 4.273 3.879 ( 3.186 0.000 2.404) 3.991 4.247 ( 1.443 0.000 0.296) 1.473 4.676 ( 4.210 0.000 5.133) 6.639 4.810 ( -0.945 -0.000 -0.600) 1.119 5.003 ( -3.263 -0.000 -1.203) 3.478 5.119 ( -3.907 -0.000 -0.409) 3.929 5.736 ( -4.277 -0.000 0.404) 4.296 5.743 ( 5.726 0.000 -5.107) 7.673 5.966 ( 1.852 0.000 -5.267) 5.583 6.080 ( -4.533 -0.000 6.270) 7.737 6.137 ( -4.077 -0.000 7.658) 8.675 7.042 ( 0.510 0.000 -0.564) 0.760 7.236 ( 1.257 0.000 2.333) 2.650 7.451 ( -0.887 -0.000 -0.215) 0.912 7.637 ( -8.721 -0.000 -1.590) 8.865 7.663 ( 1.936 0.000 -3.745) 4.216 8.521 ( -1.226 -0.000 -1.573) 1.994 9.914 ( 0.312 0.000 -2.289) 2.310 10.685 ( -1.296 -0.000 -0.840) 1.544 11.098 ( -0.746 -0.000 0.693) 1.019 11.742 ( -4.320 -0.000 -2.115) 4.810 12.960 ( -5.203 -0.000 -1.829) 5.515 14.269 ( -2.107 -0.000 2.726) 3.445 16.105 ( 3.439 0.000 0.286) 3.450 16.355 ( 12.748 0.000 0.040) 12.748 27.155 ( 0.636 0.000 0.107) 0.645 27.338 ( -0.443 -0.000 -0.574) 0.726 27.634 ( 0.445 0.000 0.260) 0.515 27.651 ( 0.484 0.000 0.469) 0.674 27.684 ( -0.068 -0.000 0.398) 0.404 28.000 ( -1.185 -0.000 -0.455) 1.270 31.387 ( 1.407 0.000 2.803) 3.136 31.801 ( -1.663 -0.000 -2.417) 2.934 32.056 ( -2.165 -0.000 -2.015) 2.957 32.740 ( 0.954 0.000 0.973) 1.363 35.194 ( -0.207 -0.000 0.000) 0.207 35.197 ( 1.314 0.000 1.546) 2.029 36.051 ( -0.496 -0.000 -0.316) 0.588 36.317 ( 0.511 0.000 0.012) 0.511 44.306 ( 3.338 0.000 0.199) 3.344 44.588 ( 3.946 0.000 -2.818) 4.849 44.670 ( -2.157 -0.000 -0.298) 2.177 44.992 ( -4.679 -0.000 3.877) 6.077 46.206 ( -2.018 -0.000 1.500) 2.514 46.483 ( -4.053 -0.000 2.110) 4.569 47.225 ( 1.072 0.000 -3.937) 4.081 48.053 ( 4.850 0.000 3.498) 5.980 49.935 ( -3.678 -0.000 2.086) 4.229 51.593 ( -2.459 -0.000 2.171) 3.280 54.663 ( 15.832 0.000 16.002) 22.510 56.500 ( -5.940 -0.000 -8.472) 10.347 70.040 ( -1.339 -0.000 -0.787) 1.553 70.124 ( 7.165 0.000 0.923) 7.224 74.620 ( 2.197 0.000 -1.722) 2.791 76.628 ( 32.662 0.000 -0.203) 32.662 ======================= Grid point 29 (19/150) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 1.795 0.843 -0.748) 2.120 1.681 ( 4.468 3.492 4.956) 7.531 2.024 ( -0.021 2.603 1.383) 2.948 2.494 ( 5.356 5.405 -6.132) 9.773 2.555 ( 2.162 0.205 7.386) 7.698 2.861 ( 0.405 1.692 0.073) 1.741 3.106 ( 0.991 -5.416 0.138) 5.507 3.370 ( 0.243 5.485 1.588) 5.715 3.439 ( 3.173 1.253 2.562) 4.266 3.532 ( 0.460 6.050 -4.727) 7.691 3.672 ( 0.577 -4.909 -1.262) 5.102 3.926 ( 1.397 -1.441 0.997) 2.241 4.262 ( 0.607 -0.205 0.508) 0.817 4.652 ( -0.449 6.607 1.665) 6.829 4.856 ( 3.481 -3.462 2.150) 5.360 4.974 ( -2.187 -0.870 -1.974) 3.072 5.041 ( -2.866 2.998 -0.348) 4.162 5.633 ( -1.533 4.623 -0.984) 4.969 5.825 ( 1.922 2.487 -1.093) 3.328 5.983 ( 3.678 -0.719 -4.929) 6.192 6.090 ( -4.003 -2.431 7.107) 8.511 6.110 ( -2.434 -10.173 2.086) 10.666 6.998 ( 0.094 6.491 -0.321) 6.500 7.247 ( 1.227 1.112 1.861) 2.491 7.450 ( -0.563 -1.085 0.252) 1.249 7.482 ( -5.094 5.664 -1.985) 7.872 7.698 ( 0.787 -1.298 -1.518) 2.146 8.490 ( -0.388 1.762 -1.312) 2.231 9.999 ( 0.224 -11.468 -0.457) 11.479 10.760 ( -0.180 -12.137 -0.122) 12.139 11.100 ( -1.313 -0.277 0.265) 1.368 11.641 ( -2.305 5.526 -1.421) 6.153 13.005 ( -3.150 -14.465 -0.954) 14.835 14.313 ( -0.948 -8.804 1.322) 8.953 16.079 ( 1.829 9.011 0.156) 9.196 16.500 ( 7.331 1.282 -0.135) 7.444 27.166 ( 0.346 -0.462 0.059) 0.580 27.313 ( -0.261 2.363 -0.254) 2.391 27.621 ( 0.147 0.861 0.111) 0.880 27.681 ( -0.037 0.308 0.128) 0.336 27.705 ( 0.464 -4.644 0.325) 4.678 27.973 ( -0.624 1.633 -0.265) 1.768 31.424 ( 0.899 -2.210 1.692) 2.925 31.729 ( -1.082 5.585 -1.556) 5.898 32.076 ( -1.001 -5.631 -0.970) 5.801 32.745 ( 0.465 0.958 0.476) 1.166 35.186 ( -0.114 0.711 -0.005) 0.720 35.215 ( 0.719 -0.140 0.834) 1.110 36.054 ( -0.303 -1.301 -0.200) 1.351 36.316 ( 0.257 0.984 -0.005) 1.017 44.365 ( 2.718 -1.454 -0.151) 3.087 44.621 ( -2.311 1.851 0.114) 2.963 44.655 ( 2.863 -2.443 -1.933) 4.231 44.889 ( -3.035 6.467 2.445) 7.551 46.204 ( -1.398 -2.882 0.505) 3.243 46.507 ( -1.951 -9.511 1.347) 9.802 47.228 ( 0.656 0.859 -2.127) 2.386 48.092 ( 2.689 3.347 1.902) 4.696 49.983 ( -2.855 -12.850 0.369) 13.168 51.800 ( -1.522 -31.552 1.713) 31.635 54.817 ( 9.281 8.519 7.725) 14.778 56.308 ( -1.844 14.721 -5.169) 15.710 70.081 ( -0.398 -8.102 -0.674) 8.140 70.383 ( 2.813 -22.818 0.854) 23.006 74.577 ( 1.108 9.000 -0.801) 9.104 76.994 ( 19.796 4.284 -0.175) 20.255 ======================= Grid point 30 (20/150) ======================= q-point: (-0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( -0.000 7.550 -0.000) 7.550 1.653 ( -0.000 3.023 -0.000) 3.023 1.971 ( -0.000 4.761 -0.000) 4.761 2.482 ( -0.000 2.131 -0.000) 2.131 2.588 ( 0.000 -0.228 0.000) 0.228 2.787 ( -0.000 7.239 -0.000) 7.239 3.192 ( 0.000 -5.237 0.000) 5.237 3.275 ( -0.000 7.841 -0.000) 7.841 3.319 ( -0.000 20.139 -0.000) 20.139 3.477 ( 0.000 -2.615 0.000) 2.615 3.754 ( 0.000 -5.331 0.000) 5.331 3.959 ( 0.000 -1.111 0.000) 1.111 4.274 ( 0.000 -0.539 0.000) 0.539 4.553 ( -0.000 5.979 -0.000) 5.979 4.882 ( -0.000 6.044 -0.000) 6.044 4.951 ( -0.000 6.420 -0.000) 6.420 5.021 ( 0.000 -9.239 0.000) 9.239 5.564 ( -0.000 3.005 -0.000) 3.005 5.771 ( -0.000 4.526 -0.000) 4.526 5.998 ( -0.000 1.516 -0.000) 1.516 6.159 ( 0.000 -9.010 0.000) 9.010 6.304 ( 0.000 -17.169 0.000) 17.169 6.874 ( -0.000 9.824 -0.000) 9.824 7.259 ( 0.000 -0.264 0.000) 0.264 7.307 ( -0.000 11.143 -0.000) 11.143 7.476 ( 0.000 -3.018 0.000) 3.018 7.705 ( -0.000 1.065 -0.000) 1.065 8.468 ( -0.000 0.838 -0.000) 0.838 10.236 ( 0.000 -20.290 0.000) 20.290 11.011 ( 0.000 -21.375 0.000) 21.375 11.033 ( -0.000 8.276 -0.000) 8.276 11.542 ( -0.000 5.048 -0.000) 5.048 13.263 ( 0.000 -24.128 0.000) 24.128 14.492 ( 0.000 -16.351 0.000) 16.351 15.911 ( -0.000 15.667 -0.000) 15.667 16.525 ( -0.000 3.589 -0.000) 3.589 27.179 ( 0.000 -0.993 0.000) 0.993 27.268 ( -0.000 3.319 -0.000) 3.319 27.618 ( 0.000 -0.262 0.000) 0.262 27.675 ( -0.000 0.539 -0.000) 0.539 27.786 ( 0.000 -5.712 0.000) 5.712 27.935 ( -0.000 2.939 -0.000) 2.939 31.481 ( 0.000 -4.325 0.000) 4.325 31.626 ( -0.000 6.858 -0.000) 6.858 32.162 ( 0.000 -6.891 0.000) 6.891 32.728 ( -0.000 1.891 -0.000) 1.891 35.171 ( -0.000 1.264 -0.000) 1.264 35.224 ( 0.000 -0.234 0.000) 0.234 36.078 ( 0.000 -2.323 0.000) 2.323 36.296 ( -0.000 1.927 -0.000) 1.927 44.421 ( 0.000 -2.914 0.000) 2.914 44.557 ( -0.000 3.952 -0.000) 3.952 44.735 ( 0.000 -5.292 0.000) 5.292 44.737 ( -0.000 10.655 -0.000) 10.655 46.252 ( 0.000 -5.317 0.000) 5.317 46.682 ( 0.000 -15.499 0.000) 15.499 47.211 ( -0.000 1.987 -0.000) 1.987 48.041 ( -0.000 6.664 -0.000) 6.664 50.233 ( 0.000 -25.159 0.000) 25.159 52.428 ( 0.000 -55.177 0.000) 55.177 54.669 ( -0.000 23.825 -0.000) 23.825 56.067 ( -0.000 14.967 -0.000) 14.967 70.230 ( 0.000 -12.295 0.000) 12.295 70.858 ( 0.000 -39.192 0.000) 39.192 74.403 ( -0.000 15.429 -0.000) 15.429 77.082 ( -0.000 6.179 -0.000) 6.179 ======================= Grid point 38 (21/150) ======================= q-point: (-0.50 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 0.000 -0.000 0.000) 0.000 1.757 ( 0.000 -0.000 0.000) 0.000 2.042 ( 0.000 -0.000 0.000) 0.000 2.562 ( 0.000 -0.000 0.000) 0.000 2.579 ( 0.000 -0.000 0.000) 0.000 2.886 ( 0.000 -0.000 0.000) 0.000 3.074 ( 0.000 -0.000 0.000) 0.000 3.394 ( 0.000 -0.000 0.000) 0.000 3.436 ( 0.000 -0.000 0.000) 0.000 3.636 ( 0.000 -0.000 0.000) 0.000 3.658 ( 0.000 -0.000 0.000) 0.000 3.924 ( 0.000 -0.000 0.000) 0.000 4.262 ( 0.000 -0.000 0.000) 0.000 4.736 ( 0.000 -0.000 0.000) 0.000 4.795 ( -0.000 0.000 -0.000) 0.000 4.976 ( 0.000 -0.000 0.000) 0.000 5.033 ( 0.000 -0.000 0.000) 0.000 5.662 ( 0.000 -0.000 0.000) 0.000 5.877 ( -0.000 0.000 -0.000) 0.000 5.964 ( -0.000 0.000 -0.000) 0.000 6.035 ( 0.000 -0.000 0.000) 0.000 6.039 ( 0.000 -0.000 0.000) 0.000 7.049 ( 0.000 -0.000 0.000) 0.000 7.260 ( 0.000 -0.000 0.000) 0.000 7.437 ( 0.000 -0.000 0.000) 0.000 7.495 ( 0.000 -0.000 0.000) 0.000 7.688 ( 0.000 -0.000 0.000) 0.000 8.497 ( 0.000 -0.000 0.000) 0.000 9.915 ( 0.000 -0.000 0.000) 0.000 10.663 ( 0.000 -0.000 0.000) 0.000 11.086 ( 0.000 -0.000 0.000) 0.000 11.668 ( 0.000 -0.000 0.000) 0.000 12.874 ( 0.000 -0.000 0.000) 0.000 14.241 ( 0.000 -0.000 0.000) 0.000 16.161 ( 0.000 -0.000 0.000) 0.000 16.561 ( 0.000 -0.000 0.000) 0.000 27.166 ( 0.000 -0.000 0.000) 0.000 27.330 ( 0.000 -0.000 0.000) 0.000 27.642 ( 0.000 -0.000 0.000) 0.000 27.660 ( 0.000 -0.000 0.000) 0.000 27.683 ( 0.000 -0.000 0.000) 0.000 27.980 ( 0.000 -0.000 0.000) 0.000 31.416 ( 0.000 -0.000 0.000) 0.000 31.768 ( 0.000 -0.000 0.000) 0.000 32.019 ( 0.000 -0.000 0.000) 0.000 32.755 ( 0.000 -0.000 0.000) 0.000 35.191 ( 0.000 -0.000 0.000) 0.000 35.221 ( 0.000 -0.000 0.000) 0.000 36.042 ( 0.000 -0.000 0.000) 0.000 36.325 ( 0.000 -0.000 0.000) 0.000 44.377 ( 0.000 -0.000 0.000) 0.000 44.616 ( 0.000 -0.000 0.000) 0.000 44.657 ( 0.000 -0.000 0.000) 0.000 44.917 ( 0.000 -0.000 0.000) 0.000 46.177 ( 0.000 -0.000 0.000) 0.000 46.416 ( 0.000 -0.000 0.000) 0.000 47.239 ( 0.000 -0.000 0.000) 0.000 48.140 ( 0.000 -0.000 0.000) 0.000 49.874 ( 0.000 -0.000 0.000) 0.000 51.556 ( 0.000 -0.000 0.000) 0.000 54.952 ( 0.000 -0.000 0.000) 0.000 56.396 ( 0.000 -0.000 0.000) 0.000 70.016 ( 0.000 -0.000 0.000) 0.000 70.243 ( 0.000 -0.000 0.000) 0.000 74.651 ( 0.000 -0.000 0.000) 0.000 77.169 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 67 (22/150) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.403 ( 2.514 0.000 20.211) 20.367 0.479 ( -7.572 -0.000 23.815) 24.990 0.980 ( 6.000 0.000 47.993) 48.366 1.290 ( -3.093 -0.000 2.571) 4.022 2.271 ( 4.595 0.000 -3.950) 6.059 2.408 ( 0.718 0.000 -4.176) 4.238 2.603 ( -0.462 -0.000 11.957) 11.966 2.939 ( 0.579 0.000 -0.896) 1.067 3.507 ( 0.706 0.000 -2.620) 2.713 3.672 ( 49.410 0.000 -2.943) 49.498 3.722 ( -3.133 -0.000 -0.168) 3.137 3.826 ( 1.390 0.000 3.065) 3.365 3.981 ( -1.294 -0.000 -4.297) 4.488 4.441 ( 1.492 0.000 5.453) 5.654 4.836 ( -4.592 -0.000 -9.387) 10.451 5.092 ( -2.157 -0.000 1.151) 2.445 5.442 ( 2.540 0.000 0.526) 2.594 5.497 ( 0.733 0.000 1.260) 1.458 5.510 ( -1.069 -0.000 2.757) 2.957 6.148 ( -0.019 -0.000 -3.720) 3.720 6.234 ( 0.409 0.000 -0.342) 0.533 6.325 ( -0.610 -0.000 -0.357) 0.707 7.033 ( -1.131 -0.000 6.546) 6.643 7.096 ( 0.915 0.000 1.421) 1.690 7.531 ( -0.632 -0.000 -0.671) 0.922 7.974 ( -20.216 -0.000 -1.036) 20.242 8.427 ( -3.388 -0.000 -7.399) 8.137 8.504 ( 3.951 0.000 -3.556) 5.316 10.075 ( -19.697 -0.000 2.187) 19.818 10.765 ( -0.446 -0.000 -4.558) 4.580 11.172 ( 0.110 0.000 5.576) 5.577 12.085 ( -1.270 -0.000 -3.066) 3.318 13.507 ( -0.976 -0.000 4.394) 4.501 14.509 ( 2.163 0.000 -4.241) 4.761 15.783 ( -0.088 -0.000 0.012) 0.089 15.813 ( 16.788 0.000 0.159) 16.789 27.103 ( -0.014 -0.000 0.764) 0.764 27.342 ( -0.206 -0.000 -1.807) 1.818 27.644 ( -0.012 -0.000 0.034) 0.036 27.653 ( 0.142 0.000 -0.024) 0.144 27.700 ( 0.335 0.000 2.498) 2.520 28.097 ( -0.119 -0.000 -1.408) 1.413 31.422 ( 2.661 0.000 3.650) 4.517 31.974 ( -1.396 -0.000 3.059) 3.363 32.336 ( -3.213 -0.000 -5.682) 6.527 32.537 ( 3.011 0.000 0.141) 3.014 35.225 ( -0.198 -0.000 0.369) 0.419 35.233 ( -1.068 -0.000 0.052) 1.069 36.094 ( -0.171 -0.000 1.173) 1.185 36.253 ( 0.200 0.000 -0.403) 0.450 44.074 ( -2.453 -0.000 0.627) 2.532 44.193 ( 1.272 0.000 -0.387) 1.329 44.640 ( -1.883 -0.000 2.298) 2.971 45.312 ( 2.850 0.000 -4.120) 5.010 46.439 ( 1.471 0.000 5.040) 5.251 46.847 ( -1.621 -0.000 4.109) 4.417 47.298 ( -3.229 -0.000 -0.945) 3.364 47.647 ( 1.474 0.000 -1.935) 2.432 50.168 ( 1.542 0.000 4.585) 4.837 51.688 ( -3.818 -0.000 -7.685) 8.581 57.396 ( -6.769 -0.000 9.265) 11.474 59.730 ( 150.790 0.000 -10.259) 151.139 69.529 ( -15.267 -0.000 1.982) 15.395 70.096 ( -0.044 -0.000 -2.915) 2.916 74.200 ( -0.754 -0.000 2.140) 2.269 74.411 ( 0.398 0.000 0.303) 0.500 ======================= Grid point 68 (23/150) ======================= q-point: ( 0.12 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.509 ( -2.993 -8.332 20.340) 22.184 0.741 ( 17.976 -11.192 12.535) 24.608 1.288 ( 5.184 -10.312 21.863) 24.722 1.479 ( 13.911 -18.565 15.636) 27.976 2.297 ( 0.027 2.442 -4.775) 5.364 2.508 ( 5.430 -7.171 -1.845) 9.182 2.613 ( 1.094 1.322 9.316) 9.472 3.085 ( 2.687 -15.074 0.415) 15.317 3.529 ( 0.655 -2.752 -2.743) 3.940 3.541 ( -2.407 16.341 0.279) 16.520 3.822 ( 1.254 2.694 4.315) 5.239 4.009 ( 0.530 -2.852 -0.273) 2.914 4.089 ( 29.189 22.536 -5.962) 37.355 4.389 ( -5.109 2.858 2.570) 6.393 4.644 ( 0.612 5.576 0.112) 5.611 4.977 ( 1.247 6.544 3.280) 7.426 5.456 ( 0.552 -0.350 1.956) 2.062 5.484 ( 0.037 1.150 0.347) 1.202 5.745 ( 0.436 -7.590 -8.310) 11.263 6.089 ( -1.515 4.062 -3.737) 5.724 6.316 ( 0.921 -2.808 -0.689) 3.034 6.355 ( -2.238 -8.910 -2.595) 9.546 6.994 ( -0.116 5.366 6.210) 8.208 7.134 ( 2.358 -0.789 1.805) 3.072 7.435 ( -9.368 7.140 7.902) 14.184 7.575 ( -2.467 3.008 5.538) 6.768 8.308 ( -3.734 6.947 -7.396) 10.812 8.495 ( -0.190 4.846 -3.350) 5.895 9.917 ( -0.497 -8.169 4.072) 9.141 10.796 ( -0.892 -6.004 -6.042) 8.564 11.677 ( -10.823 -27.653 -14.298) 32.959 11.983 ( -4.118 2.875 -5.492) 7.442 13.885 ( -11.816 -46.025 -14.329) 49.631 14.583 ( -2.767 -10.924 -2.513) 11.546 15.740 ( -2.108 8.071 2.411) 8.683 15.778 ( -3.353 5.115 3.803) 7.202 27.111 ( 0.291 -0.608 0.786) 1.036 27.326 ( -0.168 1.553 -1.611) 2.244 27.634 ( -0.549 0.315 0.447) 0.775 27.650 ( 0.191 -0.654 0.097) 0.688 27.721 ( -0.056 -1.256 2.558) 2.851 28.076 ( -0.830 1.656 -1.544) 2.411 31.403 ( 0.126 1.797 7.552) 7.763 31.918 ( -2.206 4.295 1.813) 5.157 32.305 ( -4.239 -3.873 -6.491) 8.666 32.589 ( 3.029 0.007 0.059) 3.030 35.164 ( -0.469 2.091 4.080) 4.608 35.238 ( -1.320 -0.730 0.120) 1.513 36.097 ( -0.261 -1.093 0.763) 1.358 36.252 ( 0.540 0.863 -0.294) 1.059 44.125 ( 4.604 -1.488 -1.447) 5.050 44.230 ( 1.518 -2.436 0.333) 2.890 44.651 ( -0.988 -1.331 -0.988) 1.930 45.297 ( 0.438 5.047 -2.130) 5.496 46.551 ( -1.740 -6.719 0.170) 6.943 46.851 ( -4.058 -5.504 4.699) 8.298 47.278 ( -3.816 -4.899 -3.321) 7.042 47.652 ( 3.703 4.057 -0.863) 5.560 50.725 ( -10.992 -54.967 -22.631) 60.451 51.792 ( 0.184 -23.176 -12.528) 26.346 57.005 ( -12.261 34.411 3.671) 36.714 57.949 ( -95.225 92.997 105.198) 169.655 69.592 ( 2.917 -20.491 4.127) 21.105 71.562 ( -61.101 -138.845 -59.218) 162.844 74.223 ( 9.523 6.840 1.420) 11.811 74.440 ( -2.688 -7.178 -0.170) 7.666 ======================= Grid point 69 (24/150) ======================= q-point: ( 0.25 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.667 ( 2.285 -10.483 13.796) 17.477 1.145 ( 12.905 -8.814 11.081) 19.157 1.524 ( 4.528 -10.328 10.048) 15.104 2.070 ( 14.550 -19.736 9.772) 26.395 2.202 ( -1.947 4.605 -3.238) 5.957 2.599 ( 1.670 -0.065 4.691) 4.980 2.768 ( 6.595 -9.824 -0.495) 11.843 3.229 ( -0.587 10.363 3.804) 11.054 3.441 ( 5.155 -12.283 2.806) 13.613 3.602 ( 1.097 -5.826 -2.525) 6.444 3.813 ( -0.191 0.347 1.524) 1.575 3.996 ( 7.659 13.382 5.180) 16.266 4.116 ( 0.331 1.319 -3.364) 3.629 4.350 ( 3.273 1.217 -4.937) 6.047 4.622 ( 1.625 2.428 1.816) 3.440 4.906 ( 0.160 5.604 0.990) 5.693 5.455 ( 0.804 2.620 1.377) 3.067 5.486 ( -0.981 -1.708 1.017) 2.217 5.723 ( -2.549 3.088 -3.949) 5.624 5.992 ( -2.770 3.315 -4.696) 6.381 6.365 ( -1.583 -5.639 1.761) 6.116 6.467 ( -1.459 -10.682 -0.212) 10.783 6.899 ( 0.414 8.994 6.096) 10.874 7.129 ( -0.241 5.847 5.452) 7.998 7.335 ( 1.843 -0.150 -1.730) 2.532 7.571 ( -0.486 -1.767 1.113) 2.144 8.111 ( -2.043 11.760 -6.274) 13.485 8.380 ( -4.169 4.872 -2.994) 7.077 10.134 ( 2.442 -16.824 0.917) 17.025 10.881 ( -0.609 -8.345 -9.518) 12.673 11.556 ( -5.847 13.240 0.017) 14.473 11.923 ( -7.914 -3.370 -7.869) 11.658 14.228 ( -14.403 -31.910 -11.275) 36.781 14.727 ( -4.035 -16.340 -0.049) 16.831 15.519 ( -3.113 12.789 5.542) 14.281 15.722 ( 1.712 5.163 1.159) 5.562 27.132 ( 0.493 -1.216 0.745) 1.509 27.290 ( -0.219 2.498 -0.984) 2.694 27.628 ( -0.440 -0.256 -0.042) 0.511 27.666 ( 0.331 -0.582 -0.112) 0.679 27.749 ( 0.162 -2.417 2.479) 3.466 28.022 ( -1.376 3.013 -1.554) 3.659 31.427 ( 1.215 -1.758 7.267) 7.575 31.802 ( -2.836 6.148 0.522) 6.791 32.296 ( -3.317 -3.941 -4.932) 7.131 32.623 ( 2.251 0.810 -0.353) 2.419 35.161 ( 0.814 0.206 3.458) 3.559 35.221 ( -1.182 0.293 0.004) 1.218 36.120 ( -0.370 -2.390 0.146) 2.423 36.243 ( 0.724 1.678 -0.204) 1.839 44.227 ( 3.770 -4.025 -0.987) 5.602 44.308 ( 2.324 -4.073 0.342) 4.702 44.633 ( 0.149 2.245 -1.476) 2.691 45.177 ( -2.526 8.798 -0.059) 9.153 46.569 ( -1.970 -1.308 0.877) 2.522 46.869 ( -4.349 -4.316 4.520) 7.614 47.308 ( -5.028 -9.086 -4.733) 11.412 47.647 ( 6.087 6.727 0.343) 9.079 51.096 ( -15.681 -33.746 -16.986) 40.905 52.284 ( 6.367 -35.215 -16.946) 39.595 55.945 ( -43.663 46.656 48.788) 80.395 56.287 ( -27.417 41.187 31.745) 58.786 70.039 ( 4.956 -29.240 4.721) 30.031 71.936 ( -50.003 -54.951 -27.998) 79.397 74.280 ( 16.217 12.715 -0.066) 20.608 74.514 ( -12.166 -17.604 0.437) 21.404 ======================= Grid point 70 (25/150) ======================= q-point: ( 0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.895 ( 5.580 -8.975 8.430) 13.518 1.400 ( 7.638 -2.080 6.128) 10.010 1.731 ( 0.183 -8.531 10.425) 13.472 1.999 ( -5.632 5.448 -0.408) 7.847 2.465 ( 4.334 -5.112 -4.796) 8.241 2.708 ( 9.285 -1.923 3.088) 9.972 2.933 ( 0.908 -5.425 -0.227) 5.505 3.156 ( 3.056 1.776 10.842) 11.404 3.690 ( 5.288 -6.567 0.248) 8.435 3.708 ( -2.020 -9.403 -1.328) 9.709 3.785 ( -4.387 -0.192 -5.293) 6.877 3.893 ( 4.052 11.884 1.796) 12.683 4.120 ( 1.361 -1.996 -0.332) 2.439 4.368 ( 4.442 4.827 -3.230) 7.312 4.622 ( 1.365 1.842 1.253) 2.613 4.832 ( -1.839 2.087 2.162) 3.523 5.418 ( 1.160 4.453 -0.072) 4.602 5.468 ( -5.641 -2.593 2.103) 6.555 5.659 ( 1.570 2.781 -2.271) 3.918 5.923 ( -0.653 0.785 -4.991) 5.094 6.431 ( -2.708 -6.672 4.774) 8.640 6.619 ( -0.843 -11.813 1.219) 11.906 6.779 ( 0.614 8.461 4.994) 9.844 7.004 ( -0.285 10.837 3.437) 11.372 7.404 ( 4.615 -1.469 -4.195) 6.408 7.599 ( -0.824 -3.031 1.532) 3.495 7.928 ( 0.158 8.926 -4.310) 9.913 8.243 ( -5.585 2.296 -2.278) 6.455 10.439 ( 2.778 -18.591 -2.064) 18.911 10.931 ( 0.159 3.211 -14.843) 15.187 11.318 ( -2.711 5.144 7.159) 9.223 11.789 ( -6.236 4.554 -2.557) 8.134 14.379 ( -9.460 -17.084 -4.936) 20.142 14.913 ( -4.334 -15.666 3.021) 16.532 15.320 ( 3.516 14.158 -1.150) 14.633 15.666 ( -0.467 4.388 1.527) 4.669 27.162 ( 0.519 -1.650 0.609) 1.834 27.248 ( -0.322 2.387 -0.433) 2.447 27.627 ( -0.213 -0.423 -0.029) 0.474 27.670 ( 0.135 0.375 0.318) 0.510 27.806 ( 0.759 -3.852 1.276) 4.128 27.946 ( -1.532 3.902 -1.386) 4.415 31.496 ( 1.452 -2.468 6.166) 6.799 31.675 ( -2.612 4.776 0.559) 5.472 32.304 ( -1.701 -3.218 -3.271) 4.893 32.633 ( 1.291 1.324 -1.148) 2.176 35.181 ( 0.934 -0.008 2.773) 2.926 35.196 ( -0.956 0.667 -0.125) 1.172 36.152 ( -0.564 -2.987 -0.265) 3.052 36.224 ( 0.716 2.385 -0.133) 2.494 44.331 ( 0.522 -4.389 0.464) 4.444 44.426 ( 4.568 -5.698 -1.489) 7.453 44.602 ( 1.316 2.658 -1.321) 3.247 44.980 ( -4.865 10.153 1.252) 11.328 46.561 ( -0.987 -0.973 1.452) 2.008 46.855 ( -2.234 0.107 3.281) 3.971 47.364 ( -6.006 -10.838 -5.036) 13.376 47.643 ( 6.760 7.605 2.021) 10.374 51.305 ( -10.078 -26.611 -6.548) 29.199 52.817 ( 9.853 -20.879 -14.389) 27.204 54.914 ( -16.776 43.406 9.576) 47.510 55.472 ( -23.823 19.163 32.379) 44.532 70.517 ( 4.243 -22.946 3.477) 23.593 71.816 ( -23.924 -15.333 -11.788) 30.764 74.334 ( 17.659 15.393 -1.555) 23.478 74.564 ( -16.265 -18.532 1.344) 24.694 ======================= Grid point 71 (26/150) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( 3.156 -0.484 8.438) 9.022 1.405 ( -2.667 8.701 1.038) 9.160 1.711 ( -3.343 1.942 2.726) 4.731 2.013 ( 0.133 -7.706 8.418) 11.413 2.528 ( 5.332 1.738 -4.354) 7.100 2.760 ( -0.870 0.254 -6.623) 6.685 3.014 ( -4.006 -0.941 5.476) 6.850 3.162 ( 0.326 4.241 9.928) 10.801 3.655 ( -7.697 1.245 -8.625) 11.627 3.752 ( 1.536 7.166 -1.579) 7.496 3.776 ( -2.169 -1.277 -1.968) 3.195 3.838 ( 4.687 0.733 -1.926) 5.120 4.209 ( 2.724 -3.550 3.170) 5.484 4.366 ( 1.355 -0.716 -0.639) 1.660 4.557 ( -1.090 6.493 -3.891) 7.648 4.833 ( -0.866 -3.458 4.903) 6.063 5.387 ( 2.431 2.731 -0.265) 3.665 5.430 ( -4.792 -3.533 1.515) 6.144 5.671 ( 2.036 -0.508 -0.697) 2.211 5.935 ( 2.543 -0.424 -4.283) 4.999 6.452 ( -1.925 1.681 7.102) 7.548 6.669 ( -0.451 0.456 -0.586) 0.869 6.817 ( 1.411 -2.362 3.862) 4.742 6.857 ( -0.391 2.359 3.517) 4.252 7.479 ( 3.322 -0.957 -3.540) 4.948 7.623 ( -2.039 -1.967 2.890) 4.047 7.876 ( 1.279 -1.751 -2.842) 3.575 8.170 ( -2.045 -1.635 -1.930) 3.253 10.609 ( -2.693 7.517 -11.784) 14.235 10.829 ( 4.125 -4.354 -4.501) 7.499 11.370 ( 3.032 -3.168 5.503) 7.036 11.665 ( -2.924 -1.594 0.307) 3.345 14.453 ( -1.416 -5.999 -1.609) 6.370 14.933 ( 4.094 13.989 2.236) 14.747 15.316 ( 0.829 -9.822 -2.945) 10.287 15.578 ( -3.876 3.558 0.658) 5.303 27.183 ( -0.170 0.393 0.238) 0.490 27.225 ( 0.118 -0.558 0.150) 0.590 27.633 ( 0.194 -0.374 0.191) 0.462 27.665 ( -0.046 0.404 0.347) 0.534 27.849 ( -0.760 3.151 -0.719) 3.320 27.895 ( 0.691 -2.896 0.068) 2.978 31.489 ( -1.182 4.820 1.653) 5.231 31.660 ( 0.536 -4.694 4.807) 6.740 32.328 ( 0.221 -2.240 -1.768) 2.862 32.620 ( 0.166 1.671 -2.201) 2.768 35.162 ( -1.030 1.071 0.237) 1.505 35.207 ( 1.074 -0.204 1.891) 2.185 36.185 ( -0.680 -2.908 -0.473) 3.023 36.195 ( 0.531 2.817 -0.098) 2.868 44.350 ( -1.237 0.775 -0.259) 1.482 44.588 ( 2.371 -4.579 -1.739) 5.442 44.605 ( 1.806 -1.613 -0.252) 2.435 44.776 ( -3.275 6.128 0.916) 7.009 46.575 ( -0.436 -1.994 2.113) 2.938 46.817 ( 1.957 4.945 1.549) 5.539 47.418 ( -5.335 -9.328 -4.550) 11.669 47.636 ( 4.925 6.201 3.265) 8.565 51.568 ( -0.395 -20.959 5.243) 21.608 53.030 ( 9.066 10.395 -14.896) 20.301 54.115 ( 4.525 53.134 -12.464) 54.764 55.281 ( -17.178 -30.125 30.383) 46.106 70.712 ( -3.361 0.720 -0.429) 3.464 71.765 ( 5.859 -1.502 -2.779) 6.656 74.362 ( 15.126 14.697 -2.416) 21.229 74.556 ( -16.786 -14.640 1.259) 22.309 ======================= Grid point 72 (27/150) ======================= q-point: (-0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.958 ( -6.745 12.659 7.459) 16.168 1.172 ( -5.882 11.470 6.510) 14.441 1.659 ( -0.600 4.203 2.833) 5.104 2.141 ( 1.172 -6.814 2.893) 7.494 2.563 ( 5.810 6.589 2.693) 9.188 2.675 ( -11.974 6.387 -7.091) 15.312 2.800 ( -7.665 6.928 4.543) 11.287 3.120 ( -3.138 -1.223 6.533) 7.350 3.484 ( -5.762 7.204 -8.579) 12.598 3.620 ( 2.156 11.450 -3.105) 12.058 3.732 ( -5.469 -1.926 -4.434) 7.299 3.906 ( 2.437 -0.704 -0.389) 2.566 4.243 ( -0.992 2.854 2.781) 4.106 4.376 ( -1.413 0.056 -2.503) 2.875 4.522 ( 0.854 -5.032 -1.201) 5.243 4.880 ( -1.225 -4.108 2.851) 5.148 5.402 ( 3.453 1.958 -0.814) 4.052 5.448 ( -2.190 -5.784 2.159) 6.551 5.711 ( 0.524 -1.012 0.360) 1.195 5.976 ( 3.530 -0.056 -4.033) 5.360 6.378 ( 1.768 7.127 2.720) 7.831 6.630 ( 1.673 8.311 0.743) 8.510 6.804 ( -0.702 -5.350 5.350) 7.599 6.975 ( -0.922 -7.984 3.011) 8.583 7.521 ( 1.919 -0.042 -1.861) 2.673 7.605 ( -4.098 -2.258 5.224) 7.013 8.005 ( 1.387 -12.587 -1.566) 12.760 8.226 ( 2.762 -4.877 -2.891) 6.306 10.322 ( -1.892 18.282 -7.304) 19.777 10.973 ( 3.352 -0.719 -9.657) 10.248 11.441 ( 2.309 -5.035 8.998) 10.567 11.808 ( 5.158 -11.433 -2.439) 12.778 14.506 ( 4.284 2.441 -2.356) 5.465 14.761 ( 17.952 29.558 -1.703) 34.624 15.423 ( -8.618 -0.318 3.935) 9.479 15.522 ( -2.377 -13.088 -3.910) 13.865 27.156 ( -0.599 1.608 0.338) 1.749 27.258 ( 0.264 -2.690 0.044) 2.703 27.642 ( 0.627 0.224 0.444) 0.800 27.661 ( -0.224 -0.228 -0.083) 0.330 27.772 ( -0.709 4.474 -0.189) 4.534 27.969 ( 1.364 -3.865 -0.286) 4.109 31.397 ( -1.159 4.753 1.612) 5.151 31.767 ( 0.903 -6.499 5.026) 8.265 32.369 ( 2.272 -0.955 -0.460) 2.507 32.583 ( -1.133 1.773 -3.472) 4.060 35.134 ( -0.756 0.847 0.700) 1.334 35.227 ( 0.949 -0.069 1.402) 1.695 36.159 ( 0.347 2.966 0.092) 2.988 36.214 ( -0.720 -2.503 -0.641) 2.682 44.294 ( -0.819 3.847 -1.134) 4.093 44.481 ( -6.803 5.533 0.734) 8.800 44.674 ( -0.184 -3.228 2.432) 4.046 44.859 ( 6.093 -8.025 -4.332) 10.968 46.605 ( -1.072 -2.807 1.925) 3.569 46.787 ( 7.212 8.621 1.008) 11.285 47.452 ( -2.423 -3.866 -2.647) 5.275 47.623 ( 0.652 1.864 2.435) 3.135 51.882 ( 8.340 -9.087 11.652) 16.968 52.788 ( 8.727 34.759 -26.899) 44.810 53.565 ( 22.113 44.227 0.322) 49.448 55.790 ( -5.518 -52.740 20.540) 56.867 70.446 ( -6.494 21.153 0.224) 22.128 71.970 ( 32.519 17.406 -5.744) 37.329 74.361 ( 8.369 9.582 -2.222) 12.915 74.488 ( -13.923 -8.331 0.522) 16.234 ======================= Grid point 73 (28/150) ======================= q-point: (-0.25 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.622 ( -10.997 13.006 7.993) 18.814 0.920 ( -5.379 13.709 15.808) 21.605 1.532 ( -5.046 9.385 8.190) 13.440 2.080 ( -14.406 24.113 6.840) 28.909 2.290 ( -2.635 1.117 -2.820) 4.018 2.511 ( -1.661 4.022 -0.224) 4.357 2.692 ( -1.821 3.711 2.051) 4.614 3.169 ( -3.366 -9.010 2.000) 9.824 3.256 ( -1.282 13.994 -6.052) 15.301 3.505 ( -0.613 4.403 -2.892) 5.303 3.678 ( -5.099 -3.463 -5.636) 8.352 3.901 ( -1.875 2.165 2.200) 3.612 4.153 ( -1.954 3.778 -3.374) 5.429 4.381 ( 0.871 -0.317 2.109) 2.303 4.626 ( -1.704 -9.311 -1.623) 9.604 4.927 ( -1.709 -5.160 1.903) 5.759 5.427 ( 2.058 0.629 0.588) 2.231 5.504 ( -1.205 -3.876 1.609) 4.366 5.704 ( 0.716 2.274 -1.547) 2.842 6.046 ( 4.161 -2.080 -4.436) 6.428 6.323 ( 2.548 5.779 0.329) 6.324 6.522 ( 2.150 10.274 0.065) 10.496 6.909 ( -1.789 -9.012 6.031) 10.990 7.050 ( -0.481 -3.721 2.299) 4.400 7.535 ( 1.149 0.917 -0.982) 1.768 7.619 ( -4.774 -8.650 10.488) 14.409 8.235 ( 2.077 -14.264 -1.408) 14.483 8.348 ( 2.465 -6.082 -4.454) 7.931 10.061 ( -0.676 12.923 -2.326) 13.148 10.921 ( 1.602 8.251 -6.836) 10.834 11.646 ( 4.087 -12.344 2.663) 13.273 12.029 ( 8.388 -3.239 -5.957) 10.786 14.432 ( 2.499 14.017 -12.133) 18.707 14.684 ( 38.879 42.894 -4.311) 58.052 15.276 ( -13.830 -6.719 7.463) 17.091 15.675 ( -2.445 -11.393 -0.444) 11.661 27.128 ( -0.539 1.170 0.548) 1.400 27.301 ( 0.035 -2.833 -0.422) 2.865 27.645 ( 0.481 0.508 0.369) 0.791 27.658 ( -0.179 0.722 -1.083) 1.314 27.713 ( 0.175 2.648 1.750) 3.179 28.038 ( 1.179 -2.934 -0.778) 3.257 31.333 ( -0.139 3.010 3.230) 4.417 31.876 ( 0.239 -6.042 4.277) 7.406 32.418 ( 4.336 1.436 0.288) 4.576 32.526 ( -2.742 0.840 -4.801) 5.593 35.122 ( -0.153 -0.071 1.968) 1.975 35.241 ( 0.854 0.193 0.910) 1.263 36.123 ( 0.137 2.433 0.321) 2.458 36.234 ( -0.534 -1.765 -0.620) 1.945 44.226 ( -0.256 3.893 -0.875) 3.998 44.313 ( -7.153 2.561 -0.004) 7.598 44.711 ( -1.267 -2.568 2.302) 3.674 45.063 ( 5.866 -7.691 -5.216) 10.989 46.614 ( -0.488 0.472 -0.788) 1.040 46.799 ( 9.609 7.755 2.692) 12.638 47.439 ( -0.004 3.038 0.843) 3.153 47.616 ( -2.892 -3.268 -1.091) 4.499 51.937 ( 0.830 18.084 -25.387) 31.180 52.249 ( 14.356 54.183 -28.630) 62.941 53.753 ( 65.610 18.688 58.591) 89.927 56.557 ( -0.250 -51.246 15.928) 53.664 70.001 ( -5.058 26.112 2.636) 26.727 72.105 ( 59.712 62.172 -22.580) 89.111 74.324 ( -8.796 -4.543 0.740) 9.927 74.405 ( -0.802 2.720 -1.378) 3.153 ======================= Grid point 74 (29/150) ======================= q-point: (-0.12 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.381 ( -9.320 -2.158 18.796) 21.090 0.686 ( -5.697 10.783 22.677) 25.748 1.212 ( -10.053 24.824 27.116) 38.112 1.495 ( -13.423 14.295 4.536) 20.127 2.272 ( 2.476 4.008 -7.319) 8.704 2.439 ( -1.307 1.712 -3.597) 4.192 2.632 ( -1.583 2.850 8.553) 9.153 3.037 ( 0.609 12.500 -1.816) 12.646 3.226 ( 1.382 -3.481 2.258) 4.373 3.497 ( 3.551 1.255 -1.515) 4.060 3.683 ( -5.457 -9.794 -2.783) 11.552 3.833 ( -2.594 1.390 3.123) 4.292 4.065 ( -1.380 4.857 -3.689) 6.254 4.405 ( 0.857 -0.803 3.539) 3.729 4.744 ( -3.947 -14.113 -3.070) 14.973 4.985 ( -2.452 -7.070 3.452) 8.241 5.440 ( 0.486 0.503 1.110) 1.312 5.517 ( -2.170 -1.533 1.851) 3.238 5.666 ( 3.785 9.025 -5.597) 11.274 6.123 ( 1.873 -2.186 -4.603) 5.429 6.280 ( 1.613 4.613 -1.067) 5.002 6.397 ( 0.642 9.291 -1.502) 9.434 7.003 ( -1.700 -5.753 6.526) 8.864 7.084 ( 0.346 -0.825 1.245) 1.533 7.535 ( 0.386 0.422 -0.430) 0.716 7.782 ( -5.476 -23.650 14.877) 28.471 8.430 ( 4.862 -4.410 -3.316) 7.354 8.435 ( -2.725 -6.731 -5.948) 9.386 9.968 ( -2.945 -6.039 5.447) 8.649 10.818 ( 0.532 5.971 -4.811) 7.686 11.803 ( 8.357 14.854 -14.213) 22.192 12.075 ( 2.778 5.599 -8.083) 10.218 14.066 ( 8.426 51.673 -27.022) 58.918 14.560 ( 16.914 26.842 -7.211) 32.536 15.388 ( 12.415 -9.724 19.564) 25.128 15.765 ( -1.453 -5.110 0.285) 5.320 27.109 ( -0.324 0.584 0.688) 0.959 27.335 ( -0.132 -1.821 -1.188) 2.179 27.638 ( 0.270 0.839 0.054) 0.883 27.645 ( 0.173 0.252 0.159) 0.345 27.703 ( 0.747 1.010 2.130) 2.473 28.084 ( 0.611 -1.609 -1.155) 2.073 31.331 ( 2.342 -0.499 6.205) 6.651 31.954 ( -0.636 -3.992 3.611) 5.421 32.416 ( 0.697 5.069 -4.374) 6.732 32.501 ( 0.553 -1.402 -1.515) 2.137 35.150 ( 0.994 -3.006 3.660) 4.839 35.249 ( 0.986 0.891 0.338) 1.371 36.098 ( 0.021 1.122 0.832) 1.397 36.247 ( -0.192 -0.903 -0.523) 1.061 44.169 ( -5.311 -0.202 -0.294) 5.323 44.200 ( -2.204 1.569 -1.671) 3.180 44.705 ( -1.900 1.087 0.775) 2.322 45.227 ( 4.624 -4.672 -5.177) 8.367 46.556 ( 1.948 9.801 -3.786) 10.686 46.844 ( 6.026 4.093 3.158) 7.939 47.372 ( -1.757 4.067 1.440) 4.659 47.625 ( -1.461 -2.921 -2.869) 4.347 51.059 ( 2.817 86.025 -58.651) 104.154 51.859 ( 1.162 18.237 -3.512) 18.608 55.518 ( 171.527 -19.999 132.417) 217.614 57.200 ( -0.642 -31.936 13.545) 34.696 69.619 ( -4.491 14.400 4.339) 15.696 71.668 ( 72.157 143.614 -57.837) 170.812 74.243 ( -10.654 -5.768 2.186) 12.311 74.393 ( 0.682 -0.603 -0.248) 0.944 ======================= Grid point 76 (30/150) ======================= q-point: ( 0.12 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.630 ( 15.628 0.000 15.192) 21.795 0.993 ( 19.508 0.000 16.011) 25.237 1.484 ( 12.404 0.000 2.414) 12.637 1.568 ( 23.477 0.000 30.008) 38.100 2.353 ( 0.490 0.000 -1.642) 1.714 2.501 ( 5.763 0.000 -3.130) 6.558 2.701 ( 2.559 0.000 12.039) 12.308 2.976 ( 1.372 0.000 0.467) 1.450 3.536 ( 2.870 0.000 -4.122) 5.023 3.629 ( -1.587 -0.000 -1.164) 1.968 3.833 ( -5.511 -0.000 -1.542) 5.723 3.963 ( 5.745 0.000 3.265) 6.608 4.303 ( -9.211 -0.000 2.282) 9.489 4.516 ( 2.106 0.000 7.043) 7.351 4.757 ( 2.583 0.000 -15.611) 15.823 5.134 ( 1.858 0.000 -2.666) 3.250 5.433 ( -5.224 -0.000 3.703) 6.403 5.504 ( 0.438 0.000 -0.745) 0.864 5.641 ( 5.788 0.000 -13.735) 14.905 6.139 ( -3.439 -0.000 -4.806) 5.910 6.246 ( 0.344 0.000 2.199) 2.226 6.337 ( 3.188 0.000 -1.555) 3.547 7.053 ( 1.001 0.000 4.824) 4.927 7.152 ( 2.153 0.000 2.624) 3.394 7.373 ( -4.840 -0.000 4.999) 6.958 7.567 ( -2.378 -0.000 4.391) 4.994 8.239 ( -7.752 -0.000 -6.463) 10.093 8.544 ( -0.134 -0.000 -4.053) 4.056 9.842 ( -0.426 -0.000 4.447) 4.468 10.720 ( -1.346 -0.000 -5.523) 5.685 11.189 ( -0.263 -0.000 6.088) 6.094 11.989 ( -4.091 -0.000 -4.752) 6.271 13.400 ( -6.500 -0.000 3.250) 7.268 14.478 ( -2.071 -0.000 -3.610) 4.162 15.749 ( -2.314 -0.000 13.382) 13.580 15.840 ( 3.674 0.000 0.199) 3.679 27.115 ( 0.590 0.000 0.862) 1.045 27.333 ( -0.013 -0.000 -2.003) 2.003 27.633 ( -0.565 -0.000 0.843) 1.015 27.640 ( -0.146 -0.000 0.093) 0.173 27.716 ( 0.101 0.000 2.822) 2.824 28.071 ( -1.182 -0.000 -1.745) 2.108 31.418 ( -0.754 -0.000 8.135) 8.170 31.922 ( -2.358 -0.000 1.662) 2.885 32.195 ( -4.211 -0.000 -6.447) 7.701 32.635 ( 2.906 0.000 0.123) 2.908 35.176 ( -0.553 -0.000 4.647) 4.680 35.216 ( -0.432 -0.000 0.110) 0.446 36.085 ( -0.478 -0.000 0.803) 0.935 36.267 ( 0.745 0.000 -0.346) 0.822 44.218 ( 6.569 0.000 -6.180) 9.019 44.223 ( 0.569 0.000 1.509) 1.612 44.634 ( 1.202 0.000 -0.144) 1.210 45.325 ( -1.723 -0.000 -0.641) 1.838 46.449 ( -2.134 -0.000 6.293) 6.645 46.772 ( -2.909 -0.000 7.424) 7.974 47.186 ( -3.272 -0.000 -4.871) 5.868 47.744 ( 4.992 0.000 0.339) 5.004 50.208 ( -0.469 -0.000 7.699) 7.713 51.576 ( -0.918 -0.000 -14.333) 14.363 56.851 (-111.713 -0.000 145.218) 183.216 57.050 ( -15.279 -0.000 -1.371) 15.340 69.553 ( 9.478 0.000 -0.189) 9.480 70.081 ( -0.405 -0.000 -3.050) 3.077 74.444 ( 1.954 0.000 1.238) 2.314 74.515 ( 21.210 0.000 -0.005) 21.210 ======================= Grid point 77 (31/150) ======================= q-point: ( 0.25 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.880 ( 19.450 5.442 11.548) 23.265 1.305 ( 14.671 -2.914 17.396) 22.942 1.631 ( 12.887 3.597 6.017) 14.670 2.114 ( 18.287 -9.569 9.899) 22.891 2.287 ( 3.996 3.739 -1.133) 5.589 2.656 ( 3.510 0.595 6.801) 7.677 2.712 ( 2.923 -6.127 1.662) 6.989 3.136 ( -0.082 -14.622 2.623) 14.856 3.472 ( -1.973 8.176 -1.843) 8.610 3.646 ( 7.204 0.275 -1.865) 7.447 3.763 ( -4.507 -1.686 -2.184) 5.284 4.076 ( 4.650 -1.789 1.780) 5.291 4.106 ( -11.846 2.890 4.262) 12.917 4.552 ( 5.998 2.009 4.301) 7.649 4.708 ( 2.181 6.676 -8.564) 11.076 5.037 ( 1.251 10.579 -1.992) 10.837 5.387 ( -7.073 -3.636 2.346) 8.292 5.509 ( 1.645 1.379 -0.937) 2.342 5.714 ( 2.206 -1.744 -8.497) 8.950 6.005 ( -4.778 5.486 -3.087) 7.903 6.292 ( -0.877 -3.516 2.154) 4.215 6.352 ( 0.064 -1.386 3.283) 3.564 7.024 ( 0.590 5.893 5.777) 8.273 7.195 ( 1.061 1.221 4.295) 4.589 7.365 ( 3.436 -0.654 -3.506) 4.952 7.544 ( -1.101 -0.287 1.649) 2.004 8.087 ( -9.530 1.563 -5.501) 11.114 8.463 ( -0.804 8.349 -4.496) 9.517 9.946 ( 1.213 -12.084 2.127) 12.329 10.740 ( -1.202 -6.531 -6.818) 9.518 11.375 ( -6.790 -17.971 1.411) 19.263 11.842 ( -4.475 7.637 -4.487) 9.924 13.496 ( -11.622 -26.560 0.219) 28.992 14.492 ( -3.333 -8.303 -2.319) 9.242 15.732 ( 6.382 9.249 8.058) 13.828 15.874 ( 5.111 4.652 1.237) 7.020 27.130 ( 0.757 -0.496 0.872) 1.256 27.317 ( -0.118 1.702 -1.614) 2.349 27.621 ( -0.298 0.297 0.271) 0.500 27.656 ( 0.320 -1.497 -0.071) 1.532 27.727 ( -0.149 -1.103 2.879) 3.087 28.034 ( -1.439 1.850 -1.719) 2.906 31.433 ( 0.605 -1.011 7.919) 8.006 31.843 ( -2.760 5.191 0.488) 5.900 32.167 ( -3.466 -4.877 -5.423) 8.075 32.669 ( 2.221 0.762 -0.252) 2.361 35.182 ( 0.849 0.191 3.884) 3.980 35.209 ( -0.658 0.085 0.078) 0.668 36.087 ( -0.546 -1.197 0.452) 1.391 36.272 ( 0.810 0.866 -0.415) 1.256 44.239 ( 1.501 -0.992 1.091) 2.105 44.316 ( 5.097 -1.956 -3.753) 6.625 44.658 ( 1.271 0.306 -1.142) 1.736 45.237 ( -4.034 5.896 0.911) 7.201 46.456 ( -4.513 -4.914 3.507) 7.538 46.769 ( -2.943 -4.156 6.610) 8.344 47.154 ( -2.591 -2.533 -5.387) 6.493 47.810 ( 6.204 2.904 1.100) 6.938 50.409 ( -8.057 -25.876 1.137) 27.125 51.789 ( 1.404 -31.900 -16.879) 36.118 55.684 ( -49.917 18.158 101.223) 114.313 56.596 ( -14.174 28.689 -5.340) 32.442 69.793 ( 8.355 -15.346 1.376) 17.527 70.498 ( -12.832 -50.924 -6.398) 52.904 74.442 ( 2.227 5.034 2.391) 6.001 74.836 ( 30.053 10.053 -2.125) 31.761 ======================= Grid point 78 (32/150) ======================= q-point: ( 0.38 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( 18.800 4.978 8.076) 21.059 1.543 ( 9.310 0.010 12.402) 15.507 1.768 ( 8.621 2.415 5.881) 10.712 2.056 ( -1.741 10.512 -0.910) 10.694 2.517 ( 6.236 1.884 -0.226) 6.519 2.801 ( 11.120 -9.134 9.075) 17.013 2.868 ( 1.434 -3.635 -2.733) 4.769 3.244 ( 0.450 0.797 4.545) 4.637 3.441 ( -3.059 -9.554 1.495) 10.143 3.687 ( -5.838 -0.981 -8.045) 9.988 3.781 ( 6.963 -1.179 -1.330) 7.186 3.941 ( -7.106 -0.152 4.434) 8.377 4.155 ( 4.379 -0.037 1.655) 4.681 4.597 ( 4.356 11.117 -6.673) 13.678 4.663 ( 3.656 -1.749 6.103) 7.326 4.891 ( -0.598 9.577 -2.999) 10.053 5.313 ( -8.190 -3.000 1.105) 8.792 5.504 ( 1.828 3.049 -1.051) 3.708 5.735 ( 2.474 3.475 -3.789) 5.705 5.892 ( -2.427 -0.829 -3.420) 4.275 6.320 ( -1.831 -4.108 3.666) 5.802 6.442 ( -1.027 -10.029 4.675) 11.113 6.927 ( 0.123 9.166 5.664) 10.775 7.151 ( 1.149 7.311 3.781) 8.310 7.447 ( 4.567 -1.658 -5.413) 7.273 7.547 ( -1.147 -1.942 1.372) 2.640 7.900 ( -10.308 1.829 -3.810) 11.141 8.314 ( 0.916 9.445 -4.538) 10.519 10.197 ( 1.308 -18.281 -0.183) 18.328 10.848 ( 0.496 -9.806 -9.859) 13.914 11.359 ( -6.564 3.983 4.245) 8.773 11.702 ( -5.402 0.571 -3.379) 6.397 13.733 ( -14.385 -32.182 -0.481) 35.254 14.611 ( -3.602 -15.507 -0.557) 15.929 15.683 ( 9.548 15.810 1.859) 18.563 15.871 ( 8.132 9.633 1.468) 12.692 27.154 ( 0.751 -0.967 0.776) 1.449 27.279 ( -0.312 2.600 -0.902) 2.769 27.618 ( -0.156 -0.304 0.059) 0.347 27.676 ( 0.315 -0.205 0.052) 0.379 27.763 ( 0.347 -3.476 1.961) 4.006 27.973 ( -1.400 3.128 -1.524) 3.751 31.488 ( 1.234 -2.833 7.248) 7.879 31.713 ( -2.787 6.288 -0.266) 6.883 32.198 ( -2.155 -5.914 -3.850) 7.379 32.679 ( 1.505 1.766 -0.801) 2.455 35.192 ( -0.694 0.807 0.295) 1.105 35.203 ( 1.112 -0.039 2.819) 3.031 36.104 ( -0.632 -2.273 0.070) 2.360 36.265 ( 0.733 1.736 -0.455) 1.939 44.292 ( 1.143 -2.822 0.981) 3.199 44.431 ( 5.452 -3.790 -3.142) 7.345 44.651 ( 0.646 2.215 -0.830) 2.452 45.048 ( -5.602 9.713 1.802) 11.357 46.458 ( -4.875 -5.097 1.939) 7.315 46.820 ( -1.257 -5.832 5.876) 8.373 47.156 ( -2.765 -4.421 -5.785) 7.789 47.844 ( 6.183 5.812 1.630) 8.641 50.653 ( -11.567 -30.161 -1.513) 32.339 52.395 ( 2.710 -46.958 -17.508) 50.189 55.025 ( -18.204 20.676 62.783) 68.561 55.869 ( -7.857 44.075 -7.690) 45.425 70.203 ( 3.953 -24.818 0.434) 25.135 70.971 ( -13.785 -44.393 -3.804) 46.640 74.377 ( 0.279 7.146 4.142) 8.264 75.110 ( 36.216 21.084 -5.084) 42.213 ======================= Grid point 79 (33/150) ======================= q-point: (-0.50 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( 14.370 6.824 7.428) 17.557 1.543 ( -0.364 12.552 2.009) 12.717 1.824 ( 8.487 6.087 1.245) 10.518 1.960 ( -0.101 0.165 6.317) 6.320 2.571 ( 4.425 -1.161 0.104) 4.576 2.830 ( -0.807 6.540 -3.864) 7.639 2.987 ( 1.081 1.340 4.356) 4.684 3.238 ( -0.275 3.829 6.923) 7.916 3.484 ( -8.129 -5.455 -5.020) 11.001 3.607 ( -5.064 -3.616 -4.866) 7.899 3.878 ( 1.537 1.421 -0.479) 2.147 3.893 ( 0.667 -1.461 2.203) 2.727 4.235 ( 4.295 -1.544 2.422) 5.167 4.464 ( 0.601 8.945 -2.761) 9.381 4.690 ( 2.712 10.965 -3.528) 11.833 4.795 ( 0.053 -1.231 3.347) 3.566 5.271 ( -5.110 -5.672 2.003) 7.893 5.474 ( 1.269 3.157 -2.656) 4.317 5.707 ( 1.408 1.929 -0.205) 2.397 5.931 ( 1.469 -3.443 -3.987) 5.469 6.376 ( -1.760 -6.424 5.655) 8.737 6.603 ( -0.749 -11.884 3.064) 12.295 6.797 ( -0.353 8.052 4.866) 9.415 7.043 ( 1.928 11.105 2.963) 11.654 7.509 ( 1.766 -0.324 -3.731) 4.140 7.565 ( -1.566 -2.691 2.069) 3.738 7.740 ( -9.065 -2.311 -2.261) 9.625 8.246 ( 4.878 4.557 -4.755) 8.196 10.475 ( 0.684 -16.743 -5.997) 17.798 10.894 ( -0.631 5.087 -9.118) 10.460 11.312 ( 1.154 -9.051 6.730) 11.338 11.599 ( -5.571 2.050 -0.900) 6.004 13.981 ( -12.379 -30.291 0.792) 32.732 14.819 ( -2.455 -18.884 0.625) 19.053 15.561 ( 6.747 18.147 0.465) 19.366 15.850 ( 13.542 15.712 -2.687) 20.916 27.181 ( 0.582 -1.021 0.513) 1.283 27.236 ( -0.437 2.207 -0.260) 2.265 27.626 ( 0.050 -0.772 0.092) 0.779 27.674 ( 0.024 0.642 0.504) 0.816 27.837 ( 1.015 -4.447 0.603) 4.601 27.902 ( -1.054 3.635 -1.161) 3.959 31.548 ( 0.619 2.366 4.581) 5.193 31.609 ( -1.635 -0.978 1.895) 2.687 32.257 ( -0.749 -5.812 -2.569) 6.399 32.662 ( 0.843 2.753 -1.533) 3.262 35.167 ( -0.628 1.216 0.303) 1.402 35.223 ( 0.918 -0.090 2.170) 2.358 36.132 ( -0.637 -2.828 -0.202) 2.906 36.243 ( 0.560 2.513 -0.422) 2.609 44.341 ( 0.851 -1.204 -0.205) 1.488 44.571 ( 3.939 -4.036 -2.862) 6.325 44.621 ( -0.156 1.562 0.399) 1.619 44.825 ( -4.556 8.547 1.662) 9.827 46.472 ( -4.048 -5.809 1.832) 7.313 46.908 ( 3.018 -2.831 4.946) 6.449 47.180 ( -4.190 -7.533 -6.004) 10.505 47.831 ( 4.745 7.988 1.948) 9.493 50.969 ( -10.172 -36.836 0.991) 38.228 53.062 ( 5.605 -34.828 -18.245) 39.715 54.707 ( -1.556 12.093 39.262) 41.112 55.164 ( 2.746 41.489 -8.745) 42.490 70.520 ( -3.710 -15.996 -1.108) 16.458 71.438 ( -1.516 -39.129 -0.739) 39.165 74.263 ( -3.406 5.946 5.254) 8.635 75.308 ( 41.802 31.387 -9.335) 53.101 ======================= Grid point 80 (34/150) ======================= q-point: (-0.38 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( 1.585 22.878 -1.492) 22.981 1.320 ( 2.334 12.313 9.608) 15.791 1.833 ( 5.956 10.537 2.417) 12.342 2.067 ( 5.007 -9.251 1.187) 10.586 2.617 ( -3.043 6.396 -4.471) 8.376 2.736 ( 4.505 2.550 4.712) 7.000 2.838 ( -5.768 12.444 4.469) 14.426 3.084 ( -8.565 7.321 4.601) 12.171 3.400 ( -6.458 -1.763 -6.304) 9.196 3.571 ( -6.257 -1.798 -4.454) 7.888 3.820 ( 1.195 6.641 -0.690) 6.783 3.948 ( 2.298 0.218 2.128) 3.139 4.284 ( -0.168 2.904 2.514) 3.845 4.400 ( 2.305 1.211 -1.616) 3.065 4.552 ( 1.320 8.202 -4.077) 9.254 4.821 ( -1.006 -1.948 2.150) 3.071 5.322 ( -1.865 -7.037 2.893) 7.834 5.464 ( 1.710 0.852 -2.321) 3.006 5.721 ( 1.271 -0.035 1.434) 1.916 5.984 ( 0.808 -2.382 -4.180) 4.878 6.462 ( 1.475 -3.206 4.939) 6.071 6.642 ( -1.190 1.605 0.613) 2.089 6.826 ( -1.104 -7.823 3.648) 8.702 6.915 ( 2.483 9.182 4.400) 10.480 7.482 ( -6.171 -2.133 2.985) 7.179 7.573 ( 1.234 1.038 -1.936) 2.520 7.744 ( -4.157 -12.206 -0.794) 12.919 8.301 ( 6.824 0.150 -5.320) 8.654 10.519 ( -0.604 11.295 -9.874) 15.014 10.894 ( 1.016 -10.970 -4.663) 11.963 11.449 ( -1.268 3.696 6.549) 7.626 11.631 ( 2.412 -19.438 -2.621) 19.762 14.238 ( -7.590 -25.524 1.719) 26.684 15.060 ( 0.901 -14.369 1.097) 14.439 15.382 ( 0.463 12.966 2.556) 13.224 15.817 ( 18.738 21.399 -10.128) 30.193 27.178 ( -0.123 2.057 0.146) 2.066 27.228 ( 0.029 -1.747 0.212) 1.760 27.641 ( 0.160 -1.034 0.073) 1.049 27.664 ( -0.049 0.719 0.531) 0.895 27.827 ( -0.359 4.230 -0.398) 4.264 27.925 ( 1.030 -4.687 -0.367) 4.813 31.463 ( -0.583 5.783 2.072) 6.171 31.686 ( -0.015 -6.498 4.394) 7.844 32.333 ( 0.348 -5.425 -1.613) 5.670 32.620 ( 0.348 3.748 -2.389) 4.458 35.142 ( -0.371 1.176 0.788) 1.464 35.239 ( 0.531 -0.166 1.421) 1.526 36.164 ( -0.485 -2.787 -0.372) 2.853 36.209 ( 0.350 2.999 -0.261) 3.031 44.342 ( 1.024 2.808 -1.447) 3.320 44.495 ( -4.701 8.291 0.257) 9.534 44.626 ( -1.779 -1.607 2.708) 3.617 44.829 ( 4.772 -6.768 -3.003) 8.809 46.508 ( -2.821 -5.893 2.094) 6.861 46.990 ( 6.976 3.434 3.180) 8.401 47.239 ( -5.126 -11.900 -5.123) 13.933 47.761 ( 2.138 9.172 1.809) 9.590 51.400 ( -7.694 -39.389 2.529) 40.213 53.268 ( 4.100 18.656 -13.518) 23.401 54.798 ( 32.504 17.476 0.821) 36.913 54.958 ( -2.680 -25.529 12.360) 28.490 70.539 ( -5.101 3.137 1.162) 6.101 72.060 ( 8.973 -38.244 -4.232) 39.510 74.130 ( -7.042 1.897 5.122) 8.912 75.450 ( 48.874 40.872 -17.088) 65.964 ======================= Grid point 81 (35/150) ======================= q-point: (-0.25 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.933 ( 3.027 24.067 -0.790) 24.269 1.129 ( -0.301 17.669 11.061) 20.848 1.725 ( 3.349 14.074 4.454) 15.137 2.207 ( -12.314 14.995 6.373) 20.423 2.335 ( 8.278 6.118 2.739) 10.652 2.560 ( -5.988 9.801 -4.876) 12.478 2.760 ( 0.499 7.234 2.953) 7.830 2.980 ( -3.084 -9.619 7.416) 12.531 3.345 ( -1.075 -0.245 -3.849) 4.004 3.454 ( -5.230 3.497 -5.936) 8.650 3.738 ( 2.689 8.729 0.576) 9.152 3.932 ( -1.172 4.252 3.634) 5.714 4.195 ( -0.733 5.269 -3.220) 6.218 4.420 ( 1.828 1.438 0.154) 2.331 4.524 ( -0.103 -2.340 -1.048) 2.566 4.845 ( -1.074 -3.616 1.156) 3.945 5.398 ( -0.780 -5.076 2.813) 5.856 5.479 ( 0.767 0.051 -0.741) 1.067 5.738 ( 0.955 0.034 1.069) 1.434 6.030 ( 0.561 -3.803 -5.398) 6.627 6.459 ( 2.425 7.319 1.422) 7.841 6.658 ( 0.359 1.878 -1.054) 2.183 6.779 ( -2.137 -1.725 4.543) 5.308 6.991 ( 1.132 -5.870 5.754) 8.297 7.439 ( -6.995 -5.062 6.260) 10.665 7.571 ( 1.414 1.608 -1.272) 2.490 7.925 ( -2.316 -18.444 -1.522) 18.651 8.397 ( 4.990 -1.282 -5.704) 7.686 10.284 ( 0.741 16.945 -4.263) 17.489 11.011 ( 1.175 0.330 -11.268) 11.334 11.461 ( -2.020 -11.089 7.858) 13.740 11.958 ( 3.868 -16.668 -6.299) 18.234 14.461 ( -1.685 -12.576 -2.192) 12.876 15.116 ( -1.516 7.963 6.558) 10.427 15.371 ( -0.733 -13.393 0.770) 13.436 15.773 ( 20.861 22.709 -18.530) 35.975 27.146 ( -0.157 1.915 0.390) 1.961 27.261 ( -0.015 -2.569 -0.142) 2.573 27.652 ( -0.385 -0.058 -0.186) 0.432 27.660 ( 0.350 -0.053 0.196) 0.404 27.766 ( 0.223 3.763 0.887) 3.873 28.002 ( 0.691 -3.978 -0.990) 4.158 31.392 ( 0.342 4.216 3.642) 5.582 31.785 ( -0.655 -6.787 3.328) 7.587 32.411 ( 0.075 -4.608 -1.604) 4.880 32.561 ( 0.720 4.555 -2.909) 5.453 35.128 ( 0.039 0.593 1.775) 1.871 35.249 ( 0.112 -0.331 0.754) 0.831 36.166 ( 0.100 2.945 -0.267) 2.958 36.198 ( -0.135 -2.239 -0.180) 2.250 44.294 ( -0.382 6.288 -0.222) 6.303 44.308 ( -2.416 6.421 -0.477) 6.877 44.642 ( -2.037 -3.628 2.236) 4.724 45.014 ( 4.302 -8.713 -3.611) 10.366 46.558 ( -1.511 -4.791 2.047) 5.425 47.018 ( 5.260 5.948 0.675) 7.969 47.353 ( -1.575 -11.180 -3.364) 11.781 47.637 ( -1.239 8.969 1.105) 9.121 51.780 ( -6.877 -23.663 -10.832) 26.918 52.784 ( -2.215 39.457 -8.421) 40.406 55.304 ( 64.451 5.881 4.938) 64.907 55.651 ( -7.324 -64.821 13.153) 66.546 70.310 ( -2.149 20.409 4.317) 20.971 72.754 ( 12.471 -34.770 -15.927) 40.226 74.035 ( -7.361 -3.748 3.982) 9.170 75.538 ( 52.652 50.494 -35.776) 81.251 ======================= Grid point 82 (36/150) ======================= q-point: (-0.12 0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.693 ( 7.763 20.001 5.679) 22.194 0.855 ( -2.885 18.557 12.665) 22.651 1.557 ( -0.663 14.847 0.597) 14.874 1.635 ( -3.621 32.421 26.909) 42.288 2.341 ( -2.357 4.537 -5.424) 7.454 2.492 ( 6.197 1.814 -2.187) 6.818 2.648 ( -2.857 4.436 4.549) 6.967 3.192 ( 4.445 -10.321 4.684) 12.175 3.294 ( 4.958 7.327 0.660) 8.871 3.449 ( 5.650 -7.506 0.689) 9.420 3.638 ( 1.234 8.059 -1.279) 8.253 3.851 ( -0.993 2.835 3.729) 4.789 4.119 ( -0.223 4.753 -3.533) 5.927 4.417 ( -0.715 0.423 0.089) 0.836 4.573 ( -0.386 -4.652 0.850) 4.745 4.897 ( -0.423 -4.634 1.789) 4.986 5.446 ( -0.157 -1.954 2.246) 2.981 5.477 ( -0.378 0.172 0.408) 0.582 5.762 ( 1.575 -0.476 -1.083) 1.970 6.079 ( -0.969 -3.689 -6.397) 7.448 6.378 ( 0.734 6.602 0.476) 6.660 6.530 ( -1.308 10.057 -3.609) 10.765 6.883 ( -0.853 -9.309 6.390) 11.323 7.083 ( 1.781 -2.777 3.871) 5.086 7.434 ( -7.737 -7.837 8.753) 14.068 7.568 ( 0.384 0.613 1.091) 1.309 8.161 ( -1.766 -17.532 -3.848) 18.036 8.458 ( 1.272 -1.701 -5.261) 5.674 10.069 ( 1.435 14.289 -0.103) 14.361 10.922 ( -0.038 8.217 -8.031) 11.490 11.674 ( -1.851 -17.628 0.584) 17.734 12.133 ( -1.418 -3.704 -13.004) 13.595 14.457 ( 0.802 12.699 -14.982) 19.657 14.924 ( -9.266 12.435 1.364) 15.567 15.580 ( 2.918 -11.385 -0.827) 11.782 15.756 ( 9.690 7.568 -15.751) 19.981 27.122 ( 0.023 1.305 0.603) 1.437 27.298 ( -0.116 -2.617 -0.730) 2.719 27.642 ( -0.458 0.266 -0.109) 0.541 27.658 ( 0.227 0.891 -0.458) 1.027 27.734 ( 0.459 1.767 2.391) 3.009 28.054 ( -0.156 -2.831 -1.427) 3.174 31.369 ( 1.301 1.369 6.074) 6.361 31.867 ( -1.529 -6.114 2.283) 6.703 32.415 ( -3.296 1.028 -5.174) 6.220 32.543 ( 3.276 0.909 -0.636) 3.459 35.135 ( 0.324 -0.760 3.182) 3.287 35.253 ( -0.508 -0.395 0.178) 0.668 36.125 ( -0.061 2.468 0.196) 2.476 36.227 ( 0.224 -1.695 -0.255) 1.728 44.160 ( -1.052 5.944 0.441) 6.053 44.253 ( 1.441 4.007 -0.423) 4.279 44.664 ( -1.755 -2.546 0.447) 3.125 45.183 ( 2.447 -7.862 -3.222) 8.842 46.595 ( -0.674 -1.687 1.025) 2.086 46.976 ( 0.034 5.796 -0.536) 5.821 47.430 ( -0.930 6.155 -2.562) 6.732 47.534 ( -0.647 -5.471 -0.242) 5.515 51.639 ( -12.493 23.848 -39.772) 48.027 52.206 ( 0.183 32.473 -8.424) 33.548 56.453 ( -4.579 -57.172 8.115) 57.926 56.689 ( 43.768 -67.514 46.700) 93.030 69.937 ( 0.206 28.197 5.503) 28.729 73.226 ( -2.358 -10.714 -48.509) 49.734 74.051 ( -1.610 -7.773 2.634) 8.364 75.214 ( 11.633 66.850 -62.790) 92.449 ======================= Grid point 85 (37/150) ======================= q-point: ( 0.25 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( 17.813 0.000 8.244) 19.628 1.519 ( 11.926 0.000 19.445) 22.811 1.881 ( 11.377 0.000 1.498) 11.475 2.337 ( -0.453 -0.000 -0.939) 1.043 2.424 ( 25.293 0.000 7.399) 26.353 2.716 ( 9.550 0.000 0.564) 9.567 2.738 ( -1.789 -0.000 11.940) 12.073 3.012 ( 0.894 0.000 0.744) 1.163 3.510 ( -0.761 -0.000 -6.117) 6.165 3.640 ( -6.237 -0.000 -3.460) 7.133 3.766 ( 6.443 0.000 -0.015) 6.443 3.924 ( -13.637 -0.000 2.998) 13.962 4.156 ( 5.895 0.000 2.057) 6.244 4.619 ( 3.736 0.000 6.246) 7.278 4.765 ( 0.750 0.000 -7.742) 7.778 5.140 ( -0.587 -0.000 -4.958) 4.992 5.220 ( -8.626 -0.000 2.546) 8.994 5.549 ( 2.757 0.000 -1.921) 3.360 5.730 ( 2.905 0.000 -6.078) 6.736 5.943 ( -6.736 -0.000 -5.633) 8.781 6.260 ( -0.515 -0.000 5.510) 5.534 6.361 ( -2.012 -0.000 3.860) 4.353 7.087 ( 0.176 0.000 6.363) 6.365 7.229 ( 2.185 0.000 3.124) 3.812 7.410 ( 3.822 0.000 -4.458) 5.872 7.532 ( -0.466 -0.000 0.659) 0.807 7.929 ( -11.122 -0.000 -3.598) 11.690 8.502 ( -1.343 -0.000 -4.968) 5.146 9.872 ( 1.086 0.000 1.759) 2.068 10.659 ( -1.369 -0.000 -6.104) 6.256 11.186 ( -1.147 -0.000 5.826) 5.938 11.830 ( -4.990 -0.000 -4.784) 6.913 13.174 ( -8.106 -0.000 2.376) 8.447 14.375 ( -3.661 -0.000 -2.598) 4.489 15.956 ( 11.789 0.000 4.979) 12.797 15.983 ( 5.123 0.000 0.930) 5.207 27.141 ( 0.834 0.000 0.916) 1.239 27.326 ( -0.071 -0.000 -1.764) 1.765 27.628 ( 0.055 0.000 0.357) 0.362 27.640 ( 0.192 0.000 -0.075) 0.206 27.721 ( -0.289 -0.000 2.764) 2.779 28.023 ( -1.469 -0.000 -1.748) 2.284 31.444 ( 0.490 0.000 7.540) 7.556 31.852 ( -2.327 -0.000 1.347) 2.689 32.065 ( -2.939 -0.000 -5.822) 6.522 32.705 ( 1.734 0.000 -0.503) 1.806 35.203 ( -0.373 -0.000 0.026) 0.374 35.203 ( 0.989 0.000 3.596) 3.729 36.070 ( -0.647 -0.000 0.501) 0.819 36.290 ( 0.789 0.000 -0.591) 0.986 44.251 ( 1.234 0.000 1.802) 2.184 44.378 ( 5.420 0.000 -4.732) 7.195 44.680 ( 1.203 0.000 -0.404) 1.269 45.214 ( -5.245 -0.000 1.603) 5.485 46.360 ( -4.324 -0.000 4.898) 6.533 46.677 ( -5.193 -0.000 3.656) 6.352 47.123 ( 0.657 0.000 -3.596) 3.656 47.928 ( 6.285 0.000 1.759) 6.527 50.164 ( -4.172 -0.000 8.929) 9.855 51.515 ( -0.558 -0.000 -16.697) 16.706 55.391 ( -24.210 -0.000 79.805) 83.396 56.590 ( -12.032 -0.000 -8.856) 14.940 69.860 ( 10.128 0.000 0.181) 10.129 70.051 ( -0.973 -0.000 -2.596) 2.773 74.539 ( 3.649 0.000 2.551) 4.452 75.426 ( 37.230 0.000 -4.396) 37.489 ======================= Grid point 86 (38/150) ======================= q-point: ( 0.38 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( 13.172 3.629 6.447) 15.107 1.695 ( 7.190 0.867 15.626) 17.223 1.985 ( 7.694 4.502 1.254) 9.002 2.235 ( 2.566 12.112 -0.938) 12.416 2.666 ( 1.602 6.252 8.010) 10.287 2.776 ( 5.843 -7.247 -0.812) 9.344 2.972 ( 16.635 -3.132 4.386) 17.487 3.123 ( -0.146 -10.052 1.497) 10.164 3.438 ( 0.180 5.637 -2.096) 6.016 3.565 ( -6.030 -1.062 -8.536) 10.505 3.775 ( -9.091 -4.906 3.846) 11.023 3.857 ( 4.708 -0.970 -0.335) 4.819 4.231 ( 4.022 0.558 2.216) 4.625 4.679 ( 0.942 2.753 1.393) 3.226 4.754 ( 3.815 0.930 -1.287) 4.133 5.025 ( -1.373 7.745 -3.681) 8.685 5.147 ( -7.166 -2.854 -0.140) 7.715 5.569 ( 2.012 2.857 -2.534) 4.316 5.787 ( 2.262 -3.751 -4.535) 6.305 5.830 ( -3.740 2.425 -4.996) 6.695 6.263 ( -2.171 -1.207 4.406) 5.058 6.332 ( -2.417 -2.916 6.947) 7.912 7.052 ( 0.039 6.108 6.463) 8.893 7.250 ( 1.662 2.526 3.655) 4.743 7.458 ( 1.221 -1.689 -2.823) 3.508 7.538 ( 1.576 0.501 -1.756) 2.411 7.750 ( -10.390 0.813 -2.306) 10.673 8.430 ( -0.104 5.726 -5.411) 7.879 9.983 ( 0.769 -12.059 1.149) 12.138 10.695 ( -0.344 -8.328 -7.053) 10.919 11.234 ( -3.797 -6.188 5.061) 8.850 11.696 ( -3.907 6.254 -3.593) 8.203 13.195 ( -8.158 -17.621 2.333) 19.557 14.379 ( -3.322 -8.594 -2.235) 9.481 15.987 ( 5.526 9.306 1.469) 10.922 16.134 ( 12.837 3.675 0.619) 13.367 27.157 ( 0.730 -0.406 0.870) 1.206 27.308 ( -0.164 1.906 -1.257) 2.289 27.618 ( 0.038 0.574 0.084) 0.582 27.669 ( 0.470 -1.786 -0.428) 1.896 27.729 ( -0.247 -1.603 2.573) 3.042 27.987 ( -1.208 1.734 -1.532) 2.610 31.475 ( 0.337 -1.914 6.539) 6.822 31.770 ( -1.892 6.013 0.872) 6.363 32.073 ( -1.720 -5.953 -4.029) 7.391 32.719 ( 1.132 1.032 -0.919) 1.786 35.194 ( -0.360 0.531 0.056) 0.644 35.222 ( 0.833 -0.004 2.796) 2.918 36.070 ( -0.597 -1.190 0.406) 1.392 36.294 ( 0.666 0.910 -0.696) 1.325 44.288 ( 2.006 -1.317 1.174) 2.672 44.466 ( 5.305 -1.956 -3.796) 6.810 44.680 ( -0.275 1.274 0.099) 1.307 45.084 ( -5.777 6.312 1.920) 8.770 46.325 ( -4.404 -3.200 3.114) 6.272 46.654 ( -5.365 -7.897 2.022) 9.759 47.139 ( 2.169 0.628 -2.020) 3.029 47.998 ( 5.253 3.043 1.261) 6.201 50.199 ( -6.820 -13.519 5.904) 16.252 51.737 ( -1.426 -34.105 -15.678) 37.563 55.178 ( -7.018 11.077 54.658) 56.209 56.253 ( -5.690 23.620 -9.692) 26.157 70.015 ( 4.680 -9.135 -1.119) 10.325 70.316 ( -0.273 -29.812 -0.937) 29.828 74.542 ( 3.246 7.627 4.207) 9.295 75.921 ( 39.024 10.510 -7.499) 41.104 ======================= Grid point 87 (39/150) ======================= q-point: (-0.50 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 6.728 4.191 5.128) 9.440 1.715 ( 1.041 7.388 7.572) 10.630 1.996 ( 1.791 4.388 1.895) 5.104 2.135 ( 9.421 11.702 -1.778) 15.128 2.662 ( 4.295 1.610 6.990) 8.361 2.853 ( -0.456 0.808 0.336) 0.987 3.131 ( 6.334 7.565 -0.487) 9.878 3.227 ( -1.733 -3.872 0.425) 4.264 3.363 ( -3.144 4.025 -2.247) 5.580 3.489 ( -3.380 -2.735 -4.979) 6.610 3.789 ( -2.783 -6.714 2.989) 7.859 3.931 ( 2.821 -1.156 0.066) 3.049 4.279 ( 2.326 -0.372 2.493) 3.429 4.570 ( -1.710 7.612 -2.397) 8.161 4.823 ( 3.227 1.391 1.958) 4.022 4.893 ( 1.737 10.223 -4.588) 11.339 5.110 ( -5.010 -6.411 1.509) 8.275 5.522 ( -0.193 3.398 -3.882) 5.163 5.762 ( 0.549 3.002 -1.333) 3.330 5.881 ( 1.725 -4.932 -5.049) 7.266 6.273 ( -1.972 -4.571 4.652) 6.813 6.412 ( -2.296 -11.361 6.177) 13.133 6.938 ( -0.508 9.924 6.048) 11.633 7.217 ( 2.451 7.004 3.226) 8.091 7.469 ( -5.442 -0.085 -3.608) 6.530 7.510 ( -2.205 -0.773 2.375) 3.332 7.648 ( -0.475 0.184 -2.773) 2.820 8.363 ( 2.803 4.168 -5.461) 7.420 10.213 ( 0.212 -17.886 -1.836) 17.982 10.843 ( 0.811 -9.905 -10.393) 14.380 11.221 ( -3.646 -1.781 7.296) 8.348 11.572 ( -2.450 3.487 -0.942) 4.365 13.406 ( -7.218 -26.344 3.155) 27.497 14.516 ( -2.372 -16.400 -1.865) 16.675 15.879 ( 3.374 15.074 1.704) 15.541 16.244 ( 13.314 8.392 -3.424) 16.106 27.177 ( 0.519 -0.828 0.694) 1.199 27.268 ( -0.240 2.839 -0.598) 2.911 27.617 ( 0.037 -0.327 0.023) 0.330 27.682 ( -0.002 0.211 0.332) 0.393 27.781 ( 0.431 -4.648 0.876) 4.750 27.936 ( -0.685 2.945 -1.140) 3.231 31.528 ( -0.344 -4.064 4.895) 6.372 31.653 ( -0.811 6.995 1.577) 7.217 32.148 ( -0.509 -6.993 -2.429) 7.420 32.707 ( 0.596 2.093 -1.484) 2.634 35.177 ( -0.297 1.071 0.228) 1.134 35.235 ( 0.346 -0.071 1.866) 1.899 36.087 ( -0.411 -2.166 0.291) 2.223 36.282 ( 0.475 1.817 -0.700) 2.004 44.346 ( 2.445 -1.575 0.141) 2.912 44.578 ( 4.342 -3.100 -3.435) 6.345 44.637 ( -1.603 2.210 0.979) 2.901 44.885 ( -4.926 9.034 1.843) 10.453 46.329 ( -3.631 -5.386 2.049) 6.811 46.748 ( -3.699 -13.906 0.736) 14.408 47.156 ( 2.660 1.939 -0.734) 3.373 47.996 ( 3.091 6.160 0.271) 6.897 50.381 ( -6.605 -25.477 4.190) 26.650 52.329 ( -2.549 -52.410 -16.304) 54.947 54.989 ( -1.820 18.384 38.088) 42.332 55.805 ( 6.476 31.760 -10.545) 34.086 70.240 ( -0.435 -15.885 -0.859) 15.914 70.823 ( 0.472 -39.763 -0.769) 39.773 74.432 ( 1.589 13.503 5.872) 14.810 76.282 ( 37.471 17.490 -12.101) 43.087 ======================= Grid point 88 (40/150) ======================= q-point: (-0.38 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -1.496 13.043 2.778) 13.419 1.605 ( 1.740 11.575 3.993) 12.367 1.956 ( -1.069 1.648 3.827) 4.302 2.177 ( 12.105 4.792 -6.770) 14.674 2.720 ( 1.148 2.757 4.279) 5.218 2.809 ( 0.992 1.871 9.016) 9.262 2.972 ( -2.280 17.466 -2.984) 17.865 3.133 ( -3.407 11.907 0.807) 12.411 3.269 ( -3.772 -3.117 -3.147) 5.817 3.487 ( -1.662 -1.653 -3.559) 4.262 3.841 ( -0.975 -2.582 1.416) 3.101 3.973 ( 1.132 -0.563 1.744) 2.154 4.306 ( -0.633 0.288 2.123) 2.234 4.458 ( 0.170 4.398 -2.599) 5.112 4.743 ( 1.539 12.768 -3.753) 13.397 4.817 ( 0.664 2.172 -0.305) 2.292 5.190 ( -1.060 -8.832 3.103) 9.421 5.487 ( 0.654 0.995 -3.037) 3.262 5.743 ( 0.362 1.000 0.720) 1.285 5.939 ( -0.242 -2.530 -5.164) 5.755 6.362 ( -0.363 -9.343 4.751) 10.488 6.589 ( -0.831 -13.394 3.015) 13.754 6.794 ( -0.728 8.459 5.700) 10.226 7.121 ( 2.056 12.193 1.713) 12.483 7.342 ( -7.421 -1.387 0.603) 7.574 7.552 ( -0.255 -5.184 0.737) 5.243 7.649 ( 1.405 1.230 -1.425) 2.349 8.379 ( 3.989 0.447 -5.440) 6.761 10.475 ( 0.991 -16.225 -7.363) 17.845 10.838 ( -1.265 5.580 -5.479) 7.922 11.349 ( -1.992 -16.905 0.544) 17.030 11.508 ( 1.227 2.148 4.246) 4.915 13.732 ( -4.209 -29.462 4.343) 30.076 14.761 ( -1.350 -21.035 -1.625) 21.141 15.664 ( 0.908 19.313 2.044) 19.442 16.277 ( 10.887 11.557 -7.953) 17.757 27.198 ( 0.404 -0.907 0.380) 1.063 27.222 ( -0.340 2.453 -0.064) 2.477 27.627 ( 0.003 -0.903 0.028) 0.904 27.674 ( -0.145 0.635 0.589) 0.879 27.863 ( 0.324 -5.305 -0.378) 5.328 27.881 ( 0.005 3.636 -0.488) 3.668 31.542 ( -1.131 4.227 1.084) 4.508 31.607 ( 0.342 -3.431 5.158) 6.204 32.244 ( 0.285 -6.703 -1.510) 6.877 32.673 ( 0.222 3.047 -2.128) 3.723 35.158 ( -0.079 1.239 0.672) 1.412 35.240 ( -0.233 -0.224 1.012) 1.062 36.119 ( -0.117 -2.682 0.197) 2.691 36.254 ( 0.252 2.601 -0.607) 2.683 44.398 ( 3.006 0.485 -1.124) 3.246 44.555 ( -2.357 4.599 -0.057) 5.168 44.602 ( -2.572 4.862 1.410) 5.678 44.799 ( 1.947 -4.069 -0.997) 4.620 46.378 ( -2.132 -6.756 2.079) 7.383 46.928 ( -2.362 -16.436 -1.468) 16.670 47.159 ( 3.124 3.559 1.166) 4.877 47.915 ( 0.392 8.668 -0.781) 8.712 50.757 ( -3.713 -35.709 5.005) 36.249 53.040 ( -0.805 -48.102 -23.618) 53.594 54.635 ( -10.174 20.449 30.117) 37.798 55.652 ( 21.561 16.306 -7.854) 28.150 70.424 ( -1.373 -10.535 1.802) 10.776 71.462 ( 0.655 -46.840 -3.810) 46.999 74.232 ( -0.806 15.307 6.236) 16.548 76.506 ( 30.254 20.349 -19.838) 41.508 ======================= Grid point 89 (41/150) ======================= q-point: (-0.25 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( -1.115 16.281 1.971) 16.438 1.405 ( -0.924 16.929 4.155) 17.456 1.907 ( -0.133 5.776 0.840) 5.838 2.311 ( 8.806 1.957 -3.766) 9.775 2.568 ( -5.809 10.593 3.270) 12.516 2.594 ( -10.394 15.489 3.825) 19.041 2.865 ( 4.464 4.631 4.816) 8.036 2.953 ( 3.481 7.667 4.762) 9.674 3.305 ( 2.906 -4.043 -0.877) 5.056 3.481 ( 2.088 1.643 -5.174) 5.816 3.834 ( -0.278 1.801 1.088) 2.122 3.979 ( -0.690 1.921 3.577) 4.118 4.246 ( -2.013 4.303 -1.359) 4.942 4.425 ( -1.340 0.486 -2.240) 2.655 4.591 ( 1.190 8.195 -1.761) 8.466 4.814 ( 1.158 0.061 -0.111) 1.165 5.304 ( -0.355 -7.192 3.036) 7.814 5.493 ( 1.231 0.209 -1.386) 1.866 5.733 ( -1.381 -0.296 1.300) 1.920 5.957 ( -1.141 -3.474 -6.027) 7.049 6.531 ( 0.880 -11.609 4.028) 12.319 6.617 ( -0.058 8.150 2.634) 8.565 6.797 ( -1.147 -4.086 1.864) 4.635 6.968 ( -1.053 5.456 3.942) 6.813 7.305 ( -2.467 -2.518 1.040) 3.675 7.617 ( 1.603 1.015 -1.550) 2.450 7.692 ( -0.150 -9.967 0.945) 10.013 8.422 ( 1.483 -0.710 -5.335) 5.583 10.530 ( 3.025 12.566 -6.395) 14.421 10.868 ( -1.434 -15.048 -8.052) 17.126 11.374 ( -3.234 0.840 3.562) 4.884 11.721 ( 2.269 -18.308 -0.375) 18.452 14.125 ( 0.011 -27.194 4.186) 27.514 15.058 ( -0.731 -21.764 -1.390) 21.820 15.367 ( -1.348 21.054 2.291) 21.221 16.192 ( 3.171 14.029 -12.672) 19.169 27.179 ( 0.111 2.597 0.239) 2.611 27.227 ( -0.125 -2.033 0.082) 2.038 27.639 ( -0.212 -0.767 -0.140) 0.808 27.665 ( -0.042 0.360 0.554) 0.662 27.827 ( 0.368 3.848 0.273) 3.876 27.939 ( -0.172 -4.903 -1.001) 5.008 31.472 ( 0.517 4.739 3.437) 5.877 31.679 ( -1.136 -5.968 2.988) 6.770 32.335 ( 0.088 -5.280 -1.469) 5.481 32.624 ( 0.297 3.427 -2.495) 4.250 35.144 ( 0.291 0.951 1.468) 1.773 35.239 ( -0.742 -0.463 0.372) 0.950 36.159 ( 0.226 -2.638 0.073) 2.649 36.214 ( 0.020 3.032 -0.415) 3.061 44.398 ( 1.573 6.407 -0.506) 6.616 44.402 ( 0.080 8.895 -0.751) 8.927 44.556 ( -2.707 -3.522 1.987) 4.866 44.931 ( 1.655 -8.479 -1.741) 8.813 46.460 ( -0.476 -6.524 2.337) 6.946 47.065 ( -4.942 -5.758 -3.965) 8.562 47.215 ( 6.309 -5.266 3.510) 8.936 47.759 ( -2.280 10.493 -1.830) 10.893 51.264 ( -0.740 -34.805 2.451) 34.899 53.251 ( -0.809 21.356 -23.026) 31.415 54.618 ( -12.814 -47.837 18.576) 52.893 55.877 ( 17.437 -3.902 0.715) 17.883 70.487 ( 1.260 3.401 5.093) 6.252 72.142 ( -2.361 -47.984 -10.019) 49.076 74.027 ( -1.554 9.558 4.676) 10.753 76.454 ( 5.022 24.730 -31.487) 40.352 ======================= Grid point 90 (42/150) ======================= q-point: (-0.12 0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.957 ( -5.397 17.915 5.343) 19.458 1.175 ( 4.495 15.828 6.701) 17.766 1.728 ( -3.279 15.745 3.070) 16.374 2.177 ( 8.828 22.287 11.824) 26.729 2.290 ( -9.422 5.251 -1.132) 10.846 2.555 ( 1.942 -3.962 -3.599) 5.694 2.806 ( 7.185 11.267 0.631) 13.378 3.042 ( 1.464 -8.696 9.756) 13.151 3.462 ( 6.693 2.344 -2.041) 7.380 3.542 ( 12.816 -5.501 0.110) 13.948 3.780 ( -0.431 7.910 2.348) 8.263 3.886 ( -1.924 5.214 2.035) 5.918 4.158 ( -1.521 2.634 -3.756) 4.834 4.378 ( -3.254 0.088 -2.413) 4.052 4.566 ( 2.257 -0.087 0.710) 2.368 4.845 ( 0.443 -2.435 1.270) 2.782 5.392 ( -0.069 -4.921 2.124) 5.361 5.503 ( 1.338 1.362 0.184) 1.918 5.721 ( -2.850 -2.674 0.015) 3.909 5.985 ( -1.777 -4.118 -6.533) 7.924 6.488 ( -1.155 8.274 2.497) 8.719 6.651 ( -0.831 8.268 -2.227) 8.603 6.743 ( -0.141 -7.868 5.999) 9.895 7.027 ( -0.987 -8.146 6.092) 10.220 7.316 ( -0.009 -1.114 -0.112) 1.120 7.601 ( 0.533 2.404 0.190) 2.470 7.898 ( 0.777 -16.092 -2.411) 16.290 8.416 ( -2.825 -1.019 -4.711) 5.587 10.341 ( 3.305 17.496 -1.559) 17.874 10.982 ( -0.309 -0.735 -14.310) 14.332 11.397 ( -3.353 -11.985 6.643) 14.107 11.953 ( -2.870 -12.485 -5.825) 14.073 14.458 ( 1.442 -11.561 -2.289) 11.874 15.040 ( -3.915 18.159 3.154) 18.843 15.344 ( -0.841 -18.382 -1.265) 18.445 15.902 ( -9.223 15.418 -11.653) 21.414 27.148 ( 0.234 1.962 0.517) 2.042 27.257 ( -0.189 -2.493 -0.362) 2.526 27.638 ( -0.428 0.120 -0.214) 0.493 27.666 ( 0.112 -0.079 0.179) 0.226 27.783 ( 0.536 3.398 1.452) 3.733 27.993 ( -1.010 -3.972 -1.416) 4.336 31.434 ( 1.329 3.374 5.541) 6.622 31.748 ( -2.168 -6.412 1.474) 6.927 32.370 ( -1.795 -0.833 -3.217) 3.777 32.594 ( 1.465 1.346 -1.482) 2.481 35.145 ( 0.666 0.338 2.519) 2.627 35.233 ( -1.133 -0.588 0.018) 1.276 36.164 ( -0.171 2.975 -0.260) 2.991 36.204 ( 0.506 -2.206 0.025) 2.263 44.272 ( 1.802 8.041 -0.624) 8.264 44.348 ( 1.704 5.481 0.635) 5.775 44.592 ( -0.938 -4.158 -0.216) 4.268 45.068 ( -0.557 -9.373 -1.092) 9.453 46.546 ( 0.365 -4.313 2.107) 4.814 46.996 ( -5.192 2.258 -0.369) 5.673 47.435 ( 6.065 -9.326 0.664) 11.145 47.543 ( -4.527 11.238 -2.950) 12.469 51.563 ( -5.549 -4.435 -12.108) 14.038 52.709 ( 0.379 35.395 -12.529) 37.549 55.363 ( -12.434 -68.052 2.767) 69.234 56.181 ( -14.177 -26.646 29.241) 42.024 70.354 ( 3.699 21.462 6.576) 22.750 72.618 ( -16.628 -31.464 -21.780) 41.723 73.993 ( 4.069 -3.661 2.076) 5.854 75.636 ( -39.355 47.144 -31.208) 68.886 ======================= Grid point 94 (43/150) ======================= q-point: ( 0.38 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 5.614 0.000 5.925) 8.162 1.814 ( 3.764 0.000 12.575) 13.127 2.074 ( 0.592 0.000 1.490) 1.604 2.390 ( 4.593 0.000 -1.774) 4.924 2.724 ( -0.992 -0.000 10.520) 10.567 2.809 ( 4.842 0.000 -1.246) 5.000 3.033 ( 1.333 0.000 -0.161) 1.343 3.285 ( 19.681 0.000 -0.050) 19.681 3.457 ( -4.619 -0.000 -7.287) 8.628 3.526 ( 2.781 0.000 -4.700) 5.461 3.582 ( -8.442 -0.000 4.960) 9.791 3.900 ( 2.431 0.000 -0.516) 2.486 4.281 ( 1.464 0.000 2.665) 3.041 4.766 ( 0.426 0.000 -3.805) 3.829 4.770 ( 3.631 0.000 4.272) 5.607 4.987 ( -5.522 -0.000 -0.443) 5.539 5.075 ( -2.580 -0.000 -3.874) 4.654 5.652 ( 4.415 0.000 -3.717) 5.772 5.690 ( -4.604 -0.000 -4.678) 6.564 5.846 ( 2.248 0.000 -6.063) 6.466 6.221 ( -3.759 -0.000 7.281) 8.194 6.270 ( -4.395 -0.000 5.111) 6.741 7.110 ( 0.002 0.000 7.053) 7.053 7.289 ( 0.782 0.000 3.058) 3.157 7.451 ( -0.281 -0.000 -0.071) 0.290 7.585 ( 3.593 0.000 -3.815) 5.241 7.608 ( -8.157 -0.000 -1.195) 8.244 8.458 ( -0.246 -0.000 -4.639) 4.646 9.908 ( 0.952 0.000 1.853) 2.083 10.610 ( -0.498 -0.000 -6.285) 6.304 11.159 ( -1.596 -0.000 5.193) 5.432 11.689 ( -2.975 -0.000 -3.258) 4.412 12.977 ( -4.702 -0.000 3.374) 5.787 14.264 ( -2.853 -0.000 -3.194) 4.283 16.123 ( 3.350 0.000 1.444) 3.648 16.347 ( 11.373 0.000 -0.914) 11.410 27.165 ( 0.507 0.000 0.877) 1.013 27.320 ( -0.004 -0.000 -1.210) 1.210 27.635 ( 0.257 0.000 -0.120) 0.284 27.647 ( 0.236 0.000 -0.505) 0.557 27.717 ( -0.456 -0.000 2.487) 2.528 27.982 ( -0.811 -0.000 -1.349) 1.574 31.467 ( -0.584 -0.000 5.012) 5.046 31.808 ( -0.766 -0.000 3.243) 3.333 31.992 ( -0.748 -0.000 -4.329) 4.393 32.738 ( 0.601 0.000 -1.232) 1.371 35.194 ( -0.207 -0.000 0.002) 0.207 35.234 ( 0.270 0.000 2.049) 2.067 36.054 ( -0.420 -0.000 0.659) 0.782 36.308 ( 0.523 0.000 -0.827) 0.979 44.316 ( 2.692 0.000 0.870) 2.829 44.523 ( 4.824 0.000 -3.535) 5.980 44.677 ( -1.505 -0.000 0.925) 1.766 45.050 ( -5.407 -0.000 1.711) 5.671 46.249 ( -3.316 -0.000 2.768) 4.319 46.505 ( -5.490 -0.000 -0.189) 5.493 47.186 ( 3.088 0.000 0.252) 3.099 48.089 ( 3.376 0.000 0.029) 3.376 50.030 ( -5.553 -0.000 7.445) 9.288 51.440 ( -0.887 -0.000 -15.760) 15.785 55.255 ( -3.043 -0.000 39.889) 40.005 56.348 ( -1.987 -0.000 -7.056) 7.330 70.017 ( -0.656 -0.000 -1.471) 1.611 70.125 ( 6.656 0.000 -0.825) 6.707 74.657 ( 2.971 0.000 5.525) 6.273 76.526 ( 32.092 0.000 -9.807) 33.557 ======================= Grid point 95 (44/150) ======================= q-point: (-0.50 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( 1.786 1.497 5.512) 5.984 1.809 ( -1.986 4.986 6.981) 8.806 2.049 ( -1.397 2.227 0.912) 2.783 2.398 ( 5.512 7.011 -2.790) 9.345 2.715 ( -0.342 0.441 7.997) 8.016 2.865 ( 0.831 0.041 0.544) 0.994 3.096 ( 0.102 -5.670 -1.437) 5.850 3.384 ( -2.404 2.392 -6.267) 7.126 3.414 ( 1.323 7.851 -0.144) 7.963 3.466 ( 6.764 5.380 -1.075) 8.709 3.661 ( 0.556 -7.867 0.926) 7.941 3.936 ( 0.836 -1.625 -0.432) 1.878 4.295 ( -0.007 -0.246 2.723) 2.734 4.651 ( -1.605 8.106 -1.632) 8.423 4.902 ( 3.663 -5.025 2.580) 6.732 4.935 ( -2.860 -1.095 -2.069) 3.696 5.005 ( -1.932 3.769 -3.040) 5.213 5.568 ( -0.627 4.727 -4.851) 6.802 5.771 ( 2.045 -3.420 -3.962) 5.619 5.869 ( 2.606 0.146 -5.695) 6.265 6.190 ( -3.183 -3.581 4.915) 6.864 6.238 ( -5.192 -5.150 7.047) 10.156 7.067 ( -0.326 6.826 6.897) 9.709 7.292 ( -0.697 0.212 2.591) 2.692 7.431 ( -1.669 3.550 -1.625) 4.246 7.484 ( -2.011 1.824 1.736) 3.222 7.655 ( 2.564 -1.822 -2.722) 4.159 8.435 ( 1.366 2.474 -4.220) 5.079 10.003 ( 0.465 -10.491 0.942) 10.543 10.676 ( 0.475 -9.939 -7.515) 12.469 11.162 ( -1.997 -1.808 5.396) 6.031 11.615 ( -0.531 4.656 -1.243) 4.849 13.042 ( -2.346 -14.527 4.430) 15.367 14.289 ( -1.973 -9.256 -3.711) 10.165 16.096 ( 1.573 8.881 1.599) 9.160 16.469 ( 7.115 2.362 -2.857) 8.023 27.174 ( 0.198 -0.396 0.769) 0.887 27.303 ( 0.116 2.107 -0.759) 2.242 27.620 ( 0.024 0.767 -0.167) 0.785 27.676 ( 0.063 -1.439 -0.564) 1.546 27.728 ( -0.308 -2.540 1.797) 3.126 27.961 ( -0.196 1.565 -1.008) 1.872 31.473 ( -1.506 -2.145 3.153) 4.100 31.753 ( 0.431 6.258 3.657) 7.261 32.043 ( 0.369 -6.429 -2.162) 6.793 32.733 ( 0.094 1.063 -1.701) 2.008 35.187 ( -0.109 0.621 0.090) 0.637 35.236 ( -0.417 -0.073 1.121) 1.199 36.059 ( -0.126 -1.172 0.782) 1.415 36.307 ( 0.318 0.948 -0.853) 1.314 44.366 ( 2.442 -1.096 0.281) 2.691 44.599 ( 3.689 -1.734 -3.246) 5.210 44.639 ( -1.823 1.473 1.467) 2.765 44.930 ( -4.389 6.082 1.369) 7.624 46.228 ( -2.241 -2.584 1.788) 3.860 46.510 ( -3.416 -9.863 -1.108) 10.497 47.226 ( 2.886 1.102 1.896) 3.625 48.094 ( 0.624 3.305 -1.736) 3.785 50.047 ( -3.818 -11.688 5.924) 13.648 51.643 ( -1.171 -31.459 -15.658) 35.159 55.192 ( -4.900 8.729 27.433) 29.202 56.220 ( 4.247 16.302 -3.886) 17.289 70.067 ( 0.547 -8.247 -0.638) 8.290 70.375 ( 1.855 -23.022 -1.630) 23.154 74.638 ( 1.640 8.835 7.021) 11.403 76.864 ( 20.072 5.631 -12.615) 24.367 ======================= Grid point 96 (45/150) ======================= q-point: (-0.38 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( -2.658 9.255 2.760) 10.017 1.701 ( -1.889 3.261 4.769) 6.078 1.980 ( -1.416 3.174 0.745) 3.554 2.376 ( 4.221 5.163 -5.362) 8.558 2.690 ( -6.117 0.339 4.213) 7.435 2.843 ( -0.930 2.718 5.921) 6.581 3.175 ( 0.370 -5.141 -1.977) 5.520 3.246 ( -0.534 13.904 -2.595) 14.154 3.303 ( 2.391 11.105 -1.484) 11.456 3.465 ( 2.667 0.006 -1.316) 2.974 3.764 ( -0.540 -5.727 1.202) 5.877 3.960 ( -1.073 -1.733 -0.495) 2.098 4.293 ( -1.265 0.088 2.073) 2.430 4.524 ( -0.680 6.105 -2.357) 6.580 4.857 ( -3.050 5.659 -2.370) 6.852 4.922 ( 2.440 5.904 -2.505) 6.862 5.054 ( 0.977 -8.963 2.909) 9.474 5.520 ( 1.703 2.236 -3.631) 4.592 5.766 ( -0.776 2.880 -1.060) 3.165 5.910 ( 1.159 -0.802 -6.293) 6.449 6.235 ( -1.575 -6.902 5.263) 8.821 6.340 ( -2.767 -15.931 3.417) 16.527 6.942 ( -0.348 10.266 6.318) 12.059 7.249 ( -5.168 2.767 -0.390) 5.875 7.326 ( 3.994 7.722 1.334) 8.795 7.498 ( 0.555 -2.643 2.197) 3.482 7.693 ( 1.729 0.826 -1.198) 2.259 8.430 ( 2.223 1.438 -3.881) 4.698 10.209 ( -0.085 -17.297 -2.287) 17.448 10.826 ( 0.521 -7.883 -11.776) 14.181 11.168 ( -1.242 -3.301 7.382) 8.181 11.571 ( 2.190 2.663 2.297) 4.143 13.318 ( 0.503 -24.103 5.421) 24.710 14.455 ( -1.173 -17.198 -3.874) 17.668 15.928 ( -0.409 15.553 1.670) 15.648 16.473 ( 0.985 5.386 -4.979) 7.401 27.185 ( -0.135 -0.875 0.560) 1.048 27.266 ( 0.247 3.123 -0.274) 3.145 27.617 ( -0.056 -0.347 -0.059) 0.357 27.679 ( -0.204 0.291 0.308) 0.470 27.785 ( -0.401 -5.099 -0.027) 5.114 27.930 ( 0.440 2.735 -0.530) 2.821 31.489 ( -2.271 -3.421 1.260) 4.295 31.682 ( 1.561 6.097 4.890) 7.970 32.152 ( 1.072 -6.963 -0.865) 7.098 32.706 ( -0.320 2.016 -2.261) 3.046 35.175 ( 0.084 0.985 0.443) 1.083 35.228 ( -0.998 -0.248 0.356) 1.088 36.085 ( 0.191 -2.118 0.746) 2.254 36.288 ( 0.073 1.862 -0.797) 2.026 44.418 ( 0.940 -2.418 -0.167) 2.600 44.572 ( -0.908 3.754 1.286) 4.071 44.672 ( 2.250 1.365 -3.219) 4.158 44.782 ( -2.484 3.799 1.616) 4.818 46.269 ( -0.415 -5.576 1.698) 5.843 46.656 ( -1.767 -14.992 -2.455) 15.294 47.248 ( 2.569 1.885 3.626) 4.827 48.010 ( -1.947 6.238 -3.096) 7.231 50.297 ( 0.381 -25.654 6.335) 26.427 52.207 ( -1.484 -50.970 -19.562) 54.615 54.879 ( -11.929 22.579 18.458) 31.509 56.075 ( 8.790 15.500 0.670) 17.831 70.244 ( 1.122 -13.445 1.404) 13.564 70.822 ( -1.358 -38.111 -3.614) 38.306 74.476 ( -0.322 16.032 7.339) 17.635 76.915 ( 2.148 9.171 -16.180) 18.722 ======================= Grid point 97 (46/150) ======================= q-point: (-0.25 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( -4.279 11.764 1.123) 12.569 1.565 ( -4.220 10.244 2.889) 11.450 1.971 ( 2.484 0.970 4.528) 5.255 2.376 ( 1.292 -1.710 -8.880) 9.135 2.454 ( -17.476 7.895 2.305) 19.315 2.764 ( 1.428 10.251 7.369) 12.705 3.074 ( 2.425 8.251 4.268) 9.600 3.164 ( 2.293 11.010 -1.447) 11.339 3.303 ( 5.906 -5.816 -1.603) 8.442 3.538 ( 5.829 -0.577 -1.928) 6.167 3.813 ( -1.062 -2.744 0.995) 3.106 3.956 ( -2.747 -1.906 -0.849) 3.450 4.255 ( -1.974 1.994 0.714) 2.895 4.441 ( -0.362 4.760 -1.787) 5.097 4.696 ( -2.998 7.424 -4.014) 8.956 4.882 ( 1.872 4.666 0.788) 5.089 5.196 ( 0.822 -8.000 2.815) 8.521 5.531 ( 3.175 1.281 -2.044) 3.987 5.703 ( -3.154 1.335 0.293) 3.438 5.903 ( -0.553 -0.417 -5.996) 6.036 6.365 ( -0.609 -11.282 4.966) 12.342 6.567 ( -0.866 -16.756 1.154) 16.818 6.796 ( -0.194 9.925 5.255) 11.232 7.076 ( -3.387 10.234 0.463) 10.790 7.329 ( 4.610 2.790 -0.210) 5.392 7.580 ( 2.414 -5.480 1.710) 6.227 7.684 ( 0.739 2.576 0.263) 2.693 8.423 ( -0.477 1.554 -3.578) 3.930 10.482 ( 0.162 -20.612 -6.642) 21.656 10.810 ( 1.318 8.298 -8.506) 11.956 11.270 ( -1.683 -9.336 2.853) 9.907 11.614 ( 3.259 -2.430 4.457) 6.033 13.755 ( 4.678 -28.914 5.575) 29.816 14.720 ( -0.989 -21.539 -3.627) 21.865 15.653 ( -1.744 19.913 1.405) 20.038 16.306 ( -7.779 10.174 -6.548) 14.384 27.197 ( -0.549 -1.174 0.293) 1.329 27.226 ( 0.545 2.843 0.094) 2.897 27.625 ( -0.086 -0.777 0.029) 0.783 27.670 ( -0.173 0.481 0.398) 0.648 27.848 ( -0.959 -4.550 -0.911) 4.738 27.896 ( 0.821 2.738 0.070) 2.860 31.501 ( -1.779 -2.056 0.887) 2.860 31.646 ( 1.257 2.752 5.271) 6.078 32.262 ( 1.092 -5.717 -0.654) 5.857 32.661 ( -0.492 2.512 -2.677) 3.704 35.166 ( 0.415 0.905 1.112) 1.493 35.216 ( -1.317 -0.488 -0.088) 1.407 36.126 ( 0.459 -2.654 0.558) 2.751 36.253 ( -0.188 2.623 -0.692) 2.719 44.452 ( -3.069 -3.055 0.681) 4.383 44.518 ( 3.303 4.934 -0.146) 5.940 44.569 ( 1.276 10.433 -1.177) 10.576 44.817 ( -1.306 -7.184 -0.052) 7.301 46.375 ( 1.718 -6.724 2.207) 7.282 46.837 ( -2.681 -13.234 -3.895) 14.054 47.280 ( 3.736 -0.119 5.354) 6.529 47.851 ( -3.776 8.876 -3.865) 10.391 50.808 ( 6.335 -34.741 7.981) 36.205 52.928 ( -1.148 -50.312 -31.084) 59.151 54.305 ( -16.776 22.923 17.354) 33.288 56.003 ( 0.837 8.452 7.723) 11.480 70.470 ( 3.603 -11.139 4.032) 12.382 71.392 ( -3.785 -45.246 -6.945) 45.932 74.219 ( -1.331 16.977 5.557) 17.912 76.541 ( -24.057 18.905 -18.273) 35.637 ======================= Grid point 98 (47/150) ======================= q-point: (-0.12 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.123 ( -6.194 15.936 3.428) 17.438 1.393 ( 0.671 7.282 3.602) 8.152 1.931 ( 0.304 13.886 8.091) 16.074 2.080 ( -15.229 -0.292 0.972) 15.262 2.462 ( 0.288 -6.575 -7.899) 10.282 2.649 ( 8.125 13.480 2.635) 15.959 3.004 ( 0.484 6.680 4.381) 8.003 3.104 ( 4.470 4.374 6.544) 9.052 3.547 ( 9.701 -9.746 0.087) 13.751 3.637 ( 7.619 -0.605 -3.436) 8.380 3.817 ( -1.083 0.241 0.389) 1.176 3.913 ( -4.586 1.638 -1.357) 5.055 4.177 ( -1.113 5.208 -1.098) 5.437 4.354 ( -1.385 3.304 -1.216) 3.783 4.599 ( -0.333 1.075 -2.631) 2.862 4.847 ( -0.257 2.066 3.389) 3.977 5.317 ( 1.139 -6.283 1.867) 6.653 5.551 ( 1.148 2.206 0.620) 2.563 5.638 ( -3.269 -0.687 -1.010) 3.490 5.910 ( -0.163 -2.247 -6.097) 6.500 6.507 ( -2.611 -6.262 6.939) 9.705 6.659 ( 1.279 3.236 0.729) 3.556 6.782 ( 0.017 -4.021 1.738) 4.380 6.893 ( -2.792 3.226 3.149) 5.303 7.364 ( 4.471 1.798 -2.508) 5.432 7.649 ( -0.025 3.107 1.169) 3.320 7.741 ( 4.045 -9.489 -0.647) 10.336 8.348 ( -5.196 1.780 -3.168) 6.340 10.646 ( 4.465 16.077 -4.335) 17.240 10.774 ( -1.813 -19.735 -11.856) 23.094 11.318 ( -0.748 0.304 4.089) 4.168 11.736 ( -1.319 -9.574 0.969) 9.713 14.262 ( 7.767 -23.265 3.028) 24.714 14.993 ( -3.433 -17.847 -2.131) 18.299 15.335 ( -0.864 18.572 -0.001) 18.592 15.924 ( -14.933 15.026 -4.893) 21.742 27.184 ( 0.083 1.960 0.374) 1.997 27.223 ( -0.064 -1.435 -0.023) 1.437 27.632 ( -0.151 -0.255 -0.017) 0.296 27.665 ( -0.045 -0.018 0.389) 0.392 27.846 ( 0.686 3.235 0.425) 3.334 27.911 ( -1.213 -4.082 -1.024) 4.380 31.500 ( 0.213 0.858 3.400) 3.513 31.651 ( -0.902 -1.834 3.012) 3.640 32.331 ( -0.015 -2.095 -1.634) 2.657 32.622 ( 0.116 1.298 -2.281) 2.627 35.167 ( 0.788 0.492 1.996) 2.201 35.204 ( -1.329 -0.678 -0.223) 1.509 36.175 ( 0.642 -2.577 0.251) 2.668 36.206 ( -0.423 2.920 -0.538) 3.000 44.399 ( -1.203 4.090 0.556) 4.299 44.466 ( 3.003 7.812 -0.452) 8.382 44.545 ( 2.408 -1.243 -1.382) 3.042 44.901 ( -3.328 -9.070 0.440) 9.671 46.503 ( 2.695 -4.954 2.458) 6.152 46.896 ( -5.116 -3.994 -1.743) 6.720 47.414 ( 5.727 -6.731 4.180) 9.776 47.633 ( -4.674 11.005 -4.446) 12.756 51.384 ( 7.287 -20.056 4.427) 21.793 53.084 ( -4.621 17.859 -25.313) 31.321 54.280 ( -10.641 -51.764 3.806) 52.983 55.794 ( -18.835 6.184 22.910) 30.297 70.627 ( 5.890 3.148 5.357) 8.561 71.899 ( -9.486 -34.824 -11.137) 37.772 74.061 ( 3.861 3.711 1.856) 5.668 75.571 ( -42.556 37.110 -11.841) 57.692 ======================= Grid point 103 (48/150) ======================= q-point: (-0.50 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( 0.247 -0.000 6.617) 6.622 1.792 ( -6.731 -0.000 3.335) 7.511 2.038 ( -1.723 -0.000 -0.423) 1.774 2.481 ( 0.226 -0.000 -2.741) 2.750 2.706 ( -2.729 -0.000 7.606) 8.081 2.875 ( -0.150 -0.000 -1.233) 1.242 3.052 ( 0.015 -0.000 -2.633) 2.633 3.372 ( 0.456 -0.000 -4.524) 4.547 3.445 ( -2.262 -0.000 3.734) 4.366 3.614 ( 2.842 -0.000 -2.003) 3.477 3.636 ( 2.046 -0.000 -2.322) 3.094 3.920 ( -0.963 -0.000 -1.080) 1.447 4.292 ( -0.512 -0.000 3.057) 3.099 4.726 ( -4.515 -0.000 -0.556) 4.549 4.770 ( 0.518 0.000 -2.432) 2.486 4.980 ( 2.085 -0.000 0.426) 2.128 5.009 ( 0.216 -0.000 -2.375) 2.385 5.598 ( 0.404 -0.000 -6.081) 6.094 5.788 ( 5.146 0.000 -4.768) 7.015 5.908 ( 2.593 -0.000 -6.312) 6.824 6.077 ( -6.453 -0.000 7.059) 9.564 6.153 ( -3.876 -0.000 5.139) 6.437 7.126 ( -0.397 -0.000 7.330) 7.340 7.263 ( -2.429 -0.000 0.206) 2.438 7.444 ( 0.013 -0.000 0.595) 0.595 7.510 ( 1.637 -0.000 1.465) 2.197 7.672 ( 2.462 -0.000 -1.438) 2.851 8.466 ( 1.459 -0.000 -3.262) 3.573 9.942 ( 0.907 -0.000 2.607) 2.761 10.600 ( 1.139 -0.000 -5.816) 5.927 11.132 ( -0.967 -0.000 4.296) 4.403 11.658 ( 1.588 -0.000 -1.012) 1.883 12.933 ( 0.872 -0.000 5.689) 5.756 14.190 ( -1.209 -0.000 -5.209) 5.347 16.174 ( -0.369 -0.000 1.349) 1.399 16.535 ( 0.398 -0.000 -2.448) 2.481 27.173 ( -0.161 -0.000 0.743) 0.761 27.323 ( 0.426 -0.000 -0.661) 0.786 27.637 ( -0.124 -0.000 -0.471) 0.487 27.646 ( -0.189 -0.000 -0.886) 0.906 27.709 ( -0.491 -0.000 2.052) 2.110 27.972 ( 0.409 -0.000 -0.806) 0.904 31.433 ( -2.130 -0.000 1.883) 2.843 31.830 ( 1.120 -0.000 5.969) 6.073 31.995 ( 1.571 -0.000 -2.436) 2.899 32.735 ( -0.418 -0.000 -2.094) 2.135 35.191 ( 0.013 -0.000 0.054) 0.055 35.225 ( -1.117 -0.000 0.318) 1.161 36.052 ( 0.150 -0.000 1.084) 1.094 36.316 ( 0.093 -0.000 -0.905) 0.909 44.379 ( 0.090 -0.000 0.216) 0.234 44.629 ( 2.301 -0.000 -2.578) 3.455 44.634 ( -0.262 -0.000 1.799) 1.818 44.921 ( -2.835 -0.000 0.201) 2.842 46.189 ( -0.997 -0.000 1.232) 1.585 46.396 ( -0.947 -0.000 -1.829) 2.060 47.276 ( 2.117 -0.000 3.612) 4.187 48.101 ( -2.256 -0.000 -3.862) 4.473 49.927 ( -1.910 -0.000 5.151) 5.494 51.387 ( 0.651 -0.000 -15.216) 15.230 55.169 ( -11.234 -0.000 19.733) 22.707 56.409 ( 5.983 -0.000 1.159) 6.094 70.012 ( 0.604 -0.000 -0.319) 0.683 70.219 ( -0.481 -0.000 -2.272) 2.322 74.733 ( 0.384 -0.000 8.130) 8.139 77.042 ( 1.293 -0.000 -12.573) 12.639 ======================= Grid point 105 (49/150) ======================= q-point: (-0.38 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( -9.503 4.089 0.936) 10.388 1.703 ( -1.580 0.218 6.810) 6.994 2.000 ( -0.467 2.100 -1.091) 2.412 2.429 ( -3.306 2.580 -4.456) 6.119 2.630 ( -6.035 4.410 6.394) 9.836 2.857 ( -1.209 -0.306 -0.458) 1.328 3.090 ( -0.592 -5.969 -1.714) 6.239 3.336 ( -5.482 2.985 -3.000) 6.926 3.389 ( -0.266 4.357 -0.778) 4.434 3.580 ( 2.852 4.418 0.116) 5.260 3.685 ( 0.153 -4.373 -0.160) 4.379 3.900 ( -2.996 -1.333 -1.894) 3.786 4.286 ( -0.769 0.430 3.112) 3.234 4.601 ( -1.276 5.698 -2.633) 6.405 4.810 ( -3.278 -1.913 -2.771) 4.699 5.010 ( 2.250 1.568 -0.649) 2.818 5.020 ( 3.100 -0.969 0.097) 3.249 5.592 ( 3.506 2.598 -4.632) 6.364 5.809 ( -0.414 4.694 -2.517) 5.343 5.927 ( 1.931 0.435 -6.790) 7.072 6.084 ( -3.967 -9.742 3.903) 11.220 6.150 ( -0.242 -5.654 4.822) 7.435 7.074 ( -0.551 6.921 6.700) 9.649 7.223 ( -2.388 1.054 -0.338) 2.632 7.444 ( 1.028 1.165 -0.191) 1.565 7.533 ( 4.975 2.844 2.853) 6.401 7.714 ( 1.441 -0.848 0.233) 1.689 8.479 ( 1.985 1.231 -2.669) 3.547 10.018 ( 0.208 -8.150 1.365) 8.266 10.682 ( 1.534 -8.548 -7.034) 11.176 11.151 ( 0.395 -2.304 4.744) 5.289 11.667 ( 3.739 3.671 1.004) 5.335 13.079 ( 3.522 -14.065 6.331) 15.821 14.238 ( -0.438 -9.425 -6.204) 11.292 16.090 ( -2.189 8.837 1.268) 9.193 16.475 ( -6.348 2.039 -2.498) 7.120 27.172 ( -0.486 -0.405 0.629) 0.892 27.312 ( 0.578 2.288 -0.370) 2.389 27.617 ( -0.177 0.582 -0.263) 0.662 27.670 ( -0.305 -1.606 -0.905) 1.868 27.717 ( -0.696 -2.333 1.373) 2.795 27.971 ( 0.957 1.514 -0.546) 1.873 31.415 ( -2.425 -1.956 0.949) 3.257 31.806 ( 1.824 5.886 5.593) 8.322 32.079 ( 2.221 -6.042 -0.483) 6.456 32.715 ( -0.878 0.988 -2.602) 2.918 35.188 ( 0.131 0.523 0.253) 0.595 35.206 ( -1.483 -0.217 -0.181) 1.510 36.067 ( 0.356 -1.184 1.103) 1.657 36.307 ( -0.174 0.958 -0.891) 1.320 44.370 ( -2.665 -1.626 0.305) 3.137 44.632 ( 1.898 2.059 0.867) 2.931 44.665 ( 0.187 -2.412 -0.679) 2.512 44.849 ( -0.265 6.180 -1.335) 6.328 46.211 ( 0.827 -3.553 1.145) 3.824 46.466 ( 0.891 -8.760 -2.525) 9.161 47.303 ( 1.420 0.690 5.207) 5.441 48.022 ( -4.239 2.804 -5.103) 7.202 50.031 ( 1.807 -14.960 5.041) 15.889 51.588 ( 0.797 -28.067 -17.191) 32.923 54.900 ( -18.851 9.634 13.841) 25.293 56.421 ( 8.025 13.370 6.076) 16.735 70.093 ( 0.986 -9.092 0.568) 9.163 70.343 ( -3.263 -21.837 -3.065) 22.291 74.667 ( -1.466 9.683 8.134) 12.731 76.870 ( -17.134 5.091 -12.411) 21.760 ======================= Grid point 106 (50/150) ======================= q-point: (-0.25 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( -9.163 4.335 1.047) 10.191 1.594 ( -8.405 5.926 4.695) 11.305 1.999 ( -0.232 -0.385 3.361) 3.391 2.321 ( -4.783 1.556 -6.986) 8.608 2.394 ( -8.673 10.846 4.836) 14.705 2.864 ( 0.541 -0.725 0.307) 0.956 3.139 ( -5.807 -0.281 1.978) 6.141 3.209 ( -2.484 -2.852 -0.490) 3.814 3.315 ( 0.876 2.305 -3.772) 4.506 3.641 ( 6.964 0.463 -0.559) 7.002 3.746 ( -0.340 -4.635 0.185) 4.652 3.860 ( -4.493 -1.680 -3.426) 5.895 4.260 ( -1.151 1.477 3.055) 3.584 4.526 ( 0.739 3.880 -2.238) 4.540 4.707 ( -4.820 5.653 -4.055) 8.464 4.978 ( 0.999 5.583 -0.462) 5.690 5.134 ( 3.686 -5.463 1.907) 6.861 5.615 ( 3.454 2.109 -1.249) 4.236 5.701 ( -1.610 5.277 -2.032) 5.879 5.900 ( -1.004 1.155 -4.946) 5.177 6.202 ( -0.711 -10.333 3.155) 10.828 6.332 ( 1.827 -14.322 1.971) 14.572 6.950 ( -0.463 9.966 5.639) 11.461 7.143 ( -2.305 5.166 0.398) 5.671 7.443 ( 2.573 2.322 -1.309) 3.705 7.606 ( 6.655 0.269 2.965) 7.291 7.728 ( 1.093 1.424 1.100) 2.105 8.460 ( 0.181 4.492 -1.630) 4.782 10.181 ( -1.386 -16.016 -3.150) 16.382 10.825 ( 1.879 -7.546 -10.595) 13.143 11.215 ( 3.309 -1.235 7.124) 7.951 11.686 ( 4.214 2.522 3.015) 5.762 13.461 ( 7.685 -25.652 6.035) 27.450 14.419 ( -0.136 -16.926 -6.429) 18.107 15.873 ( -3.250 15.035 1.250) 15.433 16.261 ( -13.100 7.051 -2.448) 15.077 27.173 ( -0.727 -0.855 0.465) 1.215 27.280 ( 0.614 3.185 -0.074) 3.244 27.616 ( 0.039 -0.467 0.052) 0.472 27.673 ( -0.191 0.127 -0.108) 0.253 27.758 ( -1.193 -4.660 -0.150) 4.813 27.956 ( 1.252 2.763 -0.227) 3.042 31.419 ( -2.383 -3.452 0.513) 4.226 31.756 ( 2.105 6.098 5.704) 8.611 32.204 ( 2.360 -5.849 0.120) 6.308 32.674 ( -1.213 1.667 -3.074) 3.701 35.180 ( -0.803 0.118 0.212) 0.838 35.192 ( -0.323 0.039 0.245) 0.407 36.099 ( 0.478 -2.173 0.868) 2.388 36.280 ( -0.441 1.856 -0.843) 2.086 44.356 ( -3.514 -3.029 0.378) 4.654 44.628 ( 2.392 3.251 0.272) 4.045 44.695 ( -3.126 -3.815 1.915) 5.290 44.751 ( 3.632 9.059 -3.766) 10.461 46.325 ( 3.682 -6.672 2.194) 7.930 46.626 ( 0.143 -11.465 -3.647) 12.031 47.328 ( 1.831 -0.296 6.578) 6.835 47.884 ( -4.863 5.602 -5.205) 9.062 50.468 ( 10.149 -32.046 8.552) 34.685 52.123 ( 0.269 -47.367 -25.502) 53.797 54.364 ( -24.194 20.535 9.956) 33.259 56.278 ( 4.169 21.978 12.327) 25.542 70.299 ( 0.737 -17.238 1.745) 17.342 70.742 ( -0.624 -37.434 -4.157) 37.670 74.446 ( -2.937 16.408 6.273) 17.810 76.319 ( -33.845 15.473 -10.528) 38.675 ======================= Grid point 107 (51/150) ======================= q-point: (-0.12 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.206 ( -8.821 8.602 5.463) 13.478 1.402 ( -7.268 -0.288 2.063) 7.561 1.861 ( -13.829 2.465 1.925) 14.178 2.136 ( -0.326 11.388 9.492) 14.829 2.377 ( 4.116 -6.499 -6.869) 10.313 2.845 ( 0.246 5.247 -4.612) 6.990 3.095 ( -5.976 -5.790 5.975) 10.244 3.114 ( -1.323 6.431 3.746) 7.559 3.479 ( 5.119 -13.766 -3.060) 15.002 3.713 ( 0.579 -1.354 -4.025) 4.285 3.792 ( -0.396 -0.824 -2.014) 2.212 3.830 ( -0.585 -1.889 -2.611) 3.276 4.230 ( -0.172 1.897 3.689) 4.151 4.466 ( 1.720 10.806 -1.630) 11.062 4.545 ( -5.519 -0.948 -5.065) 7.551 4.900 ( -0.687 4.951 3.308) 5.994 5.272 ( 3.803 -5.034 1.211) 6.424 5.561 ( -4.531 3.435 1.657) 5.922 5.660 ( 3.307 3.123 -1.908) 4.933 5.896 ( 1.693 -1.067 -5.103) 5.481 6.354 ( -0.718 -10.512 4.676) 11.528 6.573 ( 1.289 -14.157 1.023) 14.253 6.805 ( -0.321 9.185 4.345) 10.166 7.008 ( -1.622 9.464 1.984) 9.804 7.454 ( 3.163 1.786 -2.562) 4.445 7.666 ( -0.719 0.864 3.105) 3.302 7.776 ( 8.616 -0.024 -0.674) 8.642 8.331 ( -4.739 7.632 -1.187) 9.062 10.420 ( -2.485 -20.822 -7.927) 22.419 10.878 ( 4.428 5.078 -10.059) 12.107 11.307 ( 3.082 -2.673 7.442) 8.487 11.706 ( 2.305 3.052 2.267) 4.446 14.050 ( 13.997 -29.374 4.258) 32.815 14.676 ( -0.945 -19.342 -5.770) 20.206 15.581 ( -3.038 18.085 1.050) 18.369 15.876 ( -16.774 12.447 -1.376) 20.933 27.177 ( -0.753 -1.195 0.288) 1.441 27.245 ( 0.579 2.715 0.150) 2.781 27.627 ( 0.236 -0.567 0.249) 0.663 27.666 ( -0.143 0.335 0.109) 0.380 27.807 ( -1.368 -4.761 -0.770) 5.013 27.929 ( 1.252 3.522 0.091) 3.739 31.444 ( -1.979 -4.417 0.723) 4.894 31.709 ( 1.667 5.532 5.619) 8.059 32.305 ( 1.848 -3.154 -0.365) 3.674 32.629 ( -1.060 1.113 -3.118) 3.476 35.167 ( -1.278 -0.669 0.105) 1.446 35.194 ( 0.732 0.326 1.191) 1.435 36.144 ( 0.550 -2.778 0.465) 2.870 36.238 ( -0.652 2.586 -0.758) 2.773 44.353 ( -2.854 -2.991 0.133) 4.136 44.612 ( 1.432 2.789 -0.187) 3.141 44.644 ( 1.767 6.674 -0.634) 6.933 44.742 ( -0.906 -2.902 -0.711) 3.122 46.495 ( 5.361 -5.282 3.277) 8.208 46.747 ( -2.313 -7.582 -2.992) 8.473 47.412 ( 3.569 -4.587 5.774) 8.193 47.699 ( -4.635 8.626 -4.572) 10.807 51.229 ( 19.825 -31.990 14.504) 40.333 52.785 ( -0.614 -41.880 -41.851) 59.210 53.755 ( -19.911 5.207 12.364) 24.009 55.909 ( -6.702 30.826 20.048) 37.378 70.582 ( 0.175 -17.704 1.395) 17.760 71.345 ( 7.072 -36.360 -4.335) 37.294 74.202 ( 0.284 10.369 2.354) 10.637 75.412 ( -38.878 27.882 -4.829) 48.086 ======================= Grid point 113 (52/150) ======================= q-point: (-0.38 -0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( -13.808 -0.000 0.243) 13.810 1.658 ( -6.946 -0.000 7.587) 10.286 2.030 ( 2.128 0.000 -0.358) 2.158 2.363 ( -5.849 -0.000 -4.739) 7.528 2.624 ( -3.473 -0.000 6.935) 7.756 2.799 ( -4.207 -0.000 -3.563) 5.513 2.987 ( -6.834 -0.000 -1.971) 7.113 3.169 ( -15.069 -0.000 -1.609) 15.154 3.432 ( 0.855 0.000 -1.006) 1.320 3.643 ( -1.137 -0.000 -3.111) 3.312 3.672 ( 6.115 0.000 0.492) 6.134 3.838 ( -3.477 -0.000 -0.414) 3.501 4.283 ( -1.093 -0.000 3.803) 3.957 4.583 ( -4.938 -0.000 -3.620) 6.123 4.790 ( 1.404 0.000 -2.616) 2.969 5.037 ( 2.546 0.000 2.368) 3.477 5.086 ( 4.194 0.000 -3.757) 5.631 5.669 ( 4.656 0.000 -6.049) 7.634 5.822 ( -4.693 -0.000 1.875) 5.054 5.927 ( -0.312 -0.000 -7.770) 7.777 6.007 ( 3.375 0.000 -0.104) 3.377 6.116 ( 1.088 0.000 4.990) 5.107 7.127 ( -1.022 -0.000 7.593) 7.662 7.196 ( -1.730 -0.000 -1.697) 2.423 7.458 ( 0.823 0.000 0.366) 0.901 7.666 ( 8.093 0.000 1.281) 8.194 7.728 ( 1.337 0.000 2.864) 3.161 8.509 ( 1.644 0.000 -3.098) 3.507 9.985 ( 1.334 0.000 4.434) 4.631 10.643 ( 2.589 0.000 -4.597) 5.276 11.129 ( -0.014 -0.000 3.486) 3.486 11.770 ( 5.333 0.000 0.600) 5.367 13.049 ( 5.101 0.000 6.953) 8.623 14.159 ( 0.522 0.000 -8.256) 8.273 16.112 ( -3.753 -0.000 0.896) 3.858 16.347 ( -11.788 -0.000 -0.642) 11.806 27.161 ( -0.754 -0.000 0.625) 0.979 27.340 ( 0.731 0.000 -0.386) 0.827 27.626 ( -0.429 -0.000 -0.468) 0.635 27.633 ( -0.415 -0.000 -0.967) 1.052 27.700 ( -0.471 -0.000 1.624) 1.691 27.999 ( 1.401 0.000 -0.545) 1.503 31.365 ( -2.375 -0.000 0.697) 2.475 31.894 ( 1.585 0.000 6.770) 6.953 32.068 ( 3.499 0.000 -0.748) 3.578 32.700 ( -1.395 -0.000 -3.069) 3.371 35.178 ( -1.709 -0.000 -0.347) 1.744 35.196 ( 0.293 0.000 0.298) 0.418 36.066 ( 0.399 0.000 1.176) 1.242 36.307 ( -0.447 -0.000 -0.923) 1.026 44.307 ( -3.742 -0.000 0.222) 3.749 44.622 ( -2.399 -0.000 0.229) 2.410 44.692 ( 2.525 0.000 1.967) 3.200 44.911 ( 2.629 0.000 -3.959) 4.752 46.194 ( 1.121 0.000 0.396) 1.189 46.439 ( 3.709 0.000 -1.963) 4.197 47.330 ( 0.551 0.000 6.545) 6.569 47.956 ( -5.525 -0.000 -6.187) 8.295 49.944 ( 1.824 0.000 2.825) 3.363 51.387 ( 2.277 0.000 -15.341) 15.509 54.656 ( -24.529 -0.000 12.609) 27.580 56.680 ( 10.305 0.000 9.649) 14.117 70.047 ( 1.514 0.000 -0.025) 1.514 70.090 ( -6.923 -0.000 -2.418) 7.333 74.718 ( -2.987 -0.000 7.924) 8.468 76.533 ( -29.760 -0.000 -9.633) 31.280 ======================= Grid point 114 (53/150) ======================= q-point: (-0.25 -0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( -14.001 -1.293 2.304) 14.248 1.488 ( -14.711 2.961 7.868) 16.944 1.994 ( -5.882 5.354 2.539) 8.349 2.292 ( 0.735 0.031 -7.130) 7.168 2.463 ( -6.383 11.130 5.411) 13.925 2.757 ( -7.729 -7.534 -5.418) 12.077 2.862 ( -15.654 -9.277 4.247) 18.685 3.086 ( -2.222 -7.680 -0.843) 8.039 3.393 ( 0.143 6.290 -3.570) 7.234 3.628 ( -3.558 -3.795 -5.930) 7.889 3.770 ( 4.547 0.999 -0.476) 4.680 3.804 ( 0.860 -0.598 1.589) 1.903 4.256 ( -2.595 0.404 3.622) 4.474 4.499 ( -4.856 -0.192 -2.899) 5.659 4.772 ( 1.303 5.339 -2.888) 6.208 5.070 ( 1.585 4.551 -0.971) 4.916 5.151 ( 5.511 -2.444 -0.578) 6.056 5.664 ( -1.535 4.174 -0.853) 4.529 5.802 ( 3.443 -0.842 -3.125) 4.726 5.850 ( -3.370 3.549 -4.679) 6.771 6.114 ( 3.613 -4.668 -0.984) 5.984 6.217 ( 3.144 -8.342 4.012) 9.776 7.070 ( -1.128 6.449 6.230) 9.037 7.160 ( -1.917 1.642 -0.388) 2.554 7.475 ( 1.164 -0.119 -0.322) 1.214 7.729 ( 1.875 3.069 4.976) 6.140 7.806 ( 9.454 0.638 0.186) 9.477 8.523 ( 1.225 1.672 -2.353) 3.136 10.021 ( -0.345 -2.954 2.321) 3.772 10.729 ( 2.643 -6.629 -5.201) 8.831 11.223 ( 3.731 -8.707 3.881) 10.237 11.817 ( 5.303 4.639 1.751) 7.260 13.273 ( 7.775 -17.173 6.416) 19.913 14.225 ( 1.160 -8.911 -9.355) 12.971 15.984 ( -4.969 8.359 1.172) 9.795 16.117 ( -15.371 3.412 0.423) 15.751 27.152 ( -0.902 -0.421 0.572) 1.148 27.331 ( 0.593 2.418 -0.317) 2.510 27.614 ( 0.100 -0.015 -0.026) 0.105 27.653 ( -0.496 -2.363 -1.309) 2.746 27.700 ( -0.630 -0.950 1.507) 1.890 28.009 ( 1.574 1.645 -0.484) 2.327 31.346 ( -2.131 -1.876 0.730) 2.931 31.881 ( 1.793 5.268 6.003) 8.185 32.170 ( 3.686 -4.884 0.346) 6.128 32.664 ( -1.848 0.830 -3.554) 4.091 35.154 ( -1.519 -0.182 -0.065) 1.531 35.201 ( 0.492 0.123 0.585) 0.774 36.082 ( 0.375 -1.230 0.993) 1.625 36.291 ( -0.674 0.944 -0.912) 1.476 44.266 ( -3.315 -1.938 -0.064) 3.840 44.584 ( -4.107 -1.146 0.851) 4.348 44.717 ( 1.812 1.419 2.270) 3.233 44.917 ( 4.750 5.545 -5.300) 9.022 46.280 ( 3.479 -7.527 1.099) 8.364 46.532 ( 3.441 -4.321 -1.934) 5.853 47.349 ( 0.528 -0.547 7.430) 7.469 47.851 ( -5.174 1.777 -5.879) 8.030 50.188 ( 7.952 -27.061 4.362) 28.541 51.579 ( 2.039 -24.174 -18.940) 30.778 54.204 ( -27.302 10.483 12.520) 31.812 56.722 ( 9.563 18.655 13.610) 24.994 70.031 ( -6.597 -11.122 -0.549) 12.944 70.295 ( 3.269 -26.991 -1.642) 27.238 74.597 ( -4.337 10.093 6.218) 12.623 75.947 ( -36.875 8.942 -6.474) 38.492 ======================= Grid point 115 (54/150) ======================= q-point: (-0.12 -0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( -13.893 -0.027 9.331) 16.735 1.193 ( -16.630 -1.924 5.274) 17.552 1.752 ( -10.251 5.185 2.144) 11.686 2.237 ( -3.636 5.090 -0.970) 6.330 2.396 ( 5.746 -2.715 2.959) 7.010 2.739 ( -14.595 -13.320 -1.188) 19.795 2.824 ( -6.263 -5.403 1.015) 8.334 3.194 ( 0.402 1.328 1.742) 2.227 3.319 ( -0.677 -8.354 -4.885) 9.701 3.604 ( -5.313 -2.936 -6.384) 8.810 3.769 ( -0.198 -0.582 -1.697) 1.805 3.879 ( 4.230 0.441 -1.125) 4.399 4.228 ( -2.019 -1.405 3.382) 4.182 4.434 ( -4.542 -0.612 -2.711) 5.324 4.655 ( 0.451 11.697 -3.157) 12.124 4.972 ( -1.214 6.625 0.758) 6.778 5.289 ( 5.875 -3.275 0.163) 6.728 5.562 ( -3.117 4.366 1.351) 5.532 5.747 ( -1.087 3.593 -1.699) 4.121 5.898 ( 4.672 -2.479 -4.429) 6.899 6.240 ( 2.402 -6.713 0.999) 7.200 6.426 ( 3.341 -11.670 2.877) 12.475 6.940 ( -1.284 9.519 5.362) 11.000 7.085 ( -1.817 4.687 1.065) 5.138 7.495 ( 1.556 -0.056 -1.312) 2.036 7.686 ( -1.542 3.743 5.826) 7.094 7.953 ( 11.748 2.020 -1.557) 12.022 8.423 ( -2.506 11.603 -0.523) 11.882 10.114 ( -1.990 -13.815 -3.765) 14.457 10.873 ( 2.726 -7.863 -7.574) 11.252 11.416 ( 8.253 0.600 5.163) 9.754 11.827 ( 4.928 4.157 1.291) 6.575 13.841 ( 17.555 -34.012 4.451) 38.533 14.410 ( 1.115 -15.246 -9.134) 17.808 15.722 ( -11.857 11.232 3.964) 16.806 15.807 ( -9.698 11.074 -1.085) 14.760 27.149 ( -0.870 -0.958 0.487) 1.383 27.296 ( 0.402 3.112 -0.156) 3.141 27.625 ( 0.547 -0.593 0.347) 0.878 27.667 ( -0.177 -0.266 -0.688) 0.759 27.723 ( -0.958 -3.756 0.492) 3.907 27.998 ( 1.488 2.985 -0.349) 3.353 31.357 ( -1.712 -3.473 1.079) 4.020 31.832 ( 1.603 6.170 5.558) 8.458 32.294 ( 3.573 -4.032 0.406) 5.403 32.614 ( -2.085 0.911 -3.888) 4.504 35.139 ( -1.157 -0.456 0.384) 1.302 35.211 ( 0.827 0.039 1.037) 1.327 36.115 ( 0.346 -2.305 0.611) 2.409 36.258 ( -0.786 1.819 -0.845) 2.154 44.264 ( -2.213 -3.480 -0.545) 4.160 44.528 ( -6.387 -2.309 0.830) 6.842 44.711 ( 0.936 2.870 2.292) 3.791 44.891 ( 6.066 7.998 -5.267) 11.336 46.506 ( 7.792 -9.409 3.329) 12.662 46.625 ( 0.199 -4.580 -2.522) 5.232 47.402 ( 1.593 -3.476 6.358) 7.419 47.725 ( -4.133 5.062 -4.455) 7.909 51.066 ( 30.031 -48.897 15.148) 59.349 52.063 ( 1.995 -44.509 -37.245) 58.071 53.608 ( -24.595 16.052 15.446) 33.184 56.441 ( 3.539 37.754 17.626) 41.816 70.194 ( -6.803 -24.197 -0.060) 25.135 70.985 ( 19.613 -45.075 -3.035) 49.251 74.356 ( -3.234 12.797 2.909) 13.516 75.182 ( -34.920 18.186 -1.952) 39.420 ======================= Grid point 122 (55/150) ======================= q-point: (-0.25 -0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.023 ( -15.278 -0.000 6.534) 16.617 1.277 ( -18.155 -0.000 10.624) 21.035 1.933 ( -10.411 -0.000 4.304) 11.266 2.254 ( -31.490 -0.000 -0.560) 31.495 2.311 ( 2.011 0.000 -8.484) 8.719 2.571 ( -0.374 -0.000 7.983) 7.992 2.655 ( -6.263 -0.000 -1.252) 6.387 2.977 ( -2.378 -0.000 -1.080) 2.612 3.450 ( 0.189 0.000 -5.869) 5.872 3.512 ( -4.613 -0.000 -8.000) 9.235 3.785 ( -0.740 -0.000 5.276) 5.328 3.895 ( 7.020 0.000 -2.526) 7.461 4.187 ( -6.985 -0.000 1.585) 7.163 4.431 ( -2.984 -0.000 -0.116) 2.986 4.835 ( 2.040 0.000 -3.391) 3.958 5.176 ( 2.057 0.000 -4.010) 4.506 5.186 ( 6.364 0.000 1.597) 6.561 5.670 ( -4.766 -0.000 2.981) 5.622 5.723 ( -1.536 -0.000 -10.558) 10.669 5.952 ( 4.979 0.000 -4.811) 6.924 6.127 ( 3.593 0.000 -0.821) 3.686 6.206 ( 3.097 0.000 4.238) 5.249 7.109 ( -1.723 -0.000 7.378) 7.577 7.140 ( -1.690 -0.000 -1.643) 2.356 7.491 ( 1.169 0.000 -0.122) 1.175 7.797 ( 2.686 0.000 8.794) 9.195 7.979 ( 11.676 0.000 -1.178) 11.735 8.533 ( 0.573 0.000 -4.436) 4.472 10.062 ( 2.836 0.000 7.979) 8.468 10.715 ( 2.639 0.000 -3.577) 4.445 11.144 ( 0.128 0.000 3.423) 3.426 11.946 ( 5.490 0.000 0.746) 5.541 13.251 ( 6.354 0.000 6.408) 9.024 14.173 ( 2.465 0.000 -11.379) 11.642 15.893 ( -16.950 -0.000 3.636) 17.336 15.975 ( -4.956 -0.000 0.535) 4.985 27.135 ( -0.948 -0.000 0.613) 1.129 27.357 ( 0.340 0.000 -0.639) 0.724 27.615 ( -0.152 -0.000 -0.156) 0.217 27.624 ( 0.071 0.000 -0.495) 0.500 27.692 ( -0.342 -0.000 1.373) 1.415 28.046 ( 1.645 0.000 -0.694) 1.785 31.305 ( -1.626 -0.000 1.317) 2.092 31.955 ( 1.012 0.000 6.079) 6.163 32.194 ( 4.627 0.000 0.209) 4.632 32.632 ( -2.373 -0.000 -4.001) 4.652 35.134 ( -0.984 -0.000 0.748) 1.236 35.210 ( 0.452 0.000 0.610) 0.759 36.079 ( 0.263 0.000 0.967) 1.002 36.285 ( -0.803 -0.000 -0.908) 1.212 44.207 ( -2.409 -0.000 -0.474) 2.456 44.524 ( -3.712 -0.000 0.082) 3.713 44.743 ( -0.020 -0.000 3.004) 3.004 45.029 ( 5.671 0.000 -6.329) 8.498 46.256 ( 2.740 0.000 0.370) 2.765 46.572 ( 4.726 0.000 0.671) 4.773 47.357 ( -0.120 -0.000 7.671) 7.672 47.776 ( -4.627 -0.000 -5.648) 7.302 50.023 ( 2.616 0.000 1.344) 2.941 51.434 ( 3.970 0.000 -12.059) 12.695 53.905 ( -24.954 -0.000 20.292) 32.163 57.055 ( 11.182 0.000 14.872) 18.607 69.844 ( -7.930 -0.000 -0.714) 7.962 70.088 ( 1.083 0.000 -0.840) 1.371 74.610 ( -4.986 -0.000 5.030) 7.083 75.448 ( -35.967 -0.000 -3.501) 36.137 ======================= Grid point 123 (56/150) ======================= q-point: (-0.12 -0.25 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.865 ( -12.991 -4.901 13.532) 19.388 0.934 ( -21.280 6.379 12.558) 25.519 1.639 ( -16.059 4.002 5.613) 17.476 2.013 ( -20.328 -18.902 3.871) 28.027 2.310 ( -2.778 -2.512 -7.093) 8.021 2.524 ( -1.971 2.085 4.596) 5.418 2.662 ( -3.111 -6.113 1.295) 6.980 3.044 ( -0.651 -12.328 -2.319) 12.561 3.352 ( -1.706 7.642 -5.268) 9.437 3.487 ( -3.014 -2.894 -6.305) 7.564 3.771 ( -0.711 1.674 1.583) 2.411 3.931 ( 0.240 2.875 -2.662) 3.926 4.130 ( -3.982 -5.390 -0.770) 6.745 4.398 ( -1.289 0.922 1.720) 2.339 4.801 ( 0.606 8.287 -4.470) 9.435 5.067 ( -1.833 10.398 -1.067) 10.612 5.337 ( 5.975 -3.197 0.339) 6.785 5.581 ( -2.532 3.138 1.148) 4.193 5.691 ( -3.730 -2.776 -6.770) 8.213 5.995 ( 6.485 2.668 -3.122) 7.676 6.216 ( 2.909 -3.658 -0.599) 4.712 6.330 ( 3.191 -9.115 2.782) 10.050 7.042 ( -1.855 6.171 6.113) 8.882 7.104 ( -1.567 1.648 0.202) 2.283 7.510 ( 1.139 -0.301 -0.459) 1.264 7.775 ( 0.667 9.245 10.554) 14.046 8.153 ( 11.728 0.623 -2.484) 12.005 8.525 ( -0.833 4.232 -3.201) 5.372 10.012 ( -1.013 5.317 4.294) 6.909 10.792 ( 2.085 -5.998 -4.272) 7.654 11.437 ( 10.831 -22.957 1.020) 25.404 11.969 ( 4.180 5.474 0.811) 6.935 13.600 ( 13.825 -32.610 3.964) 35.641 14.261 ( 3.677 -7.771 -10.879) 13.865 15.605 ( -16.305 5.838 6.674) 18.560 15.858 ( -4.311 6.261 0.262) 7.607 27.126 ( -0.840 -0.478 0.615) 1.146 27.340 ( 0.072 2.283 -0.695) 2.388 27.627 ( 0.672 -0.731 0.407) 1.073 27.638 ( -0.200 -2.040 -0.943) 2.256 27.691 ( -0.230 -0.330 1.625) 1.674 28.055 ( 1.407 1.788 -0.750) 2.396 31.301 ( -0.881 -1.705 2.311) 3.004 31.938 ( 0.749 4.480 5.214) 6.915 32.299 ( 4.636 -3.896 0.373) 6.067 32.582 ( -2.758 0.651 -4.339) 5.183 35.126 ( -0.329 0.201 1.694) 1.737 35.221 ( 0.665 -0.435 0.801) 1.128 36.093 ( 0.175 -1.261 0.772) 1.489 36.265 ( -0.759 0.920 -0.825) 1.451 44.194 ( -1.212 -2.093 -0.838) 2.559 44.431 ( -6.351 2.474 -0.804) 6.864 44.741 ( -0.691 0.189 2.762) 2.853 45.072 ( 6.210 4.890 -6.233) 10.066 46.429 ( 6.059 -14.194 -0.940) 15.462 46.644 ( 4.146 0.235 3.722) 5.577 47.381 ( 0.054 -2.329 6.324) 6.739 47.706 ( -3.161 1.009 -4.453) 5.554 50.620 ( 22.407 -69.718 -4.517) 73.369 51.617 ( 5.074 -16.454 -10.312) 20.070 53.543 ( -13.910 11.952 37.255) 41.525 57.041 ( 7.502 26.198 16.232) 31.718 69.796 ( -7.515 -12.619 1.099) 14.728 70.545 ( 15.916 -52.561 -4.256) 55.083 74.466 ( -4.737 9.460 2.704) 10.920 74.879 ( -29.641 8.163 -0.287) 30.746 ======================= Grid point 131 (57/150) ======================= q-point: (-0.12 -0.12 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.669 ( -10.064 -0.000 21.883) 24.086 0.763 ( -16.263 -0.000 18.971) 24.988 1.270 ( -31.435 -0.000 14.930) 34.801 1.578 ( -12.855 -0.000 5.083) 13.824 2.248 ( -2.095 -0.000 -8.936) 9.178 2.477 ( -4.351 -0.000 -3.596) 5.645 2.613 ( -0.780 -0.000 10.122) 10.152 2.936 ( -0.089 -0.000 -0.768) 0.773 3.340 ( -6.889 -0.000 -10.441) 12.509 3.445 ( 1.985 0.000 -3.691) 4.191 3.782 ( -0.963 -0.000 4.819) 4.914 3.935 ( -7.785 -0.000 -1.032) 7.853 4.019 ( 1.596 0.000 -5.870) 6.083 4.403 ( 0.061 0.000 3.411) 3.412 4.881 ( 1.487 0.000 -5.574) 5.769 5.182 ( -0.848 -0.000 -4.994) 5.065 5.384 ( 5.627 0.000 1.725) 5.885 5.562 ( -5.875 -0.000 -10.513) 12.043 5.565 ( -2.773 -0.000 2.179) 3.527 6.107 ( 4.338 0.000 -3.206) 5.394 6.206 ( 1.744 0.000 -0.573) 1.836 6.299 ( 2.003 0.000 2.361) 3.096 7.069 ( -2.184 -0.000 6.756) 7.100 7.094 ( -0.856 -0.000 -0.368) 0.932 7.522 ( 0.837 0.000 -0.168) 0.854 7.982 ( 7.536 0.000 11.003) 13.336 8.306 ( 9.460 0.000 -3.141) 9.968 8.513 ( -0.961 -0.000 -6.127) 6.202 10.224 ( 5.840 0.000 9.164) 10.867 10.766 ( 1.262 0.000 -3.622) 3.836 11.155 ( -0.037 -0.000 4.332) 4.332 12.074 ( 2.545 0.000 -0.680) 2.634 13.437 ( 4.220 0.000 5.284) 6.763 14.272 ( 7.472 0.000 -8.427) 11.263 15.457 ( -10.189 -0.000 13.856) 17.199 15.841 ( -3.540 -0.000 0.289) 3.552 27.112 ( -0.653 -0.000 0.668) 0.935 27.354 ( -0.237 -0.000 -1.285) 1.307 27.621 ( 0.621 0.000 0.649) 0.899 27.634 ( 0.534 0.000 0.058) 0.537 27.689 ( -0.098 -0.000 1.666) 1.669 28.086 ( 1.048 0.000 -1.055) 1.487 31.294 ( 0.974 0.000 4.655) 4.755 31.985 ( -0.115 -0.000 4.646) 4.648 32.332 ( 3.915 0.000 -0.436) 3.939 32.539 ( -2.567 -0.000 -4.049) 4.794 35.145 ( 1.834 0.000 3.637) 4.073 35.223 ( 0.242 0.000 0.650) 0.694 36.088 ( 0.140 0.000 0.976) 0.986 36.260 ( -0.545 -0.000 -0.712) 0.897 44.169 ( 0.060 0.000 -1.083) 1.084 44.372 ( -7.247 -0.000 -7.051) 10.112 44.709 ( -2.580 -0.000 3.592) 4.423 45.191 ( 5.823 0.000 -6.195) 8.502 46.352 ( 3.153 0.000 2.073) 3.774 46.728 ( 5.259 0.000 6.833) 8.623 47.362 ( -1.107 -0.000 5.087) 5.206 47.662 ( -1.805 -0.000 -3.812) 4.218 50.101 ( 2.167 0.000 1.961) 2.923 51.628 ( 9.752 0.000 2.727) 10.126 53.797 ( 34.721 0.000 97.820) 103.800 57.373 ( 5.338 0.000 15.238) 16.146 69.668 ( -3.029 -0.000 2.184) 3.734 70.102 ( 0.199 0.000 -2.127) 2.136 74.476 ( -4.032 -0.000 1.418) 4.274 74.541 ( -21.716 -0.000 1.135) 21.745 ======================= Grid point 132 (58/150) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.790 ( 2.104 0.000 18.865) 18.982 0.928 ( -7.932 -0.000 21.539) 22.953 1.399 ( -2.808 -0.000 8.274) 8.737 1.848 ( 5.080 0.000 38.409) 38.743 2.221 ( 6.557 0.000 -1.210) 6.668 2.287 ( 0.487 0.000 -7.676) 7.692 2.843 ( -0.148 -0.000 11.811) 11.812 2.910 ( 1.394 0.000 -2.152) 2.564 3.468 ( -0.906 -0.000 -0.892) 1.271 3.595 ( 24.236 0.000 -4.536) 24.657 3.675 ( -3.424 -0.000 -3.651) 5.005 3.865 ( -1.452 -0.000 -7.239) 7.383 3.932 ( 1.624 0.000 6.193) 6.403 4.571 ( 2.111 0.000 7.331) 7.629 4.617 ( -2.971 -0.000 -12.326) 12.679 5.075 ( -0.271 -0.000 -2.779) 2.792 5.470 ( 0.263 0.000 2.249) 2.265 5.527 ( -1.063 -0.000 1.754) 2.051 5.590 ( -0.112 -0.000 4.998) 4.999 6.053 ( 0.255 0.000 -5.632) 5.638 6.230 ( 1.708 0.000 0.065) 1.710 6.313 ( -1.596 -0.000 -0.903) 1.834 7.140 ( 1.807 0.000 3.003) 3.504 7.202 ( -1.685 -0.000 9.819) 9.963 7.511 ( -1.271 -0.000 -1.048) 1.647 7.954 ( -9.575 -0.000 -0.671) 9.598 8.241 ( -2.985 -0.000 -11.113) 11.507 8.389 ( 4.243 0.000 -7.772) 8.855 10.138 ( -8.332 -0.000 4.116) 9.293 10.650 ( -0.653 -0.000 -6.829) 6.860 11.313 ( 0.588 0.000 8.452) 8.472 11.996 ( -2.292 -0.000 -5.865) 6.297 13.630 ( -2.034 -0.000 7.951) 8.207 14.390 ( 3.727 0.000 -7.585) 8.451 15.785 ( -0.248 -0.000 0.175) 0.303 15.815 ( 6.572 0.000 -0.028) 6.572 27.125 ( -0.004 -0.000 1.424) 1.424 27.298 ( -0.251 -0.000 -2.486) 2.498 27.645 ( -0.026 -0.000 0.075) 0.079 27.652 ( 0.233 0.000 -0.057) 0.240 27.763 ( 0.468 0.000 3.740) 3.769 28.057 ( -0.240 -0.000 -2.617) 2.628 31.524 ( 2.621 0.000 6.586) 7.089 32.060 ( -2.563 -0.000 5.525) 6.090 32.199 ( -3.856 -0.000 -7.964) 8.849 32.515 ( 3.611 0.000 -2.502) 4.393 35.234 ( -0.501 -0.000 0.433) 0.662 35.235 ( 0.637 0.000 0.149) 0.654 36.125 ( -0.331 -0.000 1.854) 1.883 36.241 ( 0.375 0.000 -0.746) 0.835 44.091 ( -2.122 -0.000 1.097) 2.389 44.181 ( 2.141 0.000 -0.734) 2.264 44.706 ( -3.429 -0.000 4.247) 5.459 45.204 ( 4.688 0.000 -6.505) 8.018 46.576 ( 2.348 0.000 8.443) 8.764 46.945 ( 1.174 0.000 5.068) 5.202 47.274 ( -7.268 -0.000 -1.081) 7.348 47.590 ( 3.022 0.000 -3.834) 4.882 50.304 ( 3.333 0.000 9.243) 9.826 51.473 ( -6.607 -0.000 -13.743) 15.249 57.660 ( -13.744 -0.000 17.208) 22.023 59.441 ( 72.569 0.000 -18.580) 74.909 69.586 ( -6.211 -0.000 3.758) 7.259 70.016 ( 0.020 0.000 -5.038) 5.038 74.256 ( -1.288 -0.000 3.345) 3.584 74.416 ( 0.792 0.000 0.060) 0.795 ======================= Grid point 133 (59/150) ======================= q-point: ( 0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( -0.621 -3.968 19.621) 20.028 1.015 ( 11.674 -7.560 15.134) 20.554 1.479 ( 5.117 -5.623 7.886) 10.954 2.082 ( 6.261 -10.442 31.088) 33.387 2.204 ( 1.758 5.486 -5.417) 7.908 2.454 ( 7.550 -9.569 -2.710) 12.486 2.779 ( 0.057 5.949 6.583) 8.873 3.103 ( 5.006 -14.200 2.001) 15.188 3.464 ( -0.759 1.251 -3.002) 3.340 3.531 ( -2.307 5.708 -0.941) 6.228 3.827 ( 1.715 2.921 -5.874) 6.780 3.904 ( 17.672 4.327 -9.210) 20.392 4.015 ( 3.095 -3.063 3.067) 5.327 4.432 ( -6.208 7.885 -2.975) 10.467 4.639 ( 2.312 -0.237 2.942) 3.749 5.005 ( -0.341 6.225 -1.348) 6.378 5.490 ( 0.571 -0.198 1.936) 2.028 5.516 ( -0.296 0.263 2.263) 2.298 5.643 ( -2.802 -6.443 -1.087) 7.110 6.005 ( -0.233 4.790 -4.994) 6.923 6.311 ( -0.011 -4.141 -0.433) 4.164 6.332 ( 0.452 -7.907 0.143) 7.921 7.155 ( -0.997 5.225 9.244) 10.665 7.179 ( 2.425 -0.224 3.085) 3.930 7.474 ( -3.699 0.837 -0.121) 3.795 7.719 ( -7.959 8.696 5.992) 13.224 8.133 ( -3.536 5.365 -10.109) 11.978 8.386 ( 1.085 4.674 -7.367) 8.792 10.028 ( -1.560 -1.999 6.778) 7.237 10.648 ( -1.130 -2.840 -8.356) 8.898 11.544 ( -2.884 -19.410 -0.170) 19.624 11.887 ( -3.677 6.064 -5.082) 8.725 13.800 ( -6.421 -26.882 2.066) 27.716 14.492 ( -1.503 -12.671 -6.467) 14.305 15.748 ( 1.985 7.006 0.066) 7.282 15.805 ( 2.292 9.291 -0.322) 9.575 27.133 ( 0.309 -0.481 1.435) 1.544 27.286 ( -0.090 0.799 -2.242) 2.382 27.641 ( -0.505 0.259 0.218) 0.608 27.652 ( 0.158 -0.330 0.134) 0.390 27.781 ( 0.225 -0.749 3.406) 3.494 28.034 ( -0.847 1.516 -2.655) 3.173 31.555 ( 1.463 0.718 8.154) 8.316 31.966 ( -3.455 5.993 2.080) 7.223 32.182 ( -3.696 -5.463 -5.234) 8.420 32.563 ( 3.273 0.432 -2.721) 4.278 35.215 ( 0.118 1.030 1.319) 1.677 35.244 ( -0.503 -0.165 0.500) 0.728 36.122 ( -0.583 -0.474 1.642) 1.805 36.242 ( 0.570 0.718 -0.647) 1.122 44.114 ( 1.921 -2.562 0.057) 3.202 44.233 ( 2.533 -2.336 -0.063) 3.447 44.667 ( -2.481 0.278 2.372) 3.444 45.223 ( 2.686 4.213 -5.113) 7.149 46.632 ( -1.069 -2.721 6.708) 7.317 46.965 ( -0.830 -1.365 6.389) 6.585 47.201 ( -6.602 -5.236 -4.221) 9.425 47.622 ( 5.205 3.400 -2.201) 6.595 50.598 ( -1.332 -28.818 3.828) 29.101 51.516 ( -3.213 -21.748 -15.454) 26.872 57.137 ( -20.840 36.753 9.433) 43.291 58.888 ( -28.075 82.379 10.191) 87.626 69.708 ( 1.019 -22.852 7.317) 24.017 70.724 ( -13.773 -81.251 -28.566) 87.221 74.263 ( 7.655 6.653 2.547) 10.457 74.439 ( 1.856 -1.264 -0.019) 2.245 ======================= Grid point 134 (60/150) ======================= q-point: ( 0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.990 ( 0.696 -3.934 17.496) 17.947 1.336 ( 11.883 -5.480 9.469) 16.152 1.711 ( 8.118 -9.423 7.837) 14.701 2.112 ( -2.320 4.694 -3.762) 6.447 2.345 ( 3.355 -5.429 10.848) 12.586 2.666 ( 6.249 -1.378 0.378) 6.410 2.791 ( 4.855 -6.074 6.741) 10.291 3.313 ( 0.872 0.290 4.609) 4.700 3.435 ( 9.599 -2.235 -3.385) 10.421 3.582 ( -3.459 -13.489 1.383) 13.994 3.767 ( -5.693 -0.373 -6.357) 8.542 3.980 ( 13.106 17.089 -7.990) 22.971 4.086 ( 1.794 -1.136 1.733) 2.741 4.297 ( -2.694 -1.586 -0.648) 3.192 4.662 ( 2.377 3.030 2.454) 4.566 4.918 ( -0.439 3.952 -0.165) 3.980 5.466 ( -1.026 2.086 0.428) 2.364 5.540 ( 0.560 -0.657 3.735) 3.833 5.638 ( -3.745 -1.352 -3.072) 5.029 5.906 ( -1.829 5.015 -4.442) 6.944 6.377 ( -1.223 -7.711 -0.454) 7.821 6.501 ( 1.892 -10.856 3.029) 11.429 7.052 ( -0.582 9.305 8.421) 12.563 7.212 ( 1.893 3.100 2.983) 4.700 7.345 ( -4.203 5.241 2.320) 7.107 7.602 ( -0.822 0.209 2.149) 2.310 7.972 ( -2.282 8.052 -7.453) 11.207 8.288 ( -2.237 5.337 -6.190) 8.474 10.159 ( 1.764 -12.127 1.933) 12.406 10.663 ( -0.553 -2.681 -11.559) 11.879 11.576 ( -4.369 5.887 1.796) 7.547 11.798 ( -4.286 -3.334 -4.506) 7.056 14.100 ( -10.077 -29.253 -2.267) 31.023 14.681 ( -4.183 -20.285 -4.367) 21.167 15.580 ( 0.941 17.971 1.450) 18.054 15.731 ( 4.141 7.722 -0.107) 8.763 27.152 ( 0.497 -0.946 1.298) 1.681 27.265 ( -0.091 1.511 -1.504) 2.134 27.631 ( -0.516 -0.071 0.278) 0.591 27.665 ( 0.335 -0.713 0.021) 0.789 27.801 ( 0.079 -1.262 2.746) 3.023 27.982 ( -1.270 2.741 -2.426) 3.874 31.590 ( 1.543 -0.782 8.955) 9.120 31.822 ( -3.682 6.060 0.924) 7.151 32.204 ( -2.821 -5.244 -3.812) 7.071 32.589 ( 2.415 1.339 -3.002) 4.079 35.210 ( -0.088 0.284 0.718) 0.777 35.234 ( -0.051 0.767 1.769) 1.929 36.130 ( -0.599 -1.547 0.911) 1.892 36.236 ( 0.626 1.370 -0.500) 1.587 44.206 ( 3.419 -4.451 -0.933) 5.689 44.320 ( 2.102 -4.384 0.749) 4.920 44.621 ( -1.013 2.562 0.425) 2.788 45.146 ( -0.459 7.790 -2.932) 8.336 46.630 ( -2.854 -0.915 4.725) 5.596 46.967 ( -1.501 0.383 5.095) 5.326 47.208 ( -6.620 -9.965 -5.289) 13.081 47.651 ( 7.157 5.220 0.021) 8.858 50.947 ( -8.607 -29.847 -0.104) 31.064 51.965 ( 4.961 -37.337 -15.155) 40.599 56.082 ( -22.581 60.583 -0.015) 64.654 57.269 ( -36.642 62.467 34.407) 80.178 70.163 ( 1.600 -31.689 7.689) 32.647 71.374 ( -23.172 -52.145 -26.355) 62.854 74.290 ( 13.592 12.502 0.923) 18.490 74.508 ( -3.248 -8.928 -0.702) 9.527 ======================= Grid point 135 (61/150) ======================= q-point: ( 0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( 3.705 -4.942 12.318) 13.779 1.526 ( 5.882 0.102 7.497) 9.530 1.880 ( -4.380 0.163 2.161) 4.887 2.059 ( 2.660 -3.639 6.134) 7.612 2.369 ( 1.835 2.332 -5.013) 5.825 2.720 ( 3.363 4.035 -1.529) 5.471 3.020 ( 4.582 -9.744 8.402) 13.658 3.364 ( 3.226 -0.747 9.788) 10.333 3.583 ( 2.341 -3.617 -6.944) 8.172 3.639 ( -5.649 0.941 -7.754) 9.640 3.746 ( -2.196 -9.274 0.849) 9.568 3.871 ( 6.095 13.846 -3.648) 15.561 4.133 ( 3.018 -1.812 0.487) 3.554 4.330 ( 1.373 -1.601 -0.180) 2.117 4.611 ( 0.538 7.301 -1.622) 7.498 4.901 ( -0.444 -1.893 3.965) 4.416 5.413 ( -0.589 3.044 -0.368) 3.122 5.518 ( -5.737 -1.645 2.881) 6.627 5.623 ( 2.383 1.082 -0.811) 2.740 5.831 ( 0.151 1.527 -4.129) 4.405 6.494 ( -1.330 -10.661 1.207) 10.811 6.694 ( 0.698 -10.740 5.777) 12.215 6.894 ( -0.623 11.651 5.861) 13.057 7.084 ( -0.674 12.213 4.568) 13.057 7.334 ( 2.810 -1.538 -2.612) 4.133 7.629 ( 0.121 -3.285 1.514) 3.619 7.835 ( -0.637 5.720 -4.750) 7.462 8.171 ( -3.975 2.345 -5.016) 6.816 10.360 ( 0.165 -10.885 -5.656) 12.268 10.665 ( 2.365 1.484 -11.239) 11.580 11.438 ( -2.168 3.196 5.025) 6.337 11.748 ( -4.120 0.952 -1.332) 4.433 14.306 ( -8.379 -19.255 -2.337) 21.128 14.927 ( -4.916 -22.854 -1.655) 23.436 15.315 ( 4.792 23.594 0.638) 24.084 15.678 ( 1.600 5.945 0.014) 6.157 27.177 ( 0.449 -1.198 0.929) 1.582 27.238 ( -0.158 1.528 -0.587) 1.645 27.630 ( -0.240 -0.486 0.218) 0.584 27.676 ( 0.238 0.018 0.250) 0.346 27.833 ( 0.392 -2.280 1.416) 2.713 27.914 ( -1.310 3.309 -1.847) 4.010 31.623 ( 0.116 2.911 5.608) 6.319 31.718 ( -1.654 -0.282 4.355) 4.667 32.236 ( -1.457 -4.459 -3.249) 5.706 32.588 ( 1.411 2.178 -3.361) 4.246 35.195 ( -0.942 0.672 -0.015) 1.157 35.236 ( 0.966 0.578 2.510) 2.751 36.150 ( -0.644 -2.258 0.055) 2.349 36.220 ( 0.547 1.916 -0.222) 2.005 44.329 ( 2.435 -5.027 -0.779) 5.640 44.412 ( 1.169 -4.787 0.381) 4.943 44.581 ( 1.659 2.579 -0.788) 3.166 44.984 ( -3.495 9.418 -0.745) 10.074 46.612 ( -2.084 -1.485 3.250) 4.137 46.924 ( 0.218 4.670 3.752) 5.994 47.256 ( -6.916 -11.648 -5.715) 14.702 47.684 ( 6.946 5.424 2.093) 9.058 51.269 ( -7.475 -32.834 1.915) 33.728 52.536 ( 10.184 -23.188 -12.708) 28.335 54.861 ( -15.713 61.608 -6.224) 63.885 56.195 ( -24.557 28.508 30.667) 48.541 70.590 ( -1.240 -22.181 3.560) 22.499 71.574 ( -11.236 -20.663 -11.457) 26.163 74.311 ( 15.404 15.143 -0.858) 21.618 74.570 ( -10.262 -13.346 -0.462) 16.841 ======================= Grid point 136 (62/150) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( 2.256 -1.721 9.310) 9.733 1.512 ( -3.004 5.428 9.287) 11.168 1.756 ( -4.026 2.920 1.889) 5.320 2.124 ( -1.461 -1.466 0.930) 2.269 2.443 ( 6.487 -2.876 -5.242) 8.822 2.678 ( 0.215 3.746 0.171) 3.756 3.148 ( -2.513 -2.254 7.128) 7.887 3.359 ( -1.694 6.281 9.655) 11.642 3.479 ( -8.451 -0.369 -7.855) 11.543 3.674 ( 2.477 6.674 -6.387) 9.564 3.705 ( 0.467 2.213 -4.483) 5.022 3.833 ( 2.323 2.129 1.610) 3.539 4.251 ( 3.842 -6.145 -0.500) 7.265 4.358 ( -0.360 0.418 0.664) 0.863 4.490 ( -1.290 5.485 -2.562) 6.189 4.931 ( -1.343 -2.118 4.599) 5.238 5.378 ( 1.480 2.195 -0.625) 2.720 5.481 ( -4.518 -4.253 3.546) 7.147 5.659 ( 2.961 -0.614 -0.305) 3.039 5.846 ( 2.701 -0.132 -4.391) 5.157 6.609 ( -3.007 1.141 8.112) 8.727 6.655 ( -0.143 3.711 -0.686) 3.776 6.908 ( 3.175 3.423 4.635) 6.579 6.945 ( -1.121 -3.848 5.139) 6.517 7.408 ( 3.348 -2.380 -3.479) 5.383 7.683 ( -0.825 -3.144 3.228) 4.581 7.796 ( 1.157 -2.218 -5.009) 5.599 8.109 ( -2.679 -2.389 -4.356) 5.644 10.360 ( -1.828 6.766 -12.277) 14.137 10.715 ( 4.058 -3.067 -6.426) 8.195 11.466 ( 2.794 -3.871 3.796) 6.100 11.681 ( -3.157 -1.556 1.338) 3.765 14.411 ( -1.859 -6.878 -2.451) 7.535 14.987 ( 7.020 23.933 2.981) 25.118 15.240 ( -1.934 -17.431 -4.357) 18.071 15.600 ( -3.764 2.695 1.419) 4.842 27.189 ( -0.248 0.612 0.327) 0.737 27.229 ( 0.199 -0.863 0.241) 0.918 27.637 ( 0.126 -0.529 0.170) 0.570 27.673 ( 0.031 0.617 0.464) 0.773 27.834 ( -0.740 3.392 -0.776) 3.557 27.895 ( 0.663 -3.053 -0.079) 3.125 31.538 ( -1.414 5.407 3.128) 6.404 31.782 ( 0.494 -5.335 7.047) 8.853 32.281 ( 0.257 -3.579 -2.885) 4.604 32.558 ( 0.295 2.885 -3.870) 4.836 35.170 ( -0.730 0.810 0.484) 1.193 35.247 ( 0.877 0.403 1.964) 2.189 36.172 ( -0.642 -2.057 -0.691) 2.263 36.198 ( 0.369 1.915 0.306) 1.974 44.348 ( -2.089 1.577 0.203) 2.625 44.544 ( 4.241 -7.135 -2.565) 8.687 44.598 ( 0.937 0.139 -0.489) 1.066 44.798 ( -3.515 6.501 1.250) 7.495 46.621 ( -1.349 -2.434 2.170) 3.529 46.865 ( 4.083 8.227 3.325) 9.768 47.312 ( -6.060 -10.786 -5.962) 13.734 47.702 ( 4.484 4.959 3.165) 7.397 51.665 ( -4.524 -30.558 3.129) 31.049 52.762 ( 18.112 21.530 -9.142) 29.583 53.944 ( -3.706 39.315 -6.058) 39.951 55.830 ( -14.581 -14.791 23.823) 31.606 70.702 ( -4.685 1.088 -0.604) 4.847 71.700 ( 7.889 -2.099 -3.440) 8.859 74.316 ( 13.308 13.766 -2.001) 19.251 74.573 ( -15.386 -13.813 0.338) 20.680 ======================= Grid point 137 (63/150) ======================= q-point: (-0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.138 ( -10.620 7.056 11.782) 17.360 1.419 ( -2.471 5.980 15.081) 16.411 1.706 ( 0.821 1.221 1.529) 2.121 2.135 ( 1.628 -0.905 -2.526) 3.138 2.453 ( -6.832 1.818 -12.165) 14.070 2.699 ( 6.252 1.554 9.143) 11.185 3.000 ( -10.737 10.521 12.361) 19.463 3.237 ( -3.624 2.712 4.402) 6.314 3.328 ( -5.312 5.242 -5.887) 9.505 3.554 ( 0.560 8.204 -3.703) 9.018 3.647 ( -4.377 1.391 -3.492) 5.769 3.888 ( 5.551 0.313 -0.934) 5.638 4.241 ( -4.583 6.824 -1.907) 8.438 4.383 ( 2.080 -4.772 1.494) 5.416 4.492 ( 0.394 -3.881 -1.287) 4.108 4.937 ( -2.141 -2.304 2.741) 4.172 5.396 ( 3.170 0.454 0.138) 3.205 5.509 ( -2.012 -4.918 3.744) 6.500 5.712 ( 1.592 -0.418 -0.136) 1.652 5.877 ( 2.898 0.323 -5.500) 6.225 6.435 ( 1.113 11.730 2.585) 12.063 6.649 ( -0.166 6.376 1.403) 6.531 6.913 ( 0.278 -6.092 5.085) 7.940 7.064 ( -0.717 -6.192 5.575) 8.363 7.481 ( 2.475 -1.524 -1.990) 3.522 7.710 ( -2.202 -4.716 5.232) 7.380 7.926 ( 3.144 -10.955 -6.286) 13.016 8.145 ( -0.694 -6.462 -5.434) 8.472 10.174 ( -0.175 12.093 -6.745) 13.848 10.781 ( 2.400 0.331 -9.506) 9.810 11.571 ( 3.336 -2.797 4.073) 5.961 11.756 ( 1.405 -9.526 -2.081) 9.851 14.430 ( 2.602 5.995 -4.284) 7.814 14.738 ( 18.633 35.072 -0.958) 39.726 15.436 ( -8.349 -13.763 -2.261) 16.256 15.534 ( -5.668 -9.263 4.397) 11.716 27.167 ( -0.561 1.212 0.697) 1.506 27.256 ( 0.125 -2.050 -0.299) 2.075 27.645 ( 0.349 0.112 -0.143) 0.394 27.664 ( -0.076 0.687 0.340) 0.771 27.778 ( -0.153 2.834 0.773) 2.942 27.956 ( 1.026 -3.323 -1.018) 3.624 31.460 ( -0.399 3.981 4.428) 5.968 31.881 ( -0.042 -6.202 6.076) 8.682 32.338 ( 2.095 -2.356 -2.604) 4.089 32.501 ( -0.993 3.380 -4.535) 5.742 35.155 ( -0.190 0.353 1.168) 1.235 35.255 ( 0.604 0.366 1.360) 1.532 36.164 ( 0.029 1.921 0.381) 1.958 36.201 ( -0.375 -1.791 -0.540) 1.908 44.276 ( -1.391 3.835 -0.610) 4.125 44.488 ( -6.366 5.468 0.100) 8.393 44.714 ( 2.604 -5.436 -0.023) 6.027 44.786 ( 3.233 -4.537 -1.410) 5.746 46.634 ( -0.884 -0.771 1.270) 1.729 46.837 ( 7.757 8.381 3.595) 11.972 47.366 ( -4.163 -8.509 -5.468) 10.938 47.680 ( 0.818 4.367 2.826) 5.265 51.778 ( -6.730 9.592 -16.565) 20.290 52.550 ( 20.037 43.537 -0.635) 47.930 53.779 ( 23.637 -4.407 17.590) 29.792 56.192 ( -6.062 -46.966 19.242) 51.116 70.472 ( -3.523 19.920 2.295) 20.359 71.794 ( 23.341 23.588 -10.963) 34.948 74.316 ( 7.558 7.470 -1.756) 10.770 74.510 ( -17.486 -12.169 1.174) 21.336 ======================= Grid point 138 (64/150) ======================= q-point: (-0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.892 ( -12.124 3.256 17.270) 21.350 1.280 ( -5.149 7.391 18.345) 20.438 1.689 ( -1.746 3.234 6.664) 7.610 2.149 ( 1.501 8.816 -1.429) 9.056 2.235 ( -6.815 5.596 -4.639) 9.963 2.569 ( -10.406 14.294 11.797) 21.255 2.827 ( 0.347 0.610 8.620) 8.649 3.137 ( -0.525 9.137 -5.387) 10.620 3.224 ( -2.974 -1.963 2.791) 4.526 3.473 ( 0.489 1.534 -0.779) 1.789 3.585 ( -2.711 -1.250 -3.045) 4.265 3.936 ( 1.753 1.455 0.096) 2.280 4.086 ( -3.464 4.871 -1.757) 6.230 4.455 ( 0.372 -2.633 3.289) 4.230 4.554 ( -0.260 -4.959 -4.117) 6.450 4.960 ( -1.490 -4.572 1.097) 4.932 5.443 ( 2.692 0.044 0.994) 2.870 5.554 ( -1.471 -3.627 3.337) 5.143 5.688 ( 0.775 5.197 -0.163) 5.257 5.936 ( 3.226 -3.021 -6.172) 7.591 6.329 ( 2.412 7.792 0.153) 8.158 6.519 ( -0.399 9.781 0.027) 9.789 7.037 ( -0.039 -7.766 5.362) 9.437 7.121 ( -1.272 -3.495 5.693) 6.800 7.515 ( 1.103 -0.105 -0.956) 1.464 7.793 ( -1.941 -9.765 6.727) 12.016 8.143 ( 4.701 -10.423 -7.653) 13.758 8.228 ( -1.896 -7.929 -7.989) 11.414 10.038 ( 0.581 4.960 0.538) 5.023 10.753 ( 1.074 4.259 -9.453) 10.424 11.668 ( 3.597 -1.135 -0.533) 3.810 11.902 ( 2.350 -5.443 -5.291) 7.947 14.252 ( 2.398 22.887 -4.679) 23.483 14.552 ( 22.867 34.516 -7.363) 42.053 15.450 ( -8.512 -13.216 7.458) 17.399 15.675 ( -3.161 -12.656 0.519) 13.055 27.144 ( -0.534 0.906 1.082) 1.509 27.284 ( -0.138 -1.923 -1.256) 2.301 27.642 ( 0.265 0.813 -0.408) 0.947 27.654 ( 0.104 0.678 0.299) 0.748 27.755 ( 0.546 1.222 2.451) 2.792 28.012 ( 0.877 -2.613 -1.781) 3.282 31.429 ( 1.159 1.901 6.144) 6.535 31.972 ( -1.028 -6.232 4.954) 8.027 32.395 ( 3.982 2.978 -2.581) 5.602 32.424 ( -2.749 -0.045 -5.217) 5.897 35.162 ( 0.544 -0.666 1.737) 1.938 35.258 ( 0.338 0.467 0.723) 0.925 36.139 ( -0.006 1.542 1.259) 1.991 36.219 ( -0.213 -1.456 -0.821) 1.685 44.207 ( -0.143 3.583 -0.875) 3.691 44.315 ( -6.928 3.937 0.229) 7.972 44.770 ( -1.734 -2.553 3.689) 4.810 44.950 ( 6.078 -6.366 -5.956) 10.627 46.616 ( 1.629 4.202 1.719) 4.823 46.864 ( 7.034 4.601 3.303) 9.031 47.412 ( -2.099 -4.862 -3.413) 6.300 47.611 ( -2.639 3.179 0.581) 4.172 51.256 ( 0.552 45.251 -22.023) 50.328 52.121 ( 2.293 34.165 -6.598) 34.871 54.885 ( 70.619 -38.915 49.133) 94.422 56.905 ( -2.245 -51.457 18.728) 54.805 70.082 ( -2.188 26.754 5.527) 27.407 71.593 ( 30.979 60.682 -26.047) 72.941 74.328 ( -1.059 -2.044 0.140) 2.306 74.416 ( -13.631 -8.217 1.518) 15.988 ======================= Grid point 139 (65/150) ======================= q-point: (-0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.775 ( -7.550 -3.764 19.695) 21.426 1.108 ( -8.091 7.336 20.154) 22.923 1.547 ( -8.970 5.889 6.360) 12.474 1.878 ( -1.767 16.154 28.610) 32.903 2.169 ( 3.026 4.428 -2.746) 6.025 2.347 ( -3.369 3.299 -3.398) 5.812 2.819 ( -2.616 -0.973 8.374) 8.827 2.996 ( 1.157 9.672 -1.105) 9.804 3.295 ( 9.097 -3.101 2.284) 9.878 3.486 ( 3.124 3.683 0.507) 4.856 3.616 ( -4.974 -12.217 -3.405) 13.623 3.913 ( -0.809 1.697 1.914) 2.683 3.978 ( -0.782 6.086 -2.719) 6.712 4.506 ( 0.355 -3.429 4.859) 5.958 4.615 ( -0.391 -4.872 -7.782) 9.189 5.023 ( -0.709 -5.952 0.018) 5.994 5.467 ( 0.569 0.215 1.629) 1.739 5.563 ( -2.634 -0.828 2.670) 3.841 5.622 ( 3.274 7.496 0.790) 8.217 6.016 ( 1.361 -3.780 -5.928) 7.161 6.261 ( 1.665 5.953 -0.921) 6.250 6.381 ( -1.062 6.663 -0.420) 6.760 7.112 ( 1.337 -0.613 2.356) 2.777 7.174 ( -2.164 -5.444 9.507) 11.167 7.522 ( 0.022 0.029 -0.744) 0.745 7.936 ( -3.563 -12.858 3.221) 13.726 8.268 ( -2.332 -3.820 -10.521) 11.433 8.309 ( 4.379 -4.136 -8.511) 10.426 10.078 ( -2.343 -10.943 5.602) 12.515 10.690 ( 0.146 3.321 -7.774) 8.455 11.579 ( 2.194 22.558 -5.253) 23.265 11.977 ( -0.886 -5.587 -4.267) 7.086 13.870 ( 1.530 29.499 0.774) 29.549 14.413 ( 11.242 17.204 -8.171) 22.116 15.617 ( 3.506 -11.588 6.387) 13.689 15.771 ( -1.793 -5.577 0.334) 5.868 27.129 ( -0.324 0.469 1.312) 1.430 27.300 ( -0.326 -0.965 -2.185) 2.410 27.640 ( 0.574 0.046 0.132) 0.591 27.648 ( 0.098 0.325 0.157) 0.374 27.756 ( 0.629 0.722 3.198) 3.339 28.049 ( 0.392 -1.457 -2.316) 2.764 31.461 ( 2.887 -0.409 7.025) 7.607 32.040 ( -1.986 -5.193 4.586) 7.207 32.303 ( -2.467 4.840 -6.021) 8.110 32.464 ( 3.140 -0.673 -2.782) 4.249 35.196 ( 1.009 -1.833 1.329) 2.479 35.252 ( 0.095 0.909 0.130) 0.923 36.126 ( -0.026 0.454 1.853) 1.909 36.233 ( 0.091 -0.762 -0.825) 1.127 44.169 ( -2.341 1.954 0.071) 3.050 44.175 ( -2.487 2.154 -0.634) 3.350 44.755 ( -3.311 -0.156 4.051) 5.234 45.107 ( 5.690 -3.813 -6.781) 9.639 46.575 ( 3.214 6.460 4.874) 8.708 46.911 ( 3.997 1.551 3.218) 5.361 47.393 ( -4.872 1.394 0.700) 5.115 47.556 ( -0.388 -1.157 -3.970) 4.154 50.580 ( 2.360 41.629 -4.853) 41.977 51.708 ( -4.229 17.609 -11.332) 21.363 57.122 ( 107.625 -60.402 41.606) 130.240 57.550 ( 4.518 -33.850 21.011) 40.096 69.720 ( -2.539 16.487 5.809) 17.664 70.828 ( 15.899 86.466 -29.490) 92.730 74.296 ( -9.628 -5.521 3.029) 11.504 74.395 ( -1.613 -3.533 0.081) 3.884 ======================= Grid point 141 (66/150) ======================= q-point: ( 0.12 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( 9.354 0.000 18.219) 20.480 1.255 ( 20.208 0.000 12.002) 23.503 1.585 ( 10.565 0.000 7.133) 12.747 2.172 ( 9.066 0.000 26.542) 28.048 2.368 ( 1.879 0.000 3.166) 3.681 2.402 ( 8.160 0.000 -6.498) 10.431 2.926 ( 2.201 0.000 10.424) 10.654 2.983 ( 2.663 0.000 0.490) 2.708 3.461 ( 0.975 0.000 -2.653) 2.826 3.567 ( -0.736 -0.000 -4.799) 4.856 3.730 ( -5.965 -0.000 -7.904) 9.902 4.045 ( 4.009 0.000 3.950) 5.628 4.234 ( 10.365 0.000 -9.309) 13.932 4.412 ( -4.085 -0.000 -14.917) 15.466 4.662 ( 2.045 0.000 7.508) 7.781 5.052 ( -0.416 -0.000 -5.625) 5.640 5.492 ( -3.323 -0.000 0.467) 3.356 5.528 ( -2.701 -0.000 4.837) 5.540 5.535 ( 3.641 0.000 0.792) 3.726 6.020 ( -3.321 -0.000 -6.745) 7.518 6.292 ( 2.623 0.000 -2.572) 3.674 6.300 ( 2.338 0.000 3.038) 3.833 7.194 ( -0.662 -0.000 7.727) 7.755 7.218 ( 2.447 0.000 4.041) 4.724 7.423 ( -3.785 -0.000 1.807) 4.194 7.678 ( -6.339 -0.000 5.397) 8.325 8.080 ( -5.651 -0.000 -9.264) 10.851 8.428 ( 0.053 0.000 -7.553) 7.553 9.981 ( -2.958 -0.000 8.454) 8.957 10.593 ( -1.590 -0.000 -6.989) 7.168 11.344 ( -0.491 -0.000 9.313) 9.326 11.873 ( -4.217 -0.000 -6.803) 8.004 13.496 ( -7.792 -0.000 6.278) 10.006 14.371 ( -1.898 -0.000 -7.017) 7.269 15.846 ( 4.097 0.000 0.375) 4.115 15.893 ( 1.029 0.000 2.899) 3.076 27.139 ( 0.583 0.000 1.548) 1.655 27.289 ( 0.128 0.000 -2.359) 2.363 27.640 ( -0.198 -0.000 -0.023) 0.200 27.644 ( -0.510 -0.000 0.294) 0.589 27.782 ( -0.024 -0.000 3.733) 3.733 28.026 ( -1.160 -0.000 -2.811) 3.040 31.585 ( 0.371 0.000 8.978) 8.986 31.985 ( -3.143 -0.000 4.605) 5.576 32.051 ( -3.886 -0.000 -7.993) 8.888 32.609 ( 2.879 0.000 -2.800) 4.016 35.217 ( -0.579 -0.000 -0.025) 0.580 35.245 ( 0.260 0.000 2.339) 2.354 36.111 ( -0.834 -0.000 1.674) 1.871 36.256 ( 0.656 0.000 -0.809) 1.041 44.148 ( 4.541 0.000 -1.756) 4.868 44.250 ( 1.845 0.000 1.105) 2.151 44.649 ( -0.435 -0.000 1.734) 1.787 45.274 ( 0.558 0.000 -4.297) 4.333 46.590 ( -3.106 -0.000 7.566) 8.179 46.923 ( -5.015 -0.000 7.345) 8.894 47.083 ( -2.602 -0.000 -5.079) 5.706 47.734 ( 6.635 0.000 -1.296) 6.761 50.411 ( 0.840 0.000 12.846) 12.874 51.257 ( -3.791 -0.000 -17.443) 17.850 57.071 ( -24.233 -0.000 2.891) 24.404 58.577 ( -79.686 -0.000 40.251) 89.275 69.597 ( 6.670 0.000 4.163) 7.862 70.004 ( 0.046 0.000 -4.611) 4.611 74.484 ( 3.203 0.000 2.522) 4.077 74.520 ( 18.287 0.000 0.387) 18.291 ======================= Grid point 142 (67/150) ======================= q-point: ( 0.25 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( 13.738 4.527 15.429) 21.149 1.550 ( 16.299 2.293 8.817) 18.672 1.785 ( 10.576 -2.979 7.957) 13.566 2.225 ( 1.483 11.207 1.060) 11.355 2.417 ( 9.533 -2.081 10.572) 14.387 2.658 ( 6.297 -10.301 -2.304) 12.291 2.856 ( 2.909 4.079 9.389) 10.642 3.205 ( 0.235 -14.637 4.429) 15.294 3.431 ( -2.871 -0.225 -1.775) 3.382 3.576 ( 4.303 2.007 -5.241) 7.072 3.644 ( -3.425 -1.145 -8.136) 8.901 4.109 ( 1.161 0.467 0.865) 1.522 4.169 ( -7.706 0.947 0.929) 7.820 4.405 ( 11.902 7.228 -13.872) 19.656 4.713 ( 1.702 -0.885 5.517) 5.841 4.977 ( -1.126 6.455 -4.005) 7.679 5.423 ( -7.129 -1.836 1.284) 7.473 5.522 ( -0.330 0.306 2.170) 2.216 5.611 ( 3.713 -1.616 -1.239) 4.235 5.909 ( -5.439 2.810 -6.000) 8.572 6.313 ( 1.319 -0.431 -0.625) 1.522 6.412 ( 2.461 -6.660 3.164) 7.774 7.160 ( -0.021 5.214 6.378) 8.238 7.270 ( 2.845 -0.638 2.850) 4.078 7.364 ( -2.079 2.897 4.043) 5.391 7.594 ( -2.578 1.521 3.216) 4.393 7.957 ( -6.568 1.920 -7.184) 9.921 8.353 ( -1.272 6.817 -6.664) 9.618 10.024 ( -0.236 -8.103 5.525) 9.810 10.584 ( -1.191 -3.525 -8.371) 9.161 11.451 ( -3.620 -11.009 5.928) 13.017 11.747 ( -4.179 5.431 -5.053) 8.514 13.536 ( -10.276 -21.040 3.660) 23.699 14.400 ( -2.931 -10.254 -6.578) 12.531 15.836 ( 4.584 10.463 2.746) 11.748 15.907 ( 5.354 4.990 1.782) 7.533 27.154 ( 0.718 -0.366 1.519) 1.720 27.281 ( 0.131 0.979 -1.944) 2.180 27.626 ( -0.426 0.453 0.169) 0.644 27.655 ( 0.098 -1.248 -0.091) 1.255 27.789 ( -0.299 -0.654 3.383) 3.459 27.991 ( -1.291 1.594 -2.643) 3.346 31.608 ( 0.325 -0.808 9.496) 9.536 31.863 ( -3.177 6.790 0.313) 7.503 32.069 ( -2.693 -6.640 -3.369) 7.918 32.637 ( 2.173 0.933 -3.057) 3.865 35.207 ( -0.543 0.201 -0.134) 0.594 35.252 ( 0.550 0.358 2.634) 2.714 36.105 ( -0.787 -0.705 1.369) 1.730 36.259 ( 0.651 0.714 -0.895) 1.316 44.228 ( 4.857 -1.296 -1.891) 5.370 44.296 ( 1.424 -2.733 1.354) 3.366 44.649 ( 0.989 1.208 0.280) 1.586 45.218 ( -2.238 5.190 -2.700) 6.264 46.549 ( -5.139 -1.617 5.213) 7.497 46.880 ( -6.833 -6.493 3.074) 9.915 47.069 ( 0.374 0.099 -1.623) 1.668 47.818 ( 7.072 2.755 -0.368) 7.599 50.516 ( -5.111 -13.382 8.540) 16.678 51.446 ( 0.634 -33.026 -16.557) 36.950 56.451 ( -21.471 35.350 -4.216) 41.574 57.288 ( -56.151 30.458 53.406) 83.264 69.837 ( 5.627 -17.336 2.914) 18.458 70.356 ( -5.574 -42.972 -7.346) 43.951 74.514 ( 3.716 4.168 4.591) 7.229 74.788 ( 26.109 10.130 -2.722) 28.138 ======================= Grid point 143 (68/150) ======================= q-point: ( 0.38 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( 14.625 6.482 11.566) 19.740 1.693 ( 8.321 5.902 5.341) 11.516 1.920 ( 2.417 4.398 5.431) 7.395 2.112 ( 2.582 5.032 6.204) 8.395 2.492 ( 6.850 6.645 -2.514) 9.869 2.801 ( 2.157 -0.860 -3.523) 4.220 2.986 ( 5.729 -5.798 8.787) 11.985 3.355 ( -0.186 -6.617 6.378) 9.193 3.424 ( -6.909 -3.529 -5.685) 9.618 3.526 ( -4.850 -5.306 -4.612) 8.541 3.736 ( 8.629 -1.786 -2.693) 9.214 4.006 ( -5.582 1.550 1.095) 5.895 4.181 ( 4.214 0.718 0.209) 4.280 4.434 ( 6.564 6.857 -8.243) 12.572 4.738 ( 2.816 5.883 0.363) 6.532 4.867 ( -2.398 1.156 1.719) 3.169 5.349 ( -7.037 -3.348 2.608) 8.217 5.486 ( -1.029 3.458 -0.986) 3.740 5.672 ( 2.864 0.358 -1.640) 3.320 5.816 ( -2.240 -0.941 -4.008) 4.687 6.360 ( -0.379 -5.578 0.553) 5.618 6.558 ( 0.419 -9.433 5.845) 11.105 7.059 ( -0.020 10.067 6.154) 11.799 7.247 ( 0.208 8.865 6.442) 10.961 7.357 ( 3.374 -1.299 -3.245) 4.859 7.580 ( -1.043 -2.452 2.112) 3.400 7.815 ( -7.189 1.801 -4.432) 8.635 8.213 ( -0.426 7.760 -5.723) 9.652 10.184 ( -0.122 -12.076 -0.745) 12.100 10.636 ( 0.803 -5.588 -10.590) 12.001 11.453 ( -4.062 2.223 4.825) 6.688 11.656 ( -4.127 -2.046 -1.204) 4.761 13.748 ( -11.265 -28.820 1.942) 31.005 14.551 ( -3.623 -18.332 -5.143) 19.382 15.727 ( 7.704 17.480 2.336) 19.245 15.890 ( 6.725 10.607 0.506) 12.569 27.174 ( 0.655 -0.644 1.263) 1.562 27.259 ( -0.059 1.718 -1.102) 2.042 27.620 ( -0.219 -0.284 0.100) 0.373 27.675 ( 0.340 -0.858 -0.158) 0.937 27.807 ( -0.178 -1.867 2.388) 3.037 27.937 ( -1.131 2.726 -2.156) 3.655 31.651 ( 0.366 -2.512 8.944) 9.297 31.723 ( -2.563 6.314 0.689) 6.850 32.128 ( -1.389 -6.430 -2.669) 7.099 32.637 ( 1.408 2.094 -3.362) 4.203 35.193 ( -0.573 0.597 -0.059) 0.830 35.259 ( 0.597 0.393 2.354) 2.460 36.112 ( -0.649 -1.564 0.823) 1.882 36.252 ( 0.557 1.409 -0.815) 1.721 44.312 ( 2.002 -2.285 0.625) 3.102 44.381 ( 3.593 -4.193 -1.443) 5.707 44.641 ( 1.453 2.406 -0.277) 2.824 45.057 ( -4.612 8.973 -0.919) 10.131 46.513 ( -5.096 -3.772 3.120) 7.066 46.912 ( -5.618 -10.047 1.576) 11.618 47.072 ( 1.364 1.146 -0.955) 2.021 47.862 ( 5.959 4.895 0.136) 7.713 50.693 ( -8.051 -25.410 4.636) 27.055 52.064 ( 2.236 -47.714 -14.756) 49.994 55.523 ( -9.107 52.966 -7.146) 54.217 56.286 ( -29.328 30.248 41.901) 59.420 70.213 ( 0.804 -24.773 0.515) 24.792 70.883 ( -6.976 -43.243 -4.636) 44.046 74.486 ( 2.102 7.049 6.691) 9.944 74.990 ( 30.965 21.055 -6.784) 38.055 ======================= Grid point 144 (69/150) ======================= q-point: (-0.50 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( 13.411 7.596 7.183) 17.004 1.603 ( -2.188 11.419 5.824) 13.003 1.851 ( 3.690 7.542 0.946) 8.449 2.108 ( -0.830 1.688 5.996) 6.284 2.524 ( 6.818 3.910 -4.699) 9.158 2.791 ( 3.792 4.681 0.371) 6.035 3.079 ( -3.271 -1.236 3.301) 4.809 3.327 ( -6.630 -2.374 -8.005) 10.662 3.392 ( -3.816 1.611 8.185) 9.174 3.550 ( -4.547 -4.920 -1.925) 6.970 3.850 ( 3.420 2.278 -2.224) 4.673 3.933 ( 1.571 1.407 1.273) 2.463 4.262 ( 5.077 -2.034 -0.228) 5.473 4.393 ( 1.328 4.714 -3.315) 5.914 4.603 ( 0.050 11.526 -3.927) 12.177 4.882 ( -1.396 -2.001 4.318) 4.959 5.339 ( -3.962 -6.280 4.776) 8.828 5.423 ( -0.132 2.094 -2.387) 3.178 5.695 ( 2.021 0.268 -0.736) 2.167 5.843 ( 0.782 -3.033 -4.577) 5.547 6.464 ( -1.047 -9.426 2.795) 9.887 6.700 ( -1.238 -7.424 6.096) 9.685 6.911 ( 0.412 9.026 5.803) 10.739 7.112 ( 1.081 11.521 4.008) 12.246 7.423 ( 2.874 -1.678 -4.253) 5.400 7.624 ( -0.780 -3.916 3.479) 5.296 7.687 ( -7.640 -1.439 -2.739) 8.243 8.136 ( 3.030 3.847 -6.230) 7.925 10.323 ( -0.189 -6.922 -8.460) 10.932 10.704 ( 1.102 -2.990 -9.479) 10.000 11.427 ( 0.260 -4.685 4.860) 6.755 11.613 ( -4.156 -0.274 1.940) 4.595 14.014 ( -8.849 -28.193 2.388) 29.645 14.790 ( -3.475 -22.292 -3.579) 22.843 15.578 ( 9.125 20.846 1.035) 22.779 15.800 ( 7.426 16.684 -1.974) 18.368 27.193 ( 0.417 -0.340 0.667) 0.857 27.231 ( -0.241 1.288 -0.144) 1.318 27.628 ( 0.027 -0.838 0.115) 0.847 27.683 ( 0.129 0.313 0.291) 0.446 27.848 ( 0.433 -2.949 0.612) 3.043 27.877 ( -0.718 2.763 -1.281) 3.129 31.607 ( -1.105 5.913 2.344) 6.456 31.717 ( -0.491 -4.688 7.413) 8.784 32.204 ( -0.034 -6.030 -2.430) 6.502 32.609 ( 0.712 3.263 -3.740) 5.014 35.175 ( -0.386 0.810 0.395) 0.980 35.264 ( 0.291 0.281 1.727) 1.774 36.132 ( -0.446 -2.094 0.273) 2.159 36.233 ( 0.388 1.994 -0.518) 2.096 44.344 ( 0.108 0.074 0.586) 0.600 44.515 ( 4.212 -5.160 -2.709) 7.191 44.627 ( 0.797 1.668 0.190) 1.858 44.846 ( -4.720 8.549 0.533) 9.780 46.518 ( -3.851 -5.621 2.601) 7.293 46.998 ( -1.284 -8.296 2.077) 8.648 47.074 ( 0.341 -0.203 -2.626) 2.656 47.853 ( 3.422 6.424 0.223) 7.282 51.037 ( -7.507 -36.372 5.371) 37.525 52.723 ( 1.123 -38.005 -15.455) 41.042 54.777 ( 15.188 50.309 -11.609) 53.818 55.628 ( -18.352 16.670 33.937) 42.029 70.509 ( -2.666 -16.610 0.036) 16.822 71.396 ( -1.501 -37.831 -3.213) 37.997 74.395 ( -1.546 7.504 7.929) 11.026 75.090 ( 33.770 30.996 -12.112) 47.411 ======================= Grid point 145 (70/150) ======================= q-point: (-0.38 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( -0.542 19.446 6.267) 20.438 1.532 ( 1.040 8.414 11.341) 14.159 1.847 ( 8.491 6.520 -1.387) 10.795 2.090 ( -2.039 -4.244 0.484) 4.734 2.489 ( 3.473 10.646 -7.357) 13.399 2.837 ( 6.041 1.710 5.491) 8.341 2.966 ( -8.493 4.121 6.111) 11.246 3.219 ( -9.358 7.009 8.172) 14.265 3.271 ( -3.280 -1.399 -5.687) 6.713 3.476 ( -7.291 1.462 -4.590) 8.739 3.810 ( 3.750 6.792 -0.425) 7.770 3.987 ( 4.184 1.159 1.760) 4.684 4.303 ( -2.219 8.212 -1.522) 8.642 4.368 ( 2.757 -3.139 -0.312) 4.189 4.484 ( 1.744 3.649 -2.380) 4.692 4.867 ( -3.467 -1.519 2.345) 4.453 5.405 ( -1.636 -6.446 5.243) 8.469 5.428 ( 1.808 -0.873 -1.286) 2.384 5.731 ( 1.735 -0.910 -0.387) 1.997 5.877 ( -0.095 -1.822 -6.030) 6.300 6.579 ( -0.268 -3.086 6.233) 6.961 6.661 ( 0.545 5.386 1.244) 5.554 6.911 ( -2.166 0.014 4.711) 5.185 7.010 ( 2.255 0.988 4.470) 5.103 7.486 ( 1.328 -3.809 -2.629) 4.815 7.583 ( -6.784 -2.461 2.278) 7.568 7.724 ( -1.301 -9.170 -0.605) 9.282 8.167 ( 5.424 0.113 -7.940) 9.617 10.320 ( 1.536 6.525 -9.427) 11.568 10.748 ( -0.366 -4.697 -9.146) 10.288 11.565 ( -2.311 -0.609 5.133) 5.662 11.602 ( 2.688 -13.216 -0.530) 13.497 14.287 ( -4.193 -21.491 3.198) 22.129 15.057 ( -1.872 -19.738 -1.903) 19.918 15.424 ( 6.140 15.012 0.447) 16.226 15.621 ( 9.166 24.597 -7.158) 27.208 27.184 ( -0.114 1.696 0.396) 1.745 27.232 ( -0.053 -1.319 0.121) 1.325 27.642 ( 0.089 -0.819 0.066) 0.827 27.675 ( -0.032 0.796 0.464) 0.922 27.822 ( 0.109 3.118 -0.073) 3.121 27.913 ( 0.536 -3.999 -0.779) 4.109 31.527 ( 0.111 4.609 4.167) 6.214 31.791 ( -1.221 -5.812 5.758) 8.272 32.291 ( 0.783 -5.432 -2.406) 5.993 32.555 ( 0.312 4.385 -4.132) 6.033 35.162 ( 0.027 0.543 1.105) 1.231 35.265 ( -0.112 0.109 1.041) 1.053 36.158 ( -0.144 -1.980 -0.162) 1.992 36.206 ( 0.152 2.144 0.002) 2.149 44.322 ( 0.624 3.376 -0.590) 3.484 44.496 ( -4.512 6.792 -0.110) 8.155 44.676 ( 0.382 -3.209 1.636) 3.622 44.771 ( 2.979 -3.453 -2.303) 5.109 46.560 ( -2.229 -5.739 3.097) 6.892 47.055 ( 5.418 6.299 2.520) 8.682 47.138 ( -3.125 -13.050 -4.195) 14.059 47.779 ( 0.039 7.390 -0.057) 7.390 51.450 ( -7.018 -30.093 2.865) 31.033 52.960 ( -3.156 4.338 -16.807) 17.642 54.645 ( 44.818 23.532 -4.919) 50.859 55.466 ( -14.770 -26.329 25.860) 39.750 70.595 ( -1.686 0.913 4.396) 4.796 71.909 ( 4.637 -29.881 -10.407) 31.979 74.257 ( -5.825 4.744 7.623) 10.702 75.074 ( 34.032 39.434 -19.325) 55.558 ======================= Grid point 146 (71/150) ======================= q-point: (-0.25 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.040 ( 2.215 18.072 10.786) 21.162 1.373 ( -3.640 11.277 13.346) 17.848 1.797 ( 0.084 10.110 2.877) 10.512 2.182 ( 1.090 -3.663 -7.378) 8.309 2.361 ( 7.060 11.621 -2.163) 13.769 2.673 ( -10.958 17.443 15.010) 25.488 2.842 ( -3.176 2.972 4.448) 6.221 3.122 ( 0.306 -5.136 6.073) 7.959 3.256 ( 2.352 2.698 -4.697) 5.906 3.352 ( -4.647 -1.620 -3.511) 6.045 3.761 ( 4.656 10.133 1.545) 11.258 3.994 ( 0.142 3.902 1.921) 4.352 4.136 ( -1.374 7.309 -1.564) 7.600 4.422 ( -0.790 -2.599 -2.566) 3.737 4.506 ( 1.808 -1.439 1.655) 2.842 4.865 ( -2.208 -4.401 0.590) 4.959 5.466 ( 1.046 -1.693 1.815) 2.693 5.478 ( -0.868 -3.868 2.758) 4.829 5.749 ( 0.650 1.141 -0.092) 1.316 5.899 ( -0.109 -3.701 -7.142) 8.044 6.499 ( 2.092 10.137 2.495) 10.647 6.638 ( -0.382 6.969 -0.557) 7.001 6.903 ( -1.720 -7.809 7.234) 10.782 7.092 ( 1.202 -3.300 4.253) 5.516 7.530 ( -1.188 0.133 -0.913) 1.503 7.581 ( -5.317 -10.932 5.130) 13.194 7.870 ( -1.599 -14.335 -3.693) 14.889 8.245 ( 4.784 -1.316 -9.298) 10.539 10.200 ( 2.778 11.671 -3.521) 12.503 10.773 ( -0.662 -1.032 -12.301) 12.362 11.591 ( -2.263 -6.982 5.269) 9.035 11.826 ( 2.871 -10.163 -6.074) 12.183 14.447 ( 0.097 -0.942 1.219) 1.544 15.213 ( -5.022 1.216 0.493) 5.191 15.374 ( 12.731 18.407 -7.094) 23.478 15.426 ( 3.062 -5.898 -6.051) 8.987 27.158 ( -0.146 1.535 0.847) 1.759 27.254 ( -0.140 -1.798 -0.670) 1.924 27.649 ( -0.102 -0.095 -0.001) 0.140 27.664 ( 0.030 0.771 0.214) 0.801 27.791 ( 0.626 2.014 1.526) 2.603 27.974 ( 0.297 -3.563 -1.748) 3.980 31.492 ( 1.395 2.797 6.175) 6.921 31.862 ( -2.103 -6.368 4.019) 7.818 32.360 ( -0.681 -3.176 -3.103) 4.492 32.492 ( 1.632 4.172 -4.002) 6.007 35.166 ( 0.521 -0.189 1.836) 1.918 35.261 ( -0.439 -0.071 0.391) 0.592 36.165 ( 0.045 1.656 0.304) 1.684 36.195 ( 0.054 -1.327 -0.070) 1.330 44.277 ( 1.605 4.629 -0.948) 4.990 44.314 ( -4.296 7.493 0.577) 8.656 44.697 ( -2.849 -3.216 3.345) 5.446 44.929 ( 5.276 -7.301 -4.831) 10.222 46.617 ( -0.658 -4.008 4.058) 5.741 47.034 ( 2.707 5.174 0.692) 5.880 47.286 ( 1.442 -9.219 -3.008) 9.804 47.642 ( -3.487 7.513 -0.594) 8.304 51.560 ( -4.731 4.695 -8.043) 10.446 52.551 ( -5.531 32.579 -14.699) 36.166 55.509 ( 62.035 -29.661 11.786) 69.764 55.962 ( -13.475 -61.087 17.244) 64.889 70.444 ( 0.540 19.857 9.210) 21.896 72.294 ( 8.173 -9.098 -28.418) 30.937 74.133 ( -7.288 -1.214 5.940) 9.480 74.898 ( 26.008 43.895 -25.572) 57.071 ======================= Grid point 147 (72/150) ======================= q-point: (-0.12 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( 7.444 12.013 14.919) 20.550 1.157 ( -6.337 11.107 16.622) 20.971 1.599 ( -3.158 12.054 4.145) 13.132 2.137 ( 3.263 8.214 7.102) 11.338 2.271 ( -4.907 13.674 10.357) 17.842 2.440 ( 7.870 5.120 -1.230) 9.469 2.757 ( -4.335 -0.575 5.212) 6.803 3.193 ( 5.053 8.853 -0.957) 10.238 3.326 ( 1.991 -12.798 0.293) 12.955 3.452 ( 10.776 -7.049 -1.296) 12.942 3.633 ( 0.664 12.426 1.563) 12.542 3.927 ( -1.803 2.056 2.024) 3.403 4.053 ( 0.446 4.726 -1.822) 5.084 4.426 ( -3.266 -3.414 -1.805) 5.057 4.574 ( 2.381 -2.790 1.833) 4.101 4.923 ( -0.673 -5.951 0.187) 5.992 5.489 ( 0.738 0.638 1.444) 1.743 5.508 ( -1.650 -2.461 3.287) 4.426 5.729 ( 0.173 2.563 -1.851) 3.167 5.950 ( -0.435 -4.734 -6.164) 7.785 6.393 ( 1.346 8.398 1.065) 8.572 6.482 ( -1.331 10.362 -1.450) 10.547 7.042 ( -0.749 -9.793 9.027) 13.340 7.144 ( 1.614 -0.609 2.964) 3.430 7.508 ( -2.867 -1.367 -0.307) 3.191 7.666 ( -6.006 -10.954 6.802) 14.224 8.048 ( -2.198 -13.605 -7.493) 15.687 8.315 ( 2.572 -2.767 -8.832) 9.606 10.086 ( 2.106 8.428 2.356) 9.001 10.724 ( -0.761 3.112 -11.157) 11.608 11.680 ( -2.165 -6.528 0.040) 6.878 11.909 ( -1.102 -0.049 -8.327) 8.399 14.276 ( -1.064 23.158 -3.166) 23.397 14.836 ( -2.985 27.482 -8.772) 29.002 15.549 ( 9.393 -9.019 -1.167) 13.074 15.606 ( -0.962 -14.241 -1.829) 14.390 27.140 ( 0.033 1.037 1.197) 1.584 27.274 ( -0.202 -1.560 -1.597) 2.242 27.645 ( -0.315 0.009 0.329) 0.455 27.655 ( 0.263 0.721 -0.016) 0.768 27.783 ( 0.575 1.055 2.641) 2.901 28.016 ( -0.314 -2.652 -2.341) 3.552 31.508 ( 2.201 0.422 7.699) 8.018 31.921 ( -2.939 -6.395 2.604) 7.504 32.312 ( -3.262 3.603 -4.725) 6.779 32.508 ( 3.531 -0.259 -2.909) 4.582 35.188 ( 0.710 -1.046 2.101) 2.452 35.254 ( -0.659 -0.068 -0.091) 0.669 36.140 ( -0.233 1.445 1.208) 1.898 36.220 ( 0.381 -1.378 -0.449) 1.498 44.172 ( -1.801 5.508 0.761) 5.844 44.242 ( 2.396 3.982 -0.709) 4.701 44.694 ( -3.374 -2.084 2.709) 4.803 45.097 ( 4.201 -6.618 -5.259) 9.440 46.654 ( -0.000 -0.218 5.056) 5.061 46.995 ( 0.534 3.522 1.878) 4.027 47.375 ( -1.594 3.439 -2.664) 4.633 47.515 ( -0.639 -2.020 -1.732) 2.737 51.163 ( -3.922 35.311 -9.995) 36.908 51.976 ( -3.441 31.328 -14.357) 34.633 56.665 ( -14.014 -59.431 13.138) 62.458 57.303 ( 45.289 -88.233 15.645) 100.404 70.092 ( 0.851 30.335 10.106) 31.985 72.072 ( -2.122 49.697 -54.786) 73.999 74.119 ( -2.468 -6.585 4.089) 8.135 74.565 ( 6.967 26.198 -13.768) 30.404 ======================= Grid point 150 (73/150) ======================= q-point: ( 0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( 14.622 0.000 12.110) 18.986 1.830 ( 12.470 0.000 11.593) 17.026 1.931 ( 9.501 0.000 3.290) 10.054 2.384 ( -0.812 -0.000 5.649) 5.707 2.527 ( 10.578 0.000 1.285) 10.655 2.722 ( 14.059 0.000 -0.797) 14.082 2.968 ( -1.407 -0.000 11.026) 11.115 3.040 ( 0.403 0.000 2.845) 2.874 3.403 ( -0.825 -0.000 -4.576) 4.650 3.488 ( -7.076 -0.000 -10.141) 12.365 3.720 ( 6.935 0.000 -3.954) 7.983 3.989 ( -11.833 -0.000 2.309) 12.056 4.192 ( 5.425 0.000 0.941) 5.506 4.563 ( 6.306 0.000 -11.555) 13.164 4.738 ( 1.959 0.000 5.693) 6.021 5.017 ( -0.580 -0.000 -6.849) 6.873 5.275 ( -9.276 -0.000 2.964) 9.738 5.540 ( 1.367 0.000 1.066) 1.733 5.661 ( 4.056 0.000 -0.973) 4.171 5.808 ( -7.768 -0.000 -7.443) 10.759 6.363 ( 0.617 0.000 4.311) 4.355 6.376 ( 1.125 0.000 -1.585) 1.944 7.224 ( 1.614 0.000 4.248) 4.545 7.301 ( 2.087 0.000 4.067) 4.571 7.376 ( 0.330 0.000 3.542) 3.558 7.570 ( -2.478 -0.000 2.858) 3.783 7.845 ( -8.233 -0.000 -4.557) 9.410 8.378 ( -1.231 -0.000 -7.458) 7.559 9.964 ( -0.347 -0.000 6.942) 6.950 10.521 ( -1.576 -0.000 -7.375) 7.541 11.335 ( -1.873 -0.000 9.019) 9.211 11.722 ( -4.090 -0.000 -6.044) 7.298 13.252 ( -8.328 -0.000 5.330) 9.887 14.270 ( -3.115 -0.000 -7.601) 8.215 16.007 ( 5.696 0.000 1.417) 5.869 16.035 ( 7.941 0.000 2.660) 8.375 27.166 ( 0.768 0.000 1.595) 1.770 27.289 ( 0.267 0.000 -1.968) 1.986 27.633 ( -0.238 -0.000 0.070) 0.248 27.636 ( -0.003 -0.000 -0.276) 0.276 27.784 ( -0.541 -0.000 3.448) 3.490 27.980 ( -1.171 -0.000 -2.605) 2.856 31.610 ( -0.803 -0.000 8.943) 8.979 31.919 ( -1.816 -0.000 5.298) 5.601 31.935 ( -2.063 -0.000 -7.201) 7.490 32.668 ( 1.629 0.000 -3.274) 3.657 35.202 ( -0.398 -0.000 -0.228) 0.459 35.265 ( 0.377 0.000 2.359) 2.389 36.090 ( -0.755 -0.000 1.577) 1.748 36.273 ( 0.625 0.000 -1.167) 1.324 44.293 ( 0.963 0.000 2.428) 2.611 44.300 ( 5.642 0.000 -3.134) 6.454 44.680 ( 1.537 0.000 0.399) 1.588 45.207 ( -3.969 -0.000 -2.143) 4.511 46.461 ( -5.887 -0.000 5.041) 7.750 46.704 ( -8.144 -0.000 -1.442) 8.270 47.107 ( 2.961 0.000 2.459) 3.849 47.938 ( 6.135 0.000 -0.739) 6.179 50.391 ( -5.044 -0.000 13.872) 14.760 51.137 ( -0.811 -0.000 -20.032) 20.048 56.425 ( -14.807 -0.000 -8.568) 17.108 56.781 ( -43.952 -0.000 56.119) 71.282 69.869 ( 9.132 0.000 0.822) 9.169 69.990 ( -0.079 -0.000 -3.424) 3.425 74.635 ( 5.615 0.000 6.919) 8.911 75.312 ( 32.681 0.000 -6.926) 33.407 ======================= Grid point 151 (74/150) ======================= q-point: ( 0.38 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( 11.048 4.385 10.614) 15.936 1.922 ( 5.486 7.261 6.107) 10.960 2.034 ( 4.032 2.614 4.056) 6.288 2.285 ( 2.167 10.276 5.445) 11.830 2.730 ( 8.640 -0.090 -1.279) 8.735 2.785 ( 3.279 5.088 0.006) 6.053 3.035 ( 6.393 -2.949 1.152) 7.134 3.172 ( -2.425 -12.049 3.628) 12.814 3.362 ( -2.313 2.560 -7.286) 8.062 3.415 ( -0.893 -2.250 -2.511) 3.488 3.812 ( 4.547 -1.500 -3.978) 6.225 3.867 ( -7.712 -4.296 4.465) 9.893 4.267 ( 4.920 0.988 1.030) 5.123 4.586 ( 3.109 5.275 -7.448) 9.641 4.805 ( 3.521 -2.546 3.740) 5.733 4.927 ( -0.840 8.390 -5.428) 10.028 5.174 ( -8.541 -4.439 2.714) 10.001 5.528 ( -0.437 4.142 -2.010) 4.625 5.712 ( -0.231 -0.503 -4.845) 4.876 5.725 ( -0.900 -3.733 -2.582) 4.627 6.323 ( -1.053 1.044 1.332) 1.994 6.448 ( -1.292 -6.492 4.413) 7.955 7.200 ( 1.003 6.801 6.111) 9.198 7.344 ( 0.885 1.283 6.325) 6.514 7.386 ( 2.448 0.511 -2.295) 3.395 7.546 ( -0.791 -0.517 1.751) 1.989 7.706 ( -8.292 0.876 -1.940) 8.561 8.307 ( 0.066 5.658 -7.115) 9.091 10.032 ( -0.214 -7.881 3.752) 8.731 10.532 ( -0.539 -5.690 -8.681) 10.394 11.363 ( -3.492 -5.035 7.722) 9.858 11.625 ( -2.679 3.612 -3.697) 5.822 13.272 ( -7.105 -16.616 5.355) 18.848 14.283 ( -3.253 -9.994 -7.255) 12.771 16.024 ( 5.520 8.930 2.233) 10.734 16.138 ( 9.663 5.473 -0.333) 11.110 27.180 ( 0.616 -0.226 1.469) 1.609 27.281 ( 0.184 1.284 -1.458) 1.951 27.618 ( -0.122 0.486 -0.081) 0.507 27.659 ( 0.223 -1.829 -0.544) 1.921 27.784 ( -0.622 -0.829 3.016) 3.190 27.950 ( -0.814 1.499 -2.225) 2.803 31.615 ( -1.853 -1.764 7.343) 7.776 31.803 ( -0.577 7.042 0.950) 7.129 32.011 ( -0.585 -7.125 -0.725) 7.185 32.675 ( 0.977 1.172 -3.571) 3.883 35.193 ( -0.306 0.371 -0.171) 0.510 35.270 ( -0.037 0.108 1.767) 1.770 36.088 ( -0.513 -0.775 1.522) 1.783 36.274 ( 0.538 0.749 -1.250) 1.554 44.319 ( 1.484 -0.718 1.909) 2.522 44.398 ( 5.266 -2.360 -2.972) 6.491 44.688 ( 0.663 1.570 0.641) 1.821 45.091 ( -5.159 5.831 -1.199) 7.877 46.391 ( -5.448 -1.980 3.295) 6.668 46.652 ( -7.202 -8.912 -2.201) 11.668 47.154 ( 4.003 1.532 3.477) 5.519 47.995 ( 4.089 2.783 -1.574) 5.190 50.358 ( -6.688 -7.931 9.520) 14.080 51.386 ( -1.474 -36.308 -17.723) 40.430 56.011 ( -5.305 28.721 -1.254) 29.234 56.258 ( -23.590 13.095 36.763) 45.601 69.992 ( 3.591 -9.490 -1.055) 10.202 70.287 ( 0.994 -29.746 -1.883) 29.822 74.680 ( 5.311 7.310 9.598) 13.182 75.725 ( 34.019 11.304 -11.919) 37.777 ======================= Grid point 152 (75/150) ======================= q-point: (-0.50 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( 4.829 4.916 9.001) 11.336 1.814 ( 1.290 13.112 3.138) 13.544 2.006 ( 2.116 5.607 -0.398) 6.007 2.200 ( 2.494 8.939 6.073) 11.091 2.747 ( 8.557 7.104 1.028) 11.169 2.857 ( 2.378 -1.693 -0.203) 2.927 3.063 ( -0.838 2.944 -7.369) 7.979 3.221 ( -2.666 -0.012 -1.257) 2.947 3.327 ( -3.055 -1.418 1.968) 3.901 3.448 ( -1.381 -2.419 -0.102) 2.788 3.845 ( -2.792 -4.080 1.018) 5.047 3.920 ( 2.386 -4.190 -0.508) 4.849 4.323 ( 3.611 0.214 1.822) 4.050 4.498 ( 0.212 7.667 -4.046) 8.671 4.776 ( 0.892 10.217 -4.938) 11.382 4.873 ( 1.160 1.356 1.337) 2.230 5.171 ( -4.673 -8.906 4.559) 11.043 5.448 ( -0.738 2.661 -3.595) 4.533 5.721 ( 1.010 -0.050 -2.157) 2.383 5.783 ( 0.427 -4.190 -4.586) 6.226 6.343 ( -0.911 -5.699 2.421) 6.259 6.538 ( -3.042 -9.930 5.475) 11.740 7.086 ( 0.066 11.135 7.708) 13.543 7.283 ( 1.044 8.866 3.348) 9.534 7.406 ( -2.140 -1.170 -2.167) 3.263 7.571 ( -1.134 -2.198 3.995) 4.699 7.593 ( -2.026 0.299 -2.421) 3.172 8.237 ( 2.836 4.653 -7.324) 9.129 10.171 ( -0.106 -11.010 -2.003) 11.192 10.619 ( -0.044 -7.109 -11.443) 13.472 11.367 ( -2.952 -2.365 7.333) 8.251 11.569 ( -0.982 0.088 0.243) 1.016 13.500 ( -5.349 -25.787 6.186) 27.053 14.434 ( -2.894 -18.411 -6.378) 19.698 15.925 ( 3.681 14.890 2.842) 15.599 16.162 ( 10.347 11.673 -4.428) 16.215 27.195 ( 0.380 -0.442 1.090) 1.236 27.255 ( -0.010 2.127 -0.684) 2.235 27.618 ( -0.004 -0.480 0.019) 0.480 27.683 ( 0.117 -0.782 -0.345) 0.862 27.805 ( -0.339 -2.754 1.601) 3.204 27.909 ( -0.233 2.498 -1.571) 2.960 31.618 ( -2.894 -1.783 4.241) 5.435 31.721 ( 1.028 4.535 4.273) 6.315 32.111 ( 0.524 -6.797 -0.568) 6.841 32.654 ( 0.390 2.360 -3.948) 4.617 35.182 ( -0.135 0.645 0.196) 0.687 35.267 ( -0.555 0.029 1.092) 1.225 36.102 ( -0.177 -1.516 1.252) 1.974 36.263 ( 0.378 1.492 -1.120) 1.903 44.357 ( 1.784 -0.568 1.037) 2.140 44.513 ( 4.258 -3.423 -3.084) 6.273 44.660 ( -0.527 2.186 1.229) 2.563 44.901 ( -4.843 8.659 -0.239) 9.924 46.378 ( -3.898 -5.413 2.656) 7.179 46.722 ( -5.366 -13.859 -3.114) 15.184 47.193 ( 4.717 2.979 4.190) 6.977 47.974 ( 1.283 5.282 -2.493) 5.980 50.509 ( -4.973 -23.923 8.343) 25.820 51.964 ( -4.338 -50.235 -18.722) 53.785 55.602 ( 13.510 33.424 -7.241) 36.771 55.732 ( -17.118 23.006 31.543) 42.629 70.235 ( 0.985 -17.510 0.341) 17.541 70.782 ( -0.998 -38.516 -3.100) 38.654 74.606 ( 3.066 13.999 11.645) 18.465 75.972 ( 31.697 20.453 -18.452) 41.994 ======================= Grid point 153 (76/150) ======================= q-point: (-0.38 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( -2.127 14.630 4.764) 15.533 1.712 ( 0.944 10.286 7.004) 12.480 2.006 ( 1.380 -2.654 -1.299) 3.261 2.108 ( 5.193 10.974 1.438) 12.226 2.785 ( 8.945 6.772 0.652) 11.238 2.835 ( -4.771 7.623 -3.017) 9.485 3.008 ( 3.829 0.795 2.199) 4.486 3.179 ( -7.070 7.139 0.630) 10.067 3.200 ( -3.571 -0.748 0.644) 3.705 3.423 ( -2.334 1.061 -2.117) 3.325 3.868 ( -0.069 -1.463 0.907) 1.722 4.002 ( 0.167 -3.941 0.687) 4.004 4.353 ( -1.386 1.424 2.713) 3.363 4.401 ( 1.480 4.872 -2.258) 5.570 4.658 ( 4.576 11.066 -4.070) 12.648 4.815 ( -3.090 1.698 -0.064) 3.526 5.277 ( -1.417 -9.250 5.394) 10.801 5.436 ( 1.197 -0.587 -2.027) 2.426 5.733 ( 0.401 -0.727 -1.582) 1.786 5.824 ( -0.713 -2.345 -5.907) 6.395 6.456 ( -0.123 -9.773 4.371) 10.706 6.665 ( -2.224 -10.934 3.829) 11.796 6.928 ( -0.782 9.934 7.322) 12.366 7.146 ( 0.085 10.887 0.734) 10.912 7.362 ( -5.164 -2.118 1.462) 5.770 7.560 ( 0.593 0.171 -1.042) 1.211 7.642 ( 1.288 -3.029 1.945) 3.823 8.240 ( 4.292 1.367 -8.475) 9.597 10.327 ( 1.907 -8.531 -6.963) 11.176 10.654 ( -1.921 -2.209 -11.435) 11.804 11.418 ( -2.450 -8.064 5.598) 10.118 11.580 ( 1.968 -1.335 2.473) 3.431 13.851 ( -2.573 -28.723 7.470) 29.790 14.693 ( -2.165 -23.155 -5.504) 23.898 15.717 ( 0.724 18.862 3.278) 19.158 16.093 ( 9.213 17.185 -9.644) 21.753 27.207 ( 0.369 0.020 0.455) 0.586 27.222 ( -0.319 1.468 0.077) 1.504 27.629 ( 0.014 -0.952 0.210) 0.975 27.684 ( -0.159 0.387 0.227) 0.476 27.854 ( -0.358 -3.431 -0.342) 3.467 27.871 ( 0.581 2.096 -0.581) 2.251 31.588 ( -1.026 1.831 3.463) 4.049 31.719 ( -0.286 -1.515 5.474) 5.687 32.216 ( 0.989 -6.091 -0.847) 6.228 32.609 ( 0.054 3.334 -4.342) 5.475 35.174 ( 0.206 0.556 0.874) 1.057 35.257 ( -0.984 -0.173 0.519) 1.126 36.129 ( 0.160 -1.974 0.862) 2.160 36.240 ( 0.145 2.111 -0.803) 2.263 44.385 ( 2.575 1.591 -0.161) 3.031 44.536 ( -1.701 4.860 -1.475) 5.356 44.641 ( -1.889 0.045 2.184) 2.887 44.773 ( 1.204 -0.137 -1.510) 1.936 46.433 ( -1.965 -7.378 3.428) 8.369 46.860 ( -3.801 -14.748 -4.710) 15.942 47.226 ( 5.414 3.548 5.078) 8.227 47.876 ( -1.603 7.381 -3.151) 8.184 50.904 ( -1.944 -33.937 9.693) 35.347 52.559 ( -5.332 -41.993 -24.079) 48.700 55.174 ( -14.529 18.531 22.161) 32.336 55.533 ( 24.549 17.462 -3.042) 30.279 70.488 ( 0.882 -13.781 4.658) 14.573 71.342 ( -1.938 -42.122 -7.942) 42.908 74.410 ( -0.596 17.437 11.741) 21.030 76.021 ( 24.314 27.944 -27.413) 46.082 ======================= Grid point 154 (77/150) ======================= q-point: (-0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( -0.250 14.108 7.003) 15.752 1.530 ( -2.372 13.320 8.462) 15.957 1.945 ( -0.198 9.638 2.889) 10.064 2.179 ( 6.108 -2.863 -8.399) 10.773 2.582 ( -6.918 8.578 0.926) 11.059 2.788 ( -0.506 12.340 9.758) 15.740 2.871 ( -2.221 10.495 -2.634) 11.046 3.111 ( 4.077 -2.319 8.163) 9.415 3.263 ( 4.322 -5.434 -3.087) 7.599 3.377 ( 2.880 4.003 -3.464) 6.026 3.879 ( 0.326 0.894 2.838) 2.993 4.024 ( -2.366 -0.319 0.338) 2.411 4.229 ( -2.801 8.847 0.131) 9.281 4.387 ( 0.061 0.828 -1.520) 1.732 4.569 ( 0.823 5.123 0.299) 5.197 4.803 ( 1.599 -1.382 -1.194) 2.427 5.382 ( -1.298 -6.639 4.569) 8.163 5.474 ( 1.639 -1.391 -0.380) 2.183 5.743 ( -1.271 -0.851 -0.435) 1.590 5.825 ( -1.277 -2.658 -6.744) 7.361 6.615 ( 1.323 -7.352 4.146) 8.543 6.690 ( 0.368 6.200 4.288) 7.548 6.851 ( -2.261 1.543 3.564) 4.494 7.042 ( -1.576 -1.968 2.832) 3.791 7.336 ( -4.432 -3.889 2.034) 6.237 7.577 ( 2.413 0.447 -2.437) 3.459 7.717 ( 0.134 -6.144 1.803) 6.404 8.275 ( 2.560 -0.077 -9.215) 9.564 10.397 ( 4.891 6.430 -6.347) 10.274 10.652 ( -3.442 -7.513 -12.270) 14.793 11.472 ( -3.240 -4.673 5.581) 7.968 11.708 ( 2.678 -9.260 -0.958) 9.687 14.239 ( 0.255 -23.641 7.280) 24.737 15.001 ( -1.283 -23.244 -4.956) 23.802 15.425 ( -2.743 19.392 3.347) 19.869 15.907 ( 5.238 21.119 -14.313) 26.045 27.186 ( 0.169 2.152 0.513) 2.219 27.227 ( -0.213 -1.397 -0.104) 1.417 27.641 ( -0.166 -0.606 0.327) 0.708 27.674 ( -0.104 0.540 0.264) 0.610 27.835 ( 0.584 2.456 0.483) 2.570 27.914 ( -0.353 -4.117 -1.433) 4.373 31.562 ( 0.858 2.255 5.465) 5.974 31.753 ( -1.853 -4.141 3.953) 6.018 32.301 ( 0.154 -3.913 -1.651) 4.250 32.555 ( 0.536 3.146 -4.398) 5.434 35.177 ( 0.640 0.115 1.676) 1.797 35.245 ( -1.215 -0.431 0.125) 1.296 36.164 ( 0.451 -1.914 0.426) 2.012 36.206 ( -0.147 2.287 -0.336) 2.316 44.383 ( 3.201 4.893 -0.708) 5.890 44.391 ( -1.527 8.731 -0.538) 8.879 44.606 ( -3.989 -2.570 2.945) 5.585 44.883 ( 3.067 -7.075 -3.013) 8.279 46.529 ( -0.336 -6.994 4.658) 8.410 46.979 ( -3.694 -8.958 -4.714) 10.776 47.294 ( 6.685 -0.344 4.603) 8.124 47.706 ( -4.213 9.163 -3.504) 10.676 51.357 ( 0.634 -23.039 7.366) 24.196 52.762 ( -4.479 2.997 -25.172) 25.742 54.999 ( -19.399 -31.255 19.067) 41.434 55.872 ( 26.597 -11.227 -1.685) 28.919 70.633 ( 2.489 0.421 9.704) 10.027 71.871 ( -3.997 -36.968 -16.655) 40.743 74.162 ( -2.935 12.890 8.992) 15.988 75.756 ( 6.884 37.300 -35.368) 51.861 ======================= Grid point 155 (78/150) ======================= q-point: (-0.12 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( -3.201 11.175 11.998) 16.705 1.337 ( 2.647 12.334 10.091) 16.155 1.795 ( 3.198 13.786 4.173) 14.755 2.163 ( -4.476 1.884 -7.958) 9.323 2.478 ( -6.648 10.824 7.470) 14.736 2.550 ( 4.928 -1.676 4.490) 6.874 2.823 ( 6.510 9.919 3.948) 12.504 3.214 ( 2.929 -4.292 6.398) 8.242 3.383 ( 6.628 4.968 -3.168) 8.868 3.519 ( 13.413 -11.327 -3.640) 17.929 3.828 ( -0.929 9.808 2.334) 10.124 3.910 ( -5.619 4.290 -0.759) 7.110 4.101 ( -0.940 2.857 -0.948) 3.153 4.356 ( -2.205 0.943 -0.585) 2.469 4.575 ( 1.738 -2.706 1.192) 3.430 4.862 ( 1.872 -2.383 0.094) 3.032 5.440 ( -1.546 -3.928 2.481) 4.896 5.517 ( 1.948 -0.357 1.551) 2.515 5.708 ( -3.706 -0.226 -1.225) 3.910 5.860 ( -0.740 -4.744 -5.695) 7.449 6.532 ( -0.839 10.341 1.541) 10.489 6.644 ( 1.154 11.025 1.401) 11.174 6.889 ( -0.582 -11.134 8.293) 13.895 7.123 ( -0.863 -7.393 3.361) 8.167 7.336 ( -4.556 -4.890 1.752) 6.909 7.601 ( 1.490 0.627 -0.195) 1.629 7.843 ( 0.006 -10.777 -2.816) 11.138 8.283 ( -0.791 -1.304 -8.403) 8.540 10.302 ( 3.820 13.018 -1.808) 13.687 10.692 ( -1.301 -3.729 -14.216) 14.754 11.513 ( -3.412 -7.429 5.056) 9.612 11.840 ( -1.006 -5.662 -4.888) 7.548 14.444 ( -1.203 1.396 1.364) 2.293 15.078 ( -4.428 20.232 -1.200) 20.746 15.307 ( -2.408 -21.124 -1.968) 21.352 15.672 ( 2.111 10.116 -9.383) 13.958 27.163 ( 0.271 1.594 0.949) 1.875 27.246 ( -0.198 -1.649 -0.824) 1.854 27.640 ( -0.437 0.097 0.351) 0.569 27.668 ( 0.219 0.409 0.097) 0.474 27.815 ( 0.528 1.819 1.738) 2.571 27.957 ( -0.964 -3.552 -2.097) 4.236 31.566 ( 1.801 1.430 7.504) 7.848 31.789 ( -3.031 -5.304 2.295) 6.526 32.302 ( -2.020 1.611 -3.257) 4.158 32.545 ( 2.076 -0.039 -3.465) 4.040 35.194 ( 0.884 -0.342 2.164) 2.362 35.234 ( -1.190 -0.645 0.064) 1.355 36.164 ( -0.284 2.220 0.296) 2.257 36.204 ( 0.486 -1.795 -0.063) 1.861 44.262 ( 0.800 7.404 -0.420) 7.459 44.354 ( 3.061 5.634 -0.014) 6.412 44.604 ( -3.057 -3.797 1.548) 5.114 45.026 ( 1.376 -8.229 -3.090) 8.897 46.620 ( -0.123 -4.047 5.289) 6.661 46.989 ( -3.434 -1.753 -0.648) 3.909 47.437 ( 4.151 2.017 -0.697) 4.667 47.493 ( -3.057 3.354 -1.644) 4.827 51.433 ( -3.710 14.385 -0.591) 14.867 52.404 ( 0.579 28.508 -17.282) 33.342 55.466 ( -20.843 -64.889 7.042) 68.517 56.599 ( 3.493 -51.389 12.574) 53.020 70.533 ( 2.449 21.580 11.394) 24.526 72.086 ( -13.504 -6.756 -29.671) 33.292 74.060 ( 1.583 -1.435 4.581) 5.055 75.052 ( -12.109 41.116 -24.736) 49.487 ======================= Grid point 159 (79/150) ======================= q-point: ( 0.38 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( 5.076 0.000 10.385) 11.559 2.017 ( -1.163 -0.000 7.047) 7.143 2.098 ( 0.200 0.000 0.936) 0.957 2.411 ( 2.382 0.000 3.886) 4.558 2.772 ( 5.707 0.000 -2.684) 6.306 2.933 ( -2.724 -0.000 10.400) 10.751 3.000 ( -2.601 -0.000 -4.272) 5.002 3.172 ( 11.811 0.000 -10.192) 15.601 3.355 ( 2.628 0.000 -1.610) 3.082 3.448 ( 4.065 0.000 -3.065) 5.091 3.708 ( -7.357 -0.000 6.406) 9.756 3.849 ( 2.524 0.000 -4.812) 5.433 4.338 ( 2.702 0.000 2.877) 3.947 4.670 ( 2.712 0.000 -5.582) 6.206 4.842 ( 4.173 0.000 2.758) 5.002 4.979 ( -0.718 -0.000 -5.476) 5.523 4.993 ( -9.183 -0.000 1.672) 9.334 5.563 ( -6.036 -0.000 -7.798) 9.861 5.606 ( 3.065 0.000 -0.820) 3.172 5.756 ( 2.504 0.000 -2.620) 3.624 6.334 ( -3.185 -0.000 1.511) 3.525 6.340 ( -3.231 -0.000 4.389) 5.450 7.282 ( 0.554 0.000 7.990) 8.009 7.351 ( -0.196 -0.000 3.003) 3.009 7.433 ( 1.864 0.000 -0.403) 1.907 7.546 ( 1.231 0.000 0.488) 1.324 7.596 ( -6.345 -0.000 0.098) 6.346 8.341 ( 0.540 0.000 -7.278) 7.298 9.982 ( 0.216 0.000 5.349) 5.354 10.465 ( -0.389 -0.000 -7.797) 7.806 11.291 ( -2.565 -0.000 7.878) 8.285 11.616 ( -1.477 -0.000 -4.110) 4.367 13.082 ( -3.534 -0.000 7.003) 7.844 14.149 ( -3.099 -0.000 -8.253) 8.815 16.160 ( 3.513 0.000 2.320) 4.210 16.319 ( 8.967 0.000 -1.802) 9.146 27.189 ( 0.360 0.000 1.494) 1.537 27.293 ( 0.380 0.000 -1.446) 1.495 27.629 ( -0.015 -0.000 -0.419) 0.419 27.636 ( 0.014 0.000 -0.587) 0.587 27.773 ( -0.778 -0.000 3.055) 3.152 27.948 ( -0.355 -0.000 -2.031) 2.062 31.576 ( -2.840 -0.000 5.938) 6.582 31.891 ( 0.483 0.000 -5.831) 5.851 31.923 ( 0.652 0.000 8.080) 8.106 32.688 ( 0.393 0.000 -3.863) 3.883 35.192 ( -0.143 -0.000 -0.197) 0.243 35.267 ( -0.739 -0.000 1.018) 1.258 36.079 ( -0.256 -0.000 1.944) 1.961 36.286 ( 0.460 0.000 -1.477) 1.547 44.342 ( 1.908 0.000 1.745) 2.586 44.456 ( 5.009 0.000 -3.185) 5.936 44.702 ( -0.572 -0.000 1.565) 1.667 45.055 ( -5.155 -0.000 -1.198) 5.292 46.307 ( -4.541 -0.000 2.874) 5.373 46.474 ( -6.079 -0.000 -2.718) 6.659 47.234 ( 4.339 0.000 4.401) 6.181 48.054 ( 1.391 0.000 -3.447) 3.717 50.220 ( -7.618 -0.000 11.480) 13.777 51.071 ( 0.363 0.000 -19.748) 19.751 56.053 ( -18.632 -0.000 37.620) 41.982 56.211 ( 1.980 0.000 -7.286) 7.551 69.986 ( 0.401 0.000 -1.537) 1.588 70.097 ( 5.423 0.000 -1.792) 5.711 74.835 ( 4.954 0.000 12.264) 13.227 76.262 ( 28.268 0.000 -16.327) 32.644 ======================= Grid point 160 (80/150) ======================= q-point: (-0.50 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( 1.332 3.890 9.521) 10.371 1.927 ( -4.532 5.700 5.000) 8.834 2.056 ( -2.521 2.431 -0.123) 3.504 2.397 ( 3.353 7.325 2.506) 8.437 2.815 ( -1.226 1.450 0.607) 1.994 2.900 ( 1.060 -1.211 1.814) 2.425 3.028 ( -1.336 -6.015 -4.487) 7.623 3.248 ( 3.748 2.470 -5.078) 6.778 3.401 ( 4.809 7.917 -1.824) 9.440 3.445 ( 1.103 3.170 -0.539) 3.399 3.712 ( -2.375 -7.944 3.414) 8.967 3.887 ( 0.600 -2.755 -4.655) 5.442 4.364 ( 0.712 0.340 4.105) 4.180 4.606 ( -0.241 8.266 -2.455) 8.626 4.884 ( -0.350 3.188 -2.928) 4.342 4.933 ( -0.288 3.511 -3.266) 4.804 4.970 ( -1.404 -9.871 3.785) 10.665 5.459 ( -1.572 1.993 -6.030) 6.542 5.696 ( 2.530 -3.985 -3.030) 5.609 5.776 ( 1.414 0.891 -3.508) 3.886 6.273 ( -2.216 -1.775 3.200) 4.278 6.354 ( -5.599 -6.804 4.373) 9.838 7.232 ( -0.698 7.438 8.219) 11.107 7.344 ( -3.441 -0.598 2.266) 4.164 7.408 ( 0.825 5.384 0.358) 5.458 7.533 ( -1.220 -0.284 2.997) 3.248 7.603 ( 3.416 -1.611 -1.836) 4.199 8.322 ( 2.188 2.999 -7.295) 8.185 10.039 ( 0.111 -6.203 2.722) 6.774 10.502 ( 0.481 -5.931 -9.331) 11.067 11.291 ( -2.597 -3.128 7.363) 8.411 11.587 ( 0.986 1.778 -1.745) 2.679 13.169 ( -1.035 -14.273 8.198) 16.492 14.168 ( -2.677 -10.414 -8.435) 13.666 16.139 ( 1.448 8.477 2.707) 9.016 16.397 ( 6.056 4.518 -4.078) 8.586 27.195 ( 0.033 -0.194 1.290) 1.305 27.285 ( 0.410 1.643 -1.019) 1.976 27.616 ( -0.054 0.400 -0.231) 0.466 27.661 ( -0.055 -2.063 -0.943) 2.269 27.772 ( -0.768 -1.050 2.536) 2.851 27.934 ( 0.230 1.320 -1.621) 2.103 31.549 ( -3.271 -1.631 4.588) 5.866 31.827 ( 1.666 6.054 1.529) 6.463 32.028 ( 1.315 -6.636 2.532) 7.224 32.675 ( -0.170 1.185 -4.242) 4.408 35.189 ( 0.039 0.335 0.057) 0.342 35.253 ( -1.298 -0.097 0.403) 1.362 36.086 ( 0.039 -0.804 1.980) 2.137 36.283 ( 0.296 0.798 -1.496) 1.722 44.378 ( 1.828 -0.717 1.057) 2.230 44.533 ( 3.812 -1.647 -3.298) 5.303 44.677 ( -1.214 1.709 2.273) 3.092 44.936 ( -4.395 5.549 -0.757) 7.120 46.269 ( -2.814 -2.687 2.211) 4.475 46.470 ( -3.863 -9.600 -2.637) 10.678 47.298 ( 4.250 1.214 5.187) 6.815 48.027 ( -1.465 2.709 -4.974) 5.851 50.206 ( -4.548 -11.152 9.804) 15.530 51.281 ( -1.095 -30.246 -19.078) 35.777 55.766 ( -16.495 10.786 28.224) 34.424 56.146 ( 10.148 17.628 -4.000) 20.730 70.059 ( 1.620 -9.524 -0.063) 9.661 70.325 ( 0.637 -22.296 -3.246) 22.540 74.848 ( 2.662 9.194 14.087) 17.031 76.526 ( 17.884 8.133 -20.747) 28.573 ======================= Grid point 161 (81/150) ======================= q-point: (-0.38 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -4.374 10.501 4.347) 12.178 1.834 ( -1.522 5.996 8.296) 10.348 1.993 ( -0.520 -0.229 0.497) 0.755 2.323 ( 2.018 8.483 0.305) 8.725 2.721 ( -7.319 3.060 -0.600) 7.955 2.957 ( -1.292 -4.645 2.707) 5.529 3.106 ( 2.487 -4.008 -4.485) 6.509 3.194 ( 3.220 11.246 -1.921) 11.855 3.275 ( -1.128 10.312 -0.764) 10.401 3.432 ( 3.123 1.343 -1.587) 3.752 3.799 ( -1.282 -6.376 1.941) 6.787 3.918 ( -2.237 -3.726 -3.571) 5.625 4.357 ( -1.270 1.466 4.035) 4.477 4.495 ( 0.430 5.998 0.048) 6.014 4.799 ( -5.288 5.835 -3.127) 8.473 4.863 ( 4.666 4.597 -3.341) 7.353 5.125 ( 0.289 -9.913 4.215) 10.776 5.447 ( 1.860 -0.289 -3.512) 3.984 5.727 ( -0.698 1.068 -2.536) 2.839 5.795 ( 1.560 -0.995 -5.096) 5.421 6.333 ( -0.541 -7.277 4.578) 8.615 6.414 ( -5.084 -13.729 3.389) 15.027 7.088 ( -1.657 10.924 7.424) 13.312 7.256 ( -3.110 5.513 1.167) 6.436 7.354 ( 1.708 4.632 1.868) 5.279 7.552 ( 0.794 -1.510 2.614) 3.121 7.667 ( 3.163 0.002 -0.843) 3.274 8.314 ( 3.383 2.514 -7.810) 8.875 10.166 ( -0.313 -11.301 -1.649) 11.425 10.581 ( 0.637 -4.591 -12.400) 13.238 11.318 ( -1.426 -3.637 7.581) 8.529 11.607 ( 2.980 -0.216 0.945) 3.134 13.465 ( 1.239 -23.893 9.148) 25.614 14.338 ( -2.092 -19.203 -7.998) 20.907 15.974 ( -0.856 15.299 2.916) 15.598 16.351 ( 1.634 9.293 -6.793) 11.627 27.200 ( -0.274 -0.505 0.895) 1.064 27.258 ( 0.414 2.585 -0.440) 2.654 27.618 ( -0.015 -0.618 0.133) 0.632 27.679 ( -0.279 -0.756 -0.502) 0.949 27.792 ( -0.768 -3.083 0.954) 3.317 27.914 ( 0.768 2.195 -1.046) 2.550 31.538 ( -3.078 -2.737 3.677) 5.522 31.781 ( 2.127 4.934 4.022) 6.711 32.147 ( 1.596 -6.173 1.124) 6.475 32.638 ( -0.574 2.161 -4.646) 5.156 35.186 ( 0.332 0.388 0.646) 0.823 35.234 ( -1.572 -0.307 0.060) 1.602 36.109 ( 0.284 -1.535 1.666) 2.284 36.267 ( 0.050 1.578 -1.344) 2.073 44.419 ( 1.062 -1.627 0.346) 1.973 44.573 ( 0.575 2.139 -2.241) 3.150 44.643 ( -0.040 1.928 1.248) 2.297 44.797 ( -1.920 4.268 -0.080) 4.681 46.316 ( -0.353 -6.467 2.977) 7.128 46.596 ( -2.190 -13.782 -3.428) 14.370 47.345 ( 4.083 1.892 6.079) 7.564 47.923 ( -3.556 5.158 -5.660) 8.443 50.472 ( 1.093 -27.187 11.146) 29.404 51.775 ( -3.318 -44.717 -22.313) 50.085 55.282 ( -19.636 23.082 20.479) 36.575 56.081 ( 15.991 17.265 -0.583) 23.540 70.287 ( 2.042 -16.628 2.999) 17.019 70.725 ( -2.360 -35.179 -5.965) 35.759 74.687 ( -0.911 17.579 13.970) 22.472 76.492 ( 3.347 15.051 -25.350) 29.670 ======================= Grid point 162 (82/150) ======================= q-point: (-0.25 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( -3.582 10.732 6.248) 12.925 1.666 ( -4.318 10.323 7.133) 13.270 2.066 ( 5.650 -0.525 3.422) 6.627 2.226 ( -1.574 4.408 -4.832) 6.727 2.486 ( -13.485 6.009 1.672) 14.857 2.862 ( -7.040 8.281 -0.724) 10.893 3.130 ( 6.697 9.671 0.177) 11.765 3.176 ( 4.449 0.343 3.393) 5.606 3.243 ( 4.540 -6.726 -2.576) 8.514 3.482 ( 6.004 1.706 -2.644) 6.778 3.855 ( -1.419 -2.632 2.597) 3.960 3.910 ( -5.621 -4.739 -3.043) 7.957 4.295 ( -1.441 4.724 2.681) 5.620 4.434 ( 0.227 4.538 1.241) 4.710 4.615 ( -4.808 5.945 -3.883) 8.575 4.884 ( 4.817 2.854 -0.575) 5.628 5.263 ( -0.340 -8.050 3.742) 8.884 5.492 ( 3.359 -0.485 -1.430) 3.683 5.697 ( -2.431 -0.788 -1.320) 2.877 5.791 ( -0.152 1.022 -4.766) 4.877 6.470 ( -0.638 -12.129 5.108) 13.176 6.599 ( -1.523 -15.931 2.037) 16.132 6.907 ( -1.611 11.326 5.466) 12.678 7.110 ( -1.615 9.735 2.932) 10.295 7.329 ( 1.907 2.939 0.370) 3.523 7.602 ( 2.580 -1.732 -0.029) 3.107 7.695 ( 1.443 0.559 1.444) 2.117 8.307 ( 1.375 2.699 -8.048) 8.599 10.345 ( -0.892 -15.124 -6.634) 16.539 10.593 ( 1.938 3.186 -11.443) 12.035 11.378 ( -0.688 -4.568 6.420) 7.909 11.670 ( 2.769 -1.955 1.316) 3.636 13.900 ( 4.032 -27.649 8.832) 29.304 14.617 ( -1.704 -24.043 -6.901) 25.071 15.691 ( -2.573 20.165 2.405) 20.470 16.146 ( -4.341 14.624 -8.649) 17.535 27.204 ( -0.589 -0.665 0.390) 0.971 27.228 ( 0.599 2.342 0.116) 2.420 27.630 ( -0.021 -0.824 0.413) 0.922 27.676 ( -0.298 0.158 0.079) 0.346 27.832 ( -0.977 -3.713 -0.555) 3.879 27.893 ( 0.954 2.205 -0.385) 2.433 31.547 ( -2.313 -3.342 3.549) 5.395 31.756 ( 1.679 3.553 5.293) 6.593 32.249 ( 1.177 -4.472 -0.284) 4.633 32.587 ( -0.537 2.302 -4.799) 5.350 35.192 ( 0.710 0.096 1.431) 1.601 35.216 ( -1.560 -0.532 -0.046) 1.649 36.143 ( 0.445 -2.015 1.125) 2.350 36.236 ( -0.243 2.209 -1.054) 2.460 44.453 ( -1.030 -1.792 -0.286) 2.086 44.509 ( 2.007 6.434 -1.457) 6.896 44.566 ( -0.842 6.208 1.395) 6.419 44.810 ( -0.115 -5.516 -0.707) 5.563 46.440 ( 1.923 -7.465 4.272) 8.814 46.760 ( -2.145 -12.864 -3.958) 13.629 47.397 ( 4.612 0.724 6.501) 8.004 47.756 ( -4.840 7.850 -5.706) 10.844 51.025 ( 8.458 -33.562 13.730) 37.235 52.325 ( -4.939 -40.600 -28.575) 49.893 54.653 ( -22.673 17.330 16.859) 33.145 56.109 ( 10.782 8.401 2.583) 13.911 70.573 ( 2.894 -15.079 6.313) 16.602 71.225 ( -3.035 -39.480 -9.500) 40.720 74.383 ( -3.627 20.241 10.982) 23.312 76.079 ( -15.009 25.344 -26.677) 39.740 ======================= Grid point 163 (83/150) ======================= q-point: (-0.12 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.262 ( -4.410 12.378 9.626) 16.289 1.509 ( -0.077 6.007 8.165) 10.137 2.053 ( -6.876 9.288 -1.680) 11.678 2.091 ( 1.593 5.914 4.276) 7.469 2.342 ( -4.802 -6.566 -3.196) 8.740 2.683 ( 0.663 5.999 -1.188) 6.151 3.078 ( 4.482 9.158 6.020) 11.840 3.274 ( 5.194 -1.272 7.778) 9.439 3.501 ( 9.212 -13.732 -5.258) 17.352 3.540 ( 6.950 3.203 -3.969) 8.621 3.782 ( -8.250 0.263 -4.352) 9.332 3.909 ( -3.180 -0.491 1.942) 3.759 4.176 ( 0.220 8.945 0.188) 8.950 4.368 ( -1.135 2.872 2.277) 3.836 4.540 ( -1.046 -2.406 -2.980) 3.970 4.908 ( 2.543 2.059 2.477) 4.104 5.357 ( -0.461 -5.322 1.854) 5.655 5.551 ( 3.375 -0.259 0.236) 3.393 5.640 ( -5.051 0.798 0.653) 5.155 5.797 ( 0.851 -2.158 -5.043) 5.551 6.660 ( 0.329 -8.257 2.128) 8.533 6.677 ( -2.336 4.330 7.148) 8.677 6.828 ( 0.658 -2.411 2.349) 3.430 6.971 ( -2.130 1.593 4.178) 4.953 7.325 ( 2.228 1.994 -1.330) 3.273 7.654 ( 2.643 2.135 -0.998) 3.541 7.734 ( 1.078 -5.120 0.475) 5.254 8.246 ( -2.833 2.240 -7.073) 7.942 10.487 ( -3.289 -1.924 -12.554) 13.120 10.567 ( 5.826 -1.292 -6.112) 8.542 11.422 ( -0.851 -1.806 5.397) 5.754 11.740 ( -0.524 -4.366 -0.348) 4.412 14.337 ( 4.375 -17.100 4.426) 18.198 14.936 ( -1.805 -24.343 -3.798) 24.704 15.338 ( -3.071 22.374 0.263) 22.585 15.804 ( -7.515 14.585 -6.172) 17.530 27.192 ( 0.023 1.394 0.488) 1.477 27.223 ( 0.044 -0.674 -0.026) 0.676 27.637 ( -0.144 -0.076 0.392) 0.424 27.672 ( -0.043 -0.058 0.300) 0.308 27.852 ( 0.162 0.605 0.053) 0.629 27.890 ( -0.606 -1.937 -0.977) 2.252 31.576 ( -1.255 -3.616 4.113) 5.618 31.740 ( 0.401 2.238 5.529) 5.978 32.291 ( -0.295 -0.036 -2.134) 2.154 32.558 ( 0.491 0.039 -4.096) 4.126 35.202 ( -1.220 -0.578 -0.025) 1.350 35.210 ( 0.891 -0.437 2.138) 2.357 36.182 ( 0.548 -2.073 0.499) 2.201 36.194 ( -0.528 2.430 -0.635) 2.566 44.390 ( 0.910 6.509 -1.284) 6.696 44.477 ( -0.344 5.123 1.417) 5.326 44.523 ( 2.043 -1.502 -0.844) 2.673 44.897 ( -1.833 -8.234 -0.813) 8.475 46.576 ( 2.281 -4.719 4.687) 7.031 46.864 ( -2.964 -7.520 -1.631) 8.246 47.492 ( 1.421 -0.717 1.950) 2.517 47.545 ( -1.179 7.916 -2.674) 8.438 51.537 ( 8.208 -4.738 10.737) 14.321 52.570 ( -1.698 -7.042 -24.648) 25.690 54.403 ( -20.910 -32.223 6.964) 39.039 56.145 ( -6.458 -7.415 12.140) 15.623 70.751 ( 1.938 0.302 6.784) 7.062 71.656 ( -4.344 -24.835 -12.431) 28.110 74.131 ( 0.372 7.653 5.238) 9.281 75.269 ( -25.335 34.030 -17.138) 45.756 ======================= Grid point 168 (84/150) ======================= q-point: (-0.50 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -8.619 -0.000 4.147) 9.565 1.875 ( 0.250 0.000 11.529) 11.532 2.028 ( -2.828 -0.000 -0.507) 2.873 2.468 ( -1.012 -0.000 1.514) 1.821 2.827 ( -1.752 -0.000 -4.264) 4.610 2.865 ( -3.779 -0.000 8.365) 9.179 2.949 ( 1.419 -0.000 -7.693) 7.822 3.294 ( 1.555 -0.000 -2.667) 3.087 3.513 ( -0.764 -0.000 0.423) 0.873 3.565 ( 2.800 -0.000 -2.880) 4.017 3.589 ( 0.301 -0.000 -0.028) 0.302 3.860 ( -0.412 -0.000 -4.871) 4.888 4.377 ( -0.195 -0.000 5.120) 5.123 4.707 ( 0.799 -0.000 -3.664) 3.750 4.736 ( -7.124 0.000 1.938) 7.383 4.946 ( -0.043 -0.000 -3.778) 3.778 4.992 ( 3.953 -0.000 0.889) 4.051 5.447 ( 0.581 -0.000 -8.635) 8.654 5.722 ( 4.623 -0.000 -1.911) 5.003 5.803 ( 1.209 -0.000 -4.172) 4.343 6.201 ( -6.321 0.000 5.162) 8.161 6.238 ( -2.929 -0.000 3.497) 4.561 7.268 ( -4.170 -0.000 0.434) 4.192 7.309 ( -0.435 -0.000 10.132) 10.142 7.452 ( 0.076 -0.000 0.210) 0.223 7.547 ( 2.057 -0.000 2.045) 2.900 7.645 ( 4.319 -0.000 -0.620) 4.363 8.362 ( 1.955 -0.000 -7.503) 7.754 10.011 ( 0.900 -0.000 4.192) 4.288 10.463 ( 1.878 -0.000 -7.489) 7.721 11.240 ( -1.959 -0.000 6.361) 6.655 11.627 ( 2.908 -0.000 -2.165) 3.626 13.086 ( 1.829 -0.000 9.543) 9.717 14.040 ( -2.290 -0.000 -9.856) 10.119 16.212 ( -0.696 -0.000 2.437) 2.535 16.473 ( 0.744 -0.000 -3.594) 3.670 27.194 ( -0.328 -0.000 1.288) 1.329 27.305 ( 0.670 -0.000 -1.094) 1.283 27.626 ( -0.158 -0.000 -0.617) 0.637 27.630 ( -0.296 -0.000 -0.742) 0.799 27.757 ( -0.809 -0.000 2.680) 2.799 27.949 ( 0.731 -0.000 -1.533) 1.699 31.493 ( -3.331 -0.000 4.128) 5.304 31.927 ( 2.819 -0.000 -4.371) 5.201 31.986 ( 1.470 -0.000 9.443) 9.556 32.670 ( -0.742 -0.000 -4.624) 4.683 35.193 ( 0.215 -0.000 0.162) 0.269 35.229 ( -1.701 -0.000 -0.019) 1.702 36.085 ( 0.176 -0.000 2.264) 2.271 36.290 ( 0.118 -0.000 -1.657) 1.661 44.388 ( -0.167 -0.000 0.730) 0.749 44.567 ( 2.770 -0.000 -3.412) 4.395 44.683 ( -0.021 -0.000 3.062) 3.062 44.915 ( -3.590 -0.000 -0.981) 3.722 46.221 ( -1.565 -0.000 1.810) 2.393 46.355 ( -0.881 -0.000 -2.129) 2.305 47.374 ( 3.550 -0.000 6.151) 7.102 47.994 ( -3.963 -0.000 -6.756) 7.832 50.067 ( -3.860 -0.000 8.803) 9.612 51.049 ( 2.025 -0.000 -17.382) 17.500 55.618 ( -18.776 -0.000 23.466) 30.054 56.430 ( 11.805 -0.000 0.560) 11.818 70.006 ( 1.076 -0.000 -0.150) 1.087 70.160 ( -0.892 -0.000 -3.472) 3.584 74.964 ( 0.253 -0.000 15.100) 15.102 76.700 ( 2.051 -0.000 -21.244) 21.343 ======================= Grid point 170 (85/150) ======================= q-point: (-0.38 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( -8.898 4.107 6.061) 11.523 1.881 ( -2.445 2.652 10.034) 10.662 1.988 ( 0.942 -0.126 0.746) 1.208 2.389 ( -5.061 4.596 0.577) 6.861 2.701 ( -5.244 6.980 -1.184) 8.810 2.854 ( -4.395 -3.951 1.293) 6.050 3.029 ( 1.527 -7.331 -4.314) 8.642 3.285 ( -2.668 0.477 -1.317) 3.013 3.386 ( -3.001 9.021 -0.693) 9.532 3.549 ( 4.095 3.438 -2.645) 5.966 3.670 ( -2.028 -7.019 -1.040) 7.380 3.853 ( -0.954 -0.675 -2.419) 2.687 4.368 ( -0.967 1.300 4.463) 4.748 4.581 ( -1.215 5.484 0.842) 5.680 4.742 ( -4.698 -0.872 -3.916) 6.178 4.945 ( 2.365 1.021 -3.582) 4.412 5.065 ( 3.166 -3.152 2.778) 5.261 5.476 ( 3.967 -0.914 -6.741) 7.875 5.749 ( -0.107 3.716 -3.042) 4.804 5.818 ( 2.624 -0.408 -4.148) 4.926 6.171 ( -5.774 -7.359 4.520) 10.389 6.249 ( 0.033 -5.265 4.828) 7.143 7.179 ( -2.787 4.800 1.629) 5.784 7.288 ( -1.270 3.453 8.488) 9.251 7.439 ( 0.901 2.272 -0.407) 2.477 7.586 ( 4.006 1.084 2.242) 4.717 7.714 ( 3.594 -0.214 0.154) 3.604 8.376 ( 2.542 0.800 -7.840) 8.281 10.052 ( 0.236 -3.160 2.178) 3.846 10.521 ( 2.727 -4.130 -8.569) 9.895 11.262 ( -0.494 -4.177 6.063) 7.379 11.672 ( 4.536 1.193 -0.611) 4.730 13.243 ( 3.747 -13.563 10.052) 17.292 14.073 ( -1.693 -10.822 -10.347) 15.068 16.126 ( -2.662 8.517 2.357) 9.229 16.411 ( -4.608 3.979 -3.652) 7.100 27.190 ( -0.611 -0.215 1.105) 1.280 27.300 ( 0.691 1.884 -0.861) 2.184 27.613 ( -0.084 0.074 -0.102) 0.152 27.649 ( -0.444 -2.075 -1.081) 2.382 27.754 ( -0.825 -0.891 2.268) 2.572 27.952 ( 1.143 1.238 -1.321) 2.141 31.462 ( -3.066 -1.717 3.752) 5.141 31.904 ( 2.896 5.768 2.290) 6.849 32.090 ( 2.062 -5.925 3.407) 7.139 32.640 ( -1.214 1.030 -5.039) 5.285 35.196 ( 0.220 0.186 0.543) 0.615 35.205 ( -1.486 -0.260 -0.038) 1.509 36.098 ( 0.253 -0.862 2.108) 2.291 36.281 ( -0.138 0.837 -1.640) 1.846 44.378 ( -2.584 -1.602 0.590) 3.097 44.599 ( 1.358 -0.522 -3.532) 3.820 44.690 ( 2.084 1.670 2.913) 3.952 44.832 ( -2.287 4.632 -0.750) 5.220 46.246 ( 0.835 -4.677 2.360) 5.305 46.418 ( 0.995 -7.610 -2.174) 7.977 47.426 ( 2.850 0.699 7.168) 7.745 47.898 ( -5.106 2.033 -7.312) 9.147 50.172 ( 0.578 -18.016 8.906) 20.105 51.230 ( 1.515 -22.774 -17.400) 28.700 55.250 ( -22.630 12.575 19.411) 32.358 56.532 ( 14.017 12.821 4.716) 19.573 70.105 ( 0.828 -10.971 0.717) 11.026 70.271 ( -2.880 -20.382 -3.995) 20.968 74.889 ( -3.111 10.570 14.185) 17.962 76.533 ( -13.197 7.179 -20.930) 25.764 ======================= Grid point 171 (86/150) ======================= q-point: (-0.25 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( -6.351 4.599 9.115) 12.024 1.722 ( -7.302 8.301 7.629) 13.432 2.094 ( 2.660 -5.251 5.558) 8.096 2.200 ( -8.056 5.403 -3.546) 10.328 2.460 ( -7.142 11.214 1.124) 13.343 2.831 ( -4.551 -0.920 -4.294) 6.325 3.170 ( 1.424 -9.582 -2.638) 10.040 3.224 ( -3.811 -1.609 3.199) 5.229 3.245 ( -0.027 5.000 -0.537) 5.029 3.593 ( 4.930 0.821 -3.295) 5.986 3.736 ( -2.384 -7.056 -1.598) 7.618 3.821 ( -2.448 1.573 0.201) 2.917 4.329 ( -1.159 1.751 2.957) 3.627 4.517 ( 0.555 3.821 1.383) 4.101 4.604 ( -5.723 6.523 -5.929) 10.510 4.963 ( 2.006 1.331 -0.808) 2.539 5.184 ( 2.807 -5.625 3.133) 7.024 5.559 ( 5.627 -0.587 -3.743) 6.784 5.669 ( -1.899 3.058 -1.681) 3.973 5.816 ( -0.198 2.136 -3.274) 3.914 6.256 ( -2.637 -12.393 2.305) 12.878 6.406 ( 2.168 -11.721 4.952) 12.908 7.049 ( -1.510 9.250 3.213) 9.908 7.205 ( -1.710 6.057 6.328) 8.925 7.419 ( 2.076 3.313 -1.146) 4.074 7.649 ( 5.599 0.615 1.074) 5.734 7.745 ( 1.965 1.898 1.020) 2.916 8.372 ( 1.625 4.030 -7.430) 8.607 10.120 ( -2.114 -8.935 -2.661) 9.559 10.618 ( 3.796 -3.527 -9.858) 11.137 11.347 ( 2.283 -3.719 6.012) 7.429 11.722 ( 3.966 1.452 0.556) 4.260 13.614 ( 6.675 -24.466 9.229) 26.987 14.261 ( -1.089 -19.570 -9.385) 21.731 15.907 ( -3.707 15.107 2.033) 15.687 16.200 ( -9.859 9.560 -3.491) 14.169 27.186 ( -0.763 -0.518 0.812) 1.228 27.274 ( 0.618 2.639 -0.432) 2.744 27.619 ( 0.150 -0.726 0.326) 0.810 27.665 ( -0.430 -1.095 -0.744) 1.392 27.767 ( -0.994 -2.505 1.120) 2.919 27.944 ( 1.299 2.221 -0.971) 2.750 31.461 ( -2.591 -3.226 3.546) 5.449 31.869 ( 2.619 5.594 4.912) 7.892 32.206 ( 2.129 -4.945 0.829) 5.448 32.592 ( -1.449 1.513 -5.278) 5.679 35.184 ( -1.425 -0.439 0.198) 1.504 35.207 ( 0.710 -0.007 1.115) 1.322 36.124 ( 0.285 -1.634 1.617) 2.317 36.257 ( -0.404 1.626 -1.470) 2.229 44.364 ( -3.776 -3.135 0.538) 4.937 44.605 ( 1.268 1.790 -3.287) 3.952 44.693 ( 3.000 6.056 -0.234) 6.762 44.743 ( -1.847 0.560 1.748) 2.604 46.386 ( 4.199 -7.937 3.841) 9.766 46.563 ( 0.475 -10.334 -2.759) 10.707 47.468 ( 2.508 0.273 7.577) 7.986 47.763 ( -4.910 4.599 -6.892) 9.630 50.676 ( 10.747 -38.342 11.790) 41.529 51.642 ( -1.043 -35.318 -21.063) 41.135 54.637 ( -25.316 23.739 15.614) 38.055 56.494 ( 10.466 20.512 8.919) 24.695 70.329 ( -1.539 -19.970 1.027) 20.056 70.661 ( 1.813 -34.757 -3.672) 34.998 74.618 ( -5.892 18.710 11.043) 22.510 76.030 ( -25.880 16.958 -18.008) 35.799 ======================= Grid point 172 (87/150) ======================= q-point: (-0.12 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( -5.043 9.438 10.304) 14.855 1.527 ( -6.531 1.513 9.964) 12.009 1.908 ( -14.256 3.588 2.340) 14.885 2.186 ( -4.212 -0.221 -4.596) 6.238 2.351 ( 9.887 3.728 3.543) 11.144 2.725 ( -3.894 3.591 -6.440) 8.339 3.191 ( -2.151 0.590 6.264) 6.650 3.262 ( -0.470 -6.058 7.606) 9.735 3.390 ( 3.845 -14.396 -5.945) 16.043 3.618 ( -3.560 -0.743 -3.866) 5.308 3.718 ( 2.334 4.818 -4.781) 7.178 3.818 ( -2.809 -4.797 0.946) 5.639 4.306 ( 1.143 3.270 3.056) 4.619 4.403 ( -2.977 6.602 -5.032) 8.819 4.486 ( -1.432 0.689 -0.083) 1.591 4.960 ( 0.213 1.508 2.712) 3.111 5.301 ( 2.364 -4.205 1.686) 5.110 5.591 ( -3.528 2.062 1.267) 4.278 5.627 ( 4.309 2.329 -1.217) 5.047 5.801 ( 1.978 -0.533 -4.127) 4.607 6.433 ( -1.464 -15.026 2.709) 15.338 6.623 ( 1.292 -11.450 4.080) 12.224 6.888 ( -0.216 10.180 3.609) 10.803 7.084 ( -1.292 8.721 5.554) 10.420 7.406 ( 2.850 3.218 -2.233) 4.844 7.724 ( 0.547 1.344 2.793) 3.148 7.743 ( 6.296 1.606 -2.667) 7.024 8.262 ( -2.907 7.832 -5.917) 10.237 10.246 ( -2.732 -13.859 -8.664) 16.571 10.691 ( 4.922 1.000 -8.476) 9.853 11.434 ( 3.274 -0.647 5.157) 6.143 11.732 ( 1.079 2.820 0.514) 3.062 14.146 ( 10.817 -25.542 4.973) 28.180 14.555 ( -0.600 -24.087 -6.001) 24.830 15.598 ( -3.634 19.718 0.634) 20.061 15.845 ( -12.529 13.116 -1.541) 18.204 27.185 ( -0.702 -0.805 0.498) 1.179 27.246 ( 0.517 2.244 0.012) 2.302 27.634 ( 0.258 -0.522 0.397) 0.705 27.668 ( -0.234 -0.292 -0.002) 0.375 27.797 ( -1.061 -3.529 -0.121) 3.687 27.924 ( 1.143 2.852 -0.515) 3.115 31.487 ( -2.014 -4.444 3.400) 5.947 31.832 ( 1.771 5.436 6.347) 8.542 32.286 ( 1.555 -1.606 -1.302) 2.587 32.549 ( -1.010 0.132 -4.846) 4.952 35.173 ( -1.109 -0.679 0.398) 1.360 35.224 ( 0.985 -0.251 1.708) 1.988 36.158 ( 0.280 -2.134 0.879) 2.325 36.219 ( -0.570 2.210 -1.083) 2.526 44.356 ( -3.603 -3.268 0.305) 4.874 44.584 ( 3.324 4.998 -3.290) 6.845 44.619 ( 0.994 5.527 -0.433) 5.632 44.760 ( -1.827 -4.104 1.834) 4.852 46.574 ( 5.484 -4.584 4.368) 8.376 46.701 ( -0.856 -10.017 -1.625) 10.184 47.501 ( -1.523 1.766 0.960) 2.522 47.621 ( -0.120 4.027 -1.039) 4.161 51.565 ( 24.762 -31.898 18.601) 44.460 52.079 ( -5.100 -37.679 -29.250) 47.972 53.978 ( -22.053 11.980 10.236) 27.104 56.252 ( -1.136 25.384 14.012) 29.017 70.598 ( -3.168 -19.371 0.067) 19.628 71.268 ( 10.054 -33.625 -3.033) 35.227 74.283 ( -3.505 14.537 5.740) 16.017 75.259 ( -29.022 25.234 -10.111) 39.765 ======================= Grid point 178 (88/150) ======================= q-point: (-0.38 -0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( -10.949 -0.000 9.874) 14.744 1.849 ( -6.992 -0.000 10.574) 12.677 2.034 ( 4.898 0.000 1.620) 5.159 2.332 ( -7.584 -0.000 1.798) 7.794 2.669 ( -7.719 -0.000 -8.978) 11.840 2.755 ( -4.472 -0.000 5.994) 7.478 2.954 ( -1.871 -0.000 -2.028) 2.759 3.170 ( -11.143 -0.000 1.448) 11.237 3.423 ( -2.490 -0.000 -0.301) 2.508 3.528 ( -3.841 -0.000 -6.628) 7.661 3.650 ( 4.869 0.000 -2.194) 5.341 3.853 ( 0.651 0.000 0.871) 1.087 4.363 ( -2.422 -0.000 3.261) 4.062 4.569 ( -4.428 -0.000 2.707) 5.190 4.706 ( 0.375 0.000 -6.074) 6.086 4.989 ( 3.398 0.000 -5.076) 6.108 5.096 ( 3.230 0.000 3.581) 4.822 5.522 ( 4.668 0.000 -8.282) 9.507 5.798 ( -0.139 -0.000 -4.969) 4.971 5.815 ( -0.084 -0.000 -1.524) 1.526 6.068 ( -1.393 -0.000 4.942) 5.135 6.217 ( 0.899 0.000 4.888) 4.970 7.169 ( -2.297 -0.000 -1.018) 2.512 7.315 ( -1.345 -0.000 10.829) 10.912 7.460 ( 0.614 0.000 -0.232) 0.656 7.682 ( 6.555 0.000 0.133) 6.556 7.776 ( 4.183 0.000 2.121) 4.690 8.393 ( 1.435 0.000 -8.687) 8.805 10.072 ( 2.442 0.000 4.187) 4.847 10.528 ( 3.504 0.000 -6.705) 7.565 11.219 ( -0.550 -0.000 5.269) 5.297 11.762 ( 5.816 0.000 -1.461) 5.997 13.223 ( 4.801 0.000 10.478) 11.526 13.957 ( -0.851 -0.000 -11.917) 11.948 16.139 ( -4.241 -0.000 1.851) 4.627 16.330 ( -9.161 -0.000 -1.123) 9.230 27.179 ( -0.846 -0.000 1.158) 1.434 27.324 ( 0.682 0.000 -1.204) 1.384 27.617 ( -0.242 -0.000 -0.366) 0.439 27.618 ( -0.258 -0.000 -0.549) 0.606 27.741 ( -0.686 -0.000 2.495) 2.587 27.979 ( 1.446 0.000 -1.478) 2.068 31.412 ( -2.594 -0.000 3.902) 4.686 32.028 ( 4.456 0.000 -3.310) 5.550 32.055 ( 1.042 0.000 9.237) 9.296 32.617 ( -1.756 -0.000 -5.475) 5.750 35.178 ( -1.424 -0.000 0.146) 1.432 35.207 ( 0.560 0.000 0.776) 0.957 36.099 ( 0.185 0.000 2.175) 2.183 36.281 ( -0.369 -0.000 -1.727) 1.766 44.315 ( -3.951 -0.000 0.585) 3.994 44.593 ( -0.743 -0.000 -2.919) 3.012 44.747 ( 2.760 0.000 3.585) 4.524 44.847 ( -0.090 -0.000 -2.503) 2.504 46.220 ( 1.050 0.000 2.067) 2.318 46.412 ( 4.654 0.000 -0.779) 4.718 47.476 ( 1.704 0.000 8.145) 8.322 47.817 ( -5.513 -0.000 -7.758) 9.517 50.039 ( 0.095 0.000 6.579) 6.580 51.102 ( 4.829 0.000 -12.417) 13.323 55.023 ( -23.515 -0.000 21.865) 32.110 56.864 ( 15.210 0.000 8.446) 17.397 70.036 ( -6.026 -0.000 -2.832) 6.658 70.041 ( 1.066 0.000 -0.440) 1.154 74.922 ( -5.684 -0.000 12.521) 13.751 76.267 ( -24.428 -0.000 -16.782) 29.637 ======================= Grid point 179 (89/150) ======================= q-point: (-0.25 -0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -9.377 -0.934 14.264) 17.096 1.690 ( -12.053 4.682 11.662) 17.412 2.069 ( -5.313 5.820 4.966) 9.314 2.182 ( -2.090 1.932 -3.306) 4.362 2.503 ( -6.803 3.043 -3.150) 8.091 2.691 ( -5.345 -2.563 0.362) 5.939 2.973 ( -9.332 -10.324 5.697) 15.038 3.065 ( -4.938 -6.535 -0.698) 8.220 3.319 ( -1.046 6.306 -3.327) 7.206 3.525 ( -4.148 -5.966 -3.449) 8.043 3.727 ( 5.032 0.280 -3.650) 6.223 3.847 ( 0.376 2.448 2.203) 3.315 4.301 ( -5.017 0.038 0.525) 5.045 4.515 ( -2.708 0.912 4.415) 5.259 4.663 ( 0.318 5.402 -8.210) 9.833 5.013 ( 2.141 2.274 -3.293) 4.539 5.186 ( 4.734 -3.118 3.615) 6.723 5.584 ( 1.814 -1.980 -5.826) 6.415 5.748 ( 3.275 4.657 -2.706) 6.303 5.795 ( -3.824 0.039 -1.025) 3.960 6.123 ( 1.958 -5.177 1.760) 5.808 6.309 ( 2.380 -7.674 4.701) 9.309 7.117 ( -1.447 3.127 -0.348) 3.464 7.269 ( -2.044 4.807 9.764) 11.073 7.467 ( 1.145 0.768 -0.369) 1.428 7.783 ( 8.605 1.819 -1.103) 8.865 7.818 ( 3.105 2.923 2.655) 5.023 8.413 ( 1.341 -0.693 -8.802) 8.931 10.070 ( 0.555 4.145 2.573) 4.910 10.603 ( 3.744 -3.841 -7.106) 8.904 11.308 ( 2.614 -8.908 4.425) 10.284 11.826 ( 5.232 2.875 -0.882) 6.035 13.434 ( 6.689 -15.856 9.660) 19.735 14.015 ( 0.355 -10.827 -11.524) 15.816 16.012 ( -4.847 7.856 1.626) 9.373 16.131 ( -12.447 5.062 0.704) 13.456 27.168 ( -0.934 -0.272 1.081) 1.454 27.316 ( 0.433 1.879 -1.166) 2.254 27.615 ( 0.310 -0.408 0.174) 0.541 27.632 ( -0.377 -1.828 -0.817) 2.038 27.738 ( -0.607 -0.469 2.368) 2.489 27.990 ( 1.519 1.333 -1.464) 2.496 31.396 ( -1.897 -1.646 4.155) 4.855 32.000 ( 2.409 5.993 4.610) 7.935 32.171 ( 2.936 -5.460 1.087) 6.294 32.572 ( -2.138 0.742 -5.772) 6.200 35.162 ( -0.900 -0.113 0.575) 1.074 35.218 ( 0.688 -0.150 1.120) 1.323 36.111 ( 0.136 -0.902 1.919) 2.125 36.265 ( -0.557 0.847 -1.631) 1.920 44.269 ( -3.815 -1.867 0.343) 4.261 44.569 ( -3.279 -1.313 -2.184) 4.153 44.777 ( 1.983 1.840 3.680) 4.567 44.824 ( 2.803 4.845 -3.924) 6.836 46.317 ( 3.091 -8.823 2.560) 9.693 46.516 ( 5.436 -2.697 0.056) 6.069 47.506 ( 0.657 0.073 8.224) 8.250 47.721 ( -4.420 1.025 -7.105) 8.430 50.288 ( 5.377 -30.939 5.432) 31.869 51.294 ( 6.297 -15.733 -9.253) 19.308 54.600 ( -21.203 16.136 24.438) 36.155 56.984 ( 13.689 17.127 12.391) 25.184 70.013 ( -6.325 -12.345 -1.207) 13.923 70.261 ( 3.282 -25.788 -1.623) 26.047 74.752 ( -7.713 11.220 9.288) 16.482 75.762 ( -30.338 8.600 -11.936) 33.717 ======================= Grid point 180 (90/150) ======================= q-point: (-0.12 -0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( -12.348 2.894 14.160) 19.009 1.409 ( -11.503 0.545 15.480) 19.294 1.808 ( -8.968 6.778 3.276) 11.709 2.143 ( -1.681 0.590 -5.155) 5.455 2.496 ( 1.954 -3.084 -2.067) 4.195 2.643 ( -4.551 -1.190 1.061) 4.822 2.978 ( -10.922 -11.494 10.860) 19.218 3.191 ( -0.653 -13.847 -5.898) 15.065 3.252 ( 0.545 1.419 2.019) 2.527 3.521 ( -4.759 -2.684 -1.722) 5.729 3.729 ( -2.756 0.760 -2.917) 4.085 3.839 ( 4.180 2.709 -1.989) 5.364 4.246 ( -5.260 -3.530 -1.153) 6.439 4.450 ( -1.570 4.517 2.629) 5.458 4.562 ( 0.895 6.828 -5.039) 8.533 4.987 ( -0.276 2.558 0.798) 2.693 5.311 ( 4.810 -2.589 2.099) 5.852 5.584 ( -1.452 1.546 0.667) 2.224 5.720 ( -0.534 2.440 -0.995) 2.689 5.806 ( 4.470 -1.732 -4.336) 6.464 6.258 ( 1.823 -8.952 0.772) 9.168 6.491 ( 1.905 -10.865 3.418) 11.548 7.027 ( -0.400 7.773 2.501) 8.176 7.164 ( -2.352 5.809 7.091) 9.463 7.472 ( 1.727 1.347 -0.897) 2.367 7.785 ( 0.771 5.112 4.167) 6.640 7.893 ( 9.565 2.687 -4.352) 10.847 8.351 ( -1.853 9.102 -7.046) 11.659 10.053 ( -1.379 -5.271 -1.914) 5.775 10.710 ( 3.447 -4.280 -8.388) 10.027 11.494 ( 6.143 -3.657 2.678) 7.634 11.830 ( 3.033 5.263 -0.863) 6.136 13.941 ( 14.168 -30.673 5.661) 34.258 14.230 ( 1.066 -18.386 -8.697) 20.367 15.785 ( -4.535 14.051 0.426) 14.771 15.813 ( -13.790 10.483 3.126) 17.602 27.163 ( -0.843 -0.680 0.926) 1.425 27.287 ( 0.241 2.401 -0.769) 2.532 27.631 ( 0.499 -0.693 0.189) 0.874 27.652 ( -0.193 -1.418 -0.567) 1.539 27.747 ( -0.477 -1.633 1.816) 2.488 27.982 ( 1.346 2.474 -1.262) 3.086 31.414 ( -1.115 -2.971 4.382) 5.411 31.950 ( 1.333 6.047 5.879) 8.538 32.285 ( 3.216 -3.447 -0.966) 4.812 32.519 ( -2.258 0.410 -5.606) 6.057 35.155 ( -0.462 -0.174 0.975) 1.093 35.236 ( 0.811 -0.384 1.374) 1.641 36.134 ( 0.094 -1.677 1.361) 2.162 36.236 ( -0.597 1.589 -1.315) 2.147 44.256 ( -2.862 -3.321 -0.162) 4.387 44.525 ( -5.899 -2.890 -0.984) 6.642 44.755 ( 2.243 5.275 0.153) 5.734 44.802 ( 3.887 4.834 -1.433) 6.366 46.546 ( 3.608 -12.543 0.784) 13.075 46.631 ( 5.691 -1.560 2.609) 6.452 47.500 ( -2.220 1.840 1.543) 3.270 47.648 ( -1.034 0.963 -1.395) 1.986 51.154 ( 14.501 -63.173 -9.288) 65.478 51.687 ( 11.843 -20.967 1.230) 24.111 54.034 ( -12.161 28.406 25.194) 39.869 56.781 ( 5.901 35.492 16.034) 39.390 70.195 ( -5.362 -23.994 0.199) 24.586 70.910 ( 15.454 -43.997 -4.183) 46.819 74.437 ( -6.644 15.441 5.114) 17.571 75.107 ( -28.615 16.116 -5.479) 33.295 ======================= Grid point 187 (91/150) ======================= q-point: (-0.25 -0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( -9.247 -0.000 18.925) 21.064 1.545 ( -14.418 -0.000 15.663) 21.288 2.038 ( -10.637 -0.000 5.899) 12.163 2.181 ( 0.204 0.000 -4.010) 4.015 2.234 ( -19.698 -0.000 -2.419) 19.846 2.696 ( -12.036 -0.000 6.442) 13.651 2.716 ( 2.172 0.000 6.508) 6.861 2.952 ( -2.418 -0.000 -1.613) 2.907 3.363 ( -2.165 -0.000 -3.310) 3.955 3.394 ( -2.574 -0.000 -3.301) 4.186 3.811 ( 5.079 0.000 -5.763) 7.681 3.872 ( -0.179 -0.000 3.390) 3.394 4.189 ( -8.631 -0.000 -0.468) 8.644 4.504 ( -1.143 -0.000 6.279) 6.382 4.699 ( 0.750 0.000 -10.820) 10.846 5.068 ( 2.208 0.000 -5.212) 5.660 5.247 ( 5.922 0.000 4.572) 7.481 5.560 ( -1.286 -0.000 -5.454) 5.603 5.719 ( -4.334 -0.000 1.968) 4.760 5.862 ( 5.747 0.000 -4.496) 7.297 6.128 ( 2.730 0.000 0.838) 2.856 6.289 ( 2.137 0.000 3.744) 4.311 7.115 ( -1.152 -0.000 -0.801) 1.403 7.290 ( -2.386 -0.000 10.309) 10.582 7.489 ( 1.140 0.000 0.060) 1.141 7.920 ( 4.819 0.000 3.882) 6.189 7.932 ( 9.751 0.000 -3.572) 10.385 8.390 ( 0.174 0.000 -9.963) 9.965 10.187 ( 4.083 0.000 4.452) 6.040 10.613 ( 3.124 0.000 -6.407) 7.128 11.234 ( 0.359 0.000 5.420) 5.432 11.932 ( 5.103 0.000 -2.273) 5.587 13.413 ( 5.326 0.000 9.838) 11.187 13.942 ( 2.970 0.000 -11.582) 11.957 15.980 ( -12.791 -0.000 4.209) 13.466 15.992 ( -5.300 -0.000 1.179) 5.430 27.153 ( -0.970 -0.000 1.187) 1.533 27.331 ( 0.030 0.000 -1.807) 1.807 27.614 ( 0.154 0.000 0.064) 0.167 27.619 ( 0.422 0.000 -0.029) 0.423 27.733 ( -0.349 -0.000 2.661) 2.683 28.021 ( 1.517 0.000 -1.791) 2.347 31.371 ( -0.802 -0.000 4.996) 5.060 32.098 ( -0.017 -0.000 8.202) 8.202 32.165 ( 4.978 0.000 -3.044) 5.836 32.533 ( -2.507 -0.000 -6.070) 6.568 35.156 ( 0.001 0.000 1.080) 1.080 35.228 ( 0.529 0.000 1.198) 1.310 36.109 ( 0.094 0.000 2.018) 2.020 36.260 ( -0.609 -0.000 -1.575) 1.688 44.203 ( -2.993 -0.000 0.036) 2.993 44.494 ( -5.119 -0.000 -2.354) 5.634 44.817 ( 0.521 0.000 4.486) 4.516 44.908 ( 4.535 0.000 -5.825) 7.383 46.295 ( 3.351 0.000 3.520) 4.860 46.601 ( 7.196 0.000 1.559) 7.363 47.519 ( -0.742 -0.000 8.498) 8.530 47.652 ( -3.554 -0.000 -6.850) 7.717 50.091 ( 1.925 0.000 5.422) 5.754 51.307 ( 10.815 0.000 -3.108) 11.253 54.548 ( -6.935 -0.000 39.544) 40.148 57.361 ( 14.295 0.000 15.596) 21.156 69.833 ( -6.169 -0.000 -0.303) 6.177 70.056 ( 0.090 0.000 -2.304) 2.306 74.724 ( -8.469 -0.000 6.339) 10.578 75.344 ( -30.324 -0.000 -6.942) 31.108 ======================= Grid point 188 (92/150) ======================= q-point: (-0.12 -0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( -16.250 4.088 15.739) 22.989 1.289 ( -10.512 2.248 21.442) 23.986 1.779 ( -9.837 5.702 7.687) 13.725 2.073 ( -7.260 -7.044 0.203) 10.117 2.225 ( -8.949 -11.781 -1.398) 14.861 2.570 ( -8.761 -4.324 5.474) 11.199 2.788 ( 1.366 -1.672 8.496) 8.766 2.997 ( -0.651 -9.218 -2.670) 9.619 3.287 ( -1.407 2.426 -1.454) 3.159 3.410 ( -1.452 -3.685 -1.480) 4.228 3.758 ( -2.354 8.439 -3.108) 9.296 3.898 ( 1.914 -0.617 -0.932) 2.216 4.097 ( -6.594 -4.314 -1.283) 7.984 4.487 ( -0.555 2.011 5.949) 6.304 4.647 ( 0.184 5.463 -10.329) 11.686 5.038 ( 0.085 4.687 -1.558) 4.940 5.367 ( 5.736 -1.625 2.853) 6.609 5.565 ( -0.376 -3.508 -1.345) 3.775 5.660 ( -4.178 -0.580 1.716) 4.554 5.915 ( 6.045 3.254 -4.741) 8.343 6.205 ( 2.461 -4.531 -0.546) 5.185 6.379 ( 1.111 -7.655 2.127) 8.023 7.090 ( -0.222 1.804 0.514) 1.889 7.223 ( -2.734 5.439 9.527) 11.306 7.503 ( 1.112 0.332 -0.132) 1.168 7.916 ( 2.511 8.600 4.072) 9.841 8.068 ( 9.943 1.329 -5.817) 11.596 8.393 ( -1.043 0.603 -9.958) 10.030 10.096 ( 0.164 12.551 4.034) 13.185 10.677 ( 2.215 -3.804 -6.948) 8.225 11.446 ( 5.627 -17.625 0.612) 18.512 11.953 ( 3.007 5.035 -2.312) 6.304 13.699 ( 8.450 -25.880 6.483) 27.986 14.072 ( 7.044 -9.738 -8.537) 14.742 15.751 ( -11.574 7.356 6.565) 15.204 15.870 ( -4.439 6.525 0.971) 7.952 27.144 ( -0.836 -0.373 1.183) 1.496 27.315 ( -0.181 1.491 -1.752) 2.308 27.626 ( 0.213 -0.799 -0.278) 0.872 27.634 ( 0.678 -0.943 0.324) 1.206 27.736 ( -0.008 -0.344 2.808) 2.829 28.029 ( 1.263 1.453 -1.850) 2.670 31.385 ( 0.428 -1.163 5.752) 5.884 32.055 ( 0.021 5.333 6.022) 8.044 32.278 ( 3.869 -4.677 -2.070) 6.413 32.481 ( -2.483 0.685 -5.835) 6.378 35.160 ( 0.618 0.530 1.431) 1.647 35.241 ( 0.495 -0.553 1.124) 1.347 36.119 ( 0.074 -0.798 1.834) 2.002 36.243 ( -0.490 0.813 -1.314) 1.621 44.181 ( -1.680 -1.985 -0.450) 2.639 44.399 ( -7.218 -0.444 -1.717) 7.433 44.811 ( -0.818 1.279 4.268) 4.530 44.946 ( 5.748 4.036 -6.345) 9.465 46.441 ( 4.377 -9.822 2.624) 11.068 46.719 ( 7.087 -0.734 3.001) 7.731 47.493 ( -2.570 1.600 3.529) 4.649 47.615 ( -1.899 -1.503 -3.358) 4.140 50.477 ( 5.699 -44.746 -4.299) 45.312 51.603 ( 12.553 -16.795 -0.072) 20.968 54.554 ( 24.675 24.346 55.586) 65.509 57.390 ( 8.729 25.776 18.533) 32.925 69.825 ( -5.278 -13.508 1.830) 14.618 70.434 ( 9.716 -45.741 -6.504) 47.212 74.525 ( -7.606 10.189 3.219) 13.115 74.856 ( -25.254 7.007 -2.008) 26.285 ======================= Grid point 196 (93/150) ======================= q-point: (-0.12 -0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.040 ( -14.633 -0.000 14.613) 20.680 1.167 ( -12.591 -0.000 21.108) 24.578 1.687 ( -13.378 -0.000 5.835) 14.595 1.749 ( -8.711 -0.000 27.938) 29.265 2.116 ( -0.413 -0.000 -4.185) 4.206 2.409 ( -7.135 -0.000 -1.760) 7.349 2.824 ( 0.740 0.000 10.867) 10.892 2.921 ( -0.128 -0.000 -1.369) 1.375 3.259 ( -1.663 -0.000 -0.657) 1.788 3.409 ( 3.528 0.000 -0.109) 3.529 3.828 ( -4.583 -0.000 -0.529) 4.613 3.885 ( 1.418 0.000 -7.959) 8.084 3.949 ( -4.684 -0.000 3.299) 5.729 4.511 ( 0.356 0.000 6.774) 6.784 4.682 ( 0.417 0.000 -13.223) 13.229 5.087 ( 0.190 0.000 -3.559) 3.564 5.449 ( 5.560 0.000 4.730) 7.300 5.493 ( -1.777 -0.000 -0.055) 1.778 5.613 ( -2.926 -0.000 2.729) 4.002 6.018 ( 4.086 0.000 -5.483) 6.838 6.190 ( 1.423 0.000 -0.995) 1.736 6.334 ( 0.193 0.000 1.236) 1.251 7.100 ( 0.298 0.000 1.030) 1.072 7.240 ( -2.675 -0.000 9.969) 10.322 7.518 ( 0.622 0.000 -0.163) 0.643 8.060 ( 2.494 0.000 0.005) 2.494 8.205 ( 8.490 0.000 -6.857) 10.913 8.344 ( -1.087 -0.000 -10.740) 10.795 10.290 ( 0.221 0.000 0.520) 0.565 10.663 ( 1.271 0.000 -6.613) 6.734 11.269 ( 0.695 0.000 6.795) 6.830 12.027 ( 1.495 0.000 -4.041) 4.309 13.579 ( 3.261 0.000 8.901) 9.480 14.130 ( 11.482 0.000 -7.230) 13.569 15.698 ( -4.528 -0.000 8.919) 10.003 15.851 ( -3.855 -0.000 0.669) 3.912 27.131 ( -0.652 -0.000 1.293) 1.448 27.317 ( -0.452 -0.000 -2.328) 2.371 27.630 ( 0.842 0.000 0.303) 0.895 27.637 ( 0.540 0.000 0.151) 0.561 27.739 ( 0.235 0.000 3.266) 3.274 28.053 ( 0.921 0.000 -2.204) 2.389 31.410 ( 2.395 0.000 6.705) 7.120 32.100 ( -1.299 -0.000 6.859) 6.981 32.275 ( 1.686 0.000 -5.212) 5.478 32.454 ( -0.385 -0.000 -4.568) 4.584 35.188 ( 1.773 0.000 0.995) 2.033 35.240 ( 0.007 0.000 1.012) 1.012 36.119 ( 0.177 0.000 2.051) 2.058 36.242 ( -0.237 -0.000 -1.133) 1.157 44.151 ( -0.229 -0.000 -0.766) 0.799 44.278 ( -8.171 -0.000 -2.294) 8.487 44.795 ( -2.779 -0.000 5.102) 5.810 45.056 ( 6.057 0.000 -7.244) 9.443 46.436 ( 4.636 0.000 6.171) 7.719 46.821 ( 6.086 0.000 2.898) 6.741 47.461 ( -4.706 -0.000 4.825) 6.740 47.570 ( -0.570 -0.000 -5.502) 5.532 50.182 ( 2.945 0.000 6.286) 6.942 51.598 ( 3.950 0.000 -6.833) 7.893 55.718 ( 91.623 0.000 77.639) 120.094 57.732 ( 4.578 0.000 20.792) 21.290 69.701 ( -2.700 -0.000 1.662) 3.171 70.037 ( -0.457 -0.000 -4.339) 4.363 74.500 ( -6.163 -0.000 1.013) 6.246 74.562 ( -18.956 -0.000 0.973) 18.981 ======================= Grid point 197 (94/150) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.134 ( 2.267 0.000 15.667) 15.831 1.303 ( -8.789 -0.000 14.801) 17.214 1.567 ( -0.673 -0.000 7.700) 7.729 2.051 ( 3.524 0.000 -11.957) 12.465 2.249 ( 7.342 0.000 5.313) 9.063 2.458 ( -1.830 -0.000 14.207) 14.324 2.892 ( 3.134 0.000 4.125) 5.181 3.042 ( -1.070 -0.000 7.441) 7.518 3.484 ( -1.662 -0.000 2.524) 3.022 3.515 ( 14.260 0.000 -3.028) 14.578 3.587 ( -4.668 -0.000 -5.196) 6.985 3.711 ( -0.714 -0.000 -7.992) 8.024 4.046 ( 1.289 0.000 5.573) 5.721 4.373 ( -1.954 -0.000 -11.827) 11.987 4.721 ( 2.323 0.000 7.719) 8.060 4.993 ( -1.335 -0.000 -5.390) 5.553 5.522 ( 1.123 0.000 2.661) 2.888 5.559 ( -1.922 -0.000 1.133) 2.231 5.697 ( -0.455 -0.000 5.774) 5.791 5.935 ( 0.546 0.000 -6.155) 6.179 6.239 ( 3.363 0.000 0.869) 3.473 6.290 ( -2.780 -0.000 -1.388) 3.107 7.213 ( 2.592 0.000 4.326) 5.043 7.346 ( -2.605 -0.000 1.720) 3.122 7.545 ( -0.700 -0.000 7.290) 7.324 7.964 ( -5.860 -0.000 2.129) 6.234 8.005 ( -2.142 -0.000 -12.432) 12.615 8.215 ( 4.384 0.000 -9.307) 10.288 10.235 ( -3.848 -0.000 5.735) 6.907 10.506 ( -0.201 -0.000 -7.540) 7.542 11.494 ( 1.477 0.000 9.621) 9.734 11.858 ( -2.724 -0.000 -8.097) 8.543 13.810 ( -3.157 -0.000 10.058) 10.542 14.218 ( 4.368 0.000 -9.711) 10.648 15.791 ( -0.594 -0.000 0.437) 0.737 15.811 ( 2.986 0.000 -0.391) 3.011 27.159 ( 0.041 0.000 1.932) 1.932 27.248 ( -0.197 -0.000 -2.512) 2.520 27.647 ( -0.089 -0.000 0.105) 0.138 27.651 ( 0.240 0.000 -0.091) 0.257 27.841 ( 0.487 0.000 4.121) 4.150 27.997 ( -0.353 -0.000 -3.498) 3.516 31.674 ( 3.108 0.000 8.434) 8.989 32.030 ( -3.889 -0.000 -9.022) 9.824 32.185 ( -3.355 -0.000 6.858) 7.635 32.439 ( 3.799 0.000 -5.113) 6.369 35.238 ( 1.225 0.000 0.202) 1.242 35.240 ( -0.898 -0.000 0.198) 0.920 36.163 ( -0.461 -0.000 1.903) 1.958 36.223 ( 0.495 0.000 -1.105) 1.211 44.115 ( -2.334 -0.000 1.312) 2.677 44.164 ( 2.527 0.000 -1.044) 2.734 44.805 ( -4.560 -0.000 5.744) 7.334 45.067 ( 5.394 0.000 -7.172) 8.974 46.754 ( 2.043 0.000 9.156) 9.381 47.000 ( 3.101 0.000 -0.697) 3.178 47.284 ( -10.168 -0.000 2.955) 10.589 47.498 ( 4.847 0.000 -5.463) 7.304 50.530 ( 5.344 0.000 13.611) 14.623 51.166 ( -7.701 -0.000 -16.877) 18.550 58.058 ( -21.439 -0.000 22.719) 31.237 59.019 ( 45.463 0.000 -23.665) 51.253 69.674 ( -2.857 -0.000 5.148) 5.888 69.905 ( 0.352 0.000 -6.026) 6.036 74.323 ( -1.502 -0.000 3.265) 3.594 74.408 ( 1.157 0.000 -0.891) 1.461 ======================= Grid point 198 (95/150) ======================= q-point: ( 0.12 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( 3.211 -2.993 13.922) 14.598 1.316 ( 3.185 -6.292 14.357) 15.996 1.627 ( 4.701 -2.323 6.163) 8.092 2.057 ( 4.173 4.700 -9.651) 11.517 2.423 ( 7.055 -3.968 2.785) 8.560 2.495 ( 0.931 -3.715 4.245) 5.718 2.923 ( 2.454 1.454 11.119) 11.479 3.160 ( 4.415 -10.352 2.529) 11.535 3.414 ( -1.309 6.623 -2.683) 7.265 3.515 ( -1.726 -3.313 -0.351) 3.753 3.672 ( 1.793 -0.713 -7.454) 7.700 3.750 ( 7.724 0.162 -6.372) 10.015 4.091 ( 1.342 -1.519 4.101) 4.575 4.299 ( -3.330 1.126 -8.025) 8.761 4.752 ( 2.058 2.190 6.757) 7.395 4.934 ( -1.098 3.249 -5.155) 6.191 5.531 ( -2.049 0.255 1.218) 2.397 5.559 ( 1.728 -1.123 2.705) 3.400 5.682 ( -2.689 -0.067 4.017) 4.835 5.897 ( -0.460 3.567 -5.753) 6.784 6.285 ( -2.441 -5.182 -1.686) 5.971 6.354 ( 3.653 -7.522 1.303) 8.463 7.252 ( 2.309 1.015 4.117) 4.828 7.282 ( -2.618 3.301 1.349) 4.424 7.534 ( -0.628 1.989 8.371) 8.627 7.806 ( -6.601 8.096 2.345) 10.706 7.934 ( -2.265 2.542 -8.360) 9.027 8.221 ( 2.091 4.103 -8.858) 9.983 10.175 ( -1.505 0.550 8.006) 8.165 10.483 ( -0.806 0.539 -8.121) 8.179 11.611 ( -0.188 -8.685 5.810) 10.451 11.777 ( -3.615 2.258 -5.951) 7.320 13.897 ( -7.057 -19.269 6.996) 21.681 14.338 ( -0.318 -13.828 -8.920) 16.459 15.748 ( 1.862 7.597 -0.191) 7.824 15.792 ( 3.851 8.972 -0.762) 9.794 27.167 ( 0.337 -0.288 1.920) 1.970 27.241 ( 0.049 0.294 -2.267) 2.286 27.643 ( -0.470 0.013 0.043) 0.472 27.654 ( 0.112 -0.354 0.011) 0.371 27.852 ( 0.184 0.049 3.782) 3.787 27.973 ( -0.834 1.199 -3.428) 3.726 31.726 ( 2.466 0.324 9.080) 9.415 31.926 ( -3.988 3.576 -6.298) 8.268 32.168 ( -3.526 -3.209 3.986) 6.214 32.484 ( 3.326 0.435 -5.171) 6.164 35.226 ( -0.804 0.121 0.018) 0.813 35.255 ( 0.998 0.266 0.462) 1.131 36.157 ( -0.707 -0.097 1.757) 1.896 36.226 ( 0.524 0.466 -1.039) 1.253 44.121 ( 0.435 -2.455 0.646) 2.576 44.226 ( 3.590 -2.321 -0.647) 4.323 44.737 ( -4.132 1.419 4.540) 6.301 45.106 ( 3.901 3.186 -6.453) 8.186 46.776 ( -2.392 -0.671 7.120) 7.541 47.026 ( 0.489 -0.374 -3.334) 3.390 47.174 ( -8.244 -3.786 4.299) 10.039 47.568 ( 7.193 1.983 -3.162) 8.104 50.765 ( -0.016 -18.141 11.396) 21.423 51.206 ( -2.292 -23.428 -14.946) 27.884 57.352 ( -32.465 41.174 11.574) 53.696 58.784 ( -2.273 61.112 -15.470) 63.080 69.870 ( -0.651 -27.472 8.922) 28.892 70.311 ( -2.902 -49.880 -15.275) 52.247 74.316 ( 5.592 6.244 2.594) 8.774 74.433 ( 4.284 1.600 -0.695) 4.625 ======================= Grid point 199 (96/150) ======================= q-point: ( 0.25 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.324 ( -0.097 -1.191 15.825) 15.870 1.515 ( 7.604 -4.452 7.805) 11.771 1.800 ( 8.088 -4.605 -0.129) 9.308 2.042 ( 3.876 2.366 -2.528) 5.197 2.398 ( -3.160 5.458 -4.707) 7.870 2.657 ( 5.561 -2.752 1.044) 6.292 3.015 ( 3.850 -5.184 11.518) 13.204 3.365 ( 5.854 2.954 -1.371) 6.699 3.388 ( 5.192 -8.771 0.112) 10.193 3.584 ( -2.623 -5.780 -4.739) 7.921 3.628 ( -6.647 -5.700 -4.167) 9.697 3.827 ( 8.811 6.923 -4.648) 12.131 4.117 ( -0.042 -0.176 1.217) 1.230 4.272 ( -0.493 -3.200 -1.942) 3.775 4.710 ( -0.149 7.029 1.368) 7.163 4.905 ( 1.860 -0.097 -0.378) 1.901 5.480 ( -2.618 1.918 0.799) 3.342 5.608 ( 1.970 -0.549 2.587) 3.298 5.632 ( -4.066 0.190 2.472) 4.762 5.817 ( -1.437 3.711 -4.388) 5.924 6.357 ( -1.588 -9.231 -1.317) 9.459 6.552 ( 3.464 -11.578 1.568) 12.187 7.168 ( -2.779 7.314 2.047) 8.088 7.265 ( 1.946 2.721 2.711) 4.305 7.446 ( -2.767 10.136 8.562) 13.554 7.643 ( -0.880 3.113 1.247) 3.467 7.846 ( -2.078 3.349 -3.822) 5.490 8.147 ( -0.404 5.390 -7.693) 9.402 10.212 ( -0.690 -4.776 2.868) 5.613 10.459 ( 0.616 -0.323 -8.169) 8.199 11.617 ( -3.472 4.048 1.874) 5.653 11.745 ( -1.998 -3.686 -0.815) 4.271 14.110 ( -10.286 -25.177 2.700) 27.331 14.568 ( -3.379 -23.023 -6.613) 24.191 15.593 ( 3.161 18.445 0.032) 18.714 15.725 ( 5.382 9.422 -0.360) 10.857 27.181 ( 0.452 -0.484 1.623) 1.752 27.234 ( 0.176 0.574 -1.598) 1.706 27.635 ( -0.597 -0.188 0.137) 0.640 27.665 ( 0.234 -0.800 -0.041) 0.834 27.857 ( -0.065 0.019 2.938) 2.939 27.929 ( -1.095 2.120 -2.929) 3.778 31.762 ( 0.721 1.856 6.198) 6.510 31.815 ( -2.200 1.816 -0.115) 2.855 32.174 ( -2.946 -3.743 1.160) 4.903 32.508 ( 2.444 1.220 -5.016) 5.712 35.211 ( -0.875 0.225 -0.304) 0.953 35.265 ( 1.018 0.527 1.034) 1.544 36.152 ( -0.755 -0.551 1.245) 1.557 36.223 ( 0.490 0.805 -0.796) 1.233 44.193 ( 2.302 -4.306 -0.422) 4.901 44.331 ( 3.495 -4.435 0.284) 5.654 44.652 ( -3.005 3.470 2.624) 5.287 45.069 ( 1.079 6.135 -4.715) 7.812 46.725 ( -4.917 -0.009 4.058) 6.375 47.030 ( 0.991 1.310 -1.245) 2.061 47.139 ( -7.727 -7.030 0.920) 10.487 47.648 ( 7.852 2.516 -0.245) 8.249 51.010 ( -8.378 -26.068 4.185) 27.699 51.726 ( 7.748 -38.612 -7.424) 40.075 56.069 ( -32.763 62.805 -2.092) 70.867 57.620 ( -17.113 65.281 4.432) 67.632 70.322 ( -4.662 -33.872 7.288) 34.959 70.954 ( -5.839 -46.701 -15.134) 49.438 74.311 ( 10.022 11.211 1.065) 15.076 74.492 ( 3.189 -1.665 -0.862) 3.699 ======================= Grid point 200 (97/150) ======================= q-point: ( 0.38 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( 0.752 -0.556 11.750) 11.787 1.683 ( 5.264 -2.731 7.311) 9.414 1.851 ( -1.061 2.702 -3.890) 4.854 2.147 ( 2.234 -2.166 1.674) 3.533 2.257 ( 1.053 4.604 -6.813) 8.289 2.705 ( 2.849 2.366 1.516) 4.002 3.173 ( 1.078 -6.787 4.192) 8.049 3.442 ( 2.776 -0.381 -3.208) 4.259 3.500 ( -4.196 -2.588 -1.793) 5.246 3.567 ( 2.488 -4.627 2.555) 5.842 3.663 ( 4.983 6.772 -6.926) 10.893 3.856 ( -0.206 -3.767 1.785) 4.174 4.122 ( 1.250 -0.311 -1.190) 1.754 4.337 ( 0.461 -4.487 0.126) 4.512 4.579 ( -0.852 8.869 -1.394) 9.018 4.965 ( 1.779 -2.580 2.302) 3.889 5.407 ( -1.825 3.098 -0.179) 3.600 5.570 ( -4.796 -1.790 2.275) 5.602 5.643 ( 2.010 0.734 2.581) 3.353 5.762 ( 0.390 1.502 -2.905) 3.294 6.496 ( -0.953 -12.368 -0.610) 12.420 6.787 ( 2.683 -13.654 2.301) 14.104 6.982 ( -2.678 13.036 2.722) 13.583 7.183 ( 0.672 14.044 4.950) 14.906 7.320 ( 0.111 1.252 1.774) 2.174 7.645 ( 1.295 -0.767 -0.511) 1.589 7.778 ( -1.444 1.561 0.417) 2.167 8.053 ( -1.987 2.847 -6.615) 7.471 10.229 ( -2.455 -0.633 -7.074) 7.515 10.517 ( 3.436 -3.790 -3.568) 6.237 11.519 ( -2.144 2.363 3.266) 4.566 11.738 ( -2.020 0.011 0.173) 2.028 14.284 ( -8.557 -17.832 -0.002) 19.779 14.862 ( -5.219 -26.959 -4.294) 27.793 15.338 ( 6.027 25.800 1.504) 26.537 15.674 ( 3.321 6.828 -0.444) 7.606 27.196 ( 0.226 -0.307 0.743) 0.835 27.227 ( 0.231 0.357 -0.392) 0.578 27.634 ( -0.346 -0.562 0.177) 0.683 27.679 ( 0.238 -0.414 0.043) 0.479 27.858 ( -0.286 0.627 0.539) 0.875 27.880 ( -0.675 1.186 -0.933) 1.653 31.680 ( -2.109 4.437 0.407) 4.929 31.848 ( 1.109 -2.524 7.593) 8.078 32.191 ( -1.698 -3.571 -0.908) 4.057 32.506 ( 1.409 2.067 -4.614) 5.248 35.193 ( -0.736 0.440 -0.225) 0.887 35.273 ( 0.852 0.530 1.250) 1.603 36.154 ( -0.649 -1.005 0.385) 1.257 36.215 ( 0.376 1.010 -0.274) 1.112 44.306 ( 3.156 -5.228 -1.303) 6.244 44.437 ( 0.053 -4.399 1.869) 4.780 44.572 ( 0.778 3.532 0.041) 3.617 44.953 ( -2.021 7.558 -2.343) 8.167 46.669 ( -3.563 -1.031 2.091) 4.258 46.999 ( 2.925 7.003 3.427) 8.327 47.148 ( -7.507 -10.479 -4.656) 13.705 47.721 ( 5.957 2.444 1.501) 6.612 51.333 ( -7.129 -33.697 3.560) 34.626 52.366 ( 11.897 -25.499 -3.715) 28.382 54.718 ( -23.118 58.185 -8.708) 63.212 56.607 ( -13.963 39.694 11.560) 43.637 70.637 ( -7.039 -19.855 0.623) 21.075 71.411 ( -1.488 -26.251 -4.220) 26.630 74.299 ( 10.572 12.053 -0.419) 16.038 74.556 ( -2.197 -5.577 -0.857) 6.055 ======================= Grid point 201 (98/150) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( 1.318 -2.599 7.215) 7.781 1.713 ( -3.849 1.892 8.609) 9.618 1.789 ( -2.051 1.603 2.563) 3.653 2.082 ( -0.292 2.805 -3.296) 4.338 2.298 ( 1.546 0.405 -8.476) 8.625 2.745 ( 4.870 0.211 4.367) 6.544 3.233 ( -4.252 -6.012 1.312) 7.480 3.363 ( -5.984 3.928 -3.806) 8.107 3.531 ( 3.835 5.203 -2.434) 6.906 3.566 ( -3.452 2.812 5.412) 7.008 3.641 ( 2.617 2.396 -0.950) 3.673 3.880 ( 0.827 2.229 2.748) 3.633 4.184 ( 2.440 -3.983 -5.014) 6.853 4.390 ( -0.612 -0.264 1.669) 1.797 4.458 ( -0.688 2.434 -0.901) 2.685 5.003 ( -1.056 -0.918 2.547) 2.906 5.364 ( 0.689 0.675 -0.711) 1.198 5.555 ( -2.626 -3.022 3.444) 5.281 5.667 ( 2.008 -0.039 1.162) 2.320 5.767 ( 1.677 0.143 -3.504) 3.887 6.634 ( 0.089 -0.778 -0.930) 1.216 6.760 ( -2.996 6.293 6.252) 9.363 6.985 ( 2.793 8.305 3.217) 9.334 7.035 ( -0.326 -9.391 3.135) 9.906 7.351 ( 2.215 -2.571 -2.038) 3.959 7.684 ( 1.233 -2.626 -4.546) 5.393 7.766 ( -0.714 -1.657 4.120) 4.498 8.002 ( -1.891 -1.396 -6.274) 6.699 10.161 ( -0.857 4.132 -7.295) 8.427 10.603 ( 2.195 -1.779 -4.349) 5.186 11.518 ( 1.358 -2.372 1.591) 3.163 11.711 ( -1.563 -0.897 1.378) 2.269 14.366 ( -1.280 -4.096 -1.859) 4.677 15.043 ( 8.728 30.039 2.623) 31.391 15.159 ( -5.909 -25.358 -3.620) 26.288 15.627 ( -1.939 0.974 1.098) 2.432 27.195 ( -0.184 0.468 0.218) 0.548 27.233 ( 0.164 -0.657 0.195) 0.705 27.639 ( -0.006 -0.368 0.041) 0.370 27.681 ( 0.081 0.480 0.321) 0.583 27.821 ( -0.405 2.051 -0.437) 2.136 27.892 ( 0.365 -1.845 -0.119) 1.885 31.600 ( -0.982 3.601 2.762) 4.643 31.917 ( 0.393 -3.760 6.009) 7.099 32.224 ( -0.000 -3.119 -2.520) 4.009 32.478 ( 0.328 2.838 -3.895) 4.830 35.178 ( -0.334 0.384 0.238) 0.562 35.278 ( 0.485 0.480 1.127) 1.317 36.162 ( -0.402 -1.070 -0.359) 1.198 36.205 ( 0.173 0.951 0.370) 1.035 44.358 ( -2.190 1.970 0.780) 3.047 44.495 ( 3.582 -5.383 -2.218) 6.836 44.588 ( 0.350 0.527 -0.383) 0.739 44.820 ( -2.017 3.692 0.851) 4.292 46.653 ( -1.300 -1.278 1.077) 2.118 46.945 ( 5.207 9.172 4.660) 11.530 47.191 ( -5.875 -10.368 -6.106) 13.390 47.753 ( 2.541 2.590 1.914) 4.102 51.672 ( -5.443 -17.526 -1.613) 18.422 52.699 ( 16.221 10.277 1.171) 19.238 53.850 ( -5.527 21.999 -3.563) 22.960 56.189 ( -8.014 -5.093 12.287) 15.529 70.691 ( -3.263 0.818 -0.433) 3.391 71.643 ( 5.329 -1.480 -2.119) 5.923 74.287 ( 7.041 7.622 -0.968) 10.421 74.572 ( -8.348 -7.725 -0.226) 11.376 ======================= Grid point 202 (99/150) ======================= q-point: (-0.38 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( -8.196 1.652 13.172) 15.602 1.695 ( 0.934 -1.512 6.747) 6.977 1.707 ( -3.172 2.246 3.370) 5.144 2.093 ( 2.803 -0.528 -0.769) 2.955 2.231 ( -5.111 2.670 -9.512) 11.123 2.832 ( 4.087 -0.682 2.572) 4.876 3.188 ( -1.535 8.776 -3.737) 9.661 3.224 ( -7.470 0.033 9.267) 11.903 3.403 ( -6.836 7.059 8.903) 13.260 3.475 ( -3.506 1.000 -3.556) 5.093 3.616 ( 1.119 4.746 -0.069) 4.877 3.879 ( 5.045 3.767 0.051) 6.296 4.200 ( -1.923 3.069 -2.651) 4.488 4.359 ( 0.314 -0.816 -2.694) 2.832 4.511 ( 0.583 -5.213 2.384) 5.762 4.980 ( -2.790 -0.434 1.460) 3.178 5.403 ( 2.747 -1.588 0.396) 3.198 5.580 ( -0.462 -2.843 2.964) 4.133 5.708 ( 1.724 -0.552 -0.162) 1.817 5.775 ( 1.013 0.468 -4.516) 4.652 6.470 ( 1.517 14.379 0.952) 14.490 6.697 ( -2.119 7.729 3.510) 8.749 6.987 ( 1.928 -6.154 2.368) 6.870 7.175 ( -1.458 -7.273 4.965) 8.926 7.445 ( 2.403 -4.102 -1.722) 5.057 7.774 ( 1.516 -9.428 -7.697) 12.265 7.811 ( 0.206 -3.975 4.443) 5.965 8.012 ( -1.351 -4.258 -7.775) 8.967 10.087 ( 1.290 4.593 -1.648) 5.047 10.614 ( 0.473 1.545 -7.131) 7.312 11.600 ( 3.694 -1.927 -0.589) 4.208 11.741 ( -0.482 -5.372 0.254) 5.400 14.354 ( 5.836 10.325 -3.284) 12.307 14.734 ( 11.816 34.187 0.972) 36.185 15.398 ( -7.508 -21.180 -1.635) 22.531 15.613 ( -5.644 -7.753 3.194) 10.108 27.182 ( -0.401 0.620 0.827) 1.108 27.246 ( -0.139 -1.024 -0.678) 1.236 27.641 ( 0.230 0.423 -0.238) 0.537 27.671 ( 0.017 0.932 0.385) 1.008 27.800 ( 0.303 0.765 1.460) 1.676 27.931 ( 0.649 -2.348 -1.490) 2.855 31.558 ( 0.473 2.381 5.168) 5.710 31.982 ( -0.808 -4.616 3.286) 5.724 32.273 ( 1.742 -2.352 -3.729) 4.741 32.423 ( -0.749 3.521 -2.645) 4.467 35.175 ( 0.245 0.015 0.761) 0.799 35.277 ( 0.043 0.420 0.824) 0.926 36.169 ( -0.059 -0.298 -0.046) 0.307 36.198 ( -0.051 0.114 0.301) 0.326 44.272 ( -1.995 4.174 0.216) 4.631 44.487 ( -5.310 5.614 -0.289) 7.733 44.654 ( 5.257 -6.638 -3.962) 9.349 44.826 ( 0.028 -3.407 3.502) 4.886 46.662 ( 1.155 0.337 1.580) 1.986 46.915 ( 6.772 8.363 4.212) 11.556 47.250 ( -3.609 -9.007 -6.010) 11.414 47.724 ( -1.416 3.044 1.549) 3.697 51.509 ( -1.089 26.735 -9.248) 28.310 52.503 ( 1.769 34.233 -5.078) 34.653 54.164 ( 31.115 -35.218 19.485) 50.874 56.517 ( -2.602 -44.024 13.098) 46.005 70.533 ( 1.370 18.859 3.780) 19.283 71.578 ( 11.481 27.742 -10.195) 31.708 74.295 ( 1.310 -0.333 -0.432) 1.419 74.528 ( -12.479 -8.186 0.671) 14.940 ======================= Grid point 203 (100/150) ======================= q-point: (-0.25 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.236 ( -9.930 1.770 16.649) 19.466 1.607 ( -5.214 2.996 14.065) 15.297 1.759 ( -0.535 -0.271 -0.641) 0.878 2.071 ( -5.680 3.368 -7.888) 10.287 2.147 ( 3.315 0.284 1.192) 3.534 2.818 ( -5.851 6.365 2.589) 9.025 2.995 ( -6.085 10.079 12.963) 17.512 3.097 ( 3.166 5.340 2.679) 6.761 3.283 ( -4.295 0.087 3.683) 5.659 3.452 ( -0.944 -3.934 -1.169) 4.212 3.571 ( 1.064 3.686 0.904) 3.942 3.889 ( 2.294 3.445 -3.703) 5.554 4.104 ( -2.282 4.029 2.343) 5.190 4.376 ( -0.296 -1.930 -7.661) 7.906 4.595 ( 1.050 -3.631 5.092) 6.342 4.962 ( -2.093 -2.730 -0.995) 3.581 5.467 ( 2.399 -1.038 1.343) 2.938 5.625 ( -0.598 -2.928 3.565) 4.651 5.690 ( 0.676 4.308 0.018) 4.361 5.816 ( 2.230 -3.439 -5.623) 6.958 6.329 ( 2.583 9.920 -0.036) 10.251 6.530 ( -1.994 10.004 1.159) 10.266 7.107 ( 2.159 -3.637 2.694) 5.014 7.257 ( -2.068 -7.816 6.169) 10.170 7.506 ( 0.545 -1.889 0.596) 2.054 7.894 ( 0.046 -6.063 3.591) 7.047 7.957 ( 1.917 -11.850 -10.289) 15.810 8.042 ( -0.666 -3.416 -9.932) 10.524 10.088 ( 1.828 -1.706 4.348) 5.015 10.570 ( -0.268 2.391 -8.819) 9.141 11.645 ( 3.306 3.838 -1.096) 5.183 11.827 ( 0.070 -5.748 -3.043) 6.504 14.224 ( 5.294 19.568 0.030) 20.271 14.429 ( 12.786 31.904 -3.932) 34.595 15.549 ( -6.093 -15.648 2.942) 17.049 15.694 ( -4.449 -11.813 1.221) 12.682 27.169 ( -0.441 0.516 1.413) 1.567 27.254 ( -0.372 -0.847 -1.721) 1.953 27.637 ( 0.484 0.536 -0.081) 0.727 27.659 ( 0.058 0.825 0.257) 0.866 27.808 ( 0.710 -0.061 2.921) 3.006 27.970 ( 0.564 -2.003 -2.503) 3.255 31.562 ( 2.021 0.899 7.098) 7.435 32.033 ( -2.075 -5.001 -0.241) 5.420 32.330 ( 2.792 -1.510 -4.583) 5.575 32.346 ( -1.547 4.237 -0.467) 4.535 35.188 ( 0.828 -0.462 0.942) 1.337 35.270 ( -0.365 0.396 0.469) 0.714 36.168 ( -0.021 0.384 1.441) 1.491 36.203 ( 0.094 -0.718 -0.781) 1.065 44.194 ( -0.582 3.612 -0.447) 3.686 44.322 ( -6.056 4.484 0.490) 7.551 44.816 ( 4.610 -5.290 -3.544) 7.861 44.874 ( -0.871 -3.238 2.790) 4.362 46.682 ( 3.799 2.773 4.480) 6.495 46.919 ( 5.970 5.215 2.219) 8.232 47.323 ( -1.040 -6.916 -5.207) 8.719 47.628 ( -5.054 3.614 0.890) 6.277 51.035 ( 3.985 36.829 -3.201) 37.182 51.933 ( -5.307 33.573 -11.456) 35.869 55.618 ( 59.736 -59.584 26.009) 88.290 57.264 ( -0.913 -54.405 16.997) 57.005 70.215 ( 2.376 29.120 7.750) 30.227 71.141 ( 11.252 53.171 -19.347) 57.689 74.332 ( -2.727 -5.890 0.134) 6.492 74.447 ( -12.575 -7.170 1.462) 14.550 ======================= Grid point 204 (101/150) ======================= q-point: (-0.12 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.134 ( -4.997 -0.180 16.207) 16.961 1.473 ( -8.857 4.623 15.812) 18.704 1.648 ( -6.845 3.761 2.802) 8.297 2.016 ( 0.739 -1.147 -8.336) 8.447 2.182 ( 5.058 3.397 3.866) 7.216 2.563 ( -6.968 9.070 14.591) 18.539 2.881 ( -1.557 2.088 3.735) 4.553 3.080 ( 0.985 4.164 6.930) 8.145 3.318 ( 6.242 -2.859 1.023) 6.942 3.507 ( 3.817 3.143 0.410) 4.961 3.559 ( -4.998 -8.534 -1.624) 10.022 3.817 ( -1.146 6.469 -6.871) 9.507 4.044 ( -0.054 2.266 4.997) 5.487 4.387 ( -0.469 -2.167 -10.504) 10.736 4.664 ( 1.705 -1.900 7.016) 7.466 4.987 ( -0.977 -3.468 -3.553) 5.060 5.503 ( 1.078 -0.217 1.913) 2.207 5.605 ( -2.431 1.779 1.339) 3.296 5.681 ( 1.921 0.717 4.546) 4.988 5.896 ( 1.641 -3.850 -6.144) 7.434 6.248 ( 2.588 6.581 -0.258) 7.076 6.376 ( -2.327 6.281 -0.177) 6.700 7.168 ( 2.262 -0.417 3.415) 4.117 7.340 ( -2.032 -5.356 4.799) 7.473 7.533 ( -0.403 -1.476 3.857) 4.149 7.978 ( -2.140 -5.911 1.857) 6.555 8.033 ( -3.698 -4.183 -12.575) 13.758 8.126 ( 5.769 -3.354 -9.471) 11.586 10.191 ( -0.739 -8.317 6.013) 10.290 10.526 ( -0.178 1.124 -8.672) 8.746 11.569 ( 2.049 11.461 2.899) 11.998 11.876 ( -1.346 -3.161 -6.001) 6.915 13.968 ( 0.687 19.282 7.701) 20.774 14.241 ( 9.483 15.925 -8.981) 20.596 15.698 ( -0.375 -10.435 2.608) 10.763 15.777 ( -2.665 -6.317 0.266) 6.861 27.160 ( -0.270 0.295 1.770) 1.815 27.254 ( -0.398 -0.371 -2.380) 2.441 27.642 ( 0.581 -0.000 0.092) 0.589 27.651 ( 0.045 0.458 0.110) 0.473 27.826 ( 0.695 -0.073 3.778) 3.842 27.994 ( 0.174 -1.141 -3.174) 3.377 31.610 ( 3.144 -0.191 8.065) 8.658 32.059 ( -3.155 -4.307 -4.972) 7.295 32.255 ( -2.749 3.734 3.293) 5.687 32.387 ( 3.726 -0.373 -4.958) 6.213 35.213 ( 1.154 -0.658 0.579) 1.449 35.256 ( -0.659 0.405 0.243) 0.811 36.165 ( -0.183 0.101 1.953) 1.964 36.215 ( 0.366 -0.499 -1.098) 1.260 44.154 ( 1.002 2.082 -0.907) 2.482 44.188 ( -4.924 2.442 1.056) 5.597 44.853 ( -3.886 -1.374 5.688) 7.025 44.971 ( 5.762 -2.905 -6.809) 9.381 46.711 ( 4.451 3.031 8.197) 9.807 46.950 ( 4.513 1.687 0.371) 4.832 47.390 ( -1.826 -3.902 -2.079) 4.784 47.487 ( -4.652 3.075 -1.775) 5.852 50.631 ( 4.858 25.885 7.854) 27.484 51.435 ( -6.810 18.249 -15.691) 25.012 57.569 ( 70.621 -56.683 8.323) 90.937 57.957 ( -3.608 -38.008 21.013) 43.579 69.849 ( 0.019 22.140 7.399) 23.344 70.392 ( 2.624 55.024 -16.764) 57.581 74.354 ( -7.042 -5.082 2.492) 9.034 74.391 ( -3.771 -4.305 -0.351) 5.734 ======================= Grid point 206 (102/150) ======================= q-point: ( 0.12 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( 6.589 0.000 12.443) 14.080 1.480 ( 15.940 0.000 10.717) 19.207 1.729 ( 8.150 0.000 7.037) 10.768 2.201 ( 8.775 0.000 -11.477) 14.447 2.476 ( 4.473 0.000 7.630) 8.845 2.504 ( 2.374 0.000 1.742) 2.945 3.050 ( 4.471 0.000 7.757) 8.954 3.084 ( 2.334 0.000 4.531) 5.097 3.436 ( -4.589 -0.000 -2.980) 5.472 3.467 ( 2.892 0.000 -1.808) 3.410 3.552 ( -7.150 -0.000 -9.360) 11.779 3.992 ( 15.064 0.000 -11.330) 18.849 4.108 ( 1.574 0.000 3.081) 3.459 4.225 ( -5.227 -0.000 -6.489) 8.333 4.805 ( 1.357 0.000 6.930) 7.062 4.929 ( -1.236 -0.000 -6.693) 6.806 5.500 ( -2.687 -0.000 0.508) 2.734 5.586 ( 2.276 0.000 3.086) 3.835 5.639 ( -3.609 -0.000 6.145) 7.127 5.884 ( -3.829 -0.000 -6.880) 7.874 6.236 ( 1.309 0.000 -2.973) 3.248 6.350 ( 3.098 0.000 1.679) 3.523 7.257 ( -2.946 -0.000 -1.474) 3.294 7.306 ( 2.459 0.000 4.702) 5.306 7.555 ( -0.545 -0.000 11.728) 11.741 7.777 ( -6.222 -0.000 5.183) 8.098 7.893 ( -3.023 -0.000 -9.288) 9.767 8.261 ( 0.477 0.000 -8.894) 8.907 10.156 ( -2.619 -0.000 9.160) 9.527 10.461 ( -1.407 -0.000 -6.120) 6.279 11.543 ( -0.420 -0.000 10.594) 10.603 11.728 ( -3.870 -0.000 -7.843) 8.746 13.639 ( -9.280 -0.000 7.967) 12.231 14.206 ( -1.986 -0.000 -9.625) 9.828 15.853 ( 4.554 0.000 0.241) 4.560 15.911 ( 3.607 0.000 -0.452) 3.635 27.175 ( 0.595 0.000 2.062) 2.146 27.243 ( 0.313 0.000 -2.288) 2.309 27.639 ( -0.335 -0.000 -0.091) 0.347 27.647 ( -0.422 -0.000 -0.029) 0.423 27.858 ( -0.220 -0.000 3.917) 3.923 27.963 ( -1.035 -0.000 -3.548) 3.695 31.771 ( 1.251 0.000 9.712) 9.792 31.886 ( -3.477 -0.000 -8.619) 9.294 32.096 ( -3.406 -0.000 6.428) 7.274 32.526 ( 2.865 0.000 -5.491) 6.194 35.214 ( -0.781 -0.000 -0.310) 0.840 35.273 ( 0.924 0.000 0.650) 1.130 36.147 ( -0.860 -0.000 1.937) 2.119 36.235 ( 0.488 0.000 -1.306) 1.394 44.130 ( 2.788 0.000 -0.292) 2.803 44.264 ( 3.543 0.000 0.326) 3.558 44.703 ( -2.483 -0.000 3.696) 4.452 45.167 ( 2.003 0.000 -6.266) 6.579 46.729 ( -4.793 -0.000 6.153) 7.800 46.918 ( -8.797 -0.000 -7.027) 11.259 47.124 ( 0.474 0.000 8.276) 8.290 47.695 ( 7.972 0.000 -2.666) 8.406 50.707 ( 2.124 0.000 16.834) 16.967 50.911 ( -5.079 -0.000 -17.192) 17.926 57.131 ( -36.732 -0.000 2.113) 36.792 58.859 ( -39.452 -0.000 -4.091) 39.664 69.699 ( 4.086 0.000 5.839) 7.127 69.908 ( 0.748 0.000 -4.957) 5.014 74.527 ( 14.665 0.000 0.256) 14.667 74.533 ( 6.372 0.000 2.177) 6.734 ======================= Grid point 207 (103/150) ======================= q-point: ( 0.25 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( 10.510 2.060 12.821) 16.705 1.690 ( 12.901 5.103 5.568) 14.949 1.906 ( 10.244 -2.896 4.121) 11.415 2.208 ( 6.817 10.441 -3.714) 13.011 2.487 ( 1.952 7.211 -4.924) 8.947 2.645 ( 3.591 -9.013 3.122) 10.192 3.046 ( 2.323 0.926 7.966) 8.350 3.278 ( 1.569 -11.772 1.179) 11.935 3.395 ( -7.359 -2.540 -5.196) 9.360 3.443 ( -2.876 -5.511 -2.992) 6.899 3.532 ( 6.591 1.216 -2.941) 7.319 4.055 ( 0.457 5.041 -7.489) 9.039 4.136 ( 3.117 1.414 -1.665) 3.807 4.233 ( 5.285 -2.530 -2.565) 6.396 4.802 ( 0.638 4.299 1.663) 4.654 4.902 ( -0.690 -0.573 -1.795) 2.007 5.447 ( -4.556 -0.530 1.242) 4.752 5.577 ( -3.504 2.134 3.035) 5.103 5.639 ( 1.930 -0.969 2.817) 3.550 5.792 ( -4.914 0.332 -5.269) 7.212 6.275 ( 1.965 -1.696 -2.836) 3.844 6.458 ( 2.622 -8.018 1.053) 8.501 7.200 ( -1.698 2.605 -1.658) 3.523 7.332 ( 1.950 1.935 3.841) 4.722 7.546 ( -0.920 3.834 12.796) 13.390 7.662 ( -3.531 3.725 3.266) 6.084 7.826 ( -3.460 0.837 -5.275) 6.364 8.205 ( -1.037 4.895 -7.956) 9.399 10.150 ( -1.637 -2.125 6.693) 7.211 10.434 ( -0.991 -1.100 -6.261) 6.433 11.589 ( -2.533 -3.366 6.822) 8.018 11.650 ( -3.357 -0.520 -3.894) 5.167 13.632 ( -10.203 -17.005 5.817) 20.667 14.244 ( -3.336 -12.416 -9.074) 15.736 15.867 ( 5.722 9.585 0.782) 11.191 15.927 ( 5.498 6.146 0.228) 8.249 27.189 ( 0.664 -0.091 1.933) 2.046 27.243 ( 0.417 0.386 -1.895) 1.979 27.627 ( -0.504 0.298 -0.039) 0.587 27.652 ( -0.140 -1.138 -0.219) 1.167 27.858 ( -0.518 0.007 3.483) 3.521 27.933 ( -1.023 1.213 -3.229) 3.598 31.797 ( 0.008 0.302 6.812) 6.818 31.803 ( -2.630 2.105 -3.256) 4.685 32.086 ( -2.186 -2.962 4.659) 5.938 32.551 ( 2.132 0.823 -5.601) 6.049 35.201 ( -0.635 0.149 -0.431) 0.782 35.284 ( 0.623 0.187 0.691) 0.949 36.138 ( -0.767 -0.156 1.905) 2.060 36.237 ( 0.445 0.408 -1.376) 1.503 44.197 ( 4.128 -1.928 -1.161) 4.701 44.329 ( 2.358 -2.216 1.631) 3.623 44.670 ( -0.430 2.092 1.902) 2.860 45.140 ( -0.764 4.033 -5.039) 6.499 46.639 ( -6.648 0.352 3.309) 7.434 46.839 ( -8.471 -8.202 -5.146) 12.866 47.141 ( 2.044 2.074 7.080) 7.656 47.794 ( 7.123 1.763 -2.020) 7.611 50.671 ( -5.536 -4.807 4.080) 8.390 51.206 ( 0.784 -37.968 -4.918) 38.293 56.329 ( -28.960 37.010 -8.752) 47.802 57.927 ( -40.053 34.343 14.510) 54.720 69.895 ( 1.712 -17.819 2.497) 18.075 70.235 ( -0.124 -37.674 -4.221) 37.910 74.610 ( 7.848 5.105 4.835) 10.537 74.732 ( 20.728 9.480 -2.807) 22.965 ======================= Grid point 208 (104/150) ======================= q-point: ( 0.38 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( 10.953 9.028 11.880) 18.510 1.789 ( 6.799 3.011 3.850) 8.374 1.960 ( 2.235 9.230 -0.637) 9.518 2.210 ( 4.477 4.128 1.770) 6.342 2.400 ( 6.269 8.213 -6.877) 12.412 2.763 ( 2.546 -1.438 0.652) 2.996 3.081 ( -3.296 -3.504 -1.725) 5.110 3.292 ( -5.703 -2.670 -2.363) 6.726 3.470 ( 0.735 -10.628 3.796) 11.310 3.516 ( -2.147 -5.061 1.532) 5.707 3.673 ( 7.386 -4.695 -4.026) 9.634 3.970 ( 0.116 5.547 -3.835) 6.745 4.158 ( 4.054 1.186 -1.845) 4.609 4.330 ( 4.412 0.319 -2.204) 4.942 4.703 ( 0.009 9.170 -2.704) 9.560 4.929 ( -0.677 -3.483 3.315) 4.856 5.404 ( -3.094 -1.608 2.153) 4.098 5.472 ( -5.491 1.499 0.336) 5.702 5.676 ( 1.270 -0.034 1.429) 1.912 5.746 ( -1.708 -1.610 -2.752) 3.617 6.347 ( 0.670 -6.692 -1.704) 6.938 6.635 ( 1.102 -11.416 1.476) 11.564 7.115 ( 0.030 7.714 -0.365) 7.722 7.334 ( 2.229 2.108 1.131) 3.270 7.412 ( -1.809 11.965 8.611) 14.852 7.629 ( -1.043 -1.228 2.532) 3.001 7.757 ( -3.447 0.481 0.140) 3.483 8.090 ( -1.095 6.101 -6.619) 9.069 10.165 ( -1.631 -2.364 -1.702) 3.339 10.470 ( 0.516 -5.411 -5.185) 7.511 11.526 ( -2.452 2.713 2.053) 4.194 11.666 ( -3.255 -4.233 2.486) 5.890 13.806 ( -8.931 -25.087 3.964) 26.923 14.422 ( -4.422 -21.378 -7.697) 23.148 15.766 ( 7.536 17.800 1.489) 19.387 15.894 ( 5.913 10.925 0.010) 12.423 27.201 ( 0.490 0.042 1.264) 1.356 27.238 ( 0.288 0.685 -0.916) 1.179 27.622 ( -0.280 -0.412 0.070) 0.503 27.670 ( 0.115 -1.242 -0.417) 1.315 27.855 ( -0.533 -0.304 2.461) 2.537 27.891 ( -0.750 1.936 -2.400) 3.173 31.712 ( -1.475 3.826 -2.366) 4.734 31.825 ( -1.131 -2.342 8.292) 8.690 32.121 ( -0.453 -3.641 2.401) 4.384 32.549 ( 1.281 1.849 -5.463) 5.908 35.189 ( -0.431 0.321 -0.305) 0.618 35.288 ( 0.188 0.209 0.596) 0.659 36.136 ( -0.485 -0.526 1.511) 1.672 36.233 ( 0.360 0.763 -1.132) 1.412 44.301 ( 4.391 -3.260 -1.368) 5.637 44.392 ( 0.496 -2.813 2.139) 3.568 44.640 ( 1.573 3.123 0.220) 3.504 45.016 ( -3.438 7.255 -3.023) 8.579 46.566 ( -5.531 -3.090 2.039) 6.656 46.856 ( -7.536 -11.432 -5.029) 14.587 47.147 ( 3.585 4.283 6.507) 8.576 47.847 ( 4.742 3.183 -1.739) 5.970 50.795 ( -6.020 -23.795 4.746) 24.999 51.850 ( -0.961 -48.915 -6.493) 49.354 55.308 ( -10.577 54.732 -13.566) 57.372 56.911 ( -26.168 37.369 20.541) 50.032 70.219 ( -1.251 -24.319 0.070) 24.351 70.809 ( -3.106 -42.723 -2.498) 42.909 74.628 ( 6.950 9.370 7.321) 13.773 74.853 ( 23.691 19.662 -6.658) 31.499 ======================= Grid point 209 (105/150) ======================= q-point: (-0.50 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( 10.057 10.070 6.588) 15.682 1.755 ( -0.874 6.678 7.524) 10.098 1.858 ( 1.038 7.016 0.482) 7.109 2.160 ( 1.496 6.248 -0.047) 6.425 2.397 ( 6.621 7.659 -7.721) 12.732 2.825 ( 4.423 -0.213 1.112) 4.565 3.050 ( -6.431 -5.690 -3.514) 9.278 3.266 ( -5.039 -2.240 0.944) 5.595 3.509 ( -5.624 1.193 -0.718) 5.793 3.558 ( -3.086 -3.076 6.002) 7.416 3.775 ( 4.155 2.494 -4.696) 6.749 3.948 ( 4.065 -0.348 0.045) 4.080 4.223 ( 5.827 1.280 -2.898) 6.632 4.364 ( 1.458 -1.024 -0.080) 1.784 4.550 ( -0.830 10.095 -1.520) 10.242 4.954 ( -2.752 -1.840 2.955) 4.438 5.378 ( 0.072 0.893 -1.707) 1.928 5.451 ( -3.342 -6.511 5.538) 9.177 5.689 ( 0.843 0.041 0.220) 0.872 5.757 ( -0.503 -2.020 -4.076) 4.577 6.490 ( 0.526 -11.543 0.142) 11.555 6.801 ( -2.175 -9.472 3.312) 10.267 6.986 ( 2.288 9.756 1.133) 10.085 7.201 ( -0.956 14.154 4.785) 14.972 7.359 ( 2.262 -0.465 -1.896) 2.988 7.621 ( -3.451 -1.665 -2.088) 4.364 7.730 ( -1.530 -1.830 6.267) 6.705 8.007 ( 1.044 3.290 -6.600) 7.448 10.171 ( 0.370 -0.785 -6.450) 6.508 10.552 ( -0.668 -5.660 -5.420) 7.865 11.501 ( 0.413 -1.683 2.584) 3.111 11.661 ( -3.051 -1.744 2.622) 4.385 14.074 ( -4.916 -24.881 3.716) 25.633 14.686 ( -4.783 -25.480 -6.597) 26.751 15.595 ( 9.515 23.667 0.659) 25.517 15.782 ( 3.760 14.731 0.163) 15.204 27.203 ( 0.236 0.603 0.260) 0.698 27.232 ( -0.019 0.261 0.216) 0.339 27.631 ( 0.073 -0.865 0.203) 0.891 27.684 ( 0.052 -0.386 -0.241) 0.458 27.847 ( -0.023 1.943 -1.153) 2.260 27.868 ( -0.371 -1.403 0.802) 1.658 31.645 ( -0.191 3.408 1.078) 3.579 31.856 ( -2.056 -3.791 6.036) 7.418 32.181 ( 1.077 -3.606 0.674) 3.823 32.520 ( 0.454 2.857 -5.070) 5.838 35.180 ( -0.067 0.294 0.150) 0.337 35.285 ( -0.309 0.149 0.387) 0.517 36.144 ( -0.110 -0.882 0.901) 1.266 36.223 ( 0.184 1.041 -0.604) 1.218 44.364 ( -0.039 0.931 1.257) 1.565 44.469 ( 3.605 -4.916 -1.761) 6.345 44.627 ( 1.159 2.574 -0.184) 2.829 44.847 ( -3.910 6.198 -0.436) 7.341 46.567 ( -3.211 -5.507 2.319) 6.783 46.919 ( -5.911 -12.223 -5.902) 14.805 47.150 ( 5.320 5.806 6.254) 10.056 47.837 ( 1.399 4.334 -1.840) 4.912 51.165 ( -4.565 -34.529 7.524) 35.633 52.458 ( -6.634 -39.765 -11.969) 42.054 54.554 ( 16.690 46.963 -10.737) 50.984 56.166 ( -16.881 22.578 20.143) 34.648 70.522 ( -0.224 -17.896 1.157) 17.935 71.325 ( -3.816 -35.584 -3.677) 35.977 74.568 ( 3.363 11.595 9.233) 15.199 74.854 ( 23.691 28.066 -11.240) 38.410 ======================= Grid point 210 (106/150) ======================= q-point: (-0.38 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( -0.970 12.991 10.992) 17.045 1.752 ( -1.797 6.489 8.690) 10.994 1.786 ( 9.638 2.421 -2.916) 10.357 2.078 ( -3.612 3.067 -1.553) 4.987 2.355 ( 7.814 11.094 -5.468) 14.630 2.883 ( 2.827 0.686 -4.018) 4.960 3.048 ( -7.432 -6.651 5.079) 11.192 3.223 ( -2.452 -1.464 1.302) 3.139 3.314 ( -9.446 5.873 -1.549) 11.230 3.480 ( -5.994 5.069 6.870) 10.431 3.794 ( 6.237 4.931 -1.390) 8.071 4.012 ( 3.709 1.909 0.500) 4.202 4.244 ( 2.463 4.350 -3.685) 6.211 4.373 ( -1.942 4.916 0.572) 5.317 4.471 ( 3.316 -2.854 0.670) 4.426 4.908 ( -5.414 -0.833 1.701) 5.736 5.410 ( 2.216 -2.356 -0.573) 3.285 5.515 ( -1.342 -5.290 5.427) 7.697 5.712 ( 0.941 -1.583 -1.248) 2.225 5.761 ( -1.039 -1.034 -5.458) 5.651 6.655 ( 1.155 -5.360 0.931) 5.561 6.725 ( -0.474 10.460 5.507) 11.831 6.998 ( -1.854 3.230 3.703) 5.252 7.068 ( 1.101 -4.576 0.754) 4.766 7.421 ( 2.620 -3.829 -3.534) 5.832 7.586 ( -6.079 -4.907 -1.661) 7.987 7.768 ( -0.142 -3.297 5.126) 6.096 8.005 ( 3.117 0.372 -8.114) 8.700 10.176 ( 3.045 2.666 -4.640) 6.157 10.579 ( -2.503 -2.887 -7.177) 8.131 11.592 ( 3.049 -5.946 -0.709) 6.720 11.651 ( -2.650 -2.964 3.526) 5.314 14.362 ( 0.655 -16.957 4.221) 17.486 14.970 ( -4.692 -23.717 -6.530) 25.043 15.381 ( 11.708 27.244 -2.657) 29.772 15.591 ( -1.191 13.459 2.022) 13.662 27.193 ( 0.005 1.077 0.463) 1.173 27.232 ( -0.238 -0.469 -0.127) 0.541 27.644 ( 0.271 -0.472 0.186) 0.575 27.681 ( -0.181 0.521 0.086) 0.559 27.824 ( 0.546 1.362 0.281) 1.494 27.897 ( 0.016 -2.650 -0.784) 2.764 31.613 ( 1.163 2.491 4.133) 4.964 31.888 ( -2.814 -4.694 3.358) 6.422 32.255 ( 1.833 -3.321 -0.717) 3.861 32.467 ( -0.119 3.723 -4.416) 5.777 35.181 ( 0.429 0.003 0.757) 0.870 35.276 ( -0.722 0.059 0.116) 0.734 36.160 ( 0.270 -0.970 0.338) 1.062 36.207 ( -0.074 1.064 0.044) 1.068 44.320 ( 0.110 4.253 0.361) 4.269 44.494 ( -4.368 5.371 -0.058) 6.923 44.653 ( 5.612 -4.233 -3.232) 7.737 44.778 ( -1.848 -1.741 2.349) 3.459 46.626 ( -0.653 -5.785 3.476) 6.780 46.995 ( -3.903 -8.705 -5.832) 11.182 47.172 ( 6.469 3.770 5.053) 9.032 47.758 ( -2.210 5.283 -2.077) 6.092 51.534 ( -3.115 -17.008 6.155) 18.353 52.620 ( -10.703 -2.555 -17.628) 20.781 54.602 ( 42.649 4.253 -0.598) 42.864 55.906 ( -14.304 -18.564 18.403) 29.797 70.706 ( 3.242 -2.413 6.638) 7.771 71.682 ( -1.611 -19.540 -11.807) 22.886 74.428 ( -2.201 10.255 9.672) 14.267 74.730 ( 20.113 31.762 -15.161) 40.537 ======================= Grid point 211 (107/150) ======================= q-point: (-0.25 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 0.346 11.314 15.006) 18.796 1.630 ( -3.780 6.532 11.279) 13.570 1.833 ( 1.896 7.869 -0.198) 8.097 1.999 ( -1.496 -0.988 -9.382) 9.552 2.323 ( 9.153 8.835 -0.659) 12.739 2.805 ( -7.207 6.357 -4.827) 10.754 3.005 ( -6.726 -0.128 12.346) 14.060 3.186 ( -0.233 -2.508 -0.439) 2.556 3.244 ( 3.164 2.610 3.617) 5.469 3.335 ( -4.363 0.439 2.965) 5.293 3.788 ( 6.181 9.907 0.853) 11.708 3.989 ( 0.447 5.525 -1.991) 5.889 4.152 ( -1.208 6.414 2.492) 6.986 4.327 ( -0.888 -1.231 -5.469) 5.676 4.579 ( 3.088 -3.173 4.358) 6.212 4.861 ( -4.230 -3.904 -1.067) 5.854 5.481 ( 2.211 -2.044 1.087) 3.201 5.565 ( -1.752 -3.484 4.388) 5.870 5.732 ( -0.230 0.964 -1.847) 2.096 5.769 ( 0.275 -4.067 -5.417) 6.780 6.547 ( 2.814 13.174 1.882) 13.602 6.643 ( -1.772 9.004 1.105) 9.243 7.035 ( 0.371 -9.571 5.614) 11.103 7.163 ( -0.128 -4.656 2.818) 5.444 7.496 ( 1.112 -0.795 -1.802) 2.261 7.627 ( -7.167 -16.245 -2.269) 17.900 7.830 ( -0.090 -4.854 1.707) 5.146 8.052 ( 3.822 -1.264 -9.694) 10.496 10.171 ( 3.976 4.802 0.984) 6.312 10.550 ( -2.575 -0.745 -9.832) 10.191 11.668 ( -1.048 -3.200 2.464) 4.173 11.733 ( 1.580 -6.583 -3.282) 7.524 14.512 ( 3.419 5.273 5.022) 8.045 15.012 ( 1.628 20.438 -13.283) 24.430 15.314 ( 6.972 -5.217 0.498) 8.722 15.460 ( -5.630 -6.486 2.856) 9.051 27.178 ( -0.064 0.971 1.124) 1.487 27.236 ( -0.293 -0.712 -1.103) 1.345 27.651 ( 0.365 0.219 0.138) 0.448 27.668 ( -0.287 0.709 0.143) 0.778 27.825 ( 0.810 0.288 1.930) 2.113 27.935 ( -0.058 -2.726 -2.111) 3.448 31.622 ( 2.367 1.211 6.628) 7.142 31.915 ( -3.413 -5.044 0.473) 6.108 32.314 ( 0.030 -1.534 -0.934) 1.796 32.409 ( 1.277 3.204 -4.174) 5.414 35.196 ( 0.887 -0.402 1.189) 1.537 35.263 ( -0.937 -0.004 -0.184) 0.954 36.175 ( 0.290 0.065 0.518) 0.597 36.196 ( -0.090 -0.132 0.079) 0.179 44.262 ( 1.458 4.951 -0.514) 5.187 44.326 ( -4.380 6.772 0.619) 8.088 44.770 ( -2.250 -3.941 3.545) 5.759 44.833 ( 4.598 -5.607 -4.388) 8.475 46.714 ( 1.266 -4.271 5.517) 7.091 47.017 ( -1.300 -1.180 -2.983) 3.462 47.262 ( 5.905 -1.924 1.112) 6.310 47.614 ( -5.456 5.833 -2.212) 8.288 51.509 ( 1.394 17.815 2.460) 18.038 52.234 ( -9.504 26.546 -16.523) 32.681 55.681 ( 51.062 -49.928 4.973) 71.588 56.296 ( -16.224 -58.419 15.951) 62.693 70.670 ( 4.786 19.144 13.556) 23.940 71.732 ( 0.862 11.427 -26.780) 29.129 74.267 ( -5.977 3.680 7.590) 10.338 74.528 ( 11.816 24.648 -13.455) 30.466 ======================= Grid point 212 (108/150) ======================= q-point: (-0.12 0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.228 ( 4.429 7.618 16.309) 18.538 1.467 ( -6.614 7.603 13.462) 16.816 1.683 ( -1.690 8.720 2.701) 9.283 1.996 ( 1.059 -0.918 -10.397) 10.491 2.374 ( 9.680 6.024 1.102) 11.454 2.582 ( -6.857 4.624 0.700) 8.300 2.917 ( -1.342 4.291 14.326) 15.015 3.216 ( 3.726 6.787 2.661) 8.187 3.310 ( 2.152 -7.739 -1.489) 8.170 3.404 ( 5.625 -6.897 -2.518) 9.249 3.686 ( 2.135 11.949 3.110) 12.530 3.871 ( -3.515 6.058 -5.802) 9.094 4.093 ( 0.707 2.254 4.242) 4.855 4.324 ( -1.485 -1.611 -6.922) 7.261 4.669 ( 2.163 -3.079 6.410) 7.432 4.891 ( -1.346 -5.463 -3.449) 6.599 5.528 ( 1.364 -0.259 2.550) 2.904 5.570 ( -2.392 -1.017 2.265) 3.448 5.709 ( -0.820 0.688 0.236) 1.096 5.838 ( 0.634 -4.892 -5.219) 7.182 6.418 ( 1.441 9.982 1.344) 10.175 6.462 ( -0.908 10.965 -0.792) 11.031 7.186 ( 1.916 -4.731 4.408) 6.744 7.226 ( -1.139 -5.978 5.022) 7.890 7.507 ( -1.019 -1.864 1.876) 2.834 7.750 ( -6.890 -13.686 -0.475) 15.330 7.904 ( -0.841 -5.775 -4.063) 7.111 8.129 ( 3.440 -3.757 -9.569) 10.840 10.169 ( 2.090 2.415 5.994) 6.791 10.507 ( -1.457 -0.090 -10.507) 10.608 11.688 ( -0.804 0.214 1.144) 1.415 11.795 ( -1.069 -1.981 -4.079) 4.658 14.303 ( -1.872 23.854 4.929) 24.429 14.638 ( 1.478 26.431 -10.466) 28.466 15.553 ( 5.049 -12.933 0.947) 13.916 15.587 ( -2.172 -14.560 -0.668) 14.736 27.168 ( 0.071 0.656 1.614) 1.744 27.239 ( -0.195 -0.582 -1.885) 1.983 27.652 ( -0.151 0.151 0.251) 0.329 27.655 ( 0.179 0.609 0.008) 0.635 27.840 ( 0.599 -0.104 3.080) 3.139 27.964 ( -0.452 -2.134 -2.952) 3.671 31.666 ( 2.956 -0.029 8.245) 8.759 31.930 ( -3.858 -4.837 -2.668) 6.738 32.265 ( -3.008 3.227 0.842) 4.491 32.432 ( 3.542 -0.396 -4.734) 5.926 35.220 ( 0.860 -0.598 1.196) 1.590 35.249 ( -0.708 -0.013 -0.414) 0.820 36.167 ( -0.400 0.520 1.437) 1.580 36.210 ( 0.470 -0.865 -0.681) 1.197 44.189 ( -2.325 4.962 0.938) 5.559 44.226 ( 2.745 4.116 -0.883) 5.025 44.767 ( -4.522 -2.776 4.581) 7.010 44.985 ( 5.050 -5.186 -5.957) 9.374 46.783 ( 0.606 -0.917 7.480) 7.560 47.009 ( 0.462 -0.007 -1.543) 1.611 47.348 ( -1.200 2.811 0.543) 3.105 47.466 ( -0.567 0.264 -3.235) 3.295 51.146 ( 0.794 32.156 6.331) 32.783 51.665 ( -4.474 30.094 -16.473) 34.598 56.948 ( -21.284 -64.007 15.007) 69.102 57.398 ( 36.887 -81.672 -3.676) 89.691 70.335 ( 1.715 34.941 14.796) 37.984 71.216 ( -2.590 50.927 -33.481) 61.002 74.207 ( -3.047 -4.468 4.691) 7.159 74.399 ( 4.593 7.047 -5.681) 10.150 ======================= Grid point 215 (109/150) ======================= q-point: ( 0.25 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( 12.749 0.000 9.416) 15.849 1.982 ( 11.600 0.000 4.326) 12.380 1.995 ( 6.994 0.000 2.903) 7.573 2.472 ( 9.295 0.000 -6.184) 11.164 2.549 ( -0.822 -0.000 10.466) 10.499 2.614 ( 8.038 0.000 -10.376) 13.125 3.096 ( -5.157 -0.000 -1.123) 5.278 3.143 ( 0.177 0.000 5.555) 5.558 3.326 ( -2.200 -0.000 -2.933) 3.666 3.332 ( -0.410 -0.000 -2.674) 2.705 3.636 ( 5.772 0.000 -3.845) 6.936 3.999 ( -6.594 -0.000 -1.174) 6.698 4.196 ( 5.031 0.000 0.286) 5.039 4.363 ( 9.563 0.000 -7.944) 12.432 4.842 ( 0.184 0.000 4.873) 4.876 4.885 ( -0.347 -0.000 -6.463) 6.473 5.337 ( -8.325 -0.000 3.357) 8.977 5.589 ( -0.553 -0.000 3.688) 3.729 5.623 ( -3.617 -0.000 -5.719) 6.767 5.711 ( -1.872 -0.000 0.062) 1.873 6.318 ( 2.860 0.000 -4.026) 4.938 6.413 ( 0.638 0.000 0.718) 0.960 7.205 ( 0.684 0.000 -3.238) 3.309 7.380 ( 1.479 0.000 3.672) 3.959 7.576 ( -0.751 -0.000 13.476) 13.497 7.641 ( -3.571 -0.000 4.480) 5.729 7.762 ( -4.499 -0.000 -3.726) 5.842 8.214 ( -1.174 -0.000 -8.894) 8.971 10.124 ( -1.545 -0.000 8.864) 8.997 10.389 ( -1.995 -0.000 -5.708) 6.047 11.527 ( -2.629 -0.000 10.055) 10.393 11.598 ( -2.966 -0.000 -6.480) 7.127 13.376 ( -8.090 -0.000 7.203) 10.832 14.089 ( -3.365 -0.000 -10.528) 11.053 16.035 ( 6.537 0.000 1.334) 6.672 16.061 ( 6.571 0.000 0.094) 6.572 27.202 ( 0.683 0.000 2.059) 2.169 27.251 ( 0.565 0.000 -1.914) 1.995 27.630 ( -0.183 -0.000 -0.364) 0.408 27.631 ( -0.468 -0.000 -0.196) 0.508 27.853 ( -0.809 -0.000 3.504) 3.596 27.923 ( -0.776 -0.000 -3.139) 3.233 31.786 ( -2.392 -0.000 8.679) 9.002 31.786 ( -1.279 -0.000 -7.738) 7.843 32.054 ( -0.371 -0.000 8.119) 8.128 32.577 ( 1.562 0.000 -5.995) 6.195 35.194 ( -0.413 -0.000 -0.509) 0.656 35.291 ( 0.028 0.000 0.284) 0.285 36.130 ( -0.595 -0.000 2.353) 2.427 36.244 ( 0.426 0.000 -1.731) 1.783 44.252 ( 5.036 0.000 -1.874) 5.373 44.344 ( 1.349 0.000 2.749) 3.062 44.696 ( 1.218 0.000 1.261) 1.753 45.137 ( -2.702 -0.000 -4.747) 5.462 46.549 ( -7.250 -0.000 3.664) 8.123 46.630 ( -8.190 -0.000 -5.486) 9.857 47.206 ( 3.135 0.000 6.856) 7.539 47.899 ( 5.203 0.000 -3.286) 6.154 50.693 ( -6.614 -0.000 16.157) 17.458 50.763 ( -1.461 -0.000 -17.490) 17.551 56.221 ( -17.743 -0.000 -12.959) 21.972 57.551 ( -40.446 -0.000 23.054) 46.555 69.896 ( 6.759 0.000 1.952) 7.035 69.922 ( 1.180 0.000 -3.245) 3.453 74.799 ( 9.745 0.000 9.391) 13.533 75.163 ( 26.309 0.000 -7.963) 27.488 ======================= Grid point 216 (110/150) ======================= q-point: ( 0.38 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( 9.833 3.242 9.885) 14.315 1.982 ( 4.999 9.528 1.489) 10.862 2.085 ( 0.300 4.243 -0.032) 4.253 2.401 ( 3.771 10.410 4.413) 11.919 2.669 ( 12.470 9.041 -7.554) 17.155 2.722 ( 2.380 -7.093 -1.877) 7.713 2.964 ( -7.168 -0.153 -7.210) 10.168 3.249 ( -0.103 -3.422 2.946) 4.516 3.303 ( 0.091 -6.294 1.403) 6.449 3.417 ( 0.661 -5.541 2.059) 5.948 3.708 ( 3.729 -2.035 -5.953) 7.314 3.926 ( -5.230 -2.830 1.163) 6.060 4.272 ( 6.803 2.169 -0.090) 7.141 4.451 ( 6.156 3.603 -5.500) 9.007 4.821 ( 0.596 6.413 -4.556) 7.889 4.877 ( -0.314 -2.484 2.773) 3.737 5.248 ( -8.226 -5.382 4.637) 10.869 5.469 ( -4.098 4.673 -4.208) 7.506 5.642 ( -1.284 -4.205 -1.158) 4.546 5.718 ( 0.896 0.066 0.985) 1.333 6.315 ( 0.616 0.474 -1.980) 2.127 6.493 ( -0.854 -8.520 0.130) 8.563 7.208 ( 2.705 2.998 -3.279) 5.201 7.388 ( 0.823 1.618 2.385) 2.997 7.532 ( -2.028 6.175 7.834) 10.179 7.607 ( -1.384 0.415 5.525) 5.711 7.693 ( -4.478 -0.970 2.107) 5.043 8.150 ( -0.311 4.536 -8.655) 9.776 10.120 ( -1.286 -0.950 4.614) 4.883 10.382 ( -1.295 -3.989 -5.846) 7.195 11.515 ( -2.992 -0.505 5.005) 5.853 11.560 ( -2.220 -2.676 -0.588) 3.527 13.400 ( -5.503 -15.201 7.564) 17.849 14.106 ( -3.657 -11.598 -10.435) 16.024 16.068 ( 6.281 8.669 1.969) 10.885 16.123 ( 7.196 6.407 -0.970) 9.684 27.213 ( 0.471 0.172 1.733) 1.804 27.252 ( 0.485 0.625 -1.403) 1.610 27.616 ( -0.216 0.208 -0.131) 0.327 27.647 ( -0.076 -1.668 -0.672) 1.800 27.845 ( -0.910 -0.130 3.061) 3.196 27.901 ( -0.359 1.113 -2.649) 2.895 31.733 ( -1.621 2.114 -0.864) 2.801 31.777 ( -1.830 -1.482 2.682) 3.569 32.089 ( 0.949 -2.165 7.614) 7.973 32.578 ( 0.846 1.060 -6.163) 6.310 35.188 ( -0.176 0.156 -0.387) 0.453 35.287 ( -0.601 -0.021 -0.070) 0.605 36.128 ( -0.275 -0.208 2.424) 2.449 36.245 ( 0.373 0.415 -1.765) 1.851 44.336 ( 4.693 -1.205 -1.518) 5.077 44.377 ( 1.260 -1.588 2.201) 2.992 44.703 ( 1.364 2.077 0.916) 2.648 45.042 ( -4.253 4.740 -3.595) 7.313 46.444 ( -6.079 -1.303 1.794) 6.471 46.586 ( -6.975 -8.947 -3.846) 11.979 47.259 ( 4.186 1.717 6.712) 8.095 47.937 ( 2.378 1.988 -4.328) 5.323 50.525 ( -4.871 -3.378 5.506) 8.090 51.108 ( -5.339 -39.550 -8.818) 40.871 55.819 ( -1.558 29.054 -12.919) 31.835 56.916 ( -28.968 17.248 23.934) 41.346 69.977 ( 3.095 -10.526 -0.466) 10.981 70.251 ( 1.120 -28.744 -1.561) 28.808 74.908 ( 9.360 7.829 13.204) 17.978 75.471 ( 26.863 11.562 -13.426) 32.180 ======================= Grid point 217 (111/150) ======================= q-point: (-0.50 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -2.159 10.014 3.419) 10.799 1.911 ( 8.464 7.717 9.579) 14.931 1.978 ( -0.156 7.516 -2.774) 8.013 2.306 ( 1.729 10.250 3.802) 11.068 2.697 ( 13.572 11.955 -5.532) 18.913 2.831 ( 0.904 -4.694 -5.659) 7.407 2.889 ( -5.120 -3.655 -4.664) 7.831 3.234 ( 0.483 3.612 2.134) 4.223 3.398 ( -6.125 -6.402 3.108) 9.389 3.459 ( -2.345 -1.357 1.289) 3.001 3.791 ( 1.805 -3.843 -4.617) 6.272 3.929 ( -1.515 -5.030 -0.023) 5.253 4.349 ( 6.759 1.498 0.872) 6.978 4.437 ( 2.966 5.531 -1.971) 6.578 4.695 ( 0.493 9.903 -3.022) 10.365 4.898 ( -2.219 -0.307 1.260) 2.570 5.274 ( -4.615 -10.103 5.157) 12.246 5.386 ( -0.761 0.328 -2.425) 2.563 5.681 ( -0.004 -2.769 -2.428) 3.682 5.718 ( -0.360 0.463 -1.237) 1.369 6.367 ( 0.915 -6.804 0.042) 6.865 6.603 ( -3.409 -10.965 0.949) 11.522 7.170 ( 3.005 8.382 -0.021) 8.905 7.340 ( -3.388 6.995 2.327) 8.113 7.419 ( 1.483 5.242 2.940) 6.190 7.563 ( -2.843 1.106 -0.100) 3.052 7.688 ( -1.195 -2.494 8.357) 8.802 8.078 ( 1.784 4.414 -8.644) 9.869 10.141 ( 0.515 -2.984 -1.238) 3.271 10.428 ( -1.979 -6.051 -7.055) 9.503 11.490 ( -0.904 -0.614 4.109) 4.252 11.581 ( -2.031 -3.569 1.707) 4.447 13.644 ( -2.815 -24.544 8.326) 26.070 14.272 ( -3.639 -20.612 -9.800) 23.111 15.985 ( 4.664 14.884 2.885) 15.862 16.083 ( 6.943 13.601 -3.344) 15.633 27.216 ( 0.284 0.361 0.963) 1.067 27.242 ( 0.121 1.139 -0.508) 1.253 27.619 ( 0.070 -0.775 0.204) 0.804 27.670 ( -0.032 -1.459 -0.894) 1.711 27.842 ( -0.795 -0.883 2.042) 2.363 27.875 ( 0.191 1.723 -1.838) 2.527 31.685 ( -0.734 1.859 1.392) 2.435 31.781 ( -1.756 -2.210 2.400) 3.705 32.157 ( 1.583 -3.026 5.451) 6.433 32.553 ( 0.158 2.127 -6.134) 6.494 35.184 ( 0.164 0.161 0.055) 0.237 35.274 ( -1.102 -0.149 -0.298) 1.152 36.136 ( 0.087 -0.556 2.086) 2.161 36.238 ( 0.216 0.841 -1.487) 1.722 44.386 ( 1.369 0.243 1.805) 2.279 44.460 ( 3.699 -3.491 -2.091) 5.499 44.682 ( 0.567 2.806 0.979) 3.025 44.879 ( -4.432 7.059 -1.833) 8.534 46.429 ( -3.609 -6.128 2.459) 7.525 46.644 ( -5.204 -12.354 -4.399) 14.109 47.304 ( 5.140 3.196 6.738) 9.057 47.900 ( -0.672 3.846 -5.007) 6.349 50.689 ( -2.237 -24.291 9.399) 26.142 51.630 ( -8.867 -47.784 -14.952) 50.847 55.417 ( 16.790 36.324 -10.107) 41.274 56.270 ( -21.196 23.965 20.852) 38.189 70.254 ( 2.863 -19.946 1.633) 20.216 70.711 ( -3.027 -36.186 -3.832) 36.514 74.882 ( 6.285 15.624 16.068) 23.276 75.590 ( 23.813 21.990 -19.621) 37.889 ======================= Grid point 218 (112/150) ======================= q-point: (-0.38 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -2.056 11.576 6.452) 13.411 1.853 ( -1.052 8.109 3.259) 8.803 1.961 ( 6.013 2.700 1.599) 6.783 2.165 ( 1.126 12.245 1.908) 12.444 2.700 ( 10.695 14.414 -4.821) 18.585 2.856 ( -5.214 -4.855 1.079) 7.205 2.910 ( 3.180 -3.214 -8.114) 9.289 3.166 ( -7.140 6.131 -0.879) 9.452 3.284 ( -2.186 0.495 3.890) 4.489 3.438 ( -4.276 0.015 3.312) 5.408 3.868 ( 2.581 -2.843 -0.769) 3.916 3.994 ( -1.606 -5.458 -1.456) 5.873 4.381 ( 4.019 6.333 -0.165) 7.502 4.412 ( -1.144 3.003 3.190) 4.528 4.593 ( 6.581 7.684 -2.611) 10.448 4.815 ( -6.518 1.107 0.213) 6.614 5.380 ( -0.823 -8.329 3.340) 9.011 5.415 ( 0.420 -3.511 1.101) 3.703 5.694 ( -0.721 -0.400 -1.909) 2.079 5.718 ( -0.123 -1.830 -4.669) 5.016 6.528 ( 1.666 -11.309 2.841) 11.779 6.714 ( -3.853 -11.340 0.851) 12.007 7.056 ( 0.697 11.318 4.545) 12.216 7.152 ( -1.923 10.113 0.304) 10.299 7.401 ( -1.072 0.107 2.254) 2.498 7.516 ( -0.198 1.372 -2.487) 2.847 7.730 ( -0.135 -2.662 6.619) 7.136 8.058 ( 3.269 1.937 -9.572) 10.299 10.219 ( 3.493 -3.516 -3.750) 6.215 10.452 ( -3.888 -4.709 -8.039) 10.095 11.527 ( -0.861 -4.681 4.661) 6.662 11.606 ( 0.491 -1.989 0.489) 2.106 14.019 ( -0.236 -27.488 9.443) 29.066 14.544 ( -3.011 -25.076 -9.409) 26.951 15.787 ( 1.071 18.917 3.705) 19.307 15.929 ( 6.328 20.480 -6.671) 22.450 27.214 ( 0.407 1.056 0.177) 1.145 27.226 ( -0.394 0.476 0.237) 0.661 27.637 ( 0.192 -1.055 0.559) 1.209 27.680 ( -0.206 -0.313 -0.578) 0.689 27.852 ( -0.213 -0.040 -0.016) 0.217 27.859 ( 0.295 -0.586 -0.375) 0.755 31.665 ( 0.296 1.023 3.794) 3.940 31.793 ( -1.790 -2.671 1.716) 3.645 32.234 ( 1.549 -3.165 3.122) 4.708 32.506 ( -0.232 2.922 -5.920) 6.606 35.190 ( 0.605 -0.053 0.709) 0.933 35.258 ( -1.367 -0.292 -0.404) 1.455 36.153 ( 0.390 -0.893 1.466) 1.761 36.222 ( -0.058 1.192 -0.982) 1.546 44.391 ( 2.035 2.741 0.819) 3.510 44.506 ( -1.565 2.558 -1.473) 3.341 44.674 ( 1.450 -1.000 0.621) 1.868 44.747 ( -1.659 2.167 -0.620) 2.799 46.509 ( -1.084 -8.581 4.132) 9.585 46.759 ( -3.420 -12.939 -5.386) 14.426 47.344 ( 5.919 4.032 6.678) 9.792 47.792 ( -3.387 5.623 -5.225) 8.389 51.131 ( 0.820 -32.639 13.328) 35.265 52.110 ( -9.442 -38.502 -21.528) 45.111 55.320 ( 26.216 19.888 -4.505) 33.213 55.689 ( -17.103 15.513 15.571) 27.850 70.603 ( 3.887 -18.601 6.807) 20.185 71.167 ( -4.956 -35.515 -9.389) 37.068 74.691 ( 0.778 21.132 16.808) 27.013 75.487 ( 17.070 30.663 -25.812) 43.564 ======================= Grid point 219 (113/150) ======================= q-point: (-0.25 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -0.180 9.791 10.178) 14.123 1.714 ( -2.233 9.044 8.485) 12.600 1.969 ( -1.125 5.503 -3.923) 6.851 2.039 ( 4.969 8.060 -2.309) 9.746 2.592 ( 2.204 8.852 0.335) 9.129 2.779 ( -11.222 10.472 -6.467) 16.656 2.920 ( 4.393 -2.360 4.484) 6.706 3.124 ( 4.401 -8.207 -4.712) 10.437 3.318 ( -0.363 1.081 6.471) 6.570 3.370 ( 3.179 3.609 1.904) 5.172 3.925 ( 0.791 0.372 1.669) 1.884 4.000 ( -3.449 -0.774 -2.124) 4.124 4.256 ( -2.878 10.211 2.428) 10.883 4.356 ( 2.579 4.907 -1.811) 5.832 4.611 ( -0.269 0.805 3.541) 3.641 4.762 ( 1.290 -2.255 -2.996) 3.965 5.466 ( -2.547 -4.865 3.226) 6.369 5.486 ( 2.187 -3.912 1.846) 4.847 5.707 ( -0.137 -3.206 -3.897) 5.048 5.720 ( -0.993 -0.185 -2.617) 2.805 6.692 ( -0.058 -2.294 3.668) 4.327 6.756 ( 2.149 4.144 1.743) 4.983 6.936 ( -2.931 0.047 4.851) 5.668 7.066 ( -1.037 -3.745 -0.447) 3.911 7.384 ( -4.404 -3.148 2.898) 6.140 7.520 ( 2.925 0.035 -3.347) 4.445 7.773 ( -0.440 -2.828 4.188) 5.073 8.077 ( 2.717 0.144 -10.304) 10.657 10.305 ( 5.772 2.300 -2.464) 6.684 10.435 ( -4.825 -4.990 -9.029) 11.389 11.572 ( -2.915 -4.423 4.348) 6.853 11.683 ( 2.580 -4.780 -1.638) 5.674 14.410 ( 0.603 -20.924 9.982) 23.191 14.850 ( -1.320 -22.568 -10.141) 24.777 15.492 ( -3.985 18.744 3.432) 19.468 15.680 ( 5.693 22.692 -8.286) 24.819 27.198 ( 0.209 1.459 0.675) 1.621 27.222 ( -0.254 -0.434 -0.411) 0.649 27.651 ( -0.029 -0.471 0.670) 0.820 27.674 ( -0.107 0.442 -0.241) 0.515 27.847 ( 0.643 0.751 0.698) 1.210 27.886 ( -0.508 -2.789 -1.336) 3.134 31.676 ( 1.072 -0.075 5.784) 5.883 31.807 ( -1.887 -2.749 0.851) 3.441 32.291 ( -0.010 -1.636 1.139) 1.994 32.456 ( 0.622 2.302 -5.451) 5.950 35.206 ( 0.984 -0.335 1.279) 1.648 35.241 ( -1.349 -0.428 -0.456) 1.487 36.176 ( 0.586 -0.977 0.748) 1.363 36.200 ( -0.403 1.213 -0.349) 1.325 44.374 ( 2.839 5.287 -0.231) 6.005 44.381 ( -1.873 7.288 -0.473) 7.540 44.670 ( -4.579 -2.751 3.510) 6.392 44.816 ( 4.087 -5.354 -3.661) 7.666 46.637 ( 0.314 -8.151 6.106) 10.189 46.878 ( -2.311 -9.978 -5.561) 11.655 47.397 ( 6.835 2.874 5.702) 9.354 47.622 ( -5.698 7.299 -5.006) 10.526 51.561 ( 3.362 -13.913 13.340) 19.566 52.287 ( -6.315 -4.585 -22.689) 23.993 55.348 ( -23.808 -24.745 16.039) 37.900 55.796 ( 28.554 -17.020 -6.303) 33.834 70.865 ( 3.577 -4.584 13.666) 14.851 71.518 ( -4.595 -23.481 -18.451) 30.214 74.381 ( -4.149 18.786 13.377) 23.432 75.140 ( 6.455 35.531 -26.719) 44.922 ======================= Grid point 220 (114/150) ======================= q-point: (-0.12 0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( -1.355 6.242 13.155) 14.624 1.557 ( -0.697 9.819 11.415) 15.073 1.837 ( 2.162 9.912 -3.977) 10.897 2.009 ( 1.978 2.631 -4.569) 5.632 2.485 ( -10.533 2.522 -4.674) 11.796 2.588 ( 5.885 2.172 1.126) 6.374 3.008 ( 5.443 3.732 9.771) 11.791 3.259 ( 2.732 -0.652 0.712) 2.898 3.399 ( 8.629 -1.690 -4.701) 9.970 3.415 ( 7.185 -3.054 0.922) 7.862 3.823 ( -7.835 4.175 -2.948) 9.355 3.905 ( -1.526 10.952 1.668) 11.183 4.124 ( -1.068 1.836 2.509) 3.287 4.322 ( 0.980 3.506 -2.922) 4.669 4.623 ( -1.936 -5.614 2.931) 6.622 4.846 ( 4.434 -1.459 -1.424) 4.881 5.484 ( -3.096 -3.290 1.943) 4.917 5.563 ( 2.281 -1.506 2.821) 3.928 5.686 ( -2.568 0.442 -0.630) 2.681 5.765 ( 0.174 -4.752 -3.929) 6.169 6.552 ( -2.399 11.799 0.758) 12.064 6.678 ( 3.572 12.864 1.165) 13.401 7.046 ( -1.293 -12.500 6.865) 14.320 7.165 ( -0.177 -8.291 1.133) 8.370 7.377 ( -5.158 -6.153 2.753) 8.488 7.586 ( 2.335 -3.038 -1.517) 4.121 7.814 ( -1.078 -3.954 0.757) 4.168 8.102 ( 0.918 -2.100 -9.482) 9.755 10.288 ( 1.715 6.399 0.363) 6.634 10.448 ( -0.296 -3.091 -9.772) 10.254 11.597 ( -3.292 -4.807 3.501) 6.797 11.767 ( 0.460 -2.706 -2.660) 3.822 14.511 ( -5.262 8.289 5.101) 11.064 14.961 ( -0.117 17.726 -8.884) 19.828 15.300 ( -3.950 -15.176 0.874) 15.706 15.557 ( 5.928 1.709 -3.203) 6.951 27.185 ( 0.244 0.995 1.210) 1.586 27.226 ( -0.056 -0.598 -1.103) 1.256 27.648 ( -0.545 0.271 0.366) 0.710 27.670 ( 0.366 0.502 0.018) 0.621 27.851 ( 0.419 0.146 1.958) 2.008 27.913 ( -0.891 -2.675 -2.324) 3.654 31.713 ( 1.239 -1.215 6.787) 7.006 31.816 ( -2.009 -2.432 0.139) 3.157 32.263 ( -2.493 2.357 -0.138) 3.433 32.463 ( 2.359 -0.631 -4.657) 5.259 35.221 ( -0.598 -0.208 0.254) 0.682 35.239 ( 0.607 -0.748 0.725) 1.206 36.173 ( -0.555 1.105 0.517) 1.340 36.202 ( 0.497 -1.090 -0.122) 1.204 44.256 ( -0.156 6.510 -0.152) 6.514 44.349 ( 3.970 5.734 -0.447) 6.988 44.653 ( -4.767 -3.970 3.296) 7.025 44.952 ( 2.787 -6.547 -4.216) 8.271 46.740 ( -1.347 -4.355 6.272) 7.754 46.958 ( -0.564 -5.710 -2.475) 6.249 47.391 ( -6.670 9.319 -3.496) 11.981 47.502 ( 6.899 -1.079 2.224) 7.328 51.516 ( -4.190 22.941 7.592) 24.525 52.076 ( 4.844 22.419 -14.480) 27.125 55.609 ( -30.047 -61.208 6.693) 68.513 56.697 ( 12.652 -58.358 -1.734) 59.739 70.794 ( -1.684 20.870 14.597) 25.524 71.536 ( -5.231 11.068 -24.476) 27.367 74.169 ( -1.369 3.060 6.486) 7.301 74.674 ( -0.740 24.571 -14.637) 28.610 ======================= Grid point 224 (115/150) ======================= q-point: ( 0.38 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 5.199 0.000 6.578) 8.385 2.078 ( -3.039 -0.000 -0.497) 3.080 2.126 ( 0.677 0.000 3.411) 3.478 2.536 ( -0.913 -0.000 8.474) 8.523 2.686 ( 6.268 0.000 -6.782) 9.235 2.819 ( -4.001 -0.000 -12.773) 13.385 3.008 ( 11.348 0.000 -5.912) 12.796 3.120 ( -2.938 -0.000 8.092) 8.609 3.364 ( 2.749 0.000 1.819) 3.297 3.407 ( 4.743 0.000 -1.095) 4.868 3.724 ( 1.810 0.000 -7.002) 7.233 3.804 ( -6.417 -0.000 3.149) 7.148 4.388 ( 5.438 0.000 2.311) 5.909 4.562 ( 4.892 0.000 -5.059) 7.038 4.872 ( 0.637 0.000 -5.250) 5.288 4.873 ( 1.615 0.000 0.736) 1.775 5.069 ( -9.125 -0.000 5.771) 10.797 5.407 ( -6.162 -0.000 -7.497) 9.704 5.617 ( 1.875 0.000 1.682) 2.519 5.737 ( 0.862 0.000 0.253) 0.899 6.332 ( -1.046 -0.000 -1.669) 1.969 6.386 ( -2.516 -0.000 0.410) 2.549 7.277 ( 4.180 0.000 -4.541) 6.172 7.400 ( -1.481 -0.000 1.905) 2.413 7.555 ( -1.769 -0.000 5.304) 5.591 7.611 ( -4.116 -0.000 1.222) 4.294 7.623 ( 0.212 0.000 10.886) 10.888 8.170 ( 0.415 0.000 -9.944) 9.952 10.106 ( -1.198 -0.000 6.968) 7.070 10.324 ( -0.747 -0.000 -6.240) 6.285 11.454 ( -3.747 -0.000 8.338) 9.141 11.529 ( -0.142 -0.000 -4.682) 4.684 13.247 ( -1.930 -0.000 9.603) 9.795 13.950 ( -3.497 -0.000 -11.631) 12.145 16.210 ( 3.981 0.000 2.654) 4.784 16.278 ( 6.944 0.000 -2.307) 7.317 27.222 ( 0.171 0.000 1.838) 1.846 27.264 ( 0.655 0.000 -1.511) 1.647 27.620 ( -0.198 -0.000 -0.468) 0.508 27.625 ( -0.106 -0.000 -0.545) 0.555 27.834 ( -1.032 -0.000 3.094) 3.262 27.903 ( 0.088 0.000 -2.502) 2.504 31.699 ( -4.236 -0.000 6.498) 7.757 31.767 ( 1.415 0.000 -6.579) 6.730 32.107 ( 1.536 0.000 10.144) 10.260 32.585 ( 0.230 0.000 -6.612) 6.616 35.187 ( 0.079 0.000 -0.292) 0.303 35.271 ( -1.243 -0.000 -0.498) 1.339 36.128 ( -0.067 -0.000 2.879) 2.880 36.251 ( 0.343 0.000 -2.081) 2.109 44.386 ( 1.118 0.000 2.684) 2.907 44.400 ( 4.771 0.000 -2.482) 5.378 44.736 ( 0.504 0.000 1.772) 1.843 45.006 ( -4.431 -0.000 -3.565) 5.687 46.357 ( -5.395 -0.000 2.086) 5.784 46.409 ( -5.168 -0.000 -3.616) 6.307 47.348 ( 4.655 0.000 6.845) 8.278 47.957 ( -0.555 -0.000 -6.275) 6.300 50.462 ( -9.715 -0.000 12.549) 15.871 50.707 ( 1.108 0.000 -16.728) 16.765 56.043 ( 6.551 0.000 -10.119) 12.055 56.655 ( -25.045 -0.000 22.751) 33.836 69.962 ( 1.715 0.000 -0.771) 1.880 70.062 ( 3.649 0.000 -1.601) 3.984 75.129 ( 8.132 0.000 17.223) 19.046 75.910 ( 22.432 0.000 -18.829) 29.287 ======================= Grid point 225 (116/150) ======================= q-point: (-0.50 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.943 ( -2.961 7.494 1.909) 8.281 2.028 ( -1.710 2.818 -0.862) 3.407 2.094 ( 1.059 3.788 10.433) 11.150 2.479 ( 0.752 7.630 4.840) 9.067 2.759 ( -2.507 -3.136 -11.005) 11.715 2.779 ( 1.049 -2.299 -4.508) 5.168 3.029 ( 7.315 6.439 -0.005) 9.745 3.207 ( -1.283 -5.149 1.326) 5.470 3.377 ( 3.929 5.482 -0.613) 6.772 3.443 ( -0.535 2.743 0.438) 2.829 3.743 ( 0.071 -3.818 -2.652) 4.649 3.795 ( -2.832 -6.592 -1.567) 7.343 4.444 ( 2.584 1.046 3.777) 4.694 4.562 ( 2.444 5.622 -2.151) 6.497 4.820 ( 1.306 5.503 -3.293) 6.545 4.880 ( -2.773 1.428 -1.830) 3.616 5.066 ( -2.126 -10.011 5.794) 11.761 5.337 ( -2.486 -2.354 -6.095) 6.990 5.662 ( 2.410 -1.021 -0.440) 2.654 5.733 ( -0.137 1.588 -1.030) 1.898 6.312 ( -0.188 -2.251 0.763) 2.384 6.405 ( -4.715 -7.279 0.829) 8.712 7.308 ( 3.579 3.897 -1.935) 5.634 7.343 ( -4.277 2.144 1.059) 4.900 7.506 ( -1.211 4.549 5.659) 7.361 7.564 ( -0.206 1.330 0.407) 1.406 7.663 ( 0.798 -1.679 9.149) 9.336 8.146 ( 1.723 2.760 -10.466) 10.960 10.108 ( -0.442 -1.539 4.186) 4.482 10.333 ( -0.100 -2.674 -7.413) 7.881 11.437 ( -3.334 -3.020 6.994) 8.316 11.543 ( 1.781 -1.243 -2.738) 3.495 13.357 ( 0.514 -13.844 10.794) 17.562 13.966 ( -3.302 -11.645 -11.802) 16.905 16.199 ( 1.549 7.926 3.289) 8.720 16.317 ( 4.848 6.439 -3.934) 8.968 27.223 ( -0.149 0.180 1.496) 1.514 27.264 ( 0.578 1.081 -1.151) 1.682 27.613 ( 0.002 -0.146 -0.023) 0.147 27.641 ( -0.193 -1.794 -0.973) 2.050 27.824 ( -1.011 -0.223 2.699) 2.891 27.898 ( 0.568 0.937 -2.104) 2.372 31.651 ( -3.925 -0.970 5.632) 6.933 31.782 ( 2.335 0.737 -4.640) 5.246 32.159 ( 1.615 -1.616 9.158) 9.438 32.565 ( -0.389 1.083 -6.858) 6.954 35.190 ( 0.398 0.036 0.106) 0.413 35.250 ( -1.581 -0.187 -0.623) 1.710 36.135 ( 0.123 -0.302 2.812) 2.831 36.248 ( 0.198 0.487 -2.080) 2.145 44.408 ( 1.051 -0.400 1.968) 2.267 44.473 ( 3.365 -1.626 -2.688) 4.604 44.725 ( -0.083 2.161 2.460) 3.276 44.902 ( -3.802 4.677 -2.666) 6.590 46.311 ( -2.747 -3.410 1.929) 4.785 46.415 ( -3.357 -8.683 -2.840) 9.733 47.421 ( 4.889 1.247 7.208) 8.798 47.904 ( -3.085 1.886 -7.280) 8.128 50.414 ( -3.892 -11.122 10.783) 15.972 50.935 ( -2.105 -28.967 -15.516) 32.928 56.047 ( 15.474 18.421 -6.438) 24.904 56.239 ( -22.086 12.892 18.976) 31.845 70.068 ( 2.742 -11.595 1.071) 11.963 70.256 ( -0.696 -20.714 -3.464) 21.013 75.183 ( 4.153 9.734 19.586) 22.263 76.083 ( 14.096 10.182 -23.484) 29.221 ======================= Grid point 226 (117/150) ======================= q-point: (-0.38 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( -2.650 9.168 4.854) 10.707 1.927 ( -2.101 5.086 -1.140) 5.620 2.080 ( 1.824 4.517 10.212) 11.315 2.365 ( 0.635 9.836 2.028) 10.063 2.676 ( -8.473 -0.147 -2.761) 8.913 2.885 ( 5.243 -5.732 -8.178) 11.279 3.045 ( 0.199 4.484 -0.955) 4.589 3.154 ( -0.808 9.757 -3.459) 10.383 3.310 ( 0.514 2.887 4.137) 5.071 3.412 ( 1.814 0.519 -0.681) 2.006 3.824 ( -0.476 -6.545 0.508) 6.582 3.852 ( -2.156 -6.057 -2.389) 6.859 4.437 ( -1.557 2.460 3.979) 4.930 4.514 ( 1.986 5.050 0.962) 5.511 4.749 ( -6.912 5.150 -1.638) 8.774 4.796 ( 6.086 4.165 -3.288) 8.075 5.216 ( -0.802 -10.529 4.856) 11.623 5.382 ( 1.744 -4.511 -3.307) 5.859 5.683 ( -1.315 1.418 -1.597) 2.509 5.713 ( 2.176 0.167 -3.166) 3.845 6.411 ( 1.033 -8.497 3.235) 9.150 6.459 ( -4.894 -11.948 1.101) 12.958 7.197 ( -4.437 7.844 3.677) 9.733 7.278 ( 2.690 7.832 0.132) 8.282 7.420 ( -1.690 4.532 4.731) 6.766 7.559 ( 2.105 1.727 -1.888) 3.313 7.716 ( 1.337 -1.440 6.485) 6.776 8.126 ( 3.019 2.644 -11.015) 11.723 10.159 ( -0.774 -5.821 1.179) 5.990 10.362 ( 1.060 -2.288 -9.367) 9.701 11.455 ( -1.992 -3.630 6.089) 7.364 11.603 ( 2.982 -1.903 -1.358) 3.789 13.669 ( 2.045 -23.385 11.449) 26.118 14.145 ( -2.576 -21.195 -11.300) 24.157 16.040 ( -1.308 14.983 3.722) 15.494 16.223 ( 1.830 12.636 -5.894) 14.062 27.218 ( -0.400 0.125 0.931) 1.021 27.248 ( 0.488 1.814 -0.580) 1.966 27.624 ( 0.114 -1.036 0.545) 1.177 27.661 ( -0.300 -1.525 -1.125) 1.918 27.820 ( -0.960 -0.991 1.738) 2.219 27.889 ( 0.948 1.414 -1.498) 2.268 31.628 ( -3.359 -2.257 5.142) 6.544 31.802 ( 2.888 1.295 -1.883) 3.683 32.223 ( 1.303 -2.297 6.495) 7.011 32.524 ( -0.774 1.873 -6.865) 7.158 35.200 ( 0.765 -0.122 0.738) 1.070 35.229 ( -1.603 -0.386 -0.530) 1.732 36.149 ( 0.267 -0.703 2.309) 2.428 36.236 ( -0.061 0.996 -1.813) 2.069 44.434 ( 0.671 -0.956 1.207) 1.679 44.517 ( 0.611 0.491 -2.889) 2.994 44.688 ( -0.453 3.104 2.696) 4.136 44.781 ( -1.081 4.232 -1.550) 4.635 46.382 ( 0.196 -8.047 3.594) 8.815 46.526 ( -1.715 -12.079 -3.610) 12.723 47.481 ( 4.875 2.194 7.583) 9.278 47.792 ( -4.654 3.886 -7.414) 9.578 50.723 ( 2.237 -29.912 14.067) 33.130 51.366 ( -3.970 -39.026 -19.067) 43.616 55.644 ( -23.067 23.949 15.800) 36.814 56.035 ( 20.741 20.103 -4.384) 29.216 70.363 ( 2.658 -21.149 4.693) 21.826 70.597 ( -2.873 -31.019 -6.687) 31.861 75.020 ( -1.788 19.355 19.677) 27.658 75.966 ( 3.417 19.204 -27.031) 33.333 ======================= Grid point 227 (118/150) ======================= q-point: (-0.25 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( -1.715 9.009 8.086) 12.227 1.815 ( -2.262 6.849 5.816) 9.266 2.033 ( 0.197 5.779 -2.959) 6.495 2.235 ( 1.454 9.488 1.346) 9.693 2.537 ( -10.590 -0.206 4.230) 11.405 2.755 ( -10.667 9.927 -6.694) 16.036 3.077 ( 8.313 -7.600 -7.805) 13.703 3.155 ( 10.976 6.398 0.454) 12.713 3.309 ( -1.364 -1.089 3.546) 3.953 3.470 ( 5.559 -0.137 1.343) 5.721 3.857 ( -6.223 -2.758 -1.090) 6.893 3.910 ( -0.579 -5.462 2.091) 5.877 4.342 ( -2.516 6.874 2.056) 7.603 4.469 ( 0.179 4.066 1.387) 4.300 4.558 ( -6.527 4.211 -1.632) 7.937 4.861 ( 7.427 1.719 -1.653) 7.801 5.333 ( -1.925 -7.330 3.109) 8.192 5.483 ( 3.601 -3.568 0.429) 5.087 5.656 ( -1.247 -1.616 -2.169) 2.978 5.720 ( 0.692 1.555 -2.762) 3.244 6.546 ( -3.261 -13.595 2.339) 14.175 6.648 ( 1.849 -14.113 2.891) 14.525 7.002 ( -3.433 11.041 4.154) 12.285 7.170 ( 1.637 11.566 2.222) 11.891 7.353 ( -1.234 2.291 2.265) 3.450 7.572 ( 3.084 1.184 -2.767) 4.309 7.755 ( 0.576 -0.635 4.621) 4.700 8.116 ( 2.135 2.508 -10.939) 11.424 10.235 ( -3.799 -8.748 -4.336) 10.477 10.412 ( 4.911 -0.083 -6.234) 7.936 11.491 ( -1.279 -3.176 4.772) 5.873 11.672 ( 2.646 -1.803 -1.053) 3.371 14.092 ( 2.632 -25.905 10.333) 28.014 14.451 ( -0.889 -26.440 -9.521) 28.116 15.745 ( -3.783 20.789 2.981) 21.340 15.992 ( -1.640 17.623 -6.722) 18.932 27.211 ( -0.557 0.076 0.282) 0.628 27.230 ( 0.569 1.599 0.061) 1.699 27.642 ( -0.052 -0.901 0.758) 1.179 27.671 ( -0.193 -0.611 -0.591) 0.871 27.829 ( -0.975 -1.981 0.298) 2.228 27.882 ( 0.986 1.286 -0.710) 1.769 31.629 ( -2.892 -3.418 4.427) 6.296 31.825 ( 3.072 1.782 1.180) 3.743 32.273 ( 0.187 -1.398 3.087) 3.394 32.477 ( -0.359 1.475 -6.205) 6.388 35.212 ( -1.386 -0.487 -0.358) 1.512 35.219 ( 1.061 -0.425 1.323) 1.748 36.169 ( 0.318 -1.047 1.493) 1.851 36.213 ( -0.340 1.383 -1.286) 1.919 44.443 ( -0.988 2.581 -0.957) 2.925 44.479 ( 1.802 2.190 -0.856) 2.963 44.607 ( -2.431 4.340 2.406) 5.526 44.790 ( 1.435 -3.354 -1.320) 3.880 46.535 ( 2.022 -8.749 5.190) 10.371 46.682 ( -0.820 -12.220 -3.933) 12.863 47.531 ( 4.338 2.171 6.765) 8.324 47.631 ( -5.023 6.414 -6.626) 10.501 51.334 ( 10.291 -34.416 17.273) 39.859 51.824 ( -5.174 -34.996 -22.191) 41.761 54.952 ( -27.568 17.267 13.368) 35.169 56.097 ( 17.915 10.955 -3.906) 21.359 70.706 ( -1.041 -20.646 6.360) 21.628 71.042 ( 1.309 -32.564 -8.036) 33.566 74.650 ( -6.958 24.417 16.067) 30.046 75.551 ( -7.678 27.479 -25.954) 38.571 ======================= Grid point 228 (119/150) ======================= q-point: (-0.12 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -4.279 8.925 10.274) 14.266 1.697 ( -0.053 6.606 10.188) 12.142 1.917 ( -2.632 4.525 -9.709) 11.030 2.165 ( 5.469 7.992 0.735) 9.712 2.318 ( -12.993 0.526 -1.211) 13.060 2.638 ( 1.613 -0.488 -0.069) 1.686 3.216 ( 5.958 6.342 5.445) 10.265 3.305 ( 7.982 -3.664 -4.513) 9.875 3.377 ( 6.144 -9.938 -6.022) 13.145 3.552 ( 4.999 1.478 4.140) 6.657 3.721 ( -10.054 3.202 -0.498) 10.563 3.955 ( -2.498 -1.181 2.190) 3.526 4.173 ( -1.933 8.591 -0.247) 8.809 4.408 ( 0.095 5.193 0.790) 5.254 4.496 ( -2.579 -5.287 -1.189) 6.001 4.937 ( 5.240 1.476 0.469) 5.464 5.385 ( -2.178 -4.235 1.027) 4.871 5.580 ( 3.111 -2.110 2.740) 4.652 5.648 ( -3.201 0.195 -0.201) 3.213 5.719 ( 1.428 -1.607 -2.677) 3.434 6.661 ( -1.566 0.782 -0.085) 1.752 6.849 ( -2.766 -2.356 2.615) 4.476 6.867 ( 2.986 -5.680 6.681) 9.264 7.038 ( -0.601 3.394 2.174) 4.075 7.320 ( -0.342 0.981 0.970) 1.422 7.611 ( 3.376 -0.123 -2.767) 4.367 7.770 ( -0.422 -0.794 3.178) 3.303 8.081 ( -0.668 1.344 -9.196) 9.318 10.264 ( -4.021 -4.705 -8.969) 10.897 10.484 ( 5.775 1.255 -2.330) 6.353 11.513 ( -1.500 -1.870 3.661) 4.376 11.728 ( 0.519 -2.453 -0.834) 2.643 14.421 ( -1.543 -11.357 3.377) 11.948 14.855 ( 3.447 -28.019 -3.463) 28.442 15.344 ( -5.682 24.682 0.296) 25.330 15.705 ( -1.964 12.727 -3.912) 13.459 27.201 ( -0.197 0.467 0.260) 0.570 27.223 ( 0.361 0.400 0.082) 0.545 27.645 ( -0.354 0.108 0.356) 0.513 27.676 ( 0.170 -0.233 0.149) 0.325 27.846 ( -0.833 -2.087 -0.616) 2.330 27.879 ( 0.411 0.545 -0.051) 0.685 31.649 ( -2.538 -4.219 2.898) 5.713 31.844 ( 2.595 2.248 4.546) 5.697 32.261 ( -1.569 1.771 -0.562) 2.432 32.469 ( 0.985 -0.982 -4.556) 4.764 35.200 ( -1.078 -0.504 -0.241) 1.214 35.247 ( 1.152 -0.624 1.547) 2.027 36.181 ( -0.647 0.973 -0.591) 1.309 36.195 ( 0.416 -0.722 0.628) 1.044 44.361 ( 1.107 6.347 -1.496) 6.614 44.500 ( 4.207 5.841 -0.022) 7.198 44.527 ( -4.475 -3.365 2.087) 5.976 44.871 ( -0.184 -6.320 -1.798) 6.574 46.668 ( 0.239 -4.636 3.817) 6.011 46.838 ( 0.818 -10.183 -0.367) 10.222 47.408 ( -6.840 8.609 -6.177) 12.611 47.609 ( 5.819 0.492 4.870) 7.604 51.757 ( 2.816 9.769 8.118) 13.010 52.186 ( 7.659 -22.656 -10.938) 26.298 54.523 ( -29.586 -21.236 4.784) 36.731 56.270 ( 3.804 -13.652 0.705) 14.190 70.863 ( -5.971 -4.465 3.141) 8.090 71.462 ( 4.776 -14.704 -5.606) 16.445 74.264 ( -4.359 13.663 8.237) 16.539 74.940 ( -11.831 26.881 -15.690) 33.298 ======================= Grid point 233 (120/150) ======================= q-point: (-0.50 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( -5.199 -0.000 3.141) 6.075 2.016 ( -2.228 -0.000 -0.633) 2.316 2.132 ( 0.133 0.000 13.867) 13.867 2.537 ( -1.713 -0.000 5.311) 5.581 2.669 ( -3.001 -0.000 -11.640) 12.021 2.801 ( 3.130 0.000 -6.758) 7.448 3.026 ( -4.985 -0.000 7.641) 9.123 3.244 ( 3.614 0.000 -3.295) 4.891 3.472 ( 2.815 0.000 -1.681) 3.279 3.505 ( 0.225 0.000 -2.839) 2.847 3.635 ( -4.827 -0.000 2.500) 5.436 3.756 ( 2.715 0.000 -4.892) 5.595 4.475 ( -0.117 -0.000 4.680) 4.681 4.634 ( 0.564 0.000 -3.710) 3.752 4.791 ( -6.293 -0.000 2.854) 6.910 4.877 ( 0.311 0.000 -2.908) 2.925 5.028 ( 4.258 0.000 3.205) 5.330 5.276 ( 0.111 0.000 -8.385) 8.385 5.706 ( 3.470 0.000 0.039) 3.470 5.744 ( -0.229 -0.000 -1.997) 2.010 6.277 ( -4.519 -0.000 2.618) 5.223 6.290 ( -1.000 -0.000 1.754) 2.019 7.285 ( -5.081 -0.000 1.420) 5.276 7.388 ( 3.293 0.000 -2.322) 4.030 7.531 ( -1.105 -0.000 5.909) 6.011 7.580 ( 1.252 0.000 1.128) 1.685 7.694 ( 2.785 0.000 7.410) 7.916 8.171 ( 1.478 0.000 -11.636) 11.730 10.101 ( -0.033 -0.000 4.889) 4.889 10.322 ( 1.960 0.000 -6.624) 6.908 11.369 ( -3.002 -0.000 6.448) 7.113 11.571 ( 3.674 0.000 -3.575) 5.127 13.299 ( 2.725 0.000 11.998) 12.303 13.813 ( -3.030 -0.000 -12.802) 13.156 16.267 ( -0.934 -0.000 3.087) 3.225 16.401 ( 0.972 0.000 -3.643) 3.770 27.222 ( -0.496 -0.000 1.537) 1.615 27.281 ( 0.721 0.000 -1.357) 1.537 27.615 ( -0.067 -0.000 -0.377) 0.383 27.618 ( -0.251 -0.000 -0.484) 0.545 27.812 ( -0.971 -0.000 2.823) 2.985 27.912 ( 0.928 0.000 -2.141) 2.333 31.591 ( -3.852 -0.000 5.698) 6.878 31.827 ( 3.603 0.000 -5.634) 6.688 32.186 ( 1.395 0.000 10.425) 10.517 32.552 ( -0.985 -0.000 -7.336) 7.402 35.199 ( 0.655 0.000 0.409) 0.772 35.223 ( -1.655 -0.000 -0.568) 1.750 36.139 ( 0.098 0.000 3.008) 3.010 36.251 ( 0.073 0.000 -2.340) 2.341 44.410 ( -0.746 -0.000 1.499) 1.675 44.502 ( 2.265 0.000 -3.112) 3.849 44.750 ( 0.771 0.000 3.628) 3.709 44.881 ( -3.009 -0.000 -2.498) 3.911 46.256 ( -1.514 -0.000 1.716) 2.289 46.317 ( -0.035 -0.000 -1.650) 1.651 47.512 ( 4.451 0.000 7.785) 8.968 47.844 ( -4.857 -0.000 -8.324) 9.637 50.261 ( -5.341 -0.000 10.645) 11.910 50.736 ( 4.127 0.000 -14.213) 14.800 56.030 ( -21.780 -0.000 17.510) 27.946 56.412 ( 17.035 0.000 -2.935) 17.286 70.011 ( 1.334 0.000 0.728) 1.519 70.092 ( -1.196 -0.000 -3.262) 3.474 75.317 ( -0.451 -0.000 20.422) 20.427 76.240 ( 2.035 0.000 -24.671) 24.755 ======================= Grid point 236 (121/150) ======================= q-point: (-0.38 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( -4.140 4.219 7.210) 9.323 1.955 ( -1.675 3.828 0.146) 4.181 2.156 ( 1.018 0.790 13.142) 13.205 2.448 ( -5.470 6.092 4.986) 9.586 2.582 ( -4.758 1.817 -9.150) 10.472 2.864 ( 0.976 -2.650 -3.648) 4.613 2.964 ( -5.361 -1.518 -0.076) 5.573 3.274 ( 0.918 -0.781 -0.522) 1.313 3.362 ( -3.443 7.855 -0.749) 8.609 3.498 ( 3.347 2.158 -2.213) 4.556 3.658 ( -3.563 -7.624 -0.049) 8.416 3.816 ( 2.680 -1.753 -1.341) 3.472 4.446 ( -2.602 2.181 3.576) 4.931 4.584 ( -1.317 3.579 -2.497) 4.559 4.702 ( -5.520 2.162 1.441) 6.100 4.889 ( 2.663 -0.255 -2.018) 3.351 5.129 ( 3.566 -4.231 3.759) 6.689 5.338 ( 3.834 -5.202 -7.024) 9.545 5.699 ( -0.842 3.364 -1.940) 3.973 5.758 ( 2.730 0.378 -2.088) 3.458 6.251 ( -4.911 -5.063 3.473) 7.862 6.334 ( 1.271 -6.254 3.757) 7.406 7.200 ( -4.132 2.314 1.400) 4.939 7.407 ( 2.731 3.005 -0.587) 4.103 7.478 ( -1.549 5.509 6.474) 8.641 7.610 ( 2.724 0.610 -0.014) 2.792 7.753 ( 3.345 0.227 5.030) 6.045 8.174 ( 2.140 0.458 -12.371) 12.563 10.105 ( -0.421 0.517 3.192) 3.261 10.362 ( 3.462 -1.588 -7.346) 8.274 11.377 ( -1.471 -4.357 5.481) 7.155 11.639 ( 4.698 -0.780 -2.800) 5.525 13.465 ( 3.823 -13.016 12.207) 18.250 13.843 ( -2.131 -12.324 -12.623) 17.770 16.180 ( -3.247 8.167 3.015) 9.292 16.338 ( -2.976 5.855 -3.690) 7.534 27.214 ( -0.697 0.125 1.295) 1.476 27.279 ( 0.610 1.280 -1.201) 1.858 27.614 ( 0.042 -0.533 0.252) 0.591 27.630 ( -0.315 -1.595 -0.840) 1.830 27.803 ( -0.870 -0.122 2.565) 2.711 27.919 ( 1.192 0.849 -1.977) 2.460 31.556 ( -3.253 -1.386 5.502) 6.540 31.872 ( 4.234 1.027 -4.196) 6.049 32.228 ( 0.976 -1.101 9.008) 9.127 32.516 ( -1.416 0.826 -7.531) 7.707 35.200 ( -1.393 -0.219 -0.268) 1.436 35.212 ( 0.879 -0.133 0.890) 1.258 36.147 ( 0.082 -0.412 2.743) 2.775 36.243 ( -0.143 0.572 -2.294) 2.368 44.395 ( -2.714 -1.518 1.175) 3.325 44.525 ( 0.921 -0.398 -3.707) 3.840 44.757 ( 2.043 3.127 3.581) 5.175 44.812 ( -1.823 3.110 -1.261) 3.819 46.298 ( 1.213 -6.140 2.735) 6.830 46.381 ( 1.877 -6.037 -1.567) 6.513 47.580 ( 3.674 0.883 8.293) 9.113 47.742 ( -5.330 1.445 -8.329) 9.994 50.369 ( -1.154 -21.014 10.779) 23.645 50.930 ( 4.866 -18.425 -13.120) 23.137 55.609 ( -22.680 15.922 16.266) 32.132 56.584 ( 19.210 13.221 -0.072) 23.320 70.119 ( -1.346 -13.022 0.461) 13.100 70.200 ( -0.538 -18.965 -2.625) 19.154 75.217 ( -6.076 11.245 18.904) 22.820 76.081 ( -9.285 8.960 -24.119) 27.353 ======================= Grid point 237 (122/150) ======================= q-point: (-0.25 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( -2.270 6.589 9.706) 11.949 1.856 ( -3.403 5.097 4.788) 7.777 2.120 ( -3.061 8.649 0.034) 9.175 2.289 ( -6.174 -0.503 8.895) 10.840 2.434 ( -6.236 6.907 -3.068) 9.798 2.729 ( -6.096 5.412 -4.228) 9.184 3.049 ( 3.761 -8.091 -7.391) 11.586 3.276 ( -0.738 -0.329 1.412) 1.627 3.314 ( 1.004 -2.422 4.846) 5.510 3.537 ( 4.051 -0.010 -2.142) 4.582 3.713 ( -3.488 -6.151 -0.196) 7.074 3.849 ( -0.795 -0.345 2.181) 2.346 4.370 ( -3.154 1.088 1.594) 3.698 4.462 ( -5.059 6.307 -5.604) 9.837 4.593 ( -1.654 4.786 3.278) 6.032 4.947 ( 3.336 -1.005 -0.918) 3.603 5.250 ( 2.535 -4.580 3.348) 6.214 5.482 ( 4.792 -5.544 -3.906) 8.304 5.639 ( -0.408 2.238 -1.026) 2.496 5.764 ( 0.865 2.247 -2.263) 3.305 6.302 ( -3.388 -10.744 2.445) 11.528 6.505 ( 2.335 -11.569 4.720) 12.711 7.091 ( -2.624 6.348 1.848) 7.113 7.350 ( -0.434 9.585 6.744) 11.728 7.399 ( 1.392 3.544 -0.853) 3.902 7.640 ( 3.862 1.767 -1.755) 4.596 7.788 ( 2.063 1.576 3.798) 4.601 8.173 ( 2.044 2.633 -12.317) 12.760 10.090 ( -2.502 -2.247 -0.160) 3.366 10.452 ( 4.928 -3.009 -6.661) 8.815 11.447 ( 0.769 -4.046 4.002) 5.743 11.708 ( 3.761 0.280 -1.924) 4.234 13.810 ( 4.778 -22.236 9.871) 24.794 14.066 ( -0.041 -22.853 -9.660) 24.811 15.951 ( -4.710 15.419 2.390) 16.299 16.131 ( -6.599 11.765 -3.372) 13.904 27.203 ( -0.717 0.051 0.893) 1.146 27.263 ( 0.466 1.751 -0.735) 1.956 27.628 ( 0.031 -0.987 0.433) 1.078 27.649 ( -0.206 -1.675 -0.680) 1.820 27.798 ( -0.788 -0.603 1.872) 2.119 27.918 ( 1.226 1.451 -1.586) 2.475 31.548 ( -2.548 -2.539 5.052) 6.202 31.911 ( 4.179 1.982 -1.000) 4.732 32.266 ( 0.286 -0.964 5.195) 5.291 32.470 ( -1.318 0.715 -6.841) 7.004 35.186 ( -1.032 -0.378 0.019) 1.099 35.232 ( 1.044 -0.360 1.377) 1.765 36.161 ( 0.056 -0.816 2.073) 2.228 36.223 ( -0.337 1.092 -1.909) 2.225 44.379 ( -3.921 -3.022 0.985) 5.048 44.527 ( 0.834 1.172 -4.054) 4.302 44.698 ( -0.046 6.121 0.253) 6.127 44.784 ( 1.353 1.213 2.406) 3.014 46.468 ( 4.239 -9.920 4.246) 11.594 46.516 ( 1.773 -8.305 -2.032) 8.732 47.586 ( -3.555 3.689 -2.317) 5.622 47.653 ( 1.228 1.371 2.297) 2.944 50.880 ( 4.336 -43.699 6.599) 44.406 51.344 ( 7.295 -27.057 -7.737) 29.071 54.937 ( -24.072 29.620 14.450) 40.812 56.606 ( 16.384 21.903 1.979) 27.424 70.330 ( -4.682 -22.382 -1.008) 22.888 70.617 ( 5.059 -32.882 -0.407) 33.271 74.875 ( -10.555 20.787 14.820) 27.624 75.644 ( -17.571 17.660 -20.346) 32.165 ======================= Grid point 238 (123/150) ======================= q-point: (-0.12 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( -4.546 11.440 8.236) 14.811 1.750 ( -3.384 2.110 11.013) 11.713 1.910 ( -7.557 5.792 -2.828) 9.932 2.137 ( -9.868 1.005 1.204) 9.992 2.324 ( 2.391 5.174 -6.500) 8.645 2.672 ( 3.208 0.459 2.032) 3.826 3.233 ( 2.175 -11.597 -6.792) 13.615 3.305 ( 0.433 -1.589 1.020) 1.937 3.396 ( 2.559 -4.560 5.404) 7.520 3.591 ( 1.021 -0.710 0.434) 1.317 3.662 ( -4.280 3.775 1.120) 5.816 3.853 ( -3.429 -4.800 2.415) 6.375 4.279 ( -2.191 8.137 -5.258) 9.932 4.357 ( -1.741 -3.831 0.661) 4.259 4.510 ( -0.496 5.229 1.601) 5.492 4.999 ( 1.556 -0.543 0.976) 1.916 5.331 ( 1.406 -1.971 1.199) 2.702 5.593 ( 0.681 -2.149 -1.119) 2.517 5.629 ( 2.140 0.803 1.329) 2.644 5.741 ( 1.260 0.926 -2.014) 2.550 6.464 ( -1.467 -15.572 0.884) 15.666 6.722 ( 0.475 -12.682 5.399) 13.791 6.942 ( -0.380 10.153 1.979) 10.351 7.201 ( -0.756 10.796 5.389) 12.090 7.369 ( 2.290 4.084 -1.465) 4.906 7.673 ( 4.267 1.832 -3.862) 6.040 7.787 ( 0.641 1.966 3.651) 4.196 8.102 ( -1.134 5.410 -9.898) 11.337 10.113 ( -2.347 -6.169 -4.299) 7.877 10.556 ( 4.412 -1.871 -5.032) 6.949 11.507 ( 1.769 -0.480 2.302) 2.943 11.731 ( 1.256 1.414 -0.635) 1.995 14.212 ( 3.974 -19.168 0.368) 19.579 14.478 ( 4.507 -30.653 -0.324) 30.984 15.605 ( -5.574 21.800 0.103) 22.502 15.819 ( -7.643 13.475 -1.173) 15.536 27.195 ( -0.538 -0.189 0.488) 0.751 27.245 ( 0.334 1.414 -0.198) 1.467 27.639 ( -0.093 -0.498 0.056) 0.509 27.668 ( 0.054 -1.115 0.143) 1.125 27.804 ( -0.677 -1.450 0.727) 1.757 27.909 ( 0.942 1.776 -0.956) 2.226 31.565 ( -1.797 -3.285 4.157) 5.594 31.932 ( 2.954 2.974 3.048) 5.183 32.267 ( -0.498 1.254 -0.584) 1.470 32.450 ( -0.368 -1.323 -4.389) 4.599 35.179 ( -0.656 -0.418 0.206) 0.805 35.257 ( 0.954 -0.551 1.511) 1.870 36.175 ( -0.193 -0.598 0.554) 0.838 36.200 ( -0.180 0.891 -0.591) 1.084 44.367 ( -3.845 -3.204 0.750) 5.061 44.513 ( 2.546 3.226 -3.482) 5.386 44.617 ( -0.235 4.220 0.112) 4.228 44.798 ( 0.202 -0.927 1.886) 2.111 46.629 ( 1.711 -3.932 0.068) 4.289 46.710 ( 4.363 -11.904 3.538) 13.162 47.418 ( -5.716 7.298 -6.633) 11.399 47.688 ( 2.847 0.016 5.102) 5.842 51.616 ( -2.482 -39.773 -17.731) 43.617 51.929 ( 22.939 -28.895 16.840) 40.555 54.167 ( -22.697 24.279 9.292) 34.510 56.440 ( 5.714 24.047 4.765) 25.172 70.584 ( -4.439 -20.091 -1.354) 20.620 71.237 ( 10.310 -32.405 -0.072) 34.005 74.423 ( -8.666 19.034 8.322) 22.509 75.036 ( -18.610 21.509 -11.935) 30.845 ======================= Grid point 244 (124/150) ======================= q-point: (-0.38 -0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( -5.503 -0.000 11.122) 12.409 1.975 ( -1.204 -0.000 2.708) 2.963 2.190 ( 0.712 0.000 13.611) 13.629 2.424 ( -7.069 -0.000 7.030) 9.970 2.475 ( -8.166 -0.000 -10.253) 13.108 2.850 ( -6.644 -0.000 3.669) 7.590 2.878 ( 2.569 0.000 -6.065) 6.587 3.212 ( -6.418 -0.000 2.284) 6.813 3.412 ( -4.497 -0.000 -0.793) 4.567 3.431 ( -2.709 -0.000 -2.788) 3.887 3.608 ( 2.509 0.000 -1.451) 2.898 3.857 ( 3.399 0.000 -0.418) 3.425 4.414 ( -5.087 -0.000 2.568) 5.699 4.563 ( -3.341 -0.000 -7.499) 8.210 4.664 ( -2.704 -0.000 5.740) 6.345 4.916 ( 2.889 0.000 -2.299) 3.692 5.177 ( 4.724 0.000 4.581) 6.580 5.358 ( 5.679 0.000 -8.164) 9.944 5.721 ( -0.148 -0.000 -3.212) 3.215 5.784 ( 0.946 0.000 -1.593) 1.853 6.173 ( -2.407 -0.000 5.446) 5.954 6.304 ( 1.164 0.000 3.836) 4.009 7.162 ( -2.938 -0.000 0.527) 2.985 7.449 ( 0.976 0.000 -0.832) 1.282 7.522 ( -0.776 -0.000 8.961) 8.995 7.667 ( 4.555 0.000 -1.592) 4.825 7.827 ( 4.540 0.000 3.888) 5.977 8.175 ( 1.059 0.000 -13.062) 13.104 10.147 ( 2.305 0.000 3.581) 4.258 10.390 ( 3.515 0.000 -7.147) 7.964 11.327 ( -0.853 -0.000 5.512) 5.577 11.709 ( 5.650 0.000 -3.988) 6.916 13.452 ( 4.490 0.000 12.462) 13.247 13.707 ( -0.902 -0.000 -13.012) 13.044 16.182 ( -4.856 -0.000 2.385) 5.410 16.302 ( -6.603 -0.000 -1.759) 6.834 27.205 ( -0.879 -0.000 1.439) 1.686 27.295 ( 0.403 0.000 -1.687) 1.734 27.611 ( -0.006 -0.000 -0.126) 0.126 27.613 ( -0.023 -0.000 -0.033) 0.040 27.795 ( -0.657 -0.000 2.844) 2.919 27.942 ( 1.371 0.000 -2.234) 2.621 31.511 ( -2.435 -0.000 5.878) 6.362 31.942 ( 4.902 0.000 -5.239) 7.175 32.245 ( 0.457 0.000 9.831) 9.841 32.484 ( -1.934 -0.000 -7.974) 8.205 35.180 ( -0.927 -0.000 0.090) 0.931 35.227 ( 0.943 0.000 1.223) 1.544 36.149 ( -0.025 -0.000 2.800) 2.800 36.240 ( -0.273 -0.000 -2.424) 2.439 44.331 ( -4.140 -0.000 1.087) 4.280 44.522 ( -0.166 -0.000 -3.937) 3.940 44.806 ( -1.499 -0.000 -1.851) 2.382 44.829 ( 3.095 0.000 4.622) 5.562 46.271 ( 1.937 0.000 3.085) 3.643 46.402 ( 5.559 0.000 -0.467) 5.579 47.645 ( 2.305 0.000 8.785) 9.082 47.657 ( -5.158 -0.000 -8.300) 9.772 50.198 ( -1.120 -0.000 9.569) 9.634 50.893 ( 9.026 0.000 -9.592) 13.171 55.448 ( -18.396 -0.000 20.226) 27.340 56.985 ( 20.305 0.000 3.038) 20.531 69.987 ( -4.693 -0.000 -2.066) 5.127 70.034 ( -0.043 -0.000 -0.160) 0.166 75.203 ( -10.199 -0.000 15.890) 18.882 75.897 ( -18.275 -0.000 -20.070) 27.143 ======================= Grid point 245 (125/150) ======================= q-point: (-0.25 -0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -5.534 0.429 12.955) 14.094 1.899 ( -4.777 5.686 8.420) 11.227 2.159 ( -10.651 10.907 -0.194) 15.247 2.201 ( -4.669 1.351 8.588) 9.868 2.405 ( -5.965 -2.482 -3.688) 7.439 2.736 ( -0.641 4.386 3.122) 5.422 2.950 ( 0.220 -6.380 -6.025) 8.778 3.164 ( -8.678 -9.236 8.135) 15.060 3.285 ( -1.037 3.465 -0.302) 3.630 3.491 ( -2.761 -7.656 -0.588) 8.160 3.650 ( 2.504 -0.167 -3.488) 4.297 3.885 ( 1.335 2.363 1.745) 3.226 4.305 ( -6.965 1.323 0.276) 7.095 4.477 ( -2.497 3.318 -8.913) 9.833 4.627 ( -1.311 2.238 5.693) 6.256 4.965 ( 2.378 -0.969 -1.834) 3.156 5.274 ( 4.955 -1.674 5.010) 7.242 5.466 ( 4.531 -4.547 -5.996) 8.784 5.697 ( 2.216 3.290 -2.433) 4.653 5.777 ( -1.473 0.464 -1.137) 1.918 6.178 ( -0.554 -3.303 3.568) 4.894 6.394 ( 1.396 -8.096 3.975) 9.126 7.116 ( -1.559 1.806 0.559) 2.451 7.431 ( -1.363 3.824 2.564) 4.801 7.490 ( 1.040 4.200 5.690) 7.148 7.736 ( 5.948 1.393 -3.197) 6.895 7.872 ( 3.455 3.322 3.096) 5.706 8.189 ( 1.239 -1.543 -13.365) 13.511 10.121 ( 1.033 7.193 2.629) 7.728 10.462 ( 3.910 -3.232 -6.928) 8.587 11.392 ( 1.455 -6.751 4.070) 8.016 11.781 ( 4.794 1.003 -3.778) 6.185 13.641 ( 5.443 -13.476 10.417) 17.882 13.791 ( 1.577 -13.502 -10.262) 17.032 16.046 ( -5.565 7.968 1.787) 9.882 16.136 ( -9.087 6.163 -0.279) 10.984 27.193 ( -0.889 0.004 1.353) 1.619 27.287 ( 0.107 1.099 -1.668) 2.000 27.617 ( 0.099 -0.593 -0.153) 0.620 27.624 ( 0.212 -1.306 0.204) 1.339 27.790 ( -0.417 0.088 2.809) 2.841 27.953 ( 1.366 0.921 -2.238) 2.779 31.499 ( -1.428 -1.172 6.052) 6.328 32.000 ( 4.744 1.390 -3.758) 6.210 32.267 ( -0.033 -0.559 7.470) 7.491 32.439 ( -2.052 0.120 -7.554) 7.828 35.172 ( -0.382 -0.090 0.427) 0.580 35.244 ( 0.853 -0.258 1.459) 1.710 36.155 ( -0.059 -0.420 2.473) 2.509 36.227 ( -0.347 0.591 -2.189) 2.293 44.281 ( -4.255 -1.778 0.860) 4.691 44.510 ( -1.763 -1.174 -3.565) 4.147 44.760 ( -0.036 3.974 -2.366) 4.625 44.863 ( 2.701 2.335 4.698) 5.900 46.378 ( 3.395 -7.879 3.501) 9.266 46.521 ( 6.938 -2.812 0.301) 7.492 47.557 ( -4.361 2.336 -7.121) 8.671 47.684 ( 0.688 -0.538 7.332) 7.384 50.400 ( 1.355 -26.240 6.090) 26.972 51.169 ( 12.543 -17.503 -4.984) 22.102 55.088 ( -11.310 23.310 23.868) 35.227 57.179 ( 19.204 17.166 6.427) 26.548 69.989 ( -5.050 -12.558 -1.035) 13.575 70.236 ( 1.928 -25.980 -0.855) 26.066 74.957 ( -12.930 11.998 11.369) 20.986 75.495 ( -22.520 8.201 -14.629) 28.078 ======================= Grid point 246 (126/150) ======================= q-point: (-0.12 -0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( -11.752 6.384 11.669) 17.749 1.721 ( -5.783 2.071 14.006) 15.294 1.852 ( -8.802 8.481 -0.198) 12.225 2.090 ( -2.084 2.304 0.981) 3.258 2.339 ( -5.448 0.679 -8.381) 10.019 2.759 ( 5.875 0.982 6.151) 8.563 3.057 ( -0.472 -10.341 -6.663) 12.311 3.217 ( -8.124 -12.113 12.377) 19.129 3.300 ( 1.864 -3.955 1.945) 4.786 3.535 ( -4.845 -4.223 2.725) 6.981 3.650 ( -1.449 1.192 -4.584) 4.953 3.831 ( 0.455 4.163 1.419) 4.422 4.215 ( -5.086 -2.265 -2.059) 5.936 4.392 ( 0.252 3.792 -5.877) 6.998 4.574 ( -0.445 4.088 3.957) 5.707 4.997 ( 0.146 -0.594 -0.017) 0.611 5.363 ( 3.774 -0.168 2.792) 4.697 5.574 ( 2.184 -2.785 -1.847) 3.992 5.699 ( 2.456 2.413 -1.270) 3.670 5.749 ( 0.164 -0.431 -1.227) 1.311 6.274 ( 0.780 -9.404 1.045) 9.494 6.558 ( 0.007 -11.226 3.409) 11.732 7.059 ( 0.276 5.109 1.309) 5.281 7.310 ( -2.425 8.107 6.000) 10.373 7.468 ( 1.939 3.421 0.798) 4.012 7.791 ( 6.537 3.534 -5.706) 9.369 7.856 ( 1.716 4.413 3.284) 5.762 8.155 ( -1.179 5.373 -12.100) 13.291 10.050 ( -0.121 1.728 1.596) 2.356 10.557 ( 2.797 -3.632 -6.875) 8.263 11.528 ( 3.771 -4.132 0.969) 5.678 11.798 ( 2.353 3.710 -2.380) 4.996 14.015 ( 8.175 -19.628 -2.867) 21.455 14.124 ( 5.189 -27.983 2.761) 28.594 15.786 ( -6.927 15.663 0.023) 17.127 15.868 ( -8.586 10.932 1.963) 14.038 27.184 ( -0.716 -0.219 1.126) 1.352 27.267 ( -0.059 1.344 -1.233) 1.824 27.629 ( 0.108 -0.799 -0.310) 0.864 27.651 ( 0.303 -1.460 0.338) 1.529 27.790 ( -0.097 -0.122 2.400) 2.405 27.949 ( 1.121 1.731 -1.969) 2.852 31.517 ( -0.421 -1.938 5.835) 6.163 32.024 ( 2.662 3.245 0.393) 4.215 32.279 ( 0.488 0.307 0.177) 0.603 32.408 ( -1.587 -1.431 -4.363) 4.858 35.171 ( 0.011 -0.047 0.650) 0.652 35.263 ( 0.586 -0.485 1.353) 1.552 36.165 ( -0.107 -0.619 1.608) 1.726 36.208 ( -0.241 0.903 -1.389) 1.674 44.259 ( -3.493 -3.277 0.472) 4.812 44.494 ( -3.795 -3.236 -2.125) 5.421 44.696 ( 2.410 6.289 -3.156) 7.438 44.859 ( 1.651 3.559 4.243) 5.779 46.566 ( 2.969 -8.332 1.371) 8.951 46.689 ( 7.645 -5.407 3.108) 9.866 47.427 ( -4.119 5.588 -6.587) 9.570 47.706 ( -0.532 -1.162 4.858) 5.023 50.961 ( 2.253 -42.907 -7.167) 43.560 51.774 ( 16.274 -35.095 3.035) 38.804 54.541 ( 1.846 44.002 25.050) 50.667 57.041 ( 11.009 36.173 9.593) 39.009 70.202 ( -2.507 -23.881 0.557) 24.018 70.834 ( 9.448 -43.088 -3.257) 44.232 74.551 ( -11.215 17.304 6.322) 21.568 74.975 ( -20.873 13.909 -7.563) 26.199 ======================= Grid point 253 (127/150) ======================= q-point: (-0.25 -0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.640 ( -9.292 -0.000 12.328) 15.437 1.857 ( -8.944 -0.000 14.573) 17.099 2.112 ( -10.926 -0.000 2.606) 11.233 2.157 ( -8.996 -0.000 -4.978) 10.282 2.217 ( -4.836 -0.000 7.260) 8.723 2.836 ( 5.700 0.000 6.203) 8.425 2.894 ( -1.618 -0.000 2.325) 2.832 2.904 ( -11.652 -0.000 6.086) 13.146 3.314 ( -2.146 -0.000 -1.554) 2.650 3.372 ( -0.661 -0.000 0.139) 0.676 3.688 ( 2.289 0.000 -6.034) 6.454 3.921 ( 0.258 0.000 1.934) 1.951 4.197 ( -8.615 -0.000 1.480) 8.742 4.451 ( -1.285 -0.000 -12.647) 12.712 4.637 ( -0.820 -0.000 6.678) 6.728 4.992 ( 2.105 0.000 -3.093) 3.742 5.358 ( 6.209 0.000 6.408) 8.923 5.478 ( 2.376 0.000 -3.623) 4.332 5.746 ( -2.637 -0.000 0.577) 2.700 5.772 ( 4.575 0.000 -4.771) 6.610 6.161 ( 0.053 0.000 2.579) 2.579 6.352 ( 0.814 0.000 2.763) 2.880 7.113 ( -0.461 -0.000 0.719) 0.854 7.445 ( -1.068 -0.000 2.055) 2.316 7.537 ( -0.182 -0.000 7.504) 7.506 7.843 ( 7.386 0.000 -5.298) 9.089 7.972 ( 4.103 0.000 2.310) 4.709 8.153 ( 0.115 0.000 -13.667) 13.668 10.249 ( 3.216 0.000 2.395) 4.010 10.470 ( 2.990 0.000 -8.037) 8.575 11.348 ( 0.977 0.000 6.066) 6.144 11.855 ( 4.361 0.000 -5.561) 7.067 13.629 ( 4.551 0.000 11.752) 12.603 13.725 ( 5.258 0.000 -10.381) 11.637 16.019 ( -5.724 -0.000 1.507) 5.919 16.040 ( -9.569 -0.000 1.808) 9.738 27.181 ( -0.925 -0.000 1.564) 1.817 27.290 ( -0.306 -0.000 -2.257) 2.277 27.617 ( 0.322 0.000 0.226) 0.394 27.621 ( 0.596 0.000 0.214) 0.633 27.792 ( -0.071 -0.000 3.271) 3.271 27.977 ( 1.319 0.000 -2.618) 2.932 31.490 ( -0.044 -0.000 6.863) 6.863 32.078 ( 4.729 0.000 -5.688) 7.397 32.268 ( -0.843 -0.000 8.857) 8.898 32.394 ( -2.140 -0.000 -7.974) 8.256 35.172 ( 0.316 0.000 0.621) 0.697 35.255 ( 0.503 0.000 1.478) 1.561 36.155 ( -0.038 -0.000 2.564) 2.565 36.224 ( -0.275 -0.000 -2.104) 2.122 44.208 ( -3.593 -0.000 0.512) 3.629 44.447 ( -4.518 -0.000 -2.407) 5.120 44.805 ( 2.454 0.000 -4.496) 5.122 44.917 ( 1.062 0.000 5.565) 5.665 46.388 ( 4.806 0.000 5.663) 7.427 46.618 ( 8.088 0.000 0.074) 8.088 47.509 ( -2.837 -0.000 -7.634) 8.144 47.679 ( -2.064 -0.000 7.552) 7.829 50.235 ( 1.579 0.000 9.274) 9.407 51.215 ( 12.113 0.000 -7.624) 14.313 55.308 ( 11.038 0.000 35.028) 36.726 57.638 ( 20.496 0.000 11.445) 23.475 69.837 ( -4.391 -0.000 0.848) 4.472 70.003 ( -1.634 -0.000 -3.001) 3.416 74.857 ( -13.499 -0.000 7.189) 15.294 75.183 ( -23.093 -0.000 -9.143) 24.837 ======================= Grid point 254 (128/150) ======================= q-point: (-0.12 -0.25 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( -15.635 2.679 11.052) 19.333 1.683 ( -8.883 3.438 17.940) 20.312 1.877 ( -7.279 7.122 0.191) 10.185 2.068 ( -2.676 -1.594 0.235) 3.123 2.192 ( -6.681 -3.255 -0.053) 7.432 2.796 ( -7.467 -6.947 11.492) 15.365 2.927 ( -1.769 -5.493 1.756) 6.032 2.972 ( 3.253 -4.345 6.886) 8.768 3.282 ( -0.378 -1.370 0.698) 1.583 3.413 ( -0.839 -3.871 0.986) 4.081 3.669 ( -0.820 4.283 -5.601) 7.098 3.883 ( -1.873 2.377 0.073) 3.027 4.102 ( -5.029 -2.573 1.363) 5.811 4.414 ( 0.137 1.454 -10.965) 11.062 4.623 ( -0.138 2.069 6.141) 6.482 5.003 ( 0.497 1.070 -2.275) 2.563 5.437 ( 3.849 1.500 3.376) 5.335 5.558 ( 3.233 -5.420 0.775) 6.358 5.698 ( -3.049 0.828 1.649) 3.564 5.815 ( 4.761 2.736 -5.254) 7.599 6.198 ( 1.047 -4.375 0.117) 4.500 6.418 ( -0.558 -7.386 1.876) 7.641 7.109 ( 0.857 1.044 1.561) 2.065 7.388 ( -2.092 5.620 4.911) 7.751 7.525 ( 0.282 2.063 3.891) 4.413 7.933 ( 7.252 2.515 -6.566) 10.101 7.967 ( 2.390 5.549 0.655) 6.077 8.157 ( -1.039 -0.346 -12.958) 13.005 10.170 ( 1.150 11.628 3.547) 12.211 10.530 ( 1.773 -3.049 -7.758) 8.522 11.477 ( 3.127 -10.265 2.651) 11.053 11.879 ( 2.273 2.787 -5.108) 6.247 13.856 ( 4.852 -19.267 8.999) 21.811 13.912 ( 10.052 -12.071 -7.643) 17.469 15.840 ( -8.473 8.763 2.573) 12.459 15.896 ( -5.244 6.097 1.600) 8.199 27.171 ( -0.762 -0.171 1.561) 1.745 27.275 ( -0.447 0.692 -2.179) 2.330 27.624 ( 0.459 -0.237 0.015) 0.517 27.640 ( 0.560 -0.986 0.324) 1.180 27.797 ( 0.315 0.169 3.377) 3.396 27.983 ( 1.045 1.049 -2.687) 3.068 31.515 ( 1.235 -0.619 7.208) 7.339 32.103 ( 1.759 3.219 -3.232) 4.888 32.281 ( 0.267 -1.841 3.737) 4.175 32.358 ( -1.472 -0.371 -5.806) 6.001 35.180 ( 0.739 0.263 0.697) 1.050 35.264 ( 0.095 -0.363 1.176) 1.235 36.161 ( -0.025 -0.255 2.220) 2.235 36.214 ( -0.083 0.515 -1.628) 1.710 44.177 ( -2.321 -1.882 -0.007) 2.988 44.373 ( -6.255 -1.828 -0.940) 6.584 44.820 ( 4.405 3.851 -5.307) 7.899 44.916 ( -0.543 1.648 5.296) 5.573 46.527 ( 5.419 -5.975 5.666) 9.858 46.756 ( 7.684 -2.274 0.851) 8.058 47.437 ( -2.024 3.696 -6.597) 7.828 47.654 ( -4.133 -1.945 4.639) 6.511 50.485 ( 3.340 -26.788 4.348) 27.343 51.511 ( 6.833 -21.556 -8.883) 24.295 55.500 ( 40.193 35.161 38.341) 65.741 57.740 ( 13.869 27.605 16.135) 34.853 69.868 ( -2.622 -15.106 2.461) 15.528 70.306 ( 3.633 -39.882 -6.042) 40.500 74.590 ( -11.224 10.268 3.337) 15.574 74.801 ( -19.429 6.013 -3.498) 20.637 ======================= Grid point 262 (129/150) ======================= q-point: (-0.12 -0.12 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( -13.073 -0.000 10.160) 16.557 1.570 ( -11.515 -0.000 19.124) 22.323 1.768 ( -11.184 -0.000 0.464) 11.194 2.023 ( -0.168 -0.000 -2.453) 2.459 2.122 ( -0.953 -0.000 6.527) 6.596 2.578 ( -9.624 -0.000 16.979) 19.517 2.882 ( -1.033 -0.000 -0.856) 1.342 3.028 ( 2.239 0.000 9.619) 9.876 3.266 ( 1.242 0.000 1.323) 1.814 3.420 ( 3.769 0.000 0.365) 3.787 3.712 ( 1.526 0.000 -9.189) 9.315 3.809 ( -8.031 -0.000 -0.335) 8.038 4.029 ( -1.678 -0.000 4.289) 4.606 4.417 ( 0.863 0.000 -12.773) 12.802 4.650 ( 0.587 0.000 7.205) 7.229 5.020 ( 0.457 0.000 -3.770) 3.798 5.502 ( 0.202 0.000 0.560) 0.595 5.556 ( 4.060 0.000 5.446) 6.793 5.672 ( -1.644 -0.000 3.226) 3.621 5.898 ( 3.625 0.000 -6.544) 7.481 6.174 ( 0.911 0.000 -0.411) 0.999 6.352 ( -1.151 -0.000 0.753) 1.375 7.136 ( 1.575 0.000 2.609) 3.047 7.406 ( -2.033 -0.000 3.864) 4.366 7.547 ( -0.484 -0.000 5.414) 5.435 8.049 ( 6.287 0.000 -8.674) 10.713 8.053 ( 0.187 0.000 0.384) 0.427 8.103 ( 0.040 0.000 -13.197) 13.198 10.306 ( -0.558 -0.000 1.612) 1.706 10.513 ( 1.415 0.000 -8.420) 8.538 11.413 ( 1.820 0.000 7.751) 7.962 11.916 ( 0.717 0.000 -7.223) 7.258 13.778 ( 2.566 0.000 10.981) 11.277 13.974 ( 11.683 0.000 -8.451) 14.419 15.813 ( -4.583 -0.000 3.377) 5.693 15.868 ( -4.226 -0.000 1.086) 4.364 27.162 ( -0.595 -0.000 1.755) 1.853 27.268 ( -0.563 -0.000 -2.542) 2.604 27.634 ( 0.697 0.000 0.149) 0.713 27.640 ( 0.481 0.000 0.202) 0.522 27.811 ( 0.556 0.000 3.880) 3.920 28.001 ( 0.714 0.000 -3.092) 3.173 31.554 ( 2.675 0.000 7.853) 8.296 32.139 ( -0.501 -0.000 -8.222) 8.237 32.247 ( -2.178 -0.000 7.810) 8.109 32.353 ( 1.898 0.000 -5.771) 6.075 35.199 ( 1.219 0.000 0.348) 1.267 35.260 ( -0.400 -0.000 0.952) 1.033 36.162 ( -0.004 -0.000 2.262) 2.262 36.216 ( 0.166 0.000 -1.466) 1.475 44.138 ( -0.776 -0.000 -0.525) 0.936 44.260 ( -6.581 -0.000 -0.025) 6.581 44.907 ( -2.835 -0.000 6.247) 6.860 44.916 ( 5.502 0.000 -6.804) 8.750 46.584 ( 6.202 0.000 8.520) 10.539 46.850 ( 6.637 0.000 0.096) 6.637 47.446 ( 0.243 0.000 -7.112) 7.117 47.552 ( -7.413 -0.000 4.370) 8.605 50.348 ( 3.917 0.000 10.547) 11.251 51.380 ( -0.817 -0.000 -14.554) 14.577 56.752 ( 76.523 0.000 31.180) 82.632 58.170 ( 7.931 0.000 23.002) 24.331 69.745 ( -2.355 -0.000 2.886) 3.725 69.937 ( -1.362 -0.000 -5.696) 5.857 74.517 ( -8.392 -0.000 0.751) 8.425 74.574 ( -14.942 -0.000 0.137) 14.943 ======================= Grid point 263 (130/150) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( -4.884 -0.000 -7.157) 8.665 1.375 ( 4.884 0.000 7.157) 8.665 1.781 ( 1.769 0.000 -14.216) 14.325 1.781 ( -1.769 -0.000 14.216) 14.325 2.425 ( -4.627 -0.000 -10.139) 11.145 2.425 ( 4.627 0.000 10.139) 11.145 3.071 ( -2.619 -0.000 -6.304) 6.826 3.071 ( 2.619 0.000 6.304) 6.826 3.498 ( -7.345 -0.000 -2.072) 7.632 3.498 ( 7.345 0.000 2.072) 7.632 3.569 ( 1.327 0.000 -5.914) 6.061 3.569 ( -1.327 -0.000 5.914) 6.061 4.174 ( -1.167 -0.000 -8.062) 8.146 4.174 ( 1.167 0.000 8.062) 8.146 4.869 ( -2.111 -0.000 -7.063) 7.372 4.869 ( 2.111 0.000 7.063) 7.372 5.561 ( -2.014 -0.000 -1.033) 2.263 5.561 ( 2.014 0.000 1.033) 2.263 5.814 ( 0.674 0.000 -6.064) 6.102 5.814 ( -0.674 -0.000 6.064) 6.102 6.262 ( -3.755 -0.000 -1.358) 3.993 6.262 ( 3.755 0.000 1.358) 3.993 7.301 ( -2.996 -0.000 -4.245) 5.196 7.301 ( 2.996 0.000 4.245) 5.196 7.759 ( -0.686 -0.000 -12.358) 12.377 7.759 ( 0.686 0.000 12.358) 12.377 8.051 ( 4.537 0.000 -6.740) 8.125 8.051 ( -4.537 -0.000 6.740) 8.125 10.361 ( 1.246 0.000 -6.996) 7.106 10.361 ( -1.246 -0.000 6.996) 7.106 11.683 ( -2.372 -0.000 -9.438) 9.732 11.683 ( 2.372 0.000 9.438) 9.732 14.016 ( 4.079 0.000 -10.582) 11.340 14.016 ( -4.079 -0.000 10.582) 11.340 15.801 ( 1.354 0.000 -0.567) 1.468 15.801 ( -1.354 -0.000 0.567) 1.468 27.200 ( -0.114 -0.000 -2.291) 2.294 27.200 ( 0.114 0.000 2.291) 2.294 27.649 ( 0.178 0.000 -0.111) 0.210 27.649 ( -0.178 -0.000 0.111) 0.210 27.922 ( -0.442 -0.000 -4.006) 4.030 27.922 ( 0.442 0.000 4.006) 4.030 31.849 ( -3.595 -0.000 -9.196) 9.874 31.849 ( 3.595 0.000 9.196) 9.874 32.321 ( 3.744 0.000 -6.714) 7.688 32.321 ( -3.744 -0.000 6.714) 7.688 35.241 ( -1.224 -0.000 -0.084) 1.227 35.241 ( 1.224 0.000 0.084) 1.227 36.197 ( 0.525 0.000 -1.544) 1.630 36.197 ( -0.525 -0.000 1.544) 1.630 44.141 ( 2.538 0.000 -1.269) 2.838 44.141 ( -2.538 -0.000 1.269) 2.838 44.929 ( 5.261 0.000 -6.772) 8.576 44.929 ( -5.261 -0.000 6.772) 8.576 46.917 ( -0.004 -0.000 -6.900) 6.900 46.917 ( 0.004 0.000 6.900) 6.900 47.382 ( 7.396 0.000 -6.024) 9.539 47.382 ( -7.396 -0.000 6.024) 9.539 50.831 ( -7.074 -0.000 -16.609) 18.053 50.831 ( 7.074 0.000 16.609) 18.053 58.534 ( 31.071 0.000 -25.019) 39.892 58.534 ( -31.071 -0.000 25.019) 39.892 69.785 ( 1.182 0.000 -5.978) 6.094 69.785 ( -1.182 -0.000 5.978) 6.094 74.378 ( 1.426 0.000 -2.221) 2.639 74.378 ( -1.426 -0.000 2.221) 2.639 ======================= Grid point 265 (131/150) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( 0.950 -4.095 -4.974) 6.513 1.533 ( 8.266 -5.035 7.858) 12.467 1.755 ( 0.589 4.216 2.738) 5.061 1.857 ( 6.510 -2.098 -4.548) 8.213 2.353 ( -2.967 1.258 -10.703) 11.178 2.561 ( 7.881 -3.872 6.925) 11.183 3.083 ( 0.230 -5.250 -4.694) 7.046 3.142 ( 2.479 -2.508 -0.876) 3.633 3.358 ( -2.799 3.164 -2.417) 4.867 3.495 ( 0.742 3.100 -1.165) 3.393 3.578 ( -3.217 -4.038 -2.307) 5.655 3.705 ( 5.765 -4.277 2.899) 7.741 4.146 ( -1.627 -0.618 -4.747) 5.056 4.209 ( 0.904 -1.259 5.978) 6.176 4.800 ( -2.321 3.496 -5.965) 7.293 4.894 ( 2.251 1.579 5.073) 5.770 5.533 ( -2.066 -0.034 -0.848) 2.233 5.607 ( 2.393 -1.322 1.402) 3.072 5.771 ( -2.443 3.132 1.433) 4.223 5.791 ( -0.722 1.749 -1.479) 2.402 6.256 ( -3.098 -6.282 -1.072) 7.086 6.371 ( 3.551 -6.878 0.427) 7.753 7.240 ( -3.024 1.155 -3.618) 4.854 7.334 ( 2.274 2.247 3.358) 4.636 7.690 ( -1.002 5.684 -9.814) 11.385 7.765 ( 1.356 3.834 13.372) 13.977 7.958 ( -5.334 2.798 6.916) 9.171 8.065 ( 2.613 4.064 -6.317) 7.953 10.303 ( -2.260 4.460 -1.819) 5.320 10.369 ( 1.409 0.152 3.445) 3.725 11.658 ( -3.052 -3.107 -5.567) 7.068 11.745 ( 1.089 -1.913 7.029) 7.366 14.051 ( -8.464 -15.110 7.530) 18.885 14.156 ( 0.033 -16.692 -8.346) 18.662 15.735 ( 1.429 9.153 -1.215) 9.344 15.782 ( 3.624 7.344 -0.261) 8.194 27.198 ( 0.129 0.005 -1.909) 1.914 27.208 ( 0.429 -0.077 2.067) 2.113 27.643 ( -0.530 -0.022 -0.036) 0.531 27.653 ( 0.048 -0.457 -0.081) 0.467 27.901 ( -0.785 0.729 -3.801) 3.949 27.926 ( 0.033 0.671 3.662) 3.723 31.774 ( -3.591 0.881 -8.336) 9.120 31.907 ( 3.104 0.867 8.951) 9.514 32.276 ( -3.819 -0.458 6.030) 7.152 32.366 ( 3.160 -0.325 -6.427) 7.169 35.222 ( -1.160 0.151 -0.350) 1.221 35.259 ( 1.155 0.048 0.014) 1.156 36.188 ( -0.636 0.297 1.292) 1.471 36.201 ( 0.411 0.088 -1.382) 1.444 44.136 ( -0.470 -2.233 0.846) 2.434 44.209 ( 4.314 -2.393 -1.048) 5.043 44.841 ( -5.326 2.262 5.975) 8.318 44.977 ( 4.256 2.180 -6.502) 8.071 46.857 ( -5.663 0.611 -3.261) 6.563 46.932 ( -1.880 -3.805 -0.656) 4.294 47.296 ( -4.273 1.500 6.395) 7.836 47.506 ( 8.903 -0.605 -2.711) 9.326 50.832 ( -8.128 -17.423 -10.050) 21.694 51.132 ( 8.289 -22.563 12.619) 27.148 57.552 ( -48.909 47.982 7.412) 68.915 58.394 ( 6.073 47.153 -22.362) 52.539 69.990 ( -4.779 -29.872 -3.346) 30.436 70.148 ( 3.497 -40.292 4.854) 40.733 74.359 ( 3.646 5.645 1.625) 6.914 74.409 ( 6.572 3.363 -1.687) 7.572 ======================= Grid point 266 (132/150) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( 6.834 -5.757 -6.236) 10.897 1.636 ( -2.307 3.324 8.863) 9.743 1.771 ( 7.482 0.225 -0.802) 7.528 1.996 ( 7.781 -3.158 -1.995) 8.631 2.249 ( -3.618 4.097 -8.021) 9.706 2.732 ( 5.042 -1.969 6.017) 8.094 3.135 ( -0.878 -3.105 0.503) 3.265 3.279 ( 6.080 -9.247 -11.044) 15.635 3.352 ( 5.675 1.629 -1.757) 6.160 3.466 ( -3.003 -2.091 -3.877) 5.332 3.589 ( -1.031 -2.719 -0.994) 3.073 3.823 ( 1.150 -4.075 2.590) 4.963 4.137 ( -1.060 -1.172 -0.060) 1.581 4.259 ( 1.584 -2.415 2.444) 3.783 4.686 ( -2.038 6.412 -3.540) 7.602 4.926 ( 3.262 0.106 2.155) 3.911 5.486 ( -2.676 1.576 -0.394) 3.130 5.664 ( 1.968 -1.197 2.171) 3.165 5.673 ( -3.893 2.920 0.822) 4.935 5.752 ( -0.690 1.706 -0.805) 2.008 6.335 ( -2.395 -10.411 -0.761) 10.710 6.556 ( 3.192 -11.121 -0.982) 11.611 7.156 ( -3.172 4.162 -2.131) 5.650 7.308 ( 1.540 5.423 0.816) 5.696 7.551 ( -1.174 9.157 -2.359) 9.528 7.719 ( 0.747 7.219 10.894) 13.090 7.873 ( -2.852 0.775 5.827) 6.534 8.005 ( 0.860 5.809 -6.204) 8.542 10.192 ( -3.227 3.298 -5.241) 6.982 10.424 ( 2.122 -2.942 4.967) 6.150 11.634 ( -3.486 -0.355 0.215) 3.511 11.768 ( -0.152 0.676 2.695) 2.783 14.183 ( -11.016 -20.949 3.966) 23.999 14.445 ( -3.902 -27.297 -4.965) 28.018 15.584 ( 4.553 17.474 -0.958) 18.083 15.715 ( 5.354 10.440 -0.765) 11.757 27.197 ( 0.199 0.088 -1.214) 1.234 27.220 ( 0.592 -0.086 1.445) 1.564 27.637 ( -0.597 -0.353 0.018) 0.694 27.663 ( 0.079 -0.865 -0.163) 0.884 27.868 ( -0.916 1.270 -3.059) 3.437 27.916 ( -0.268 1.087 2.852) 3.064 31.699 ( -2.787 0.971 -6.412) 7.059 31.947 ( 2.449 1.010 7.325) 7.790 32.237 ( -3.312 -0.567 4.540) 5.648 32.403 ( 2.219 -0.260 -5.096) 5.564 35.202 ( -0.934 0.268 -0.569) 1.126 35.275 ( 0.920 0.032 0.039) 0.922 36.175 ( -0.602 0.423 0.877) 1.145 36.204 ( 0.326 -0.006 -1.003) 1.055 44.189 ( 1.312 -3.914 0.022) 4.128 44.331 ( 4.964 -4.508 -0.305) 6.712 44.723 ( -4.831 4.447 4.471) 7.944 44.968 ( 1.933 4.419 -5.293) 7.161 46.755 ( -5.938 -0.011 -1.633) 6.159 46.963 ( -3.402 -6.239 -3.003) 7.715 47.218 ( -1.815 4.137 5.224) 6.907 47.641 ( 7.228 -0.901 -0.503) 7.302 51.038 ( -8.104 -28.962 -1.263) 30.101 51.728 ( 9.446 -36.451 7.267) 38.350 55.960 ( -45.533 64.045 -10.137) 79.232 57.543 ( -4.870 59.738 -10.381) 60.829 70.359 ( -8.583 -32.443 -4.885) 33.913 70.862 ( 0.158 -47.098 6.990) 47.614 74.328 ( 6.160 9.013 0.562) 10.932 74.472 ( 8.375 3.592 -1.160) 9.186 ======================= Grid point 267 (133/150) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( -2.088 4.366 4.834) 6.841 1.679 ( 7.907 -3.450 -5.775) 10.382 1.839 ( 1.952 -0.871 0.493) 2.194 2.117 ( -1.536 4.607 -4.446) 6.584 2.144 ( 2.789 -2.265 -0.969) 3.721 2.787 ( 1.762 1.030 5.392) 5.765 3.174 ( -3.099 -7.346 -1.536) 8.120 3.386 ( 1.407 4.124 -5.773) 7.233 3.434 ( 8.394 3.548 -2.309) 9.401 3.543 ( 1.169 -10.513 -2.209) 10.806 3.628 ( 1.994 -2.529 -1.172) 3.427 3.881 ( -2.471 -5.892 0.290) 6.396 4.132 ( -0.636 0.796 3.017) 3.185 4.333 ( 1.380 -4.225 -0.031) 4.445 4.552 ( -1.287 7.616 -1.617) 7.891 4.991 ( 2.898 -1.436 0.365) 3.255 5.407 ( -2.680 3.059 0.024) 4.067 5.604 ( -2.514 -0.355 0.692) 2.632 5.697 ( 0.537 0.052 2.375) 2.435 5.722 ( 0.130 1.360 -0.637) 1.507 6.482 ( -1.423 -13.839 -0.590) 13.924 6.771 ( 3.194 -11.521 -3.214) 12.380 7.008 ( -3.056 8.267 0.139) 8.815 7.232 ( 1.559 9.704 -0.381) 9.836 7.395 ( -2.038 7.780 3.996) 8.981 7.650 ( 0.426 3.821 3.080) 4.926 7.852 ( -0.654 0.301 5.574) 5.621 7.928 ( -0.114 3.726 -5.142) 6.351 10.113 ( -2.381 0.699 -4.029) 4.732 10.513 ( 1.718 -3.547 2.789) 4.828 11.571 ( -2.647 2.005 2.098) 3.928 11.744 ( -0.423 1.670 0.184) 1.733 14.303 ( -8.251 -14.429 1.856) 16.725 14.780 ( -6.790 -30.375 -3.559) 31.327 15.368 ( 6.820 24.208 1.458) 25.193 15.657 ( 4.559 7.344 -1.416) 8.759 27.197 ( 0.130 0.102 -0.556) 0.580 27.231 ( 0.432 -0.028 0.720) 0.841 27.637 ( -0.335 -0.567 0.146) 0.674 27.678 ( 0.107 -0.790 -0.209) 0.824 27.833 ( -0.668 1.142 -1.794) 2.229 27.899 ( -0.286 0.915 1.618) 1.881 31.647 ( -1.468 0.530 -3.496) 3.828 31.974 ( 1.472 0.624 4.202) 4.496 32.208 ( -2.039 -0.364 2.423) 3.188 32.425 ( 1.131 -0.091 -2.843) 3.061 35.186 ( -0.527 0.209 -0.440) 0.718 35.285 ( 0.514 0.014 0.034) 0.515 36.163 ( -0.365 0.278 0.445) 0.639 36.208 ( 0.193 -0.055 -0.531) 0.567 44.283 ( 2.650 -4.735 -0.922) 5.504 44.472 ( 2.693 -5.472 1.341) 6.244 44.591 ( -2.550 5.592 2.081) 6.489 44.896 ( -0.750 5.297 -3.348) 6.311 46.686 ( -3.281 -0.391 -0.420) 3.331 46.998 ( -3.737 -6.594 -3.741) 8.452 47.142 ( 0.453 5.556 4.308) 7.045 47.738 ( 3.938 -0.563 0.133) 3.980 51.396 ( -4.470 -31.136 3.390) 31.637 52.389 ( 8.940 -29.958 4.996) 31.660 54.498 ( -29.417 50.714 -13.998) 60.276 56.682 ( -4.279 42.833 -3.035) 43.153 70.607 ( -6.612 -18.376 -3.240) 19.796 71.421 ( -2.128 -28.981 4.942) 29.477 74.293 ( 4.795 7.025 -0.129) 8.506 74.540 ( 5.556 1.979 -0.668) 5.936 ======================= Grid point 268 (134/150) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( -0.000 0.000 0.000) 0.000 1.761 ( -0.000 0.000 0.000) 0.000 1.880 ( -0.000 0.000 0.000) 0.000 2.042 ( -0.000 0.000 0.000) 0.000 2.182 ( -0.000 0.000 0.000) 0.000 2.794 ( -0.000 0.000 0.000) 0.000 3.258 ( -0.000 -0.000 0.000) 0.000 3.298 ( -0.000 0.000 -0.000) 0.000 3.470 ( -0.000 -0.000 0.000) 0.000 3.632 ( -0.000 0.000 -0.000) 0.000 3.677 ( -0.000 0.000 0.000) 0.000 3.919 ( -0.000 0.000 0.000) 0.000 4.113 ( -0.000 0.000 0.000) 0.000 4.407 ( -0.000 -0.000 0.000) 0.000 4.449 ( -0.000 0.000 0.000) 0.000 5.028 ( -0.000 0.000 0.000) 0.000 5.356 ( -0.000 0.000 0.000) 0.000 5.594 ( -0.000 0.000 0.000) 0.000 5.695 ( -0.000 0.000 -0.000) 0.000 5.717 ( -0.000 0.000 0.000) 0.000 6.623 ( -0.000 0.000 0.000) 0.000 6.828 ( -0.000 0.000 0.000) 0.000 7.026 ( -0.000 -0.000 -0.000) 0.000 7.058 ( -0.000 0.000 0.000) 0.000 7.332 ( -0.000 0.000 0.000) 0.000 7.631 ( -0.000 0.000 0.000) 0.000 7.851 ( -0.000 0.000 0.000) 0.000 7.893 ( -0.000 0.000 -0.000) 0.000 10.087 ( -0.000 0.000 0.000) 0.000 10.559 ( -0.000 0.000 0.000) 0.000 11.533 ( -0.000 0.000 0.000) 0.000 11.726 ( -0.000 0.000 0.000) 0.000 14.347 ( -0.000 0.000 0.000) 0.000 15.084 ( -0.000 -0.000 -0.000) 0.000 15.108 ( 0.000 0.000 0.000) 0.000 15.638 ( -0.000 0.000 0.000) 0.000 27.197 ( -0.000 0.000 0.000) 0.000 27.235 ( -0.000 0.000 0.000) 0.000 27.640 ( -0.000 0.000 0.000) 0.000 27.685 ( -0.000 0.000 0.000) 0.000 27.817 ( -0.000 0.000 0.000) 0.000 27.891 ( -0.000 0.000 0.000) 0.000 31.630 ( -0.000 0.000 0.000) 0.000 31.984 ( -0.000 0.000 0.000) 0.000 32.196 ( -0.000 0.000 0.000) 0.000 32.432 ( -0.000 0.000 0.000) 0.000 35.180 ( -0.000 0.000 0.000) 0.000 35.289 ( -0.000 0.000 0.000) 0.000 36.158 ( -0.000 0.000 0.000) 0.000 36.209 ( -0.000 0.000 0.000) 0.000 44.369 ( -0.000 0.000 0.000) 0.000 44.469 ( -0.000 -0.000 0.000) 0.000 44.584 ( -0.000 0.000 0.000) 0.000 44.829 ( -0.000 -0.000 0.000) 0.000 46.664 ( -0.000 0.000 0.000) 0.000 47.020 ( -0.000 -0.000 0.000) 0.000 47.102 ( -0.000 0.000 0.000) 0.000 47.773 ( -0.000 0.000 0.000) 0.000 51.648 ( -0.000 0.000 0.000) 0.000 52.725 ( -0.000 0.000 0.000) 0.000 53.812 ( -0.000 0.000 0.000) 0.000 56.310 ( -0.000 0.000 0.000) 0.000 70.686 ( -0.000 0.000 0.000) 0.000 71.621 ( -0.000 0.000 0.000) 0.000 74.277 ( -0.000 0.000 0.000) 0.000 74.569 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 274 (135/150) ======================= q-point: ( 0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.409 ( 8.478 0.000 -1.249) 8.569 1.666 ( 11.844 0.000 7.625) 14.086 1.881 ( 4.775 0.000 8.723) 9.944 1.933 ( 10.581 0.000 -15.565) 18.821 2.346 ( 1.174 0.000 -13.285) 13.336 2.639 ( 5.990 0.000 7.360) 9.490 3.042 ( 2.201 0.000 -9.977) 10.217 3.162 ( 0.546 0.000 -1.136) 1.260 3.321 ( -1.995 -0.000 -4.804) 5.202 3.420 ( -5.944 -0.000 -1.965) 6.261 3.546 ( -0.812 -0.000 7.040) 7.087 3.842 ( 10.932 0.000 -4.176) 11.702 4.116 ( -0.538 -0.000 -4.751) 4.781 4.208 ( -0.439 -0.000 7.885) 7.898 4.792 ( -1.102 -0.000 -7.140) 7.225 4.929 ( 0.359 0.000 5.500) 5.512 5.507 ( -1.810 -0.000 0.089) 1.812 5.621 ( 0.687 0.000 -0.388) 0.789 5.756 ( -2.837 -0.000 -5.734) 6.398 5.767 ( -3.529 -0.000 6.688) 7.561 6.186 ( 0.008 0.000 -1.770) 1.770 6.363 ( 2.406 0.000 -0.184) 2.413 7.199 ( -2.642 -0.000 -3.498) 4.384 7.390 ( 1.946 0.000 3.386) 3.906 7.714 ( -0.173 -0.000 -9.234) 9.236 7.820 ( 0.475 0.000 14.097) 14.105 7.898 ( -6.398 -0.000 7.382) 9.769 8.109 ( 0.379 0.000 -5.644) 5.657 10.338 ( -1.869 -0.000 9.203) 9.391 10.360 ( -0.509 -0.000 -3.965) 3.997 11.570 ( -3.004 -0.000 -8.058) 8.600 11.747 ( -0.369 -0.000 9.735) 9.742 13.804 ( -10.719 -0.000 8.672) 13.787 13.999 ( -2.158 -0.000 -11.150) 11.357 15.850 ( 4.788 0.000 -0.747) 4.846 15.892 ( 4.336 0.000 -1.228) 4.507 27.200 ( 0.479 0.000 -2.073) 2.128 27.219 ( 0.599 0.000 2.398) 2.472 27.637 ( -0.514 -0.000 -0.121) 0.528 27.644 ( -0.427 -0.000 -0.181) 0.464 27.888 ( -0.825 -0.000 -3.915) 4.001 27.933 ( -0.463 -0.000 3.673) 3.702 31.716 ( -3.036 -0.000 -8.541) 9.065 31.962 ( 1.366 0.000 9.548) 9.646 32.229 ( -3.054 -0.000 6.753) 7.411 32.398 ( 2.683 0.000 -7.311) 7.788 35.206 ( -0.981 -0.000 -0.404) 1.061 35.274 ( 0.835 0.000 -0.400) 0.926 36.184 ( -0.580 -0.000 1.771) 1.864 36.204 ( 0.261 0.000 -1.873) 1.891 44.131 ( 1.598 0.000 0.256) 1.619 44.264 ( 5.141 0.000 -0.260) 5.147 44.794 ( -4.290 -0.000 5.484) 6.963 45.037 ( 2.660 0.000 -6.762) 7.267 46.757 ( -7.467 -0.000 -8.805) 11.545 46.821 ( -6.273 -0.000 3.111) 7.003 47.292 ( -0.494 -0.000 8.382) 8.396 47.632 ( 8.444 0.000 -3.685) 9.213 50.596 ( -4.853 -0.000 -14.496) 15.287 51.054 ( 2.482 0.000 17.825) 17.997 57.099 ( -54.098 -0.000 -7.213) 54.577 58.600 ( -17.868 -0.000 -19.385) 26.363 69.816 ( 1.587 0.000 -4.239) 4.527 69.819 ( 2.497 0.000 6.186) 6.671 74.527 ( 11.204 0.000 -0.251) 11.207 74.565 ( 10.510 0.000 1.082) 10.566 ======================= Grid point 275 (136/150) ======================= q-point: ( 0.25 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( 12.369 -2.086 -0.369) 12.549 1.795 ( 8.100 8.209 6.024) 13.011 1.939 ( 8.084 5.396 -3.340) 10.277 2.079 ( 9.513 -0.860 -5.950) 11.254 2.312 ( 2.129 5.553 -9.980) 11.618 2.760 ( 2.794 -3.708 6.968) 8.373 3.070 ( -4.429 0.229 -5.848) 7.340 3.185 ( 3.727 -10.159 -10.546) 15.110 3.305 ( -4.021 -2.364 -1.693) 4.962 3.429 ( 3.089 -6.552 -0.809) 7.289 3.557 ( 0.851 0.375 4.957) 5.044 3.926 ( 4.940 4.528 -4.492) 8.068 4.127 ( 2.258 0.461 -0.545) 2.369 4.245 ( 1.631 -3.027 4.717) 5.837 4.740 ( -0.516 4.181 -5.497) 6.925 4.945 ( 0.146 -1.245 3.528) 3.744 5.466 ( -2.648 0.771 0.308) 2.775 5.597 ( -6.023 -0.705 -1.984) 6.381 5.698 ( -0.383 1.366 2.838) 3.172 5.737 ( -1.678 -0.483 0.570) 1.837 6.220 ( 0.892 -3.297 -2.208) 4.067 6.452 ( 1.797 -7.849 -1.378) 8.169 7.152 ( -1.722 1.428 -2.595) 3.426 7.397 ( 1.366 3.004 2.258) 3.999 7.643 ( -0.899 6.450 -5.478) 8.510 7.793 ( -4.621 3.645 8.218) 10.108 7.851 ( -0.200 -0.830 10.796) 10.830 8.068 ( -1.144 3.282 -4.811) 5.935 10.227 ( -2.399 7.430 -0.906) 7.860 10.395 ( -0.667 -3.695 4.168) 5.610 11.547 ( -3.007 -3.424 -4.279) 6.251 11.754 ( -1.949 -1.095 7.412) 7.742 13.760 ( -10.205 -14.029 7.181) 18.776 14.052 ( -4.101 -15.313 -10.142) 18.819 15.869 ( 6.813 9.443 -0.635) 11.661 15.921 ( 5.696 5.979 -0.784) 8.295 27.204 ( 0.584 0.226 -1.632) 1.748 27.232 ( 0.641 0.030 2.037) 2.136 27.626 ( -0.532 0.076 -0.107) 0.548 27.646 ( -0.369 -1.057 -0.314) 1.163 27.866 ( -0.679 0.749 -3.475) 3.619 27.925 ( -0.779 0.562 3.232) 3.372 31.662 ( -1.866 0.384 -7.564) 7.800 31.978 ( -1.066 -0.137 8.279) 8.349 32.207 ( -1.003 0.127 6.921) 6.995 32.423 ( 1.896 -0.048 -7.009) 7.261 35.192 ( -0.698 0.125 -0.543) 0.893 35.283 ( 0.348 -0.091 -0.640) 0.734 36.176 ( -0.392 0.425 1.751) 1.844 36.205 ( 0.214 -0.097 -1.767) 1.783 44.181 ( 3.137 -1.916 -0.485) 3.708 44.355 ( 4.385 -2.157 1.046) 4.997 44.727 ( -2.594 2.947 3.867) 5.511 45.030 ( 0.176 2.822 -5.905) 6.547 46.637 ( -7.046 -1.377 -4.239) 8.337 46.766 ( -7.517 -5.957 -1.066) 9.650 47.292 ( 1.540 2.717 7.790) 8.392 47.738 ( 6.173 0.203 -3.664) 7.181 50.613 ( -4.441 -14.346 -7.298) 16.697 51.298 ( -1.713 -28.963 10.948) 31.011 56.062 ( -37.186 38.168 -19.739) 56.826 57.979 ( -24.071 31.337 -6.681) 40.076 69.910 ( 0.206 -16.555 -1.218) 16.601 70.216 ( 0.801 -37.107 2.417) 37.194 74.651 ( 14.873 10.232 -2.317) 18.201 74.725 ( 14.058 5.126 3.623) 15.396 ======================= Grid point 276 (137/150) ======================= q-point: ( 0.38 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( 7.247 13.619 5.660) 16.433 1.803 ( 10.553 -1.512 -1.752) 10.804 1.909 ( 2.516 7.368 -4.845) 9.170 2.171 ( 4.922 5.245 -4.865) 8.683 2.271 ( 5.906 5.694 -3.202) 8.807 2.816 ( -0.701 0.131 2.143) 2.258 2.992 ( -5.869 -6.375 -2.694) 9.074 3.306 ( -2.953 -4.072 0.987) 5.126 3.433 ( 4.030 -11.863 -7.875) 14.798 3.568 ( -0.931 -1.219 3.517) 3.837 3.598 ( 6.052 -5.563 -3.103) 8.786 3.890 ( 2.196 4.963 -4.054) 6.774 4.160 ( 3.439 0.664 2.558) 4.337 4.321 ( 2.398 -1.036 1.127) 2.845 4.646 ( -0.087 6.939 -3.181) 7.633 4.980 ( -0.248 -2.678 1.734) 3.200 5.407 ( -2.597 2.392 -1.355) 3.782 5.518 ( -5.639 -3.790 3.380) 7.589 5.689 ( -1.572 -0.663 -0.276) 1.728 5.731 ( 0.173 0.503 0.962) 1.099 6.305 ( 0.527 -8.253 -2.115) 8.536 6.620 ( 1.015 -12.016 -2.489) 12.313 7.088 ( -0.384 5.316 -1.620) 5.571 7.359 ( 1.703 5.143 0.427) 5.434 7.499 ( -2.442 9.487 -0.581) 9.813 7.686 ( -3.265 3.553 4.341) 6.491 7.866 ( 0.094 0.684 7.646) 7.677 7.981 ( -1.364 4.570 -1.690) 5.060 10.107 ( -1.249 3.605 -3.678) 5.300 10.454 ( -1.188 -5.229 3.022) 6.155 11.539 ( -2.440 -1.420 -0.224) 2.832 11.736 ( -2.541 -0.136 3.807) 4.579 13.903 ( -7.031 -21.456 5.825) 23.318 14.261 ( -5.896 -25.043 -8.298) 27.033 15.784 ( 7.498 17.144 0.378) 18.716 15.891 ( 6.439 10.872 -0.477) 12.645 27.205 ( 0.475 0.461 -0.906) 1.122 27.241 ( 0.382 0.277 1.223) 1.311 27.624 ( -0.210 -0.632 0.169) 0.687 27.660 ( -0.182 -1.391 -0.527) 1.499 27.839 ( -0.301 1.105 -2.556) 2.801 27.906 ( -0.850 0.758 2.390) 2.648 31.631 ( -0.356 0.112 -5.383) 5.396 31.965 ( -2.949 -1.024 5.585) 6.398 32.212 ( 1.060 0.776 5.869) 6.014 32.435 ( 0.893 0.125 -5.460) 5.534 35.182 ( -0.266 0.083 -0.446) 0.526 35.285 ( -0.222 -0.213 -0.772) 0.831 36.167 ( -0.064 0.527 1.482) 1.574 36.207 ( 0.143 -0.121 -1.341) 1.354 44.275 ( 4.102 -3.386 -1.107) 5.433 44.444 ( 1.216 -2.744 2.832) 4.127 44.653 ( 0.354 4.530 1.267) 4.717 44.944 ( -2.364 5.226 -4.158) 7.085 46.585 ( -4.788 -4.207 -0.154) 6.376 46.760 ( -7.264 -9.412 -4.301) 12.643 47.287 ( 3.605 4.973 7.316) 9.552 47.793 ( 2.796 1.015 -3.706) 4.752 50.868 ( -3.281 -29.594 3.251) 29.952 51.794 ( -7.875 -44.743 -0.393) 45.433 54.984 ( -9.462 52.534 -19.532) 56.841 57.124 ( -18.297 37.978 2.209) 42.214 70.214 ( -0.417 -23.926 -0.537) 23.936 70.792 ( -4.361 -42.725 0.782) 42.954 74.675 ( 15.973 17.984 -5.239) 24.617 74.826 ( 14.311 12.273 6.469) 19.932 ======================= Grid point 277 (138/150) ======================= q-point: ( 0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.668 ( 7.801 11.866 -0.641) 14.215 1.815 ( -0.775 6.432 2.245) 6.856 1.909 ( 2.755 2.133 -0.162) 3.488 2.160 ( 5.908 7.120 1.584) 9.386 2.255 ( 5.968 6.359 -4.680) 9.897 2.763 ( -3.485 -0.542 -5.845) 6.827 3.088 ( -2.161 -10.979 6.393) 12.887 3.296 ( -3.487 -1.024 1.633) 3.984 3.469 ( -5.621 3.932 -2.807) 7.412 3.614 ( -0.533 -5.267 -0.912) 5.372 3.715 ( 4.224 0.650 -1.849) 4.656 3.914 ( 3.439 -3.264 -3.381) 5.823 4.201 ( 5.403 5.035 1.676) 7.573 4.365 ( 1.561 -3.123 -0.090) 3.493 4.532 ( -0.291 8.041 -0.700) 8.077 4.996 ( -2.723 -1.437 1.206) 3.306 5.351 ( -0.618 -0.150 -1.024) 1.205 5.545 ( -1.828 -5.451 3.747) 6.863 5.674 ( -1.447 -1.145 -2.867) 3.409 5.713 ( -0.878 1.213 0.785) 1.690 6.481 ( 1.452 -13.553 -0.833) 13.656 6.809 ( -1.353 -14.331 -2.619) 14.631 6.973 ( 1.880 10.928 -1.403) 11.177 7.261 ( -0.803 14.618 0.060) 14.640 7.348 ( -0.231 2.342 0.527) 2.412 7.613 ( -2.863 0.973 1.599) 3.421 7.861 ( 0.330 0.975 -0.043) 1.030 7.915 ( -0.625 2.316 4.344) 4.962 10.087 ( 1.405 -0.951 -1.685) 2.391 10.501 ( -2.856 -4.464 0.268) 5.307 11.528 ( -0.226 -0.641 0.150) 0.696 11.706 ( -2.139 -0.635 1.853) 2.901 14.157 ( -1.712 -20.801 4.444) 21.339 14.551 ( -6.641 -29.033 -6.373) 30.457 15.604 ( 7.755 23.626 0.241) 24.868 15.797 ( 4.402 13.554 1.060) 14.290 27.203 ( 0.317 0.501 -0.269) 0.651 27.239 ( -0.092 0.485 0.395) 0.632 27.636 ( 0.219 -0.761 0.306) 0.848 27.675 ( -0.157 -1.019 -0.506) 1.149 27.823 ( 0.311 0.556 -1.162) 1.325 27.889 ( -0.671 0.268 1.118) 1.331 31.634 ( 1.136 -0.413 -2.331) 2.626 31.938 ( -3.776 -1.648 2.186) 4.664 32.232 ( 2.391 1.122 3.427) 4.327 32.431 ( -0.206 0.281 -2.933) 2.954 35.181 ( 0.268 -0.114 -0.028) 0.292 35.280 ( -0.741 -0.300 -0.818) 1.143 36.165 ( 0.301 0.365 1.117) 1.213 36.208 ( -0.030 -0.041 -0.862) 0.864 44.379 ( 2.423 -1.291 -0.121) 2.749 44.461 ( 0.127 -0.929 1.354) 1.647 44.622 ( 0.915 3.549 -0.309) 3.678 44.830 ( -2.284 2.683 -1.271) 3.745 46.607 ( -1.959 -5.475 1.716) 6.063 46.806 ( -5.647 -11.212 -5.512) 13.710 47.281 ( 5.484 6.665 6.976) 11.098 47.780 ( -0.872 2.032 -3.905) 4.488 51.341 ( -0.635 -34.740 10.846) 36.399 52.221 ( -16.467 -36.585 -12.881) 42.137 54.353 ( 20.211 37.333 -9.748) 43.557 56.426 ( -12.201 24.214 6.599) 27.905 70.552 ( 2.713 -19.341 1.763) 19.610 71.262 ( -7.465 -33.383 -2.446) 34.295 74.601 ( 14.777 22.672 -8.903) 28.490 74.810 ( 10.459 17.739 9.956) 22.873 ======================= Grid point 278 (139/150) ======================= q-point: (-0.38 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( 6.414 5.516 -7.823) 11.523 1.705 ( -1.189 7.468 11.166) 13.485 1.862 ( 0.306 6.092 -3.899) 7.240 2.089 ( -3.291 4.716 5.556) 7.996 2.299 ( 11.310 7.579 -0.435) 13.622 2.734 ( -1.354 -1.249 -8.308) 8.510 3.182 ( -7.650 -9.872 7.232) 14.432 3.262 ( -10.322 0.784 0.334) 10.357 3.287 ( 1.295 2.779 1.887) 3.600 3.591 ( -6.599 2.425 1.983) 7.304 3.754 ( 7.864 4.385 -2.532) 9.353 3.996 ( 2.222 -0.209 -1.961) 2.971 4.184 ( 4.583 6.173 -1.813) 7.899 4.395 ( -1.998 7.598 1.424) 7.984 4.485 ( 3.809 -6.090 0.468) 7.198 4.932 ( -6.278 0.388 0.814) 6.342 5.400 ( 2.800 -3.571 -0.561) 4.573 5.602 ( -0.931 -3.996 2.906) 5.028 5.664 ( -1.138 -0.603 -3.978) 4.181 5.696 ( -0.423 -1.103 -0.195) 1.197 6.661 ( 2.367 -0.536 -0.016) 2.427 6.820 ( -1.348 3.815 3.463) 5.326 7.018 ( 0.276 -5.388 -5.644) 7.807 7.048 ( -0.761 1.580 1.022) 2.030 7.358 ( 2.202 -1.212 -2.689) 3.681 7.570 ( -3.642 -1.707 0.790) 4.099 7.859 ( 1.357 0.127 -5.409) 5.578 7.906 ( -0.541 -0.645 7.621) 7.668 10.151 ( 3.829 -1.600 2.239) 4.716 10.483 ( -4.396 -0.853 -2.373) 5.068 11.567 ( 2.274 -2.839 -1.935) 4.120 11.703 ( -1.651 -2.551 1.812) 3.538 14.435 ( 5.022 -11.898 2.283) 13.114 14.852 ( -7.399 -26.041 -3.821) 27.340 15.352 ( 8.374 26.177 -0.651) 27.492 15.641 ( -0.730 11.373 2.790) 11.733 27.200 ( 0.209 0.374 0.266) 0.504 27.227 ( -0.447 0.456 -0.295) 0.703 27.648 ( 0.483 -0.015 0.074) 0.488 27.679 ( -0.324 -0.075 -0.163) 0.370 27.833 ( 0.868 -0.726 0.588) 1.276 27.884 ( -0.400 -0.755 -0.509) 0.994 31.670 ( 2.458 -0.952 1.101) 2.856 31.905 ( -3.967 -1.817 -1.449) 4.598 32.261 ( 3.135 1.051 0.342) 3.324 32.412 ( -1.341 0.369 0.039) 1.391 35.193 ( 0.784 -0.319 0.465) 0.965 35.270 ( -1.107 -0.322 -0.774) 1.388 36.169 ( 0.582 0.100 0.584) 0.831 36.205 ( -0.271 0.034 -0.339) 0.435 44.334 ( -0.534 5.331 1.097) 5.469 44.495 ( -4.371 4.400 0.195) 6.206 44.585 ( 5.602 -2.591 -3.393) 7.043 44.828 ( -1.251 -3.945 2.498) 4.834 46.685 ( 1.352 -5.466 1.948) 5.958 46.884 ( -4.236 -10.365 -4.844) 12.200 47.285 ( 6.949 7.017 6.136) 11.627 47.698 ( -4.281 2.937 -3.922) 6.506 51.695 ( 2.414 -3.865 9.512) 10.547 52.283 ( -15.942 -10.474 -15.376) 24.501 54.586 ( 37.124 -10.681 -1.692) 38.668 56.182 ( -10.772 -15.913 9.397) 21.391 70.834 ( 8.535 -5.909 5.383) 11.694 71.483 ( -7.685 -12.250 -7.117) 16.117 74.454 ( 10.714 21.351 -10.776) 26.206 74.663 ( 3.272 18.769 12.043) 22.539 ======================= Grid point 279 (140/150) ======================= q-point: (-0.25 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( 0.394 8.142 5.903) 10.065 1.684 ( -1.233 1.481 -1.466) 2.422 1.754 ( 4.283 8.363 -7.453) 11.993 1.949 ( -6.397 5.294 4.042) 9.235 2.367 ( 9.852 4.867 5.119) 12.122 2.667 ( -6.350 3.348 -6.680) 9.806 3.131 ( -3.127 -2.792 -4.013) 5.803 3.210 ( -6.752 -6.849 8.248) 12.670 3.306 ( 1.243 1.126 1.698) 2.387 3.424 ( -6.050 4.714 3.117) 8.279 3.791 ( 8.194 7.900 0.085) 11.382 3.942 ( -0.625 8.680 -2.222) 8.982 4.179 ( 2.685 2.082 -1.833) 3.861 4.265 ( -3.027 4.196 1.191) 5.309 4.645 ( 4.815 -5.990 1.509) 7.832 4.834 ( -6.580 -1.669 -0.834) 6.839 5.502 ( 3.498 -2.913 0.441) 4.574 5.614 ( -3.375 -1.876 -1.169) 4.034 5.683 ( 1.885 -2.010 -0.392) 2.783 5.719 ( -0.468 -2.495 -0.247) 2.551 6.563 ( 3.546 13.236 -0.116) 13.703 6.674 ( -3.663 11.830 1.437) 12.467 7.109 ( 3.017 -9.420 1.274) 9.973 7.184 ( -1.756 -9.543 -0.852) 9.740 7.451 ( 3.017 -6.922 -3.728) 8.421 7.564 ( -4.120 -6.072 -0.947) 7.399 7.888 ( 2.457 -1.403 -6.462) 7.054 7.931 ( -1.438 -3.010 7.436) 8.150 10.238 ( 4.629 -0.457 5.278) 7.036 10.400 ( -4.546 1.468 -4.840) 6.801 11.657 ( 3.130 -3.421 -2.661) 5.346 11.727 ( -1.711 -3.217 1.651) 4.001 14.592 ( 9.923 9.200 0.047) 13.532 14.843 ( -4.902 16.737 -0.882) 17.463 15.315 ( 4.985 -10.041 -0.445) 11.219 15.509 ( -6.102 -2.676 2.165) 7.006 27.200 ( 0.188 0.223 0.813) 0.863 27.213 ( -0.500 0.302 -0.888) 1.063 27.652 ( 0.619 0.441 -0.046) 0.762 27.669 ( -0.455 0.512 0.042) 0.686 27.866 ( 0.942 -1.434 2.121) 2.729 27.893 ( -0.360 -1.373 -2.030) 2.477 31.737 ( 3.452 -1.416 4.382) 5.755 31.867 ( -3.906 -1.745 -4.722) 6.372 32.296 ( 3.442 0.829 -2.523) 4.348 32.379 ( -2.456 0.489 2.763) 3.729 35.214 ( 1.149 -0.374 0.690) 1.392 35.255 ( -1.278 -0.291 -0.656) 1.466 36.180 ( 0.698 -0.138 -0.074) 0.715 36.199 ( -0.493 -0.026 0.208) 0.536 44.256 ( 0.939 5.624 -0.149) 5.704 44.338 ( -4.328 6.111 0.611) 7.513 44.730 ( 5.722 -4.759 -4.401) 8.646 44.865 ( -3.536 -4.842 4.445) 7.464 46.805 ( 4.245 -4.437 1.982) 6.453 46.940 ( -3.909 -6.008 -2.936) 7.746 47.317 ( 7.846 4.783 3.748) 9.924 47.559 ( -7.086 3.303 -3.164) 8.434 51.599 ( 9.082 24.791 3.157) 26.591 51.965 ( -13.778 20.789 -7.081) 25.926 55.704 ( 39.985 -57.662 -2.326) 70.207 56.566 ( -16.183 -58.454 10.829) 61.612 70.941 ( 12.645 17.421 9.234) 23.423 71.310 ( -7.885 19.227 -11.120) 23.569 74.316 ( 5.338 10.977 -8.502) 14.875 74.439 ( -3.762 11.873 9.745) 15.814 ======================= Grid point 280 (141/150) ======================= q-point: (-0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( -3.445 7.797 -10.224) 13.312 1.510 ( 3.445 7.797 10.224) 13.312 1.792 ( 2.905 2.010 -9.863) 10.477 1.792 ( -2.905 2.010 9.863) 10.477 2.470 ( -8.312 2.777 -7.669) 11.646 2.470 ( 8.312 2.777 7.669) 11.646 3.165 ( 3.486 2.871 -8.384) 9.523 3.165 ( -3.486 2.871 8.384) 9.523 3.347 ( 1.106 -4.162 -3.744) 5.707 3.347 ( -1.106 -4.162 3.744) 5.707 3.758 ( -3.741 9.570 -4.764) 11.326 3.758 ( 3.742 9.570 4.764) 11.326 4.193 ( -0.656 1.045 -5.888) 6.016 4.193 ( 0.656 1.045 5.888) 6.016 4.795 ( -2.617 -4.268 -5.848) 7.699 4.795 ( 2.617 -4.268 5.848) 7.699 5.575 ( -2.851 -0.098 -1.597) 3.270 5.575 ( 2.851 -0.098 1.597) 3.270 5.748 ( 0.649 -3.215 -3.611) 4.878 5.748 ( -0.649 -3.215 3.611) 4.878 6.443 ( -3.320 11.021 -0.873) 11.543 6.443 ( 3.320 11.021 0.873) 11.543 7.251 ( -2.185 -4.220 -2.063) 5.180 7.251 ( 2.185 -4.220 2.063) 5.180 7.621 ( -2.073 -8.916 -8.581) 12.547 7.621 ( 2.073 -8.916 8.581) 12.547 7.960 ( 3.273 -4.099 -6.962) 8.717 7.960 ( -3.273 -4.099 6.962) 8.717 10.316 ( -2.199 -0.470 -8.701) 8.987 10.316 ( 2.199 -0.470 8.701) 8.987 11.728 ( -1.101 -0.426 -2.715) 2.961 11.728 ( 1.101 -0.426 2.715) 2.961 14.444 ( 1.332 24.198 -8.744) 25.764 14.444 ( -1.332 24.198 8.744) 25.764 15.573 ( -3.232 -13.758 -0.852) 14.158 15.573 ( 3.232 -13.758 0.852) 14.158 27.202 ( -0.147 0.136 -1.844) 1.855 27.202 ( 0.147 0.136 1.844) 1.855 27.655 ( -0.444 0.424 -0.021) 0.614 27.655 ( 0.444 0.424 0.021) 0.614 27.902 ( -0.554 -1.260 -3.210) 3.492 27.902 ( 0.554 -1.260 3.210) 3.492 31.823 ( -3.653 -1.510 -7.316) 8.316 31.823 ( 3.653 -1.510 7.316) 8.316 32.332 ( 3.263 0.622 -4.937) 5.951 32.332 ( -3.263 0.622 4.937) 5.951 35.238 ( -1.085 -0.236 -0.682) 1.303 35.238 ( 1.085 -0.236 0.682) 1.303 36.192 ( 0.420 -0.217 -1.070) 1.170 36.192 ( -0.420 -0.217 1.070) 1.170 44.208 ( 1.870 4.458 -0.730) 4.889 44.208 ( -1.870 4.458 0.730) 4.889 44.869 ( 5.018 -3.869 -5.640) 8.483 44.869 ( -5.018 -3.869 5.640) 8.483 46.925 ( -1.338 -1.387 -6.235) 6.526 46.925 ( 1.338 -1.387 6.235) 6.526 47.395 ( -5.101 1.911 -2.812) 6.130 47.395 ( 5.101 1.911 2.812) 6.130 51.357 ( -6.145 30.167 -13.633) 33.670 51.357 ( 6.145 30.167 13.633) 33.670 57.227 ( 12.299 -71.789 -8.355) 73.312 57.227 ( -12.299 -71.789 8.355) 73.312 70.687 ( -3.631 42.167 -21.288) 47.375 70.687 ( 3.631 42.167 21.288) 47.375 74.300 ( 3.557 -0.593 -4.731) 5.949 74.300 ( -3.557 -0.593 4.731) 5.949 ======================= Grid point 284 (142/150) ======================= q-point: ( 0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( 11.937 0.000 -0.314) 11.941 2.013 ( 6.651 0.000 -1.428) 6.803 2.059 ( 5.627 0.000 4.273) 7.066 2.280 ( 14.476 0.000 -12.857) 19.361 2.390 ( 4.789 0.000 -10.149) 11.222 2.758 ( -0.128 -0.000 9.605) 9.606 2.975 ( -8.567 -0.000 -7.859) 11.626 3.126 ( 5.140 0.000 -7.737) 9.289 3.304 ( 0.970 0.000 -0.327) 1.024 3.357 ( 0.629 0.000 2.320) 2.404 3.606 ( 1.916 0.000 1.506) 2.437 3.960 ( -2.055 -0.000 -2.182) 2.997 4.250 ( 9.045 0.000 -3.987) 9.885 4.253 ( 3.434 0.000 6.534) 7.381 4.762 ( 0.292 0.000 -6.173) 6.180 4.927 ( -1.232 -0.000 3.723) 3.922 5.407 ( -5.850 -0.000 3.606) 6.872 5.490 ( -6.599 -0.000 -6.911) 9.555 5.675 ( -2.641 -0.000 4.857) 5.528 5.738 ( 0.965 0.000 1.320) 1.635 6.231 ( 2.472 0.000 -4.374) 5.024 6.399 ( 0.132 0.000 -1.852) 1.857 7.145 ( 0.075 0.000 -2.525) 2.526 7.436 ( 0.577 0.000 1.844) 1.932 7.682 ( -0.842 -0.000 -5.386) 5.451 7.734 ( -5.356 -0.000 5.467) 7.654 7.867 ( -0.246 -0.000 14.918) 14.920 8.053 ( -2.333 -0.000 -6.519) 6.924 10.301 ( -2.452 -0.000 -3.295) 4.107 10.301 ( -2.393 -0.000 8.959) 9.273 11.471 ( -1.876 -0.000 -6.358) 6.629 11.714 ( -3.473 -0.000 8.577) 9.253 13.535 ( -7.142 -0.000 8.873) 11.390 13.865 ( -3.927 -0.000 -11.961) 12.589 16.048 ( 6.096 0.000 -1.216) 6.216 16.053 ( 7.710 0.000 0.300) 7.716 27.214 ( 0.790 0.000 -1.783) 1.950 27.245 ( 0.543 0.000 2.286) 2.350 27.623 ( -0.310 -0.000 -0.344) 0.463 27.626 ( -0.599 -0.000 -0.297) 0.669 27.858 ( -0.336 -0.000 -3.372) 3.388 27.919 ( -1.075 -0.000 3.196) 3.372 31.634 ( -0.596 -0.000 -7.643) 7.667 31.946 ( -3.853 -0.000 7.535) 8.463 32.225 ( 1.164 0.000 8.951) 9.026 32.437 ( 1.346 0.000 -8.033) 8.145 35.183 ( -0.389 -0.000 -0.556) 0.679 35.281 ( -0.295 -0.000 -1.080) 1.119 36.178 ( -0.175 -0.000 2.453) 2.459 36.204 ( 0.221 0.000 -2.317) 2.328 44.223 ( 4.278 0.000 -1.071) 4.410 44.398 ( 2.710 0.000 2.622) 3.770 44.734 ( -0.192 -0.000 2.677) 2.684 45.031 ( -1.740 -0.000 -5.804) 6.059 46.509 ( -6.637 -0.000 -6.418) 9.233 46.602 ( -8.021 -0.000 1.757) 8.211 47.355 ( 2.714 0.000 7.887) 8.341 47.810 ( 3.725 0.000 -5.641) 6.760 50.458 ( -1.564 -0.000 -13.378) 13.469 50.998 ( -9.300 -0.000 13.942) 16.759 55.878 ( -18.141 -0.000 -22.739) 29.088 57.762 ( -29.887 -0.000 0.398) 29.890 69.868 ( 2.697 0.000 -2.230) 3.499 69.944 ( 4.014 0.000 2.828) 4.910 74.992 ( 15.834 0.000 9.999) 18.727 75.006 ( 19.602 0.000 -7.862) 21.120 ======================= Grid point 285 (143/150) ======================= q-point: ( 0.38 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( 5.473 0.826 -3.957) 6.804 2.019 ( 0.747 4.852 -3.324) 5.928 2.077 ( 7.703 10.338 5.799) 14.136 2.389 ( 7.470 5.849 -5.900) 11.172 2.458 ( 10.292 5.032 -10.229) 15.358 2.779 ( -2.310 0.124 3.459) 4.161 2.846 ( -3.541 -2.546 -1.665) 4.669 3.279 ( 1.507 0.817 0.329) 1.745 3.298 ( 2.649 -9.788 -3.632) 10.771 3.469 ( 0.420 -7.143 2.218) 7.491 3.622 ( 1.277 -1.250 -1.534) 2.355 3.918 ( -2.950 -0.343 -1.482) 3.319 4.291 ( 7.529 4.255 2.113) 8.902 4.384 ( 5.683 0.405 -0.634) 5.732 4.729 ( 0.770 4.278 -4.757) 6.443 4.928 ( -1.653 -2.254 2.187) 3.549 5.351 ( -7.033 -5.344 5.589) 10.453 5.374 ( -5.062 0.693 -5.016) 7.160 5.654 ( -1.189 0.098 1.796) 2.156 5.748 ( 0.312 0.584 1.720) 1.843 6.254 ( 1.582 -1.162 -3.879) 4.347 6.463 ( -0.820 -8.723 -2.821) 9.204 7.146 ( 1.982 1.740 -2.487) 3.625 7.427 ( 0.043 1.988 1.297) 2.374 7.584 ( -2.152 7.144 -1.313) 7.576 7.675 ( -3.578 1.324 2.441) 4.530 7.887 ( -0.305 -0.026 11.982) 11.985 7.992 ( -2.304 1.834 -4.831) 5.658 10.165 ( -1.179 6.712 -0.978) 6.885 10.349 ( -3.013 -5.084 3.357) 6.797 11.469 ( -1.060 -3.179 -3.817) 5.079 11.678 ( -4.180 -1.438 6.490) 7.853 13.570 ( -3.520 -13.476 9.543) 16.884 13.885 ( -4.491 -13.462 -11.630) 18.348 16.078 ( 6.691 8.553 -1.205) 10.926 16.121 ( 6.676 6.363 1.003) 9.277 27.220 ( 0.740 0.483 -1.330) 1.597 27.253 ( 0.220 0.319 1.748) 1.791 27.615 ( -0.161 -0.217 0.024) 0.272 27.634 ( -0.297 -1.405 -0.627) 1.567 27.846 ( 0.080 0.643 -2.853) 2.926 27.903 ( -1.157 0.429 2.777) 3.039 31.625 ( 0.845 -0.135 -6.515) 6.571 31.897 ( -4.660 -0.897 6.217) 7.822 32.259 ( 1.950 0.572 8.751) 8.984 32.438 ( 0.534 0.176 -7.675) 7.695 35.180 ( 0.048 -0.015 -0.395) 0.398 35.272 ( -0.857 -0.195 -1.235) 1.516 36.178 ( 0.095 0.398 2.393) 2.427 36.205 ( 0.174 -0.121 -2.119) 2.130 44.303 ( 4.700 -1.735 -1.462) 5.219 44.438 ( 0.828 -0.978 3.547) 3.771 44.725 ( 1.367 2.873 1.352) 3.458 44.958 ( -3.376 3.435 -4.744) 6.760 46.443 ( -4.891 -4.203 -2.347) 6.862 46.530 ( -7.087 -5.931 -1.167) 9.315 47.404 ( 4.111 1.841 7.800) 9.007 47.828 ( 0.604 0.930 -6.615) 6.707 50.519 ( -0.518 -13.980 -5.050) 14.874 51.074 ( -12.240 -28.761 3.768) 31.483 55.510 ( 3.081 27.817 -18.600) 33.604 57.198 ( -25.162 17.891 5.577) 31.374 69.975 ( 3.659 -11.759 0.326) 12.319 70.231 ( -0.074 -27.255 -0.377) 27.257 75.159 ( 17.124 12.107 2.568) 21.128 75.239 ( 17.582 7.913 -0.569) 19.289 ======================= Grid point 286 (144/150) ======================= q-point: ( 0.50 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( 1.049 6.573 -4.273) 7.909 1.892 ( -1.738 7.352 -1.252) 7.657 2.091 ( 8.538 8.834 6.066) 13.702 2.335 ( 1.745 10.592 0.487) 10.746 2.535 ( 11.444 2.997 -10.655) 15.921 2.706 ( 1.787 4.738 -2.341) 5.579 2.919 ( -3.850 -8.068 4.878) 10.184 3.274 ( 0.925 1.863 1.448) 2.534 3.394 ( -5.764 -2.191 -2.873) 6.803 3.502 ( -3.068 -3.356 2.025) 4.978 3.726 ( 3.132 -6.155 -1.589) 7.086 3.900 ( -0.783 -2.737 -2.606) 3.859 4.373 ( 8.537 1.899 1.988) 8.969 4.408 ( 3.396 4.248 -1.043) 5.538 4.648 ( 0.510 7.661 -2.241) 7.998 4.924 ( -3.832 -1.188 1.315) 4.222 5.307 ( -2.616 -3.275 -2.068) 4.674 5.402 ( -3.343 -8.627 4.066) 10.106 5.639 ( -0.347 0.083 -1.201) 1.253 5.726 ( -1.143 1.907 1.441) 2.650 6.347 ( 2.710 -8.481 -1.910) 9.106 6.582 ( -2.911 -11.690 -2.797) 12.368 7.134 ( 3.478 5.758 -2.456) 7.161 7.375 ( -3.028 4.824 1.276) 5.837 7.439 ( 1.198 8.761 -1.632) 8.992 7.594 ( -3.371 2.686 2.594) 5.031 7.885 ( 0.213 1.357 1.934) 2.373 7.932 ( -1.809 1.602 3.472) 4.230 10.110 ( 2.148 1.013 -1.786) 2.972 10.370 ( -4.508 -5.087 1.164) 6.896 11.504 ( 0.448 -2.664 -1.684) 3.184 11.649 ( -3.699 -1.771 3.895) 5.656 13.821 ( -0.201 -22.234 8.961) 23.973 14.067 ( -4.940 -23.184 -10.105) 25.768 15.998 ( 6.348 15.875 -2.083) 17.224 16.070 ( 4.255 12.705 2.502) 13.630 27.219 ( 0.586 0.802 -0.650) 1.187 27.246 ( -0.226 0.747 0.850) 1.154 27.626 ( 0.281 -1.091 0.455) 1.215 27.652 ( -0.249 -1.591 -0.806) 1.801 27.837 ( 0.555 0.714 -1.989) 2.185 27.883 ( -1.070 0.449 1.981) 2.295 31.646 ( 2.193 -0.656 -4.345) 4.911 31.852 ( -4.675 -1.598 4.141) 6.446 32.292 ( 2.324 0.939 6.608) 7.067 32.424 ( -0.447 0.422 -5.901) 5.933 35.185 ( 0.568 -0.187 0.043) 0.600 35.258 ( -1.223 -0.373 -1.190) 1.747 36.178 ( 0.361 0.433 1.977) 2.055 36.205 ( -0.018 -0.036 -1.666) 1.666 44.401 ( 3.669 -2.104 -0.928) 4.330 44.458 ( 0.361 -0.404 2.478) 2.537 44.696 ( 1.135 4.190 0.426) 4.362 44.834 ( -3.503 4.349 -2.565) 6.145 46.473 ( -2.610 -7.710 2.088) 8.403 46.556 ( -4.858 -10.465 -4.434) 12.360 47.448 ( 5.342 3.611 7.741) 10.075 47.781 ( -2.317 2.242 -6.863) 7.583 50.859 ( 1.693 -31.162 7.001) 31.984 51.383 ( -14.054 -39.459 -9.496) 42.950 55.199 ( 20.947 34.406 -12.115) 42.063 56.551 ( -20.560 23.860 8.092) 32.519 70.295 ( 4.737 -22.139 2.245) 22.751 70.643 ( -5.066 -33.719 -2.750) 34.208 75.165 ( 15.451 21.081 -4.689) 26.554 75.284 ( 12.071 18.013 6.012) 22.502 ======================= Grid point 287 (145/150) ======================= q-point: (-0.38 0.25 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( 0.530 6.827 -3.166) 7.544 1.798 ( -1.394 5.429 2.451) 6.117 2.066 ( 6.358 11.121 -0.576) 12.823 2.175 ( -1.744 10.808 3.809) 11.591 2.656 ( 13.810 9.486 -1.885) 16.860 2.700 ( 3.293 0.059 -6.715) 7.479 2.943 ( -7.017 -7.978 5.235) 11.845 3.151 ( -11.402 6.421 -0.037) 13.086 3.334 ( 2.677 -0.219 0.895) 2.831 3.488 ( -6.181 -2.156 0.676) 6.581 3.854 ( 4.730 -3.670 -0.425) 6.002 3.953 ( -0.966 -5.028 -2.365) 5.640 4.373 ( 4.333 7.578 -0.970) 8.783 4.466 ( -0.328 3.419 1.749) 3.854 4.554 ( 7.157 4.774 -1.139) 8.679 4.829 ( -8.355 1.166 1.256) 8.529 5.378 ( 2.634 -5.555 -1.399) 6.305 5.478 ( -3.606 -7.479 2.093) 8.563 5.646 ( 0.766 -0.825 -1.767) 2.095 5.682 ( -1.358 0.727 0.708) 1.695 6.563 ( 3.874 -13.125 0.559) 13.696 6.700 ( -4.473 -12.559 -1.977) 13.478 7.069 ( 3.863 9.735 -2.309) 10.725 7.178 ( -3.660 12.063 1.309) 12.674 7.407 ( 3.320 2.385 -2.315) 4.698 7.512 ( -3.884 1.409 2.556) 4.859 7.877 ( 1.353 0.606 -5.893) 6.077 7.902 ( -1.532 0.450 8.200) 8.353 10.185 ( 4.940 -3.023 0.453) 5.810 10.360 ( -5.793 -4.218 -1.073) 7.246 11.558 ( 2.203 -2.650 -1.751) 3.866 11.634 ( -2.923 -2.521 2.506) 4.602 14.204 ( 3.014 -25.070 6.819) 26.155 14.352 ( -5.110 -27.406 -7.363) 28.834 15.809 ( 5.539 21.618 -3.355) 22.567 15.884 ( 0.117 18.271 3.949) 18.693 27.214 ( 0.476 0.798 -0.078) 0.932 27.229 ( -0.486 0.827 0.116) 0.966 27.649 ( 0.516 -0.899 0.474) 1.140 27.665 ( -0.394 -1.005 -0.590) 1.230 27.841 ( 0.918 -0.058 -0.739) 1.180 27.867 ( -0.908 -0.177 0.755) 1.194 31.697 ( 3.297 -1.263 -1.490) 3.832 31.813 ( -4.400 -1.842 1.377) 4.964 32.323 ( 2.548 0.962 3.388) 4.347 32.395 ( -1.519 0.610 -3.113) 3.517 35.202 ( 1.040 -0.388 0.572) 1.249 35.243 ( -1.361 -0.461 -1.038) 1.773 36.183 ( 0.534 0.276 1.397) 1.521 36.200 ( -0.306 0.092 -1.200) 1.242 44.415 ( 1.449 3.951 1.519) 4.474 44.482 ( -1.626 0.708 -0.854) 1.968 44.654 ( 3.432 2.372 -2.126) 4.683 44.761 ( -2.989 -0.830 1.473) 3.434 46.588 ( 0.398 -9.609 3.247) 10.151 46.655 ( -3.210 -11.743 -4.533) 12.991 47.483 ( 6.121 5.096 7.259) 10.776 47.674 ( -4.685 3.804 -6.616) 8.955 51.428 ( 3.953 -34.714 16.611) 38.686 51.709 ( -11.543 -33.777 -18.946) 40.412 55.177 ( 30.464 18.338 -9.429) 36.786 55.954 ( -21.567 13.953 10.524) 27.759 70.734 ( 7.721 -23.537 4.969) 25.264 71.003 ( -8.482 -29.502 -5.566) 31.198 75.001 ( 11.313 27.615 -12.699) 32.432 75.094 ( 3.190 26.127 13.305) 29.493 ======================= Grid point 288 (146/150) ======================= q-point: (-0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 134 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( 0.768 5.207 -9.182) 10.583 1.699 ( -0.768 5.207 9.182) 10.583 1.981 ( 4.898 10.394 -5.342) 12.671 1.981 ( -4.898 10.394 5.342) 12.671 2.645 ( -7.225 9.485 -5.652) 13.195 2.645 ( 7.225 9.485 5.652) 13.195 3.018 ( 0.992 -7.604 -5.551) 9.466 3.018 ( -0.992 -7.604 5.551) 9.466 3.394 ( -4.880 1.908 0.058) 5.240 3.394 ( 4.880 1.908 -0.058) 5.240 3.958 ( -3.453 0.101 -1.685) 3.844 3.958 ( 3.453 0.101 1.685) 3.844 4.311 ( 2.080 8.532 -2.566) 9.149 4.311 ( -2.080 8.532 2.566) 9.149 4.690 ( -4.632 -1.734 -3.300) 5.946 4.690 ( 4.632 -1.734 3.300) 5.946 5.507 ( -3.371 -4.577 -0.616) 5.717 5.507 ( 3.371 -4.577 0.616) 5.717 5.676 ( -0.742 -1.665 -1.210) 2.188 5.676 ( 0.742 -1.665 1.210) 2.188 6.752 ( -0.197 1.147 -1.664) 2.030 6.752 ( 0.197 1.147 1.664) 2.030 7.025 ( 1.019 -2.271 -3.660) 4.427 7.025 ( -1.019 -2.271 3.660) 4.427 7.450 ( 2.630 -1.130 -3.477) 4.504 7.450 ( -2.630 -1.130 3.477) 4.504 7.892 ( 1.762 -0.735 -7.950) 8.176 7.892 ( -1.762 -0.735 7.950) 8.176 10.312 ( -5.707 -1.767 -3.279) 6.815 10.312 ( 5.707 -1.767 3.279) 6.815 11.641 ( 2.566 -3.754 -2.694) 5.285 11.641 ( -2.566 -3.754 2.694) 5.285 14.627 ( -2.153 -20.562 -11.553) 23.683 14.627 ( 2.153 -20.562 11.553) 23.683 15.564 ( 4.291 20.124 -4.075) 20.976 15.564 ( -4.291 20.124 4.075) 20.976 27.211 ( -0.307 0.576 -0.627) 0.905 27.211 ( 0.307 0.576 0.627) 0.905 27.665 ( -0.224 -0.054 -0.614) 0.655 27.665 ( 0.224 -0.054 0.614) 0.655 27.863 ( -0.700 -1.056 -0.991) 1.608 27.863 ( 0.700 -1.056 0.991) 1.608 31.775 ( -2.400 -1.717 -3.670) 4.709 31.775 ( 2.400 -1.717 3.670) 4.709 32.352 ( -0.059 0.746 -4.631) 4.691 32.352 ( 0.059 0.746 4.631) 4.691 35.228 ( -1.282 -0.448 -0.895) 1.626 35.228 ( 1.282 -0.448 0.895) 1.626 36.190 ( -0.576 0.087 -0.637) 0.863 36.190 ( 0.576 0.087 0.637) 0.863 44.374 ( -2.944 6.107 -0.174) 6.781 44.374 ( 2.944 6.107 0.174) 6.781 44.742 ( 4.185 -3.792 -3.694) 6.748 44.742 ( -4.185 -3.792 3.694) 6.748 46.761 ( -1.583 -9.445 -6.188) 11.402 46.761 ( 1.583 -9.445 6.188) 11.402 47.513 ( -6.593 5.226 -5.897) 10.274 47.513 ( 6.593 5.226 5.897) 10.274 51.878 ( -6.153 -8.669 -18.556) 21.385 51.878 ( 6.153 -8.669 18.556) 21.385 55.620 ( 7.553 -21.005 -6.750) 23.320 55.620 ( -7.553 -21.005 6.750) 23.320 71.167 ( -6.072 -12.294 -16.567) 21.505 71.167 ( 6.072 -12.294 16.567) 21.505 74.696 ( 5.257 27.041 -18.846) 33.377 74.696 ( -5.257 27.041 18.846) 33.377 ======================= Grid point 294 (147/150) ======================= q-point: ( 0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( 2.750 0.000 -5.475) 6.127 2.031 ( -1.931 -0.000 -3.243) 3.774 2.275 ( 6.000 0.000 9.825) 11.512 2.475 ( 1.228 0.000 -14.051) 14.105 2.591 ( 4.797 0.000 -9.714) 10.834 2.720 ( -3.357 -0.000 9.422) 10.002 2.916 ( 8.539 0.000 -3.650) 9.286 3.225 ( 0.431 0.000 2.043) 2.088 3.399 ( 1.749 0.000 1.350) 2.209 3.400 ( 4.840 0.000 0.212) 4.844 3.616 ( 0.162 0.000 -2.963) 2.968 3.841 ( -5.123 -0.000 1.102) 5.240 4.445 ( 6.343 0.000 4.112) 7.559 4.475 ( 5.853 0.000 -3.755) 6.953 4.771 ( 1.622 0.000 -5.139) 5.389 4.887 ( -1.586 -0.000 0.944) 1.846 5.203 ( -7.207 -0.000 7.519) 10.415 5.277 ( -5.845 -0.000 -5.728) 8.184 5.663 ( 0.820 0.000 2.785) 2.903 5.754 ( -0.450 -0.000 1.323) 1.397 6.272 ( 1.215 0.000 -4.306) 4.474 6.365 ( -1.688 -0.000 -2.298) 2.852 7.197 ( 3.737 0.000 -3.075) 4.839 7.429 ( -1.660 -0.000 1.203) 2.050 7.621 ( -2.143 -0.000 -1.197) 2.454 7.622 ( -2.706 -0.000 2.826) 3.913 7.896 ( -0.712 -0.000 14.735) 14.752 7.966 ( -1.295 -0.000 -9.910) 9.995 10.222 ( -1.492 -0.000 -4.244) 4.499 10.248 ( -2.617 -0.000 7.277) 7.733 11.432 ( 0.679 0.000 -5.147) 5.191 11.604 ( -4.895 -0.000 6.628) 8.239 13.459 ( -0.253 -0.000 11.875) 11.878 13.705 ( -4.049 -0.000 -12.967) 13.584 16.230 ( 5.666 0.000 -2.499) 6.192 16.261 ( 4.915 0.000 2.386) 5.463 27.234 ( 0.820 0.000 -1.523) 1.730 27.259 ( -0.087 -0.000 1.893) 1.895 27.613 ( -0.186 -0.000 -0.252) 0.313 27.616 ( -0.107 -0.000 -0.325) 0.343 27.851 ( 0.442 0.000 -2.792) 2.827 27.892 ( -1.226 -0.000 2.786) 3.044 31.636 ( 2.049 0.000 -6.655) 6.964 31.827 ( -4.842 -0.000 6.338) 7.976 32.307 ( 1.890 0.000 9.813) 9.994 32.431 ( -0.025 -0.000 -8.809) 8.809 35.183 ( 0.455 0.000 -0.166) 0.484 35.252 ( -1.248 -0.000 -1.278) 1.786 36.187 ( 0.124 0.000 2.942) 2.945 36.204 ( 0.197 0.000 -2.657) 2.664 44.359 ( 4.422 0.000 -1.742) 4.752 44.447 ( 0.459 0.000 3.530) 3.560 44.771 ( 1.392 0.000 1.781) 2.261 44.923 ( -3.666 -0.000 -4.710) 5.968 46.338 ( -3.513 -0.000 -3.562) 5.003 46.388 ( -5.772 -0.000 1.086) 5.874 47.495 ( 4.819 0.000 7.997) 9.337 47.813 ( -1.921 -0.000 -8.132) 8.356 50.417 ( 1.492 0.000 -12.772) 12.859 50.696 ( -10.730 -0.000 10.899) 15.295 55.798 ( 12.157 0.000 -15.090) 19.377 56.949 ( -24.405 -0.000 7.596) 25.560 69.960 ( 3.187 0.000 0.623) 3.247 70.039 ( 1.712 0.000 -0.702) 1.851 75.498 ( 12.618 0.000 19.953) 23.608 75.541 ( 16.036 0.000 -18.226) 24.277 ======================= Grid point 295 (148/150) ======================= q-point: ( 0.50 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 256 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( -0.189 4.584 -1.032) 4.702 1.967 ( -0.851 4.799 -3.861) 6.218 2.309 ( 4.585 5.544 7.128) 10.128 2.470 ( -4.707 2.406 -6.348) 8.261 2.566 ( 7.643 1.988 -6.025) 9.933 2.757 ( -4.804 -5.521 4.005) 8.343 2.996 ( 11.654 7.125 -2.197) 13.835 3.251 ( -5.146 -3.902 1.819) 6.709 3.367 ( 3.527 5.146 -0.566) 6.264 3.463 ( -2.145 2.184 1.458) 3.390 3.675 ( 3.441 -6.153 -2.177) 7.378 3.799 ( -4.403 -4.427 0.506) 6.264 4.508 ( 4.352 2.744 -0.534) 5.173 4.519 ( 3.053 2.146 1.143) 3.903 4.757 ( 2.442 4.857 -3.182) 6.299 4.865 ( -3.204 0.421 0.331) 3.249 5.182 ( -2.467 -6.487 3.687) 7.859 5.237 ( -3.940 -6.392 -1.993) 7.768 5.670 ( 1.697 1.848 1.033) 2.713 5.731 ( -1.702 1.475 0.718) 2.364 6.303 ( 2.478 -3.405 -1.635) 4.517 6.392 ( -2.968 -7.034 -1.960) 7.882 7.245 ( 4.683 1.995 -3.129) 5.975 7.377 ( -3.819 2.128 1.837) 4.742 7.549 ( 0.393 4.732 -0.729) 4.804 7.590 ( -2.369 1.956 1.796) 3.559 7.905 ( -0.619 0.467 10.785) 10.812 7.928 ( -0.520 1.123 -7.992) 8.087 10.168 ( 1.678 2.464 -1.327) 3.264 10.250 ( -3.681 -2.490 2.099) 4.916 11.472 ( 2.092 -3.033 -4.052) 5.477 11.561 ( -4.317 -2.423 5.066) 7.083 13.588 ( 1.885 -12.984 12.202) 17.917 13.719 ( -3.904 -12.782 -12.628) 18.387 16.243 ( 3.987 7.710 -3.236) 9.264 16.268 ( 1.923 7.012 3.290) 7.981 27.239 ( 0.720 0.644 -1.165) 1.513 27.254 ( -0.427 0.598 1.332) 1.521 27.616 ( 0.194 -0.800 0.330) 0.887 27.625 ( -0.228 -1.252 -0.619) 1.415 27.852 ( 0.784 0.456 -2.446) 2.609 27.875 ( -1.143 0.368 2.460) 2.737 31.669 ( 3.133 -0.547 -5.713) 6.539 31.771 ( -4.518 -0.846 5.561) 7.215 32.345 ( 1.749 0.462 8.876) 9.059 32.410 ( -0.767 0.325 -8.363) 8.404 35.194 ( 0.904 -0.159 0.281) 0.960 35.232 ( -1.361 -0.225 -1.064) 1.742 36.191 ( 0.196 0.226 2.615) 2.632 36.202 ( 0.023 0.016 -2.426) 2.426 44.425 ( 3.045 -1.316 -1.774) 3.762 44.460 ( -0.019 -0.552 2.793) 2.847 44.770 ( 1.194 3.061 2.021) 3.857 44.838 ( -3.043 3.375 -3.569) 5.778 46.339 ( -1.514 -5.789 0.142) 5.985 46.365 ( -3.174 -6.269 -1.362) 7.158 47.575 ( 5.289 1.324 8.246) 9.885 47.748 ( -3.909 1.170 -8.398) 9.337 50.554 ( 3.721 -16.884 -3.160) 17.576 50.738 ( -9.110 -22.423 1.833) 24.273 55.878 ( 20.012 17.950 -10.984) 29.040 56.506 ( -22.483 13.687 8.358) 27.617 70.100 ( 3.861 -13.525 1.967) 14.202 70.198 ( -1.976 -18.877 -2.116) 19.098 75.595 ( 8.480 11.391 9.338) 16.996 75.640 ( 7.682 9.609 -8.447) 14.923 ======================= Grid point 296 (149/150) ======================= q-point: (-0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( 0.100 6.420 -4.143) 7.642 1.868 ( -0.100 6.420 4.143) 7.642 2.292 ( -1.092 9.146 -9.310) 13.096 2.292 ( 1.092 9.146 9.310) 13.096 2.717 ( 6.828 -4.153 -6.961) 10.599 2.717 ( -6.828 -4.153 6.962) 10.599 3.075 ( -10.602 8.475 -2.286) 13.765 3.075 ( 10.602 8.475 2.286) 13.765 3.384 ( -1.743 -0.113 -2.226) 2.829 3.384 ( 1.743 -0.113 2.226) 2.829 3.828 ( -3.353 -6.784 -0.319) 7.574 3.828 ( 3.353 -6.784 0.319) 7.574 4.503 ( 1.974 3.427 -2.272) 4.561 4.503 ( -1.974 3.427 2.272) 4.561 4.746 ( -6.897 4.632 1.222) 8.397 4.746 ( 6.897 4.632 -1.222) 8.397 5.308 ( 1.017 -8.840 -4.180) 9.831 5.308 ( -1.017 -8.840 4.180) 9.831 5.673 ( 0.292 1.643 -0.316) 1.698 5.673 ( -0.292 1.643 0.316) 1.698 6.457 ( -4.025 -10.154 -1.179) 10.986 6.457 ( 4.025 -10.154 1.179) 10.986 7.254 ( 4.310 6.490 -2.191) 8.093 7.254 ( -4.310 6.490 2.191) 8.093 7.505 ( 1.719 4.251 -3.389) 5.701 7.505 ( -1.719 4.251 3.389) 5.701 7.900 ( 1.331 0.932 -11.290) 11.406 7.900 ( -1.331 0.932 11.290) 11.406 10.219 ( -0.461 -2.572 -4.846) 5.506 10.219 ( 0.461 -2.572 4.846) 5.506 11.553 ( 2.275 -2.976 -3.710) 5.272 11.553 ( -2.275 -2.976 3.710) 5.272 13.907 ( -2.682 -22.546 -12.403) 25.872 13.907 ( 2.682 -22.546 12.403) 25.872 16.121 ( 1.630 14.340 -4.564) 15.137 16.121 ( -1.630 14.340 4.564) 15.137 27.235 ( 0.415 0.944 -0.757) 1.280 27.235 ( -0.415 0.944 0.757) 1.280 27.639 ( -0.274 -1.449 -0.987) 1.775 27.639 ( 0.274 -1.449 0.987) 1.775 27.856 ( 1.006 0.402 -1.795) 2.097 27.856 ( -1.006 0.402 1.795) 2.097 31.730 ( 2.834 -1.281 -4.797) 5.717 31.730 ( -2.834 -1.281 4.797) 5.717 32.374 ( -1.060 0.673 -8.076) 8.173 32.374 ( 1.060 0.673 8.076) 8.173 35.215 ( -1.257 -0.368 -0.787) 1.528 35.215 ( 1.257 -0.368 0.787) 1.528 36.195 ( -0.191 0.192 -2.265) 2.281 36.195 ( 0.191 0.192 2.265) 2.281 44.467 ( -0.183 -0.312 -2.110) 2.141 44.467 ( 0.183 -0.312 2.110) 2.141 44.740 ( -0.859 3.775 -2.352) 4.530 44.740 ( 0.859 3.775 2.352) 4.530 46.454 ( -0.959 -10.052 -3.684) 10.749 46.454 ( 0.959 -10.052 3.684) 10.749 47.638 ( -5.130 2.845 -8.088) 9.991 47.638 ( 5.130 2.845 8.088) 9.991 51.021 ( -4.288 -33.937 -16.033) 37.778 51.021 ( 4.288 -33.937 16.033) 37.778 55.897 ( 8.513 22.837 -6.256) 25.162 55.897 ( -8.513 22.837 6.256) 25.162 70.470 ( -3.972 -26.173 -5.939) 27.131 70.470 ( 3.972 -26.173 5.939) 27.131 75.456 ( 2.656 20.321 -24.319) 31.803 75.456 ( -2.656 20.321 24.319) 31.803 ======================= Grid point 305 (150/150) ======================= q-point: ( 0.50 0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 0.344 0.000 -1.819) 1.852 1.993 ( -0.344 -0.000 1.819) 1.852 2.410 ( -1.182 -0.000 -14.035) 14.084 2.410 ( 1.182 0.000 14.035) 14.084 2.665 ( 2.043 0.000 -7.110) 7.397 2.665 ( -2.043 -0.000 7.110) 7.397 3.156 ( 5.656 0.000 -5.506) 7.893 3.156 ( -5.656 -0.000 5.506) 7.893 3.467 ( -1.566 -0.000 -0.891) 1.802 3.467 ( 1.566 0.000 0.891) 1.802 3.681 ( 5.156 0.000 -2.730) 5.834 3.681 ( -5.156 -0.000 2.730) 5.834 4.559 ( 0.177 0.000 -3.921) 3.925 4.559 ( -0.177 -0.000 3.921) 3.925 4.833 ( 2.632 0.000 -1.748) 3.159 4.833 ( -2.632 -0.000 1.748) 3.159 5.126 ( -1.727 -0.000 -6.592) 6.814 5.126 ( 1.727 0.000 6.592) 6.814 5.716 ( -1.852 -0.000 -0.925) 2.070 5.716 ( 1.852 0.000 0.925) 2.070 6.305 ( -1.700 -0.000 0.279) 1.723 6.305 ( 1.700 0.000 -0.279) 1.723 7.328 ( 4.915 0.000 -2.925) 5.720 7.328 ( -4.915 -0.000 2.925) 5.720 7.585 ( 0.157 0.000 -0.751) 0.768 7.585 ( -0.157 -0.000 0.751) 0.768 7.920 ( 0.358 0.000 -13.301) 13.305 7.920 ( -0.358 -0.000 13.301) 13.305 10.203 ( 1.228 0.000 -5.515) 5.650 10.203 ( -1.228 -0.000 5.515) 5.650 11.485 ( 3.694 0.000 -5.189) 6.370 11.485 ( -3.694 -0.000 5.189) 6.370 13.551 ( -3.201 -0.000 -13.348) 13.727 13.551 ( 3.201 0.000 13.348) 13.727 16.332 ( 1.037 0.000 -3.406) 3.561 16.332 ( -1.037 -0.000 3.406) 3.561 27.252 ( 0.643 0.000 -1.525) 1.654 27.252 ( -0.643 -0.000 1.525) 1.654 27.612 ( -0.101 -0.000 -0.068) 0.122 27.612 ( 0.101 0.000 0.068) 0.122 27.866 ( 1.005 0.000 -2.596) 2.784 27.866 ( -1.005 -0.000 2.596) 2.784 31.710 ( 3.932 0.000 -6.149) 7.298 31.710 ( -3.932 -0.000 6.149) 7.298 32.384 ( -1.200 -0.000 -9.512) 9.588 32.384 ( 1.200 0.000 9.512) 9.588 35.209 ( -1.212 -0.000 -0.672) 1.385 35.209 ( 1.212 0.000 0.672) 1.385 36.198 ( -0.005 -0.000 -2.928) 2.928 36.198 ( 0.005 0.000 2.928) 2.928 44.448 ( 1.496 0.000 -2.359) 2.794 44.448 ( -1.496 -0.000 2.359) 2.794 44.821 ( -1.898 -0.000 -3.453) 3.940 44.821 ( 1.898 0.000 3.453) 3.940 46.287 ( 0.909 0.000 -1.481) 1.738 46.287 ( -0.909 -0.000 1.481) 1.738 47.675 ( -4.951 -0.000 -8.597) 9.921 47.675 ( 4.951 0.000 8.597) 9.921 50.482 ( 5.530 0.000 -11.854) 13.080 50.482 ( -5.530 -0.000 11.854) 13.080 56.295 ( 20.788 0.000 -9.414) 22.820 56.295 ( -20.788 -0.000 9.414) 22.820 70.038 ( -1.360 -0.000 -2.084) 2.489 70.038 ( 1.360 0.000 2.084) 2.489 75.756 ( 1.375 0.000 -23.884) 23.923 75.756 ( -1.375 -0.000 23.884) 23.923 =================== 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 3/33792 10.0 8.435 13.747 20.423 -0.000 2.144 0.000 3/33792 20.0 4.744 6.138 7.853 -0.000 0.178 0.000 3/33792 30.0 2.824 3.438 4.211 -0.000 -0.047 0.000 3/33792 40.0 1.980 2.367 2.783 -0.000 -0.067 0.000 3/33792 50.0 1.522 1.820 2.067 -0.000 -0.062 0.000 3/33792 60.0 1.236 1.494 1.647 -0.000 -0.054 0.000 3/33792 70.0 1.041 1.280 1.375 -0.000 -0.048 0.000 3/33792 80.0 0.901 1.129 1.186 -0.000 -0.044 0.000 3/33792 90.0 0.796 1.019 1.047 -0.000 -0.040 0.000 3/33792 100.0 0.714 0.933 0.941 -0.000 -0.037 0.000 3/33792 110.0 0.648 0.866 0.856 -0.000 -0.034 0.000 3/33792 120.0 0.594 0.810 0.787 -0.000 -0.032 0.000 3/33792 130.0 0.549 0.764 0.729 -0.000 -0.030 0.000 3/33792 140.0 0.511 0.724 0.680 -0.000 -0.028 0.000 3/33792 150.0 0.478 0.689 0.638 -0.000 -0.026 0.000 3/33792 160.0 0.449 0.658 0.601 -0.000 -0.025 0.000 3/33792 170.0 0.424 0.630 0.568 -0.000 -0.024 0.000 3/33792 180.0 0.401 0.605 0.539 -0.000 -0.022 0.000 3/33792 190.0 0.381 0.582 0.512 -0.000 -0.021 -0.000 3/33792 200.0 0.363 0.561 0.489 -0.000 -0.020 -0.000 3/33792 210.0 0.347 0.541 0.467 -0.000 -0.020 -0.000 3/33792 220.0 0.332 0.523 0.447 -0.000 -0.019 -0.000 3/33792 230.0 0.318 0.506 0.429 -0.000 -0.018 -0.000 3/33792 240.0 0.306 0.490 0.413 -0.000 -0.017 -0.000 3/33792 250.0 0.294 0.475 0.398 -0.000 -0.017 -0.000 3/33792 260.0 0.284 0.461 0.384 -0.000 -0.016 -0.000 3/33792 270.0 0.274 0.448 0.370 -0.000 -0.015 -0.000 3/33792 280.0 0.265 0.435 0.358 -0.000 -0.015 -0.000 3/33792 290.0 0.256 0.423 0.347 -0.000 -0.014 -0.000 3/33792 300.0 0.248 0.412 0.336 -0.000 -0.014 -0.000 3/33792 310.0 0.240 0.401 0.326 -0.000 -0.013 -0.000 3/33792 320.0 0.233 0.391 0.317 -0.000 -0.013 -0.000 3/33792 330.0 0.227 0.381 0.308 -0.000 -0.013 -0.000 3/33792 340.0 0.220 0.372 0.299 -0.000 -0.012 -0.000 3/33792 350.0 0.214 0.363 0.292 -0.000 -0.012 -0.000 3/33792 360.0 0.209 0.355 0.284 -0.000 -0.012 -0.000 3/33792 370.0 0.203 0.347 0.277 -0.000 -0.011 -0.000 3/33792 380.0 0.198 0.339 0.270 -0.000 -0.011 -0.000 3/33792 390.0 0.194 0.332 0.264 -0.000 -0.011 -0.000 3/33792 400.0 0.189 0.325 0.258 -0.000 -0.011 -0.000 3/33792 410.0 0.185 0.318 0.252 -0.000 -0.010 -0.000 3/33792 420.0 0.180 0.311 0.246 -0.000 -0.010 -0.000 3/33792 430.0 0.177 0.305 0.241 -0.000 -0.010 -0.000 3/33792 440.0 0.173 0.299 0.236 -0.000 -0.010 -0.000 3/33792 450.0 0.169 0.294 0.231 -0.000 -0.009 -0.000 3/33792 460.0 0.166 0.288 0.226 -0.000 -0.009 -0.000 3/33792 470.0 0.162 0.283 0.222 -0.000 -0.009 -0.000 3/33792 480.0 0.159 0.278 0.218 -0.000 -0.009 -0.000 3/33792 490.0 0.156 0.273 0.214 -0.000 -0.009 -0.000 3/33792 500.0 0.153 0.268 0.210 -0.000 -0.009 -0.000 3/33792 510.0 0.150 0.263 0.206 -0.000 -0.008 -0.000 3/33792 520.0 0.148 0.259 0.202 -0.000 -0.008 -0.000 3/33792 530.0 0.145 0.255 0.198 -0.000 -0.008 -0.000 3/33792 540.0 0.142 0.250 0.195 -0.000 -0.008 -0.000 3/33792 550.0 0.140 0.246 0.192 -0.000 -0.008 -0.000 3/33792 560.0 0.138 0.243 0.189 -0.000 -0.008 -0.000 3/33792 570.0 0.135 0.239 0.185 -0.000 -0.008 -0.000 3/33792 580.0 0.133 0.235 0.182 -0.000 -0.007 -0.000 3/33792 590.0 0.131 0.232 0.180 -0.000 -0.007 -0.000 3/33792 600.0 0.129 0.228 0.177 -0.000 -0.007 -0.000 3/33792 610.0 0.127 0.225 0.174 -0.000 -0.007 -0.000 3/33792 620.0 0.125 0.222 0.171 -0.000 -0.007 -0.000 3/33792 630.0 0.123 0.218 0.169 -0.000 -0.007 -0.000 3/33792 640.0 0.121 0.215 0.166 -0.000 -0.007 -0.000 3/33792 650.0 0.120 0.212 0.164 -0.000 -0.007 -0.000 3/33792 660.0 0.118 0.210 0.162 -0.000 -0.007 -0.000 3/33792 670.0 0.116 0.207 0.159 -0.000 -0.006 -0.000 3/33792 680.0 0.115 0.204 0.157 -0.000 -0.006 -0.000 3/33792 690.0 0.113 0.201 0.155 -0.000 -0.006 -0.000 3/33792 700.0 0.111 0.199 0.153 -0.000 -0.006 -0.000 3/33792 710.0 0.110 0.196 0.151 -0.000 -0.006 -0.000 3/33792 720.0 0.109 0.194 0.149 -0.000 -0.006 -0.000 3/33792 730.0 0.107 0.191 0.147 -0.000 -0.006 -0.000 3/33792 740.0 0.106 0.189 0.145 -0.000 -0.006 -0.000 3/33792 750.0 0.104 0.187 0.143 -0.000 -0.006 -0.000 3/33792 760.0 0.103 0.185 0.141 -0.000 -0.006 -0.000 3/33792 770.0 0.102 0.182 0.140 -0.000 -0.006 -0.000 3/33792 780.0 0.101 0.180 0.138 -0.000 -0.006 -0.000 3/33792 790.0 0.099 0.178 0.136 -0.000 -0.006 -0.000 3/33792 800.0 0.098 0.176 0.135 -0.000 -0.006 -0.000 3/33792 810.0 0.097 0.174 0.133 -0.000 -0.005 -0.000 3/33792 820.0 0.096 0.172 0.132 -0.000 -0.005 -0.000 3/33792 830.0 0.095 0.170 0.130 -0.000 -0.005 -0.000 3/33792 840.0 0.094 0.169 0.129 -0.000 -0.005 -0.000 3/33792 850.0 0.093 0.167 0.127 -0.000 -0.005 -0.000 3/33792 860.0 0.092 0.165 0.126 -0.000 -0.005 -0.000 3/33792 870.0 0.091 0.163 0.124 -0.000 -0.005 -0.000 3/33792 880.0 0.090 0.162 0.123 -0.000 -0.005 -0.000 3/33792 890.0 0.089 0.160 0.122 -0.000 -0.005 -0.000 3/33792 900.0 0.088 0.158 0.120 -0.000 -0.005 -0.000 3/33792 910.0 0.087 0.157 0.119 -0.000 -0.005 -0.000 3/33792 920.0 0.086 0.155 0.118 -0.000 -0.005 -0.000 3/33792 930.0 0.085 0.154 0.117 -0.000 -0.005 -0.000 3/33792 940.0 0.084 0.152 0.115 -0.000 -0.005 -0.000 3/33792 950.0 0.084 0.151 0.114 -0.000 -0.005 -0.000 3/33792 960.0 0.083 0.149 0.113 -0.000 -0.005 -0.000 3/33792 970.0 0.082 0.148 0.112 -0.000 -0.005 -0.000 3/33792 980.0 0.081 0.146 0.111 -0.000 -0.005 -0.000 3/33792 990.0 0.080 0.145 0.110 -0.000 -0.005 -0.000 3/33792 1000.0 0.080 0.144 0.109 -0.000 -0.004 -0.000 3/33792 Thermal conductivity related properties were written into "kappa-m888.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:37:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|