# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/9aebcd91-f1d9-48e9-81ae-1da739b629f3/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [First-principles lattice thermal conductivity calculation for LuSeO3F / P2_1/c (14) / materials id 555022](https://mdr.nims.go.jp/datasets/0dfc9463-0a49-4010-908f-6a76d2071682) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-08 11:36:34]-------------------------Compiled with OpenMP support (max 128 threads).Running in phonopy.load mode.Python version 3.14.2Spglib version 2.6.1Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".Unit of length: angstromSettings: Supercell: [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P2_1/c (14)Number of symmetry operations in supercell: 16------------------------------ primitive cell ------------------------------Lattice vectors: a 6.451566250000002 0.000000000000000 0.000000000000000 b 0.000000000000000 6.733424719999999 0.000000000000000 c -1.031088610668973 0.000000000000000 6.881763654428819Atomic positions (fractional): *1 Lu 0.13459387223624 0.35682846866102 0.82519562712238 174.967 2 Lu 0.13459387223624 0.14317153133898 0.32519562712238 174.967 3 Lu 0.86540612776376 0.85682846866102 0.67480437287762 174.967 4 Lu 0.86540612776376 0.64317153133898 0.17480437287762 174.967 *5 Se 0.64318177126776 0.38179473929828 0.70668775310213 78.960 6 Se 0.35681822873224 0.61820526070172 0.29331224689787 78.960 7 Se 0.35681822873224 0.88179473929828 0.79331224689787 78.960 8 Se 0.64318177126776 0.11820526070172 0.20668775310213 78.960 *9 O 0.52138429654606 0.81032693197033 0.63561033119438 15.999 *10 O 0.82791215847208 0.96640548011554 0.35324404113683 15.999 11 O 0.17208784152792 0.46640548011554 0.14675595886317 15.999 12 O 0.52138429654606 0.68967306802967 0.13561033119438 15.999 *13 O 0.17477286346472 0.80916022779608 0.28260717458681 15.999 14 O 0.17208784152792 0.03359451988446 0.64675595886317 15.999 15 O 0.17477286346472 0.69083977220392 0.78260717458681 15.999 16 O 0.82522713653528 0.19083977220392 0.71739282541319 15.999 17 O 0.47861570345394 0.18967306802967 0.36438966880562 15.999 18 O 0.82522713653528 0.30916022779608 0.21739282541319 15.999 19 O 0.82791215847208 0.53359451988446 0.85324404113683 15.999 20 O 0.47861570345394 0.31032693197033 0.86438966880562 15.999 *21 F 0.16642347356388 0.38545924438004 0.52608126899430 18.998 22 F 0.83357652643612 0.88545924438004 0.97391873100570 18.998 23 F 0.16642347356388 0.11454075561996 0.02608126899430 18.998 24 F 0.83357652643612 0.61454075561996 0.47391873100570 18.998-------------------------------- unit cell ---------------------------------Lattice vectors: a 6.451566250000002 0.000000000000000 0.000000000000000 b 0.000000000000000 6.733424719999999 0.000000000000000 c -1.031088610668973 0.000000000000000 6.881763654428819Atomic positions (fractional): *1 Lu 0.13459387223624 0.35682846866102 0.82519562712238 174.967 > 1 2 Lu 0.13459387223624 0.14317153133898 0.32519562712238 174.967 > 2 3 Lu 0.86540612776376 0.85682846866102 0.67480437287762 174.967 > 3 4 Lu 0.86540612776376 0.64317153133898 0.17480437287762 174.967 > 4 *5 Se 0.64318177126776 0.38179473929828 0.70668775310213 78.960 > 5 6 Se 0.35681822873224 0.61820526070172 0.29331224689787 78.960 > 6 7 Se 0.35681822873224 0.88179473929828 0.79331224689787 78.960 > 7 8 Se 0.64318177126776 0.11820526070172 0.20668775310213 78.960 > 8 *9 O 0.52138429654606 0.81032693197033 0.63561033119438 15.999 > 9 *10 O 0.82791215847208 0.96640548011554 0.35324404113683 15.999 > 10 11 O 0.17208784152792 0.46640548011554 0.14675595886317 15.999 > 11 12 O 0.52138429654606 0.68967306802967 0.13561033119438 15.999 > 12 *13 O 0.17477286346472 0.80916022779608 0.28260717458681 15.999 > 13 14 O 0.17208784152792 0.03359451988446 0.64675595886317 15.999 > 14 15 O 0.17477286346472 0.69083977220392 0.78260717458681 15.999 > 15 16 O 0.82522713653528 0.19083977220392 0.71739282541319 15.999 > 16 17 O 0.47861570345394 0.18967306802967 0.36438966880562 15.999 > 17 18 O 0.82522713653528 0.30916022779608 0.21739282541319 15.999 > 18 19 O 0.82791215847208 0.53359451988446 0.85324404113683 15.999 > 19 20 O 0.47861570345394 0.31032693197033 0.86438966880562 15.999 > 20 *21 F 0.16642347356388 0.38545924438004 0.52608126899430 18.998 > 21 22 F 0.83357652643612 0.88545924438004 0.97391873100570 18.998 > 22 23 F 0.16642347356388 0.11454075561996 0.02608126899430 18.998 > 23 24 F 0.83357652643612 0.61454075561996 0.47391873100570 18.998 > 24-------------------------------- super cell --------------------------------Lattice vectors: a 12.903132500000003 0.000000000000000 0.000000000000000 b 0.000000000000000 13.466849439999997 0.000000000000000 c -1.031088610668973 0.000000000000000 6.881763654428819Atomic positions (fractional): *1 Lu 0.06729693611812 0.17841423433051 0.82519562712238 174.967 > 1 2 Lu 0.56729693611812 0.17841423433051 0.82519562712238 174.967 > 1 3 Lu 0.06729693611812 0.67841423433051 0.82519562712238 174.967 > 1 4 Lu 0.56729693611812 0.67841423433051 0.82519562712238 174.967 > 1 5 Lu 0.06729693611812 0.07158576566949 0.32519562712238 174.967 > 2 6 Lu 0.56729693611812 0.07158576566949 0.32519562712238 174.967 > 2 7 Lu 0.06729693611812 0.57158576566949 0.32519562712238 174.967 > 2 8 Lu 0.56729693611812 0.57158576566949 0.32519562712238 174.967 > 2 9 Lu 0.43270306388188 0.42841423433051 0.67480437287762 174.967 > 3 10 Lu 0.93270306388188 0.42841423433051 0.67480437287762 174.967 > 3 11 Lu 0.43270306388188 0.92841423433051 0.67480437287762 174.967 > 3 12 Lu 0.93270306388188 0.92841423433051 0.67480437287762 174.967 > 3 13 Lu 0.43270306388188 0.32158576566949 0.17480437287762 174.967 > 4 14 Lu 0.93270306388188 0.32158576566949 0.17480437287762 174.967 > 4 15 Lu 0.43270306388188 0.82158576566949 0.17480437287762 174.967 > 4 16 Lu 0.93270306388188 0.82158576566949 0.17480437287762 174.967 > 4 *17 Se 0.32159088563388 0.19089736964914 0.70668775310213 78.960 > 5 18 Se 0.82159088563388 0.19089736964914 0.70668775310213 78.960 > 5 19 Se 0.32159088563388 0.69089736964914 0.70668775310213 78.960 > 5 20 Se 0.82159088563388 0.69089736964914 0.70668775310213 78.960 > 5 21 Se 0.17840911436612 0.30910263035086 0.29331224689787 78.960 > 6 22 Se 0.67840911436612 0.30910263035086 0.29331224689787 78.960 > 6 23 Se 0.17840911436612 0.80910263035086 0.29331224689787 78.960 > 6 24 Se 0.67840911436612 0.80910263035086 0.29331224689787 78.960 > 6 25 Se 0.17840911436612 0.44089736964914 0.79331224689787 78.960 > 7 26 Se 0.67840911436612 0.44089736964914 0.79331224689787 78.960 > 7 27 Se 0.17840911436612 0.94089736964914 0.79331224689787 78.960 > 7 28 Se 0.67840911436612 0.94089736964914 0.79331224689787 78.960 > 7 29 Se 0.32159088563388 0.05910263035086 0.20668775310213 78.960 > 8 30 Se 0.82159088563388 0.05910263035086 0.20668775310213 78.960 > 8 31 Se 0.32159088563388 0.55910263035086 0.20668775310213 78.960 > 8 32 Se 0.82159088563388 0.55910263035086 0.20668775310213 78.960 > 8 *33 O 0.26069214827303 0.40516346598517 0.63561033119438 15.999 > 9 34 O 0.76069214827303 0.40516346598517 0.63561033119438 15.999 > 9 35 O 0.26069214827303 0.90516346598517 0.63561033119438 15.999 > 9 36 O 0.76069214827303 0.90516346598517 0.63561033119438 15.999 > 9 *37 O 0.41395607923604 0.48320274005777 0.35324404113683 15.999 > 10 38 O 0.91395607923604 0.48320274005777 0.35324404113683 15.999 > 10 39 O 0.41395607923604 0.98320274005777 0.35324404113683 15.999 > 10 40 O 0.91395607923604 0.98320274005777 0.35324404113683 15.999 > 10 41 O 0.08604392076396 0.23320274005777 0.14675595886317 15.999 > 11 42 O 0.58604392076396 0.23320274005777 0.14675595886317 15.999 > 11 43 O 0.08604392076396 0.73320274005777 0.14675595886317 15.999 > 11 44 O 0.58604392076396 0.73320274005777 0.14675595886317 15.999 > 11 45 O 0.26069214827303 0.34483653401483 0.13561033119438 15.999 > 12 46 O 0.76069214827303 0.34483653401483 0.13561033119438 15.999 > 12 47 O 0.26069214827303 0.84483653401483 0.13561033119438 15.999 > 12 48 O 0.76069214827303 0.84483653401483 0.13561033119438 15.999 > 12 *49 O 0.08738643173236 0.40458011389804 0.28260717458681 15.999 > 13 50 O 0.58738643173236 0.40458011389804 0.28260717458681 15.999 > 13 51 O 0.08738643173236 0.90458011389804 0.28260717458681 15.999 > 13 52 O 0.58738643173236 0.90458011389804 0.28260717458681 15.999 > 13 53 O 0.08604392076396 0.01679725994223 0.64675595886317 15.999 > 14 54 O 0.58604392076396 0.01679725994223 0.64675595886317 15.999 > 14 55 O 0.08604392076396 0.51679725994223 0.64675595886317 15.999 > 14 56 O 0.58604392076396 0.51679725994223 0.64675595886317 15.999 > 14 57 O 0.08738643173236 0.34541988610196 0.78260717458681 15.999 > 15 58 O 0.58738643173236 0.34541988610196 0.78260717458681 15.999 > 15 59 O 0.08738643173236 0.84541988610196 0.78260717458681 15.999 > 15 60 O 0.58738643173236 0.84541988610196 0.78260717458681 15.999 > 15 61 O 0.41261356826764 0.09541988610196 0.71739282541319 15.999 > 16 62 O 0.91261356826764 0.09541988610196 0.71739282541319 15.999 > 16 63 O 0.41261356826764 0.59541988610196 0.71739282541319 15.999 > 16 64 O 0.91261356826764 0.59541988610196 0.71739282541319 15.999 > 16 65 O 0.23930785172697 0.09483653401483 0.36438966880562 15.999 > 17 66 O 0.73930785172697 0.09483653401483 0.36438966880562 15.999 > 17 67 O 0.23930785172697 0.59483653401483 0.36438966880562 15.999 > 17 68 O 0.73930785172697 0.59483653401483 0.36438966880562 15.999 > 17 69 O 0.41261356826764 0.15458011389804 0.21739282541319 15.999 > 18 70 O 0.91261356826764 0.15458011389804 0.21739282541319 15.999 > 18 71 O 0.41261356826764 0.65458011389804 0.21739282541319 15.999 > 18 72 O 0.91261356826764 0.65458011389804 0.21739282541319 15.999 > 18 73 O 0.41395607923604 0.26679725994223 0.85324404113683 15.999 > 19 74 O 0.91395607923604 0.26679725994223 0.85324404113683 15.999 > 19 75 O 0.41395607923604 0.76679725994223 0.85324404113683 15.999 > 19 76 O 0.91395607923604 0.76679725994223 0.85324404113683 15.999 > 19 77 O 0.23930785172697 0.15516346598517 0.86438966880562 15.999 > 20 78 O 0.73930785172697 0.15516346598517 0.86438966880562 15.999 > 20 79 O 0.23930785172697 0.65516346598517 0.86438966880562 15.999 > 20 80 O 0.73930785172697 0.65516346598517 0.86438966880562 15.999 > 20 *81 F 0.08321173678194 0.19272962219002 0.52608126899430 18.998 > 21 82 F 0.58321173678194 0.19272962219002 0.52608126899430 18.998 > 21 83 F 0.08321173678194 0.69272962219002 0.52608126899430 18.998 > 21 84 F 0.58321173678194 0.69272962219002 0.52608126899430 18.998 > 21 85 F 0.41678826321806 0.44272962219002 0.97391873100570 18.998 > 22 86 F 0.91678826321806 0.44272962219002 0.97391873100570 18.998 > 22 87 F 0.41678826321806 0.94272962219002 0.97391873100570 18.998 > 22 88 F 0.91678826321806 0.94272962219002 0.97391873100570 18.998 > 22 89 F 0.08321173678194 0.05727037780998 0.02608126899430 18.998 > 23 90 F 0.58321173678194 0.05727037780998 0.02608126899430 18.998 > 23 91 F 0.08321173678194 0.55727037780998 0.02608126899430 18.998 > 23 92 F 0.58321173678194 0.55727037780998 0.02608126899430 18.998 > 23 93 F 0.41678826321806 0.30727037780998 0.47391873100570 18.998 > 24 94 F 0.91678826321806 0.30727037780998 0.47391873100570 18.998 > 24 95 F 0.41678826321806 0.80727037780998 0.47391873100570 18.998 > 24 96 F 0.91678826321806 0.80727037780998 0.47391873100570 18.998 > 24----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 4.0813019 0.0000000 -0.0864103 0.0000000 3.7937734 0.0000000 -0.0864033 0.0000000 3.5521391-------------------------- Born effective charges -------------------------- 1 Lu 4.4288628 -0.0247934 0.0890700 -0.0932754 3.8713053 0.2579250 -0.2242800 -0.2148513 3.7576517 2 Lu 4.4288628 0.0247934 0.0890700 0.0932754 3.8713053 -0.2579250 -0.2242800 0.2148513 3.7576517 3 Lu 4.4288628 0.0247934 0.0890700 0.0932754 3.8713053 -0.2579250 -0.2242800 0.2148513 3.7576517 4 Lu 4.4288628 -0.0247934 0.0890700 -0.0932754 3.8713053 0.2579250 -0.2242800 -0.2148513 3.7576517 5 Se 3.5922164 0.0893715 -0.3678804 0.4280126 3.0564630 0.2540699 -0.1974799 0.3448596 2.6723699 6 Se 3.5922164 0.0893715 -0.3678804 0.4280126 3.0564630 0.2540699 -0.1974799 0.3448596 2.6723699 7 Se 3.5922164 -0.0893715 -0.3678804 -0.4280126 3.0564630 -0.2540699 -0.1974799 -0.3448596 2.6723699 8 Se 3.5922164 -0.0893715 -0.3678804 -0.4280126 3.0564630 -0.2540699 -0.1974799 -0.3448596 2.6723699 9 O -2.8226378 0.3856897 0.8864998 0.2364615 -1.2086808 -0.4263854 0.3952608 -0.3813279 -1.5933785 10 O -2.0497195 0.1391379 -0.4909312 0.7289537 -1.9619311 0.7465331 -0.3842112 0.3295676 -1.9567083 11 O -2.0497195 -0.1391379 -0.4909312 -0.7289537 -1.9619311 -0.7465331 -0.3842112 -0.3295676 -1.9567083 12 O -2.8226378 -0.3856897 0.8864998 -0.2364615 -1.2086808 0.4263854 0.3952608 0.3813279 -1.5933785 13 O -2.1211394 0.5909731 -0.3103464 0.6651771 -2.3687963 -0.0539348 0.0931883 -0.4516290 -0.9241703 14 O -2.0497195 0.1391379 -0.4909312 0.7289537 -1.9619311 0.7465331 -0.3842112 0.3295676 -1.9567083 15 O -2.1211394 -0.5909731 -0.3103464 -0.6651771 -2.3687963 0.0539348 0.0931883 0.4516290 -0.9241703 16 O -2.1211394 0.5909731 -0.3103464 0.6651771 -2.3687963 -0.0539348 0.0931883 -0.4516290 -0.9241703 17 O -2.8226378 0.3856897 0.8864998 0.2364615 -1.2086808 -0.4263854 0.3952608 -0.3813279 -1.5933785 18 O -2.1211394 -0.5909731 -0.3103464 -0.6651771 -2.3687963 0.0539348 0.0931883 0.4516290 -0.9241703 19 O -2.0497195 -0.1391379 -0.4909312 -0.7289537 -1.9619311 -0.7465331 -0.3842112 -0.3295676 -1.9567083 20 O -2.8226378 -0.3856897 0.8864998 -0.2364615 -1.2086808 0.4263854 0.3952608 0.3813279 -1.5933785 21 F -1.0275827 -0.0730681 0.1935883 -0.1086703 -1.3883601 -0.2160069 0.3175220 -0.0603549 -1.9557644 22 F -1.0275827 0.0730681 0.1935883 0.1086703 -1.3883601 0.2160069 0.3175220 0.0603549 -1.9557644 23 F -1.0275827 0.0730681 0.1935883 0.1086703 -1.3883601 0.2160069 0.3175220 0.0603549 -1.9557644 24 F -1.0275827 -0.0730681 0.1935883 -0.1086703 -1.3883601 -0.2160069 0.3175220 -0.0603549 -1.9557644----------------------------------------------------------------------------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: 288/288Permutation basis: 10656/10656Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 2700Number of blocks in projector: 2700Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 66 eigenvectors found. (2) Complementary block size: 33 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found.(1) 564 eigenvectors found.(1) Complementary block size: 12(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 2 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 66 eigenvectors found. (2) Complementary block size: 33 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found.(1) 564 eigenvectors found.(1) Complementary block size: 12(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 3 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 241 eigenvectors found. (2) Block: 576 / 576 (2) 71 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found.(1) 565 eigenvectors found.(1) Complementary block size: 10(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 4 / 6 ---Block_size: 324Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 324Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 324Use standard eigh solver.Tree of FC basis block matrices:- (2700, 2647), data: False|-- (324, 318), data: True|-- (324, 318), data: True|-- (324, 318), data: True|-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 14), data: (576, 25) @ (25, 14) |-- (76, 71), data: True |-- (250, 241), data: True |-- (250, 239), data: True|-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 21), data: (576, 33) @ (33, 21) |-- (76, 66), data: True |-- (250, 239), data: True |-- (250, 238), data: True|-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 21), data: (576, 33) @ (33, 21) |-- (76, 66), data: True |-- (250, 239), data: True |-- (250, 238), data: True-----Solver_atoms: 1 -- 96 / 96Time (Solver_compr_matrix_reshape): 0.002Solver_block: 100 / 720 - Time: 0.812Solver_block: 200 / 720 - Time: 0.645Solver_block: 300 / 720 - Time: 0.626Solver_block: 400 / 720 - Time: 0.634Solver_block: 500 / 720 - Time: 0.628Solver_block: 600 / 720 - Time: 0.637Solver_block: 700 / 720 - Time: 0.636Solver_block: 720 / 720 - Time: 0.225Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.949--------------------------------- Symfc end --------------------------------Max drift of force constants: -0.00000000 (yz) -0.00000000 (yz) Permutation basis: 288/288Permutation basis: 10656/10656Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 2700Number of blocks in projector: 2700Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 66 eigenvectors found. (2) Complementary block size: 33 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found.(1) 564 eigenvectors found.(1) Complementary block size: 12(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 2 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 66 eigenvectors found. (2) Complementary block size: 33 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found.(1) 564 eigenvectors found.(1) Complementary block size: 12(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 3 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 241 eigenvectors found. (2) Block: 576 / 576 (2) 71 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found.(1) 565 eigenvectors found.(1) Complementary block size: 10(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 4 / 6 ---Block_size: 324Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 324Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 324Use standard eigh solver.Tree of FC basis block matrices:- (2700, 2647), data: False|-- (324, 318), data: True|-- (324, 318), data: True|-- (324, 318), data: True|-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 14), data: (576, 25) @ (25, 14) |-- (76, 71), data: True |-- (250, 241), data: True |-- (250, 239), data: True|-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 21), data: (576, 33) @ (33, 21) |-- (76, 66), data: True |-- (250, 239), data: True |-- (250, 238), data: True|-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 21), data: (576, 33) @ (33, 21) |-- (76, 66), data: True |-- (250, 239), data: True |-- (250, 238), data: TrueMax drift after symmetrization by symfc projector: -0.00000000 (yz) -0.00000000 (yz) 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 11:37:05]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 11:37:05]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: force constantsHDF5 data compression filter: gzipCrystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz".Supercell (dim): [2 2 1]Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P2_1/c (14)------------------------------ primitive cell ------------------------------Lattice vectors: a 6.451566250000002 0.000000000000000 0.000000000000000 b 0.000000000000000 6.733424719999999 0.000000000000000 c -1.031088610668973 0.000000000000000 6.881763654428819Atomic positions (fractional): 1 Lu 0.13459387223624 0.35682846866102 0.82519562712238 174.967 2 Lu 0.13459387223624 0.14317153133898 0.32519562712238 174.967 3 Lu 0.86540612776376 0.85682846866102 0.67480437287762 174.967 4 Lu 0.86540612776376 0.64317153133898 0.17480437287762 174.967 5 Se 0.64318177126776 0.38179473929828 0.70668775310213 78.960 6 Se 0.35681822873224 0.61820526070172 0.29331224689787 78.960 7 Se 0.35681822873224 0.88179473929828 0.79331224689787 78.960 8 Se 0.64318177126776 0.11820526070172 0.20668775310213 78.960 9 O 0.52138429654606 0.81032693197033 0.63561033119438 15.999 10 O 0.82791215847208 0.96640548011554 0.35324404113683 15.999 11 O 0.17208784152792 0.46640548011554 0.14675595886317 15.999 12 O 0.52138429654606 0.68967306802967 0.13561033119438 15.999 13 O 0.17477286346472 0.80916022779608 0.28260717458681 15.999 14 O 0.17208784152792 0.03359451988446 0.64675595886317 15.999 15 O 0.17477286346472 0.69083977220392 0.78260717458681 15.999 16 O 0.82522713653528 0.19083977220392 0.71739282541319 15.999 17 O 0.47861570345394 0.18967306802967 0.36438966880562 15.999 18 O 0.82522713653528 0.30916022779608 0.21739282541319 15.999 19 O 0.82791215847208 0.53359451988446 0.85324404113683 15.999 20 O 0.47861570345394 0.31032693197033 0.86438966880562 15.999 21 F 0.16642347356388 0.38545924438004 0.52608126899430 18.998 22 F 0.83357652643612 0.88545924438004 0.97391873100570 18.998 23 F 0.16642347356388 0.11454075561996 0.02608126899430 18.998 24 F 0.83357652643612 0.61454075561996 0.47391873100570 18.998-------------------------------- supercell ---------------------------------Lattice vectors: a 12.903132500000003 0.000000000000000 0.000000000000000 b 0.000000000000000 13.466849439999997 0.000000000000000 c -1.031088610668973 0.000000000000000 6.881763654428819Atomic positions (fractional): 1 Lu 0.06729693611812 0.17841423433051 0.82519562712238 174.967 > 1 2 Lu 0.56729693611812 0.17841423433051 0.82519562712238 174.967 > 1 3 Lu 0.06729693611812 0.67841423433051 0.82519562712238 174.967 > 1 4 Lu 0.56729693611812 0.67841423433051 0.82519562712238 174.967 > 1 5 Lu 0.06729693611812 0.07158576566949 0.32519562712238 174.967 > 5 6 Lu 0.56729693611812 0.07158576566949 0.32519562712238 174.967 > 5 7 Lu 0.06729693611812 0.57158576566949 0.32519562712238 174.967 > 5 8 Lu 0.56729693611812 0.57158576566949 0.32519562712238 174.967 > 5 9 Lu 0.43270306388188 0.42841423433051 0.67480437287762 174.967 > 9 10 Lu 0.93270306388188 0.42841423433051 0.67480437287762 174.967 > 9 11 Lu 0.43270306388188 0.92841423433051 0.67480437287762 174.967 > 9 12 Lu 0.93270306388188 0.92841423433051 0.67480437287762 174.967 > 9 13 Lu 0.43270306388188 0.32158576566949 0.17480437287762 174.967 > 13 14 Lu 0.93270306388188 0.32158576566949 0.17480437287762 174.967 > 13 15 Lu 0.43270306388188 0.82158576566949 0.17480437287762 174.967 > 13 16 Lu 0.93270306388188 0.82158576566949 0.17480437287762 174.967 > 13 17 Se 0.32159088563388 0.19089736964914 0.70668775310213 78.960 > 17 18 Se 0.82159088563388 0.19089736964914 0.70668775310213 78.960 > 17 19 Se 0.32159088563388 0.69089736964914 0.70668775310213 78.960 > 17 20 Se 0.82159088563388 0.69089736964914 0.70668775310213 78.960 > 17 21 Se 0.17840911436612 0.30910263035086 0.29331224689787 78.960 > 21 22 Se 0.67840911436612 0.30910263035086 0.29331224689787 78.960 > 21 23 Se 0.17840911436612 0.80910263035086 0.29331224689787 78.960 > 21 24 Se 0.67840911436612 0.80910263035086 0.29331224689787 78.960 > 21 25 Se 0.17840911436612 0.44089736964914 0.79331224689787 78.960 > 25 26 Se 0.67840911436612 0.44089736964914 0.79331224689787 78.960 > 25 27 Se 0.17840911436612 0.94089736964914 0.79331224689787 78.960 > 25 28 Se 0.67840911436612 0.94089736964914 0.79331224689787 78.960 > 25 29 Se 0.32159088563388 0.05910263035086 0.20668775310213 78.960 > 29 30 Se 0.82159088563388 0.05910263035086 0.20668775310213 78.960 > 29 31 Se 0.32159088563388 0.55910263035086 0.20668775310213 78.960 > 29 32 Se 0.82159088563388 0.55910263035086 0.20668775310213 78.960 > 29 33 O 0.26069214827303 0.40516346598517 0.63561033119438 15.999 > 33 34 O 0.76069214827303 0.40516346598517 0.63561033119438 15.999 > 33 35 O 0.26069214827303 0.90516346598517 0.63561033119438 15.999 > 33 36 O 0.76069214827303 0.90516346598517 0.63561033119438 15.999 > 33 37 O 0.41395607923604 0.48320274005777 0.35324404113683 15.999 > 37 38 O 0.91395607923604 0.48320274005777 0.35324404113683 15.999 > 37 39 O 0.41395607923604 0.98320274005777 0.35324404113683 15.999 > 37 40 O 0.91395607923604 0.98320274005777 0.35324404113683 15.999 > 37 41 O 0.08604392076396 0.23320274005777 0.14675595886317 15.999 > 41 42 O 0.58604392076396 0.23320274005777 0.14675595886317 15.999 > 41 43 O 0.08604392076396 0.73320274005777 0.14675595886317 15.999 > 41 44 O 0.58604392076396 0.73320274005777 0.14675595886317 15.999 > 41 45 O 0.26069214827303 0.34483653401483 0.13561033119438 15.999 > 45 46 O 0.76069214827303 0.34483653401483 0.13561033119438 15.999 > 45 47 O 0.26069214827303 0.84483653401483 0.13561033119438 15.999 > 45 48 O 0.76069214827303 0.84483653401483 0.13561033119438 15.999 > 45 49 O 0.08738643173236 0.40458011389804 0.28260717458681 15.999 > 49 50 O 0.58738643173236 0.40458011389804 0.28260717458681 15.999 > 49 51 O 0.08738643173236 0.90458011389804 0.28260717458681 15.999 > 49 52 O 0.58738643173236 0.90458011389804 0.28260717458681 15.999 > 49 53 O 0.08604392076396 0.01679725994223 0.64675595886317 15.999 > 53 54 O 0.58604392076396 0.01679725994223 0.64675595886317 15.999 > 53 55 O 0.08604392076396 0.51679725994223 0.64675595886317 15.999 > 53 56 O 0.58604392076396 0.51679725994223 0.64675595886317 15.999 > 53 57 O 0.08738643173236 0.34541988610196 0.78260717458681 15.999 > 57 58 O 0.58738643173236 0.34541988610196 0.78260717458681 15.999 > 57 59 O 0.08738643173236 0.84541988610196 0.78260717458681 15.999 > 57 60 O 0.58738643173236 0.84541988610196 0.78260717458681 15.999 > 57 61 O 0.41261356826764 0.09541988610196 0.71739282541319 15.999 > 61 62 O 0.91261356826764 0.09541988610196 0.71739282541319 15.999 > 61 63 O 0.41261356826764 0.59541988610196 0.71739282541319 15.999 > 61 64 O 0.91261356826764 0.59541988610196 0.71739282541319 15.999 > 61 65 O 0.23930785172697 0.09483653401483 0.36438966880562 15.999 > 65 66 O 0.73930785172697 0.09483653401483 0.36438966880562 15.999 > 65 67 O 0.23930785172697 0.59483653401483 0.36438966880562 15.999 > 65 68 O 0.73930785172697 0.59483653401483 0.36438966880562 15.999 > 65 69 O 0.41261356826764 0.15458011389804 0.21739282541319 15.999 > 69 70 O 0.91261356826764 0.15458011389804 0.21739282541319 15.999 > 69 71 O 0.41261356826764 0.65458011389804 0.21739282541319 15.999 > 69 72 O 0.91261356826764 0.65458011389804 0.21739282541319 15.999 > 69 73 O 0.41395607923604 0.26679725994223 0.85324404113683 15.999 > 73 74 O 0.91395607923604 0.26679725994223 0.85324404113683 15.999 > 73 75 O 0.41395607923604 0.76679725994223 0.85324404113683 15.999 > 73 76 O 0.91395607923604 0.76679725994223 0.85324404113683 15.999 > 73 77 O 0.23930785172697 0.15516346598517 0.86438966880562 15.999 > 77 78 O 0.73930785172697 0.15516346598517 0.86438966880562 15.999 > 77 79 O 0.23930785172697 0.65516346598517 0.86438966880562 15.999 > 77 80 O 0.73930785172697 0.65516346598517 0.86438966880562 15.999 > 77 81 F 0.08321173678194 0.19272962219002 0.52608126899430 18.998 > 81 82 F 0.58321173678194 0.19272962219002 0.52608126899430 18.998 > 81 83 F 0.08321173678194 0.69272962219002 0.52608126899430 18.998 > 81 84 F 0.58321173678194 0.69272962219002 0.52608126899430 18.998 > 81 85 F 0.41678826321806 0.44272962219002 0.97391873100570 18.998 > 85 86 F 0.91678826321806 0.44272962219002 0.97391873100570 18.998 > 85 87 F 0.41678826321806 0.94272962219002 0.97391873100570 18.998 > 85 88 F 0.91678826321806 0.94272962219002 0.97391873100570 18.998 > 85 89 F 0.08321173678194 0.05727037780998 0.02608126899430 18.998 > 89 90 F 0.58321173678194 0.05727037780998 0.02608126899430 18.998 > 89 91 F 0.08321173678194 0.55727037780998 0.02608126899430 18.998 > 89 92 F 0.58321173678194 0.55727037780998 0.02608126899430 18.998 > 89 93 F 0.41678826321806 0.30727037780998 0.47391873100570 18.998 > 93 94 F 0.91678826321806 0.30727037780998 0.47391873100570 18.998 > 93 95 F 0.41678826321806 0.80727037780998 0.47391873100570 18.998 > 93 96 F 0.91678826321806 0.80727037780998 0.47391873100570 18.998 > 93----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 4.0813019 0.0000000 -0.0864103 0.0000000 3.7937734 0.0000000 -0.0864033 0.0000000 3.5521391-------------------------- Born effective charges -------------------------- 1 Lu 4.4288628 -0.0247934 0.0890700 -0.0932754 3.8713053 0.2579250 -0.2242800 -0.2148513 3.7576517 2 Lu 4.4288628 0.0247934 0.0890700 0.0932754 3.8713053 -0.2579250 -0.2242800 0.2148513 3.7576517 3 Lu 4.4288628 0.0247934 0.0890700 0.0932754 3.8713053 -0.2579250 -0.2242800 0.2148513 3.7576517 4 Lu 4.4288628 -0.0247934 0.0890700 -0.0932754 3.8713053 0.2579250 -0.2242800 -0.2148513 3.7576517 5 Se 3.5922164 0.0893715 -0.3678804 0.4280126 3.0564630 0.2540699 -0.1974799 0.3448596 2.6723699 6 Se 3.5922164 0.0893715 -0.3678804 0.4280126 3.0564630 0.2540699 -0.1974799 0.3448596 2.6723699 7 Se 3.5922164 -0.0893715 -0.3678804 -0.4280126 3.0564630 -0.2540699 -0.1974799 -0.3448596 2.6723699 8 Se 3.5922164 -0.0893715 -0.3678804 -0.4280126 3.0564630 -0.2540699 -0.1974799 -0.3448596 2.6723699 9 O -2.8226378 0.3856897 0.8864998 0.2364615 -1.2086808 -0.4263854 0.3952608 -0.3813279 -1.5933785 10 O -2.0497195 0.1391379 -0.4909312 0.7289537 -1.9619311 0.7465331 -0.3842112 0.3295676 -1.9567083 11 O -2.0497195 -0.1391379 -0.4909312 -0.7289537 -1.9619311 -0.7465331 -0.3842112 -0.3295676 -1.9567083 12 O -2.8226378 -0.3856897 0.8864998 -0.2364615 -1.2086808 0.4263854 0.3952608 0.3813279 -1.5933785 13 O -2.1211394 0.5909731 -0.3103464 0.6651771 -2.3687963 -0.0539348 0.0931883 -0.4516290 -0.9241703 14 O -2.0497195 0.1391379 -0.4909312 0.7289537 -1.9619311 0.7465331 -0.3842112 0.3295676 -1.9567083 15 O -2.1211394 -0.5909731 -0.3103464 -0.6651771 -2.3687963 0.0539348 0.0931883 0.4516290 -0.9241703 16 O -2.1211394 0.5909731 -0.3103464 0.6651771 -2.3687963 -0.0539348 0.0931883 -0.4516290 -0.9241703 17 O -2.8226378 0.3856897 0.8864998 0.2364615 -1.2086808 -0.4263854 0.3952608 -0.3813279 -1.5933785 18 O -2.1211394 -0.5909731 -0.3103464 -0.6651771 -2.3687963 0.0539348 0.0931883 0.4516290 -0.9241703 19 O -2.0497195 -0.1391379 -0.4909312 -0.7289537 -1.9619311 -0.7465331 -0.3842112 -0.3295676 -1.9567083 20 O -2.8226378 -0.3856897 0.8864998 -0.2364615 -1.2086808 0.4263854 0.3952608 0.3813279 -1.5933785 21 F -1.0275827 -0.0730681 0.1935883 -0.1086703 -1.3883601 -0.2160069 0.3175220 -0.0603549 -1.9557644 22 F -1.0275827 0.0730681 0.1935883 0.1086703 -1.3883601 0.2160069 0.3175220 0.0603549 -1.9557644 23 F -1.0275827 0.0730681 0.1935883 0.1086703 -1.3883601 0.2160069 0.3175220 0.0603549 -1.9557644 24 F -1.0275827 -0.0730681 0.1935883 -0.1086703 -1.3883601 -0.2160069 0.3175220 -0.0603549 -1.9557644----------------------------------------------------------------------------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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099]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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099]Computing fc3[ 33, 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099]Computing fc3[ 37, 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099]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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099]Computing fc3[ 81, 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] [-0.0015 0.0000 0.0099] [ 0.0015 0.0000 -0.0099]Expanding fc3.Symmetrizing fc3 by traditional approach (N=3).Symmetrizing fc2 by traditional approach (N=3).Max drift of fc3: -0.00000002 (zzz) -0.00000002 (zzz) -0.00000002 (zzz)fc3 was written into "fc3.hdf5".Max drift of fc2: -0.00000002 (xz) -0.00000002 (xz) fc2 was written into "fc2.hdf5".--------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperatures: 0.0 300.0 Cutoff frequency: 0.01Frequency 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 11:37:27]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 11:37:27]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: conductivity-RTAHDF5 data compression filter: gzipCrystal structure was read from "phono3py.yaml".Supercell (dim): [2 2 1]Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P2_1/c (14)------------------------------ primitive cell ------------------------------Lattice vectors: a 6.451566250000002 0.000000000000000 0.000000000000000 b 0.000000000000000 6.733424719999999 0.000000000000000 c -1.031088610668973 0.000000000000000 6.881763654428819Atomic positions (fractional): 1 Lu 0.13459387223624 0.35682846866102 0.82519562712238 174.967 2 Lu 0.13459387223624 0.14317153133898 0.32519562712238 174.967 3 Lu 0.86540612776376 0.85682846866102 0.67480437287762 174.967 4 Lu 0.86540612776376 0.64317153133898 0.17480437287762 174.967 5 Se 0.64318177126776 0.38179473929828 0.70668775310213 78.960 6 Se 0.35681822873224 0.61820526070172 0.29331224689787 78.960 7 Se 0.35681822873224 0.88179473929828 0.79331224689787 78.960 8 Se 0.64318177126776 0.11820526070172 0.20668775310213 78.960 9 O 0.52138429654606 0.81032693197033 0.63561033119438 15.999 10 O 0.82791215847208 0.96640548011554 0.35324404113683 15.999 11 O 0.17208784152792 0.46640548011554 0.14675595886317 15.999 12 O 0.52138429654606 0.68967306802967 0.13561033119438 15.999 13 O 0.17477286346472 0.80916022779608 0.28260717458681 15.999 14 O 0.17208784152792 0.03359451988446 0.64675595886317 15.999 15 O 0.17477286346472 0.69083977220392 0.78260717458681 15.999 16 O 0.82522713653528 0.19083977220392 0.71739282541319 15.999 17 O 0.47861570345394 0.18967306802967 0.36438966880562 15.999 18 O 0.82522713653528 0.30916022779608 0.21739282541319 15.999 19 O 0.82791215847208 0.53359451988446 0.85324404113683 15.999 20 O 0.47861570345394 0.31032693197033 0.86438966880562 15.999 21 F 0.16642347356388 0.38545924438004 0.52608126899430 18.998 22 F 0.83357652643612 0.88545924438004 0.97391873100570 18.998 23 F 0.16642347356388 0.11454075561996 0.02608126899430 18.998 24 F 0.83357652643612 0.61454075561996 0.47391873100570 18.998-------------------------------- supercell ---------------------------------Lattice vectors: a 12.903132500000003 0.000000000000000 0.000000000000000 b 0.000000000000000 13.466849439999997 0.000000000000000 c -1.031088610668973 0.000000000000000 6.881763654428819Atomic positions (fractional): 1 Lu 0.06729693611812 0.17841423433051 0.82519562712238 174.967 > 1 2 Lu 0.56729693611812 0.17841423433051 0.82519562712238 174.967 > 1 3 Lu 0.06729693611812 0.67841423433051 0.82519562712238 174.967 > 1 4 Lu 0.56729693611812 0.67841423433051 0.82519562712238 174.967 > 1 5 Lu 0.06729693611812 0.07158576566949 0.32519562712238 174.967 > 5 6 Lu 0.56729693611812 0.07158576566949 0.32519562712238 174.967 > 5 7 Lu 0.06729693611812 0.57158576566949 0.32519562712238 174.967 > 5 8 Lu 0.56729693611812 0.57158576566949 0.32519562712238 174.967 > 5 9 Lu 0.43270306388188 0.42841423433051 0.67480437287762 174.967 > 9 10 Lu 0.93270306388188 0.42841423433051 0.67480437287762 174.967 > 9 11 Lu 0.43270306388188 0.92841423433051 0.67480437287762 174.967 > 9 12 Lu 0.93270306388188 0.92841423433051 0.67480437287762 174.967 > 9 13 Lu 0.43270306388188 0.32158576566949 0.17480437287762 174.967 > 13 14 Lu 0.93270306388188 0.32158576566949 0.17480437287762 174.967 > 13 15 Lu 0.43270306388188 0.82158576566949 0.17480437287762 174.967 > 13 16 Lu 0.93270306388188 0.82158576566949 0.17480437287762 174.967 > 13 17 Se 0.32159088563388 0.19089736964914 0.70668775310213 78.960 > 17 18 Se 0.82159088563388 0.19089736964914 0.70668775310213 78.960 > 17 19 Se 0.32159088563388 0.69089736964914 0.70668775310213 78.960 > 17 20 Se 0.82159088563388 0.69089736964914 0.70668775310213 78.960 > 17 21 Se 0.17840911436612 0.30910263035086 0.29331224689787 78.960 > 21 22 Se 0.67840911436612 0.30910263035086 0.29331224689787 78.960 > 21 23 Se 0.17840911436612 0.80910263035086 0.29331224689787 78.960 > 21 24 Se 0.67840911436612 0.80910263035086 0.29331224689787 78.960 > 21 25 Se 0.17840911436612 0.44089736964914 0.79331224689787 78.960 > 25 26 Se 0.67840911436612 0.44089736964914 0.79331224689787 78.960 > 25 27 Se 0.17840911436612 0.94089736964914 0.79331224689787 78.960 > 25 28 Se 0.67840911436612 0.94089736964914 0.79331224689787 78.960 > 25 29 Se 0.32159088563388 0.05910263035086 0.20668775310213 78.960 > 29 30 Se 0.82159088563388 0.05910263035086 0.20668775310213 78.960 > 29 31 Se 0.32159088563388 0.55910263035086 0.20668775310213 78.960 > 29 32 Se 0.82159088563388 0.55910263035086 0.20668775310213 78.960 > 29 33 O 0.26069214827303 0.40516346598517 0.63561033119438 15.999 > 33 34 O 0.76069214827303 0.40516346598517 0.63561033119438 15.999 > 33 35 O 0.26069214827303 0.90516346598517 0.63561033119438 15.999 > 33 36 O 0.76069214827303 0.90516346598517 0.63561033119438 15.999 > 33 37 O 0.41395607923604 0.48320274005777 0.35324404113683 15.999 > 37 38 O 0.91395607923604 0.48320274005777 0.35324404113683 15.999 > 37 39 O 0.41395607923604 0.98320274005777 0.35324404113683 15.999 > 37 40 O 0.91395607923604 0.98320274005777 0.35324404113683 15.999 > 37 41 O 0.08604392076396 0.23320274005777 0.14675595886317 15.999 > 41 42 O 0.58604392076396 0.23320274005777 0.14675595886317 15.999 > 41 43 O 0.08604392076396 0.73320274005777 0.14675595886317 15.999 > 41 44 O 0.58604392076396 0.73320274005777 0.14675595886317 15.999 > 41 45 O 0.26069214827303 0.34483653401483 0.13561033119438 15.999 > 45 46 O 0.76069214827303 0.34483653401483 0.13561033119438 15.999 > 45 47 O 0.26069214827303 0.84483653401483 0.13561033119438 15.999 > 45 48 O 0.76069214827303 0.84483653401483 0.13561033119438 15.999 > 45 49 O 0.08738643173236 0.40458011389804 0.28260717458681 15.999 > 49 50 O 0.58738643173236 0.40458011389804 0.28260717458681 15.999 > 49 51 O 0.08738643173236 0.90458011389804 0.28260717458681 15.999 > 49 52 O 0.58738643173236 0.90458011389804 0.28260717458681 15.999 > 49 53 O 0.08604392076396 0.01679725994223 0.64675595886317 15.999 > 53 54 O 0.58604392076396 0.01679725994223 0.64675595886317 15.999 > 53 55 O 0.08604392076396 0.51679725994223 0.64675595886317 15.999 > 53 56 O 0.58604392076396 0.51679725994223 0.64675595886317 15.999 > 53 57 O 0.08738643173236 0.34541988610196 0.78260717458681 15.999 > 57 58 O 0.58738643173236 0.34541988610196 0.78260717458681 15.999 > 57 59 O 0.08738643173236 0.84541988610196 0.78260717458681 15.999 > 57 60 O 0.58738643173236 0.84541988610196 0.78260717458681 15.999 > 57 61 O 0.41261356826764 0.09541988610196 0.71739282541319 15.999 > 61 62 O 0.91261356826764 0.09541988610196 0.71739282541319 15.999 > 61 63 O 0.41261356826764 0.59541988610196 0.71739282541319 15.999 > 61 64 O 0.91261356826764 0.59541988610196 0.71739282541319 15.999 > 61 65 O 0.23930785172697 0.09483653401483 0.36438966880562 15.999 > 65 66 O 0.73930785172697 0.09483653401483 0.36438966880562 15.999 > 65 67 O 0.23930785172697 0.59483653401483 0.36438966880562 15.999 > 65 68 O 0.73930785172697 0.59483653401483 0.36438966880562 15.999 > 65 69 O 0.41261356826764 0.15458011389804 0.21739282541319 15.999 > 69 70 O 0.91261356826764 0.15458011389804 0.21739282541319 15.999 > 69 71 O 0.41261356826764 0.65458011389804 0.21739282541319 15.999 > 69 72 O 0.91261356826764 0.65458011389804 0.21739282541319 15.999 > 69 73 O 0.41395607923604 0.26679725994223 0.85324404113683 15.999 > 73 74 O 0.91395607923604 0.26679725994223 0.85324404113683 15.999 > 73 75 O 0.41395607923604 0.76679725994223 0.85324404113683 15.999 > 73 76 O 0.91395607923604 0.76679725994223 0.85324404113683 15.999 > 73 77 O 0.23930785172697 0.15516346598517 0.86438966880562 15.999 > 77 78 O 0.73930785172697 0.15516346598517 0.86438966880562 15.999 > 77 79 O 0.23930785172697 0.65516346598517 0.86438966880562 15.999 > 77 80 O 0.73930785172697 0.65516346598517 0.86438966880562 15.999 > 77 81 F 0.08321173678194 0.19272962219002 0.52608126899430 18.998 > 81 82 F 0.58321173678194 0.19272962219002 0.52608126899430 18.998 > 81 83 F 0.08321173678194 0.69272962219002 0.52608126899430 18.998 > 81 84 F 0.58321173678194 0.69272962219002 0.52608126899430 18.998 > 81 85 F 0.41678826321806 0.44272962219002 0.97391873100570 18.998 > 85 86 F 0.91678826321806 0.44272962219002 0.97391873100570 18.998 > 85 87 F 0.41678826321806 0.94272962219002 0.97391873100570 18.998 > 85 88 F 0.91678826321806 0.94272962219002 0.97391873100570 18.998 > 85 89 F 0.08321173678194 0.05727037780998 0.02608126899430 18.998 > 89 90 F 0.58321173678194 0.05727037780998 0.02608126899430 18.998 > 89 91 F 0.08321173678194 0.55727037780998 0.02608126899430 18.998 > 89 92 F 0.58321173678194 0.55727037780998 0.02608126899430 18.998 > 89 93 F 0.41678826321806 0.30727037780998 0.47391873100570 18.998 > 93 94 F 0.91678826321806 0.30727037780998 0.47391873100570 18.998 > 93 95 F 0.41678826321806 0.80727037780998 0.47391873100570 18.998 > 93 96 F 0.91678826321806 0.80727037780998 0.47391873100570 18.998 > 93----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 4.0813019 0.0000000 -0.0864103 0.0000000 3.7937734 0.0000000 -0.0864033 0.0000000 3.5521391-------------------------- Born effective charges -------------------------- 1 Lu 4.4288628 -0.0247934 0.0890700 -0.0932754 3.8713053 0.2579250 -0.2242800 -0.2148513 3.7576517 2 Lu 4.4288628 0.0247934 0.0890700 0.0932754 3.8713053 -0.2579250 -0.2242800 0.2148513 3.7576517 3 Lu 4.4288628 0.0247934 0.0890700 0.0932754 3.8713053 -0.2579250 -0.2242800 0.2148513 3.7576517 4 Lu 4.4288628 -0.0247934 0.0890700 -0.0932754 3.8713053 0.2579250 -0.2242800 -0.2148513 3.7576517 5 Se 3.5922164 0.0893715 -0.3678804 0.4280126 3.0564630 0.2540699 -0.1974799 0.3448596 2.6723699 6 Se 3.5922164 0.0893715 -0.3678804 0.4280126 3.0564630 0.2540699 -0.1974799 0.3448596 2.6723699 7 Se 3.5922164 -0.0893715 -0.3678804 -0.4280126 3.0564630 -0.2540699 -0.1974799 -0.3448596 2.6723699 8 Se 3.5922164 -0.0893715 -0.3678804 -0.4280126 3.0564630 -0.2540699 -0.1974799 -0.3448596 2.6723699 9 O -2.8226378 0.3856897 0.8864998 0.2364615 -1.2086808 -0.4263854 0.3952608 -0.3813279 -1.5933785 10 O -2.0497195 0.1391379 -0.4909312 0.7289537 -1.9619311 0.7465331 -0.3842112 0.3295676 -1.9567083 11 O -2.0497195 -0.1391379 -0.4909312 -0.7289537 -1.9619311 -0.7465331 -0.3842112 -0.3295676 -1.9567083 12 O -2.8226378 -0.3856897 0.8864998 -0.2364615 -1.2086808 0.4263854 0.3952608 0.3813279 -1.5933785 13 O -2.1211394 0.5909731 -0.3103464 0.6651771 -2.3687963 -0.0539348 0.0931883 -0.4516290 -0.9241703 14 O -2.0497195 0.1391379 -0.4909312 0.7289537 -1.9619311 0.7465331 -0.3842112 0.3295676 -1.9567083 15 O -2.1211394 -0.5909731 -0.3103464 -0.6651771 -2.3687963 0.0539348 0.0931883 0.4516290 -0.9241703 16 O -2.1211394 0.5909731 -0.3103464 0.6651771 -2.3687963 -0.0539348 0.0931883 -0.4516290 -0.9241703 17 O -2.8226378 0.3856897 0.8864998 0.2364615 -1.2086808 -0.4263854 0.3952608 -0.3813279 -1.5933785 18 O -2.1211394 -0.5909731 -0.3103464 -0.6651771 -2.3687963 0.0539348 0.0931883 0.4516290 -0.9241703 19 O -2.0497195 -0.1391379 -0.4909312 -0.7289537 -1.9619311 -0.7465331 -0.3842112 -0.3295676 -1.9567083 20 O -2.8226378 -0.3856897 0.8864998 -0.2364615 -1.2086808 0.4263854 0.3952608 0.3813279 -1.5933785 21 F -1.0275827 -0.0730681 0.1935883 -0.1086703 -1.3883601 -0.2160069 0.3175220 -0.0603549 -1.9557644 22 F -1.0275827 0.0730681 0.1935883 0.1086703 -1.3883601 0.2160069 0.3175220 0.0603549 -1.9557644 23 F -1.0275827 0.0730681 0.1935883 0.1086703 -1.3883601 0.2160069 0.3175220 0.0603549 -1.9557644 24 F -1.0275827 -0.0730681 0.1935883 -0.1086703 -1.3883601 -0.2160069 0.3175220 -0.0603549 -1.9557644----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: -0.00000002 (zzz) -0.00000002 (zzz) -0.00000002 (zzz)Max drift of fc2: -0.00000000 (yz) -0.00000000 (yz) --------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330Length for sampling mesh generation: 50.00Generating grid system ... [ 8 7 7 ]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: 0.62, Number of G-points: 293, Lambda: 0.13Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/116) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency 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 1.942 ( 0.000 0.000 0.000) 0.000 2.265 ( 0.000 0.000 0.000) 0.000 2.801 ( 0.000 0.000 0.000) 0.000 2.907 ( 0.000 0.000 0.000) 0.000 3.078 ( 0.000 0.000 0.000) 0.000 3.212 ( 0.000 0.000 0.000) 0.000 3.238 ( 0.000 0.000 0.000) 0.000 3.303 ( 0.000 0.000 0.000) 0.000 3.551 ( 0.000 0.000 0.000) 0.000 3.609 ( 0.000 0.000 0.000) 0.000 3.728 ( 0.000 0.000 0.000) 0.000 3.764 ( 0.000 0.000 0.000) 0.000 3.975 ( 0.000 0.000 0.000) 0.000 4.199 ( 0.000 0.000 0.000) 0.000 4.372 ( 0.000 0.000 0.000) 0.000 4.545 ( 0.000 0.000 0.000) 0.000 4.604 ( 0.000 0.000 0.000) 0.000 4.911 ( 0.000 0.000 0.000) 0.000 5.310 ( 0.000 0.000 0.000) 0.000 5.323 ( 0.000 0.000 0.000) 0.000 5.415 ( 0.000 0.000 0.000) 0.000 5.859 ( 0.000 0.000 0.000) 0.000 6.045 ( 0.000 0.000 0.000) 0.000 6.268 ( 0.000 0.000 0.000) 0.000 6.328 ( 0.000 0.000 0.000) 0.000 6.431 ( 0.000 0.000 0.000) 0.000 6.447 ( 0.000 0.000 0.000) 0.000 6.604 ( 0.000 0.000 0.000) 0.000 6.934 ( 0.000 0.000 0.000) 0.000 7.246 ( 0.000 0.000 0.000) 0.000 7.368 ( 0.000 0.000 0.000) 0.000 7.616 ( 0.000 0.000 0.000) 0.000 8.024 ( 0.000 0.000 0.000) 0.000 8.282 ( 0.000 0.000 0.000) 0.000 8.381 ( 0.000 0.000 0.000) 0.000 8.654 ( 0.000 0.000 0.000) 0.000 8.777 ( 0.000 0.000 0.000) 0.000 9.388 ( 0.000 0.000 0.000) 0.000 9.526 ( 0.000 0.000 0.000) 0.000 9.934 ( 0.000 0.000 0.000) 0.000 10.165 ( 0.000 0.000 0.000) 0.000 10.574 ( 0.000 0.000 0.000) 0.000 10.767 ( 0.000 0.000 0.000) 0.000 11.111 ( 0.000 0.000 0.000) 0.000 11.359 ( 0.000 0.000 0.000) 0.000 11.797 ( 0.000 0.000 0.000) 0.000 12.028 ( 0.000 0.000 0.000) 0.000 12.628 ( 0.000 0.000 0.000) 0.000 12.850 ( 0.000 0.000 0.000) 0.000 12.937 ( 0.000 0.000 0.000) 0.000 13.010 ( 0.000 0.000 0.000) 0.000 13.872 ( 0.000 0.000 0.000) 0.000 13.930 ( 0.000 0.000 0.000) 0.000 14.095 ( 0.000 0.000 0.000) 0.000 14.209 ( 0.000 0.000 0.000) 0.000 14.320 ( 0.000 0.000 0.000) 0.000 14.427 ( 0.000 0.000 0.000) 0.000 18.874 ( 0.000 0.000 0.000) 0.000 19.088 ( 0.000 0.000 0.000) 0.000 19.990 ( 0.000 0.000 0.000) 0.000 20.083 ( 0.000 0.000 0.000) 0.000 21.642 ( 0.000 0.000 0.000) 0.000 21.857 ( 0.000 0.000 0.000) 0.000 21.978 ( 0.000 0.000 0.000) 0.000 22.018 ( 0.000 0.000 0.000) 0.000 23.539 ( 0.000 0.000 0.000) 0.000 23.787 ( 0.000 0.000 0.000) 0.000 23.977 ( 0.000 0.000 0.000) 0.000 24.377 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/116) =======================q-point: ( 0.12 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.447 ( 20.942 0.000 12.928) 24.611 0.494 ( 24.007 0.000 3.239) 24.225 1.100 ( 54.189 0.000 -2.369) 54.240 2.083 ( 11.915 0.000 4.131) 12.611 2.252 ( -1.275 0.000 0.278) 1.305 2.888 ( 6.826 0.000 -1.848) 7.072 2.960 ( 4.318 0.000 -1.072) 4.449 2.984 ( -7.035 0.000 -3.680) 7.939 3.193 ( -2.126 0.000 1.989) 2.912 3.245 ( 3.782 0.000 -1.978) 4.268 3.361 ( 3.639 0.000 -4.201) 5.558 3.453 ( -2.325 0.000 1.268) 2.648 3.645 ( -1.692 0.000 -2.624) 3.122 3.763 ( -0.388 0.000 1.511) 1.560 3.816 ( 4.768 0.000 4.730) 6.716 4.017 ( 0.737 0.000 0.885) 1.151 4.338 ( -11.172 0.000 5.882) 12.626 4.372 ( -3.421 0.000 2.878) 4.471 4.449 ( 9.430 0.000 -0.163) 9.432 4.833 ( 11.102 0.000 -5.347) 12.322 4.833 ( -6.729 0.000 -2.237) 7.091 5.134 ( -7.449 0.000 -3.469) 8.217 5.479 ( -1.640 0.000 7.805) 7.975 5.500 ( 6.902 0.000 7.532) 10.216 5.876 ( 2.067 0.000 -5.257) 5.649 6.073 ( 1.707 0.000 0.566) 1.798 6.268 ( -0.749 0.000 -1.812) 1.960 6.288 ( -1.954 0.000 0.166) 1.961 6.455 ( 3.612 0.000 -1.027) 3.755 6.667 ( 4.904 0.000 2.126) 5.345 7.010 ( 5.467 0.000 3.545) 6.516 7.143 ( -5.868 0.000 13.669) 14.875 7.174 ( -5.897 0.000 -0.946) 5.972 7.691 ( 6.467 0.000 0.612) 6.496 7.986 ( -3.532 0.000 1.523) 3.846 8.119 ( 3.094 0.000 -27.992) 28.163 8.256 ( -2.322 0.000 -1.167) 2.599 8.393 ( 1.112 0.000 0.594) 1.261 8.613 ( -2.517 0.000 0.193) 2.524 8.909 ( 0.678 0.000 3.887) 3.946 9.519 ( -0.063 0.000 -3.739) 3.740 9.661 ( 6.626 0.000 -34.950) 35.572 9.975 ( 3.969 0.000 -0.573) 4.010 10.172 ( 1.249 0.000 -1.277) 1.786 10.577 ( 0.104 0.000 0.619) 0.627 10.768 ( -0.120 0.000 1.151) 1.157 11.121 ( -2.276 0.000 -10.404) 10.650 11.324 ( -3.769 0.000 0.721) 3.837 11.912 ( -5.763 0.000 25.957) 26.589 12.056 ( 1.348 0.000 5.905) 6.057 12.644 ( 1.779 0.000 -1.056) 2.069 12.850 ( -0.188 0.000 1.130) 1.145 13.016 ( 0.817 0.000 -0.246) 0.853 13.259 ( 0.746 0.000 14.150) 14.170 13.607 ( -15.512 0.000 -3.726) 15.953 13.951 ( -12.681 0.000 2.422) 12.910 14.173 ( -3.477 0.000 -0.745) 3.556 14.217 ( 6.059 0.000 2.505) 6.557 14.717 ( 16.614 0.000 -2.351) 16.779 15.489 ( -5.554 0.000 25.926) 26.514 18.837 ( -3.597 0.000 1.165) 3.781 19.104 ( 1.833 0.000 -1.693) 2.495 20.052 ( 6.298 0.000 -2.948) 6.953 20.078 ( -4.891 0.000 11.627) 12.613 21.585 ( -4.412 0.000 -0.971) 4.518 22.010 ( -0.918 0.000 1.253) 1.553 22.068 ( 7.407 0.000 4.107) 8.469 23.399 ( 1.373 0.000 19.093) 19.142 23.789 ( 0.229 0.000 -0.320) 0.394 23.953 ( -1.492 0.000 -6.046) 6.227 24.399 ( 1.935 0.000 1.176) 2.264 24.693 ( 14.140 0.000 -84.627) 85.800======================= Grid point 2 (3/116) =======================q-point: ( 0.25 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.881 ( 19.978 0.000 11.707) 23.155 0.919 ( 17.655 0.000 4.104) 18.126 1.922 ( 18.684 0.000 -3.081) 18.936 2.313 ( 7.709 0.000 7.540) 10.783 2.328 ( 20.483 0.000 0.105) 20.483 2.811 ( -4.666 0.000 -3.893) 6.077 2.993 ( -0.867 0.000 -2.247) 2.409 3.049 ( 6.601 0.000 -5.015) 8.290 3.224 ( 4.346 0.000 0.514) 4.376 3.325 ( 3.790 0.000 -6.380) 7.421 3.405 ( 1.592 0.000 0.117) 1.596 3.498 ( 5.138 0.000 0.428) 5.156 3.563 ( -3.489 0.000 -1.268) 3.712 3.752 ( -1.257 0.000 1.171) 1.718 3.946 ( 6.071 0.000 -0.045) 6.071 4.007 ( 0.714 0.000 0.554) 0.904 4.201 ( -2.788 0.000 5.914) 6.538 4.320 ( -2.626 0.000 0.194) 2.634 4.542 ( -7.530 0.000 -2.585) 7.962 4.822 ( 11.475 0.000 1.801) 11.616 5.007 ( 8.638 0.000 -4.543) 9.760 5.021 ( -2.939 0.000 -1.260) 3.198 5.466 ( -2.317 0.000 8.738) 9.040 5.619 ( 3.223 0.000 6.809) 7.533 5.891 ( 1.263 0.000 -6.099) 6.229 6.073 ( -1.306 0.000 -0.769) 1.516 6.208 ( -4.260 0.000 -2.976) 5.197 6.323 ( 4.767 0.000 3.104) 5.689 6.574 ( 8.081 0.000 -2.767) 8.542 6.737 ( 0.064 0.000 2.223) 2.224 7.034 ( -8.245 0.000 7.448) 11.111 7.055 ( -4.787 0.000 -0.931) 4.877 7.107 ( 2.341 0.000 2.623) 3.515 7.833 ( 7.261 0.000 1.018) 7.332 7.910 ( -5.137 0.000 4.927) 7.118 8.037 ( -4.150 0.000 -18.886) 19.336 8.198 ( -2.920 0.000 -1.287) 3.191 8.428 ( 2.287 0.000 0.756) 2.409 8.622 ( 3.533 0.000 1.080) 3.695 8.926 ( -0.132 0.000 4.389) 4.391 9.506 ( -0.084 0.000 -3.711) 3.712 9.688 ( 2.990 0.000 -11.583) 11.963 10.055 ( 3.497 0.000 -0.366) 3.516 10.236 ( 6.871 0.000 -2.828) 7.430 10.578 ( -0.310 0.000 1.566) 1.596 10.770 ( -0.047 0.000 1.759) 1.760 11.020 ( -5.515 0.000 -4.580) 7.168 11.214 ( -7.879 0.000 0.949) 7.936 11.879 ( -2.538 0.000 7.757) 8.162 12.100 ( 1.737 0.000 3.129) 3.579 12.693 ( 3.641 0.000 -1.441) 3.916 12.852 ( 0.006 0.000 1.917) 1.917 13.044 ( 2.056 0.000 -0.380) 2.090 13.303 ( -14.131 0.000 -2.686) 14.384 13.325 ( 2.487 0.000 7.050) 7.476 13.698 ( -11.577 0.000 0.322) 11.582 14.081 ( -5.267 0.000 -1.096) 5.380 14.356 ( 5.664 0.000 2.404) 6.153 14.989 ( 11.675 0.000 -1.909) 11.830 15.446 ( -4.064 0.000 9.889) 10.691 18.763 ( -3.927 0.000 1.353) 4.154 19.144 ( 2.818 0.000 -2.674) 3.885 20.001 ( -5.606 0.000 7.656) 9.489 20.185 ( 7.592 0.000 -3.865) 8.519 21.499 ( -3.850 0.000 -0.594) 3.895 21.995 ( -0.958 0.000 1.624) 1.886 22.246 ( 8.789 0.000 5.084) 10.153 23.503 ( 4.967 0.000 7.195) 8.743 23.791 ( 0.063 0.000 -0.539) 0.543 23.893 ( -2.378 0.000 -8.267) 8.603 24.451 ( 2.710 0.000 1.661) 3.178 24.726 ( 6.531 0.000 -32.028) 32.688======================= Grid point 3 (4/116) =======================q-point: ( 0.38 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.166 ( 6.515 0.000 3.781) 7.533 1.280 ( 17.697 0.000 9.647) 20.156 1.891 ( -9.284 0.000 -4.202) 10.191 2.448 ( 6.873 0.000 3.849) 7.878 2.747 ( -3.766 0.000 1.259) 3.971 2.907 ( 25.310 0.000 -3.527) 25.555 2.956 ( -0.160 0.000 1.007) 1.019 3.119 ( 2.406 0.000 -9.021) 9.336 3.301 ( 2.845 0.000 -1.277) 3.119 3.326 ( 0.026 0.000 -4.084) 4.084 3.429 ( 0.271 0.000 2.962) 2.974 3.442 ( -4.960 0.000 0.708) 5.010 3.705 ( 10.147 0.000 -0.274) 10.151 3.723 ( -1.772 0.000 0.928) 2.000 4.004 ( 1.060 0.000 0.355) 1.118 4.076 ( 5.032 0.000 -0.908) 5.113 4.259 ( 3.930 0.000 3.366) 5.175 4.282 ( -0.486 0.000 -1.740) 1.807 4.341 ( -9.832 0.000 0.494) 9.844 4.926 ( -0.742 0.000 -0.040) 0.743 5.142 ( 11.852 0.000 0.430) 11.860 5.153 ( 7.866 0.000 -3.964) 8.808 5.423 ( -5.068 0.000 6.473) 8.221 5.659 ( -0.917 0.000 4.789) 4.876 5.915 ( 3.451 0.000 -2.614) 4.329 6.059 ( 0.635 0.000 -0.719) 0.960 6.114 ( -4.162 0.000 -2.634) 4.925 6.446 ( 6.149 0.000 3.489) 7.070 6.681 ( -4.904 0.000 0.530) 4.933 6.681 ( 1.735 0.000 -4.479) 4.803 6.906 ( -4.739 0.000 5.726) 7.432 6.958 ( -5.123 0.000 -0.900) 5.201 7.142 ( 0.923 0.000 1.072) 1.414 7.822 ( -5.332 0.000 6.099) 8.101 7.905 ( -3.247 0.000 -12.211) 12.635 7.956 ( 4.624 0.000 0.856) 4.702 8.147 ( -1.807 0.000 -0.789) 1.972 8.474 ( 1.876 0.000 0.496) 1.941 8.721 ( 5.273 0.000 0.287) 5.281 8.930 ( -0.534 0.000 2.633) 2.686 9.496 ( -0.039 0.000 -2.135) 2.135 9.705 ( 0.946 0.000 -3.744) 3.861 10.099 ( 1.352 0.000 -0.090) 1.355 10.406 ( 9.900 0.000 -4.323) 10.802 10.585 ( 1.162 0.000 3.464) 3.654 10.778 ( 0.421 0.000 1.726) 1.776 10.902 ( -4.959 0.000 -2.629) 5.613 11.030 ( -10.929 0.000 0.534) 10.943 11.860 ( -0.995 0.000 2.602) 2.786 12.136 ( 1.152 0.000 1.087) 1.584 12.770 ( 4.302 0.000 -0.902) 4.395 12.861 ( 0.393 0.000 1.875) 1.915 13.065 ( -9.480 0.000 -1.868) 9.662 13.086 ( 2.127 0.000 -0.303) 2.149 13.384 ( 1.787 0.000 3.417) 3.856 13.527 ( -5.971 0.000 -0.289) 5.978 13.982 ( -4.122 0.000 -0.818) 4.203 14.438 ( 2.385 0.000 1.360) 2.745 15.153 ( 5.656 0.000 -1.056) 5.754 15.399 ( -2.551 0.000 3.763) 4.546 18.705 ( -2.240 0.000 0.825) 2.387 19.189 ( 2.232 0.000 -2.174) 3.116 19.922 ( -3.918 0.000 4.555) 6.008 20.299 ( 4.754 0.000 -2.577) 5.408 21.440 ( -2.056 0.000 -0.240) 2.070 21.985 ( -0.504 0.000 1.075) 1.187 22.410 ( 6.086 0.000 3.464) 7.003 23.618 ( 4.900 0.000 4.362) 6.560 23.788 ( -0.213 0.000 -0.470) 0.517 23.818 ( -2.871 0.000 -7.071) 7.632 24.502 ( 1.901 0.000 1.176) 2.236 24.754 ( 2.887 0.000 -12.346) 12.679======================= Grid point 4 (5/116) =======================q-point: (-0.50 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 60Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.225 ( 0.000 0.000 0.000) 0.000 1.568 ( -0.000 0.000 -0.000) 0.000 1.690 ( 0.000 0.000 0.000) 0.000 2.619 ( -0.000 0.000 0.000) 0.000 2.624 ( 0.000 0.000 -0.000) 0.000 2.929 ( 0.000 0.000 0.000) 0.000 3.114 ( 0.000 0.000 0.000) 0.000 3.200 ( 0.000 0.000 0.000) 0.000 3.325 ( 0.000 0.000 -0.000) 0.000 3.351 ( -0.000 0.000 0.000) 0.000 3.368 ( 0.000 0.000 -0.000) 0.000 3.425 ( 0.000 0.000 0.000) 0.000 3.704 ( 0.000 0.000 0.000) 0.000 3.816 ( 0.000 0.000 -0.000) 0.000 4.016 ( 0.000 0.000 0.000) 0.000 4.150 ( -0.000 0.000 0.000) 0.000 4.217 ( 0.000 0.000 -0.000) 0.000 4.264 ( 0.000 0.000 0.000) 0.000 4.319 ( 0.000 0.000 0.000) 0.000 4.919 ( 0.000 0.000 0.000) 0.000 5.273 ( -0.000 0.000 0.000) 0.000 5.277 ( 0.000 0.000 0.000) 0.000 5.326 ( 0.000 0.000 -0.000) 0.000 5.641 ( 0.000 0.000 -0.000) 0.000 5.989 ( -0.000 0.000 -0.000) 0.000 6.042 ( 0.000 0.000 0.000) 0.000 6.074 ( 0.000 0.000 -0.000) 0.000 6.543 ( -0.000 0.000 -0.000) 0.000 6.605 ( 0.000 0.000 -0.000) 0.000 6.651 ( 0.000 0.000 0.000) 0.000 6.890 ( 0.000 0.000 0.000) 0.000 6.893 ( 0.000 0.000 -0.000) 0.000 7.153 ( 0.000 0.000 -0.000) 0.000 7.770 ( 0.000 0.000 -0.000) 0.000 7.858 ( 0.000 0.000 0.000) 0.000 8.003 ( 0.000 0.000 0.000) 0.000 8.128 ( 0.000 0.000 0.000) 0.000 8.494 ( 0.000 0.000 0.000) 0.000 8.782 ( 0.000 0.000 0.000) 0.000 8.926 ( 0.000 0.000 0.000) 0.000 9.492 ( 0.000 0.000 0.000) 0.000 9.707 ( 0.000 0.000 0.000) 0.000 10.112 ( 0.000 0.000 0.000) 0.000 10.495 ( 0.000 0.000 -0.000) 0.000 10.661 ( 0.000 0.000 0.000) 0.000 10.793 ( 0.000 0.000 0.000) 0.000 10.839 ( -0.000 0.000 -0.000) 0.000 10.866 ( 0.000 0.000 0.000) 0.000 11.854 ( 0.000 0.000 0.000) 0.000 12.149 ( 0.000 0.000 0.000) 0.000 12.822 ( 0.000 0.000 -0.000) 0.000 12.882 ( 0.000 0.000 -0.000) 0.000 12.946 ( 0.000 0.000 0.000) 0.000 13.109 ( 0.000 0.000 0.000) 0.000 13.407 ( 0.000 0.000 0.000) 0.000 13.468 ( 0.000 0.000 -0.000) 0.000 13.938 ( 0.000 0.000 0.000) 0.000 14.462 ( 0.000 0.000 0.000) 0.000 15.205 ( 0.000 0.000 0.000) 0.000 15.378 ( 0.000 0.000 0.000) 0.000 18.684 ( 0.000 0.000 0.000) 0.000 19.209 ( 0.000 0.000 0.000) 0.000 19.889 ( 0.000 0.000 0.000) 0.000 20.343 ( 0.000 0.000 0.000) 0.000 21.420 ( 0.000 0.000 0.000) 0.000 21.981 ( 0.000 0.000 -0.000) 0.000 22.478 ( 0.000 0.000 0.000) 0.000 23.695 ( 0.000 0.000 0.000) 0.000 23.758 ( 0.000 0.000 -0.000) 0.000 23.784 ( 0.000 0.000 -0.000) 0.000 24.523 ( 0.000 0.000 -0.000) 0.000 24.764 ( 0.000 0.000 0.000) 0.000======================= Grid point 9 (6/116) =======================q-point: ( 0.00 0.14 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.534 ( 0.000 25.029 0.000) 25.029 0.583 ( 0.000 27.177 0.000) 27.177 0.855 ( 0.000 38.952 0.000) 38.952 1.994 ( 0.000 4.762 0.000) 4.762 2.275 ( 0.000 0.395 0.000) 0.395 2.734 ( 0.000 -7.766 0.000) 7.766 2.897 ( 0.000 -1.513 0.000) 1.513 3.099 ( 0.000 1.869 0.000) 1.869 3.225 ( 0.000 -2.772 0.000) 2.772 3.230 ( 0.000 -6.672 0.000) 6.672 3.232 ( 0.000 -1.262 0.000) 1.262 3.553 ( 0.000 -2.128 0.000) 2.128 3.711 ( 0.000 -2.916 0.000) 2.916 3.817 ( 0.000 5.545 0.000) 5.545 4.003 ( 0.000 1.906 0.000) 1.906 4.087 ( 0.000 2.667 0.000) 2.667 4.296 ( 0.000 8.595 0.000) 8.595 4.572 ( 0.000 2.400 0.000) 2.400 4.626 ( 0.000 1.072 0.000) 1.072 4.837 ( 0.000 -4.143 0.000) 4.143 4.879 ( 0.000 -2.597 0.000) 2.597 5.277 ( 0.000 -2.214 0.000) 2.214 5.284 ( 0.000 -1.647 0.000) 1.647 5.478 ( 0.000 4.512 0.000) 4.512 5.873 ( 0.000 0.610 0.000) 0.610 6.037 ( 0.000 -1.627 0.000) 1.627 6.213 ( 0.000 -4.824 0.000) 4.824 6.336 ( 0.000 4.810 0.000) 4.810 6.391 ( 0.000 -3.129 0.000) 3.129 6.540 ( 0.000 6.057 0.000) 6.057 6.688 ( 0.000 5.443 0.000) 5.443 6.918 ( 0.000 -1.567 0.000) 1.567 7.157 ( 0.000 -5.613 0.000) 5.613 7.447 ( 0.000 4.788 0.000) 4.788 7.584 ( 0.000 -11.174 0.000) 11.174 7.957 ( 0.000 -5.996 0.000) 5.996 8.374 ( 0.000 -0.250 0.000) 0.250 8.523 ( 0.000 -4.702 0.000) 4.702 8.747 ( 0.000 -2.788 0.000) 2.788 8.927 ( 0.000 6.670 0.000) 6.670 9.403 ( 0.000 1.768 0.000) 1.768 9.553 ( 0.000 4.578 0.000) 4.578 10.083 ( 0.000 1.961 0.000) 1.961 10.645 ( 0.000 6.103 0.000) 6.103 10.777 ( 0.000 1.128 0.000) 1.128 10.953 ( 0.000 2.758 0.000) 2.758 11.055 ( 0.000 -5.011 0.000) 5.011 11.330 ( 0.000 -2.966 0.000) 2.966 11.823 ( 0.000 2.443 0.000) 2.443 12.065 ( 0.000 3.406 0.000) 3.406 12.574 ( 0.000 -5.044 0.000) 5.044 12.823 ( 0.000 -2.786 0.000) 2.786 12.939 ( 0.000 0.389 0.000) 0.389 13.024 ( 0.000 1.162 0.000) 1.162 13.868 ( 0.000 -0.126 0.000) 0.126 13.934 ( 0.000 -0.853 0.000) 0.853 14.111 ( 0.000 1.012 0.000) 1.012 14.206 ( 0.000 -0.374 0.000) 0.374 14.447 ( 0.000 2.002 0.000) 2.002 15.054 ( 0.000 -5.201 0.000) 5.201 19.154 ( 0.000 5.852 0.000) 5.852 19.864 ( 0.000 -6.765 0.000) 6.765 20.235 ( 0.000 9.055 0.000) 9.055 20.648 ( 0.000 0.074 0.000) 0.074 21.845 ( 0.000 -0.977 0.000) 0.977 21.902 ( 0.000 0.543 0.000) 0.543 21.978 ( 0.000 -0.012 0.000) 0.012 22.001 ( 0.000 -1.602 0.000) 1.602 23.561 ( 0.000 2.063 0.000) 2.063 23.955 ( 0.000 -2.021 0.000) 2.021 24.375 ( 0.000 -0.155 0.000) 0.155 24.417 ( 0.000 -0.752 0.000) 0.752======================= Grid point 10 (7/116) =======================q-point: ( 0.12 0.14 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.699 ( 13.022 19.383 7.751) 24.604 0.849 ( 15.084 23.575 1.881) 28.051 1.311 ( 41.697 19.113 -2.133) 45.919 2.101 ( 4.987 1.552 0.090) 5.223 2.317 ( 6.948 4.249 3.107) 8.717 2.790 ( 4.777 -8.265 -1.442) 9.654 2.939 ( 3.367 -1.912 -3.209) 5.029 3.028 ( -4.902 3.588 -0.157) 6.077 3.121 ( -4.491 -5.462 -0.068) 7.071 3.217 ( -0.219 -2.681 -1.959) 3.328 3.338 ( 5.649 -2.746 0.891) 6.344 3.498 ( -4.236 0.446 -1.003) 4.375 3.685 ( -2.131 2.002 -2.556) 3.884 3.761 ( -4.131 0.232 0.683) 4.193 3.915 ( 5.867 7.491 -0.155) 9.516 4.119 ( -5.195 7.377 1.270) 9.112 4.372 ( -9.336 2.612 3.671) 10.366 4.438 ( 13.352 2.950 2.771) 13.952 4.535 ( -9.085 6.716 -0.067) 11.298 4.801 ( -3.752 -1.282 -4.004) 5.635 4.886 ( 6.876 2.747 -1.940) 7.654 5.096 ( -8.354 -2.258 -3.751) 9.431 5.438 ( 3.769 -3.413 7.298) 8.895 5.527 ( 2.387 2.158 7.933) 8.561 5.869 ( 1.363 0.038 -6.984) 7.116 6.067 ( 1.987 -2.248 -0.702) 3.082 6.186 ( -0.298 -4.500 0.623) 4.553 6.279 ( -1.139 0.509 -1.218) 1.744 6.532 ( 0.621 4.383 0.944) 4.527 6.717 ( 7.568 1.631 6.148) 9.886 6.872 ( 4.669 -11.968 -0.052) 12.847 6.992 ( 5.328 -2.122 3.339) 6.636 7.181 ( 2.061 -4.094 -1.497) 4.822 7.538 ( 9.765 -2.912 -3.740) 10.854 7.684 ( 9.833 -14.657 -1.928) 17.755 7.925 ( -3.400 -5.439 3.374) 7.248 8.369 ( -1.332 0.680 0.895) 1.743 8.453 ( -4.212 1.019 -6.206) 7.569 8.759 ( 0.461 1.743 -2.348) 2.960 8.947 ( 0.804 3.523 3.132) 4.783 9.455 ( 5.607 -3.124 -6.899) 9.423 9.544 ( -0.553 3.987 -1.040) 4.157 10.115 ( 3.794 2.493 -1.602) 4.814 10.500 ( -14.654 14.761 -7.376) 22.069 10.652 ( -0.439 6.120 -2.975) 6.819 10.826 ( -0.501 5.129 0.141) 5.155 11.075 ( -2.026 -4.073 -8.838) 9.940 11.339 ( -1.714 0.009 -2.368) 2.923 11.899 ( -0.961 -0.319 20.037) 20.062 12.088 ( 1.424 3.087 4.254) 5.445 12.587 ( 1.977 -5.426 0.185) 5.778 12.809 ( -1.115 -3.640 -0.364) 3.824 13.012 ( 1.439 -0.493 2.923) 3.295 13.117 ( 6.208 -5.565 7.209) 11.022 13.627 ( -14.357 1.830 -3.845) 14.975 13.948 ( -8.477 -1.040 2.257) 8.834 14.147 ( -2.268 -1.545 -0.679) 2.827 14.295 ( 6.957 3.318 -0.358) 7.716 14.512 ( 13.553 -8.568 2.141) 16.176 15.252 ( 10.457 -10.724 5.818) 16.069 19.141 ( -1.828 5.981 -2.197) 6.629 19.526 ( -37.069 28.549 -2.707) 46.867 19.945 ( -7.150 -1.229 11.292) 13.422 20.236 ( 0.236 7.918 1.161) 8.006 21.588 ( -5.958 0.366 0.374) 5.981 21.977 ( 1.367 -2.630 3.011) 4.225 22.089 ( 7.035 1.579 0.637) 7.238 23.030 ( 35.156 -27.766 -4.400) 45.014 23.621 ( 5.932 -1.642 -7.173) 9.452 23.976 ( 1.176 -2.199 2.121) 3.273 24.334 ( -0.111 -1.822 -7.006) 7.240 24.546 ( 11.280 -4.299 -19.111) 22.604======================= Grid point 11 (8/116) =======================q-point: ( 0.25 0.14 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.023 ( 16.586 12.352 9.969) 22.957 1.135 ( 12.704 17.653 3.239) 21.989 2.002 ( 13.674 7.413 -2.976) 15.836 2.195 ( 15.814 -3.128 -0.929) 16.147 2.513 ( 9.959 8.429 6.775) 14.701 2.828 ( 1.046 -2.158 -2.770) 3.664 2.926 ( 0.427 -1.610 -3.619) 3.983 3.060 ( -0.312 -3.881 -5.728) 6.926 3.067 ( 3.661 -5.299 0.577) 6.466 3.257 ( 4.794 -4.114 -0.051) 6.318 3.444 ( 4.830 -0.613 0.523) 4.897 3.494 ( 3.161 -0.340 1.043) 3.346 3.630 ( -2.201 5.002 -5.073) 7.456 3.741 ( 0.346 -2.036 -0.518) 2.129 3.996 ( -4.569 3.103 3.972) 6.803 4.064 ( 6.112 6.452 -1.865) 9.081 4.266 ( -1.047 4.114 3.244) 5.343 4.406 ( -4.412 7.647 -0.352) 8.835 4.602 ( -7.559 4.687 -1.891) 9.093 4.799 ( 12.573 -1.630 3.032) 13.036 4.965 ( -0.938 -3.805 -1.383) 4.156 5.035 ( 6.541 1.862 -4.033) 7.907 5.453 ( -2.864 -1.268 9.119) 9.643 5.621 ( 3.291 0.050 6.076) 6.910 5.870 ( 1.420 -1.342 -6.356) 6.650 6.079 ( -0.166 -0.697 -2.192) 2.307 6.189 ( -1.947 -1.189 -2.262) 3.213 6.282 ( 3.179 -1.893 2.187) 4.297 6.584 ( 3.595 -0.154 0.686) 3.663 6.802 ( -4.700 -1.228 -3.326) 5.887 6.866 ( 3.374 -2.576 7.115) 8.285 7.054 ( -1.214 -2.264 2.372) 3.497 7.171 ( -0.889 2.411 -1.170) 2.824 7.679 ( 4.024 -7.802 -0.321) 8.784 7.867 ( -0.411 -5.957 4.724) 7.614 7.875 ( 6.122 -11.531 -4.408) 13.779 8.278 ( -5.863 7.613 -4.381) 10.560 8.415 ( 0.554 -0.621 -0.011) 0.833 8.758 ( 0.605 4.311 -1.847) 4.729 8.961 ( -0.291 2.452 3.673) 4.426 9.523 ( 1.332 1.342 -7.622) 7.853 9.557 ( 3.760 -3.288 0.375) 5.009 10.229 ( 8.204 3.496 -2.223) 9.191 10.318 ( -3.930 11.485 -2.380) 12.370 10.644 ( -0.041 5.748 -1.515) 5.945 10.825 ( -0.176 4.615 1.258) 4.787 10.971 ( -6.213 -4.164 -3.541) 8.275 11.257 ( -5.895 3.144 -1.579) 6.866 11.903 ( -1.936 2.148 8.190) 8.685 12.130 ( 1.615 2.831 3.177) 4.552 12.651 ( 4.343 -5.119 0.195) 6.716 12.788 ( -0.834 -4.736 -0.300) 4.818 13.042 ( 0.647 0.458 1.957) 2.111 13.205 ( 0.742 -7.069 4.514) 8.420 13.363 ( -10.183 4.080 -2.184) 11.185 13.744 ( -10.097 2.043 0.568) 10.317 14.065 ( -5.020 -1.325 -1.234) 5.337 14.426 ( 5.676 5.746 1.512) 8.217 14.784 ( 11.393 -15.223 0.958) 19.038 15.385 ( 2.677 -5.501 3.811) 7.208 18.961 ( -12.468 13.990 0.518) 18.747 19.222 ( -0.858 7.849 -2.314) 8.228 19.883 ( -4.414 -7.598 5.338) 10.282 20.263 ( 2.328 3.490 -1.098) 4.336 21.488 ( -4.356 -0.165 0.567) 4.396 22.032 ( 3.356 2.255 0.429) 4.066 22.236 ( 6.867 -0.093 4.087) 7.992 23.399 ( 10.719 -10.336 0.830) 14.913 23.693 ( 2.920 -2.442 -5.341) 6.559 23.993 ( -0.135 2.179 2.366) 3.220 24.328 ( 1.332 -7.109 -8.078) 10.843 24.686 ( 7.833 -2.811 -13.964) 16.256======================= Grid point 12 (9/116) =======================q-point: ( 0.38 0.14 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.304 ( 4.770 11.477 4.326) 13.160 1.379 ( 15.343 9.345 7.860) 19.610 1.962 ( -7.953 6.555 -3.979) 11.048 2.418 ( 7.943 -1.809 -0.986) 8.206 2.722 ( -0.123 -0.760 3.732) 3.811 2.883 ( -0.504 -5.838 -0.404) 5.874 3.000 ( -1.872 -8.629 -5.014) 10.154 3.025 ( 16.459 6.189 -1.822) 17.679 3.196 ( 7.835 -1.458 -3.220) 8.595 3.344 ( 2.995 -3.317 2.761) 5.253 3.477 ( -1.884 1.986 1.640) 3.191 3.519 ( -2.211 4.219 -2.887) 5.570 3.656 ( 5.512 -0.578 -1.067) 5.644 3.748 ( 1.197 -0.372 -1.270) 1.784 3.971 ( 1.477 -1.519 2.905) 3.596 4.138 ( 2.034 3.510 -0.560) 4.096 4.306 ( -2.203 4.809 -2.891) 6.028 4.359 ( 2.728 7.972 3.761) 9.227 4.449 ( -4.998 8.017 -0.952) 9.495 4.866 ( -0.853 -4.873 0.102) 4.949 5.150 ( 12.005 0.683 1.071) 12.072 5.155 ( 7.013 -0.496 -3.525) 7.865 5.399 ( -4.937 -1.103 6.245) 8.037 5.670 ( 0.363 0.675 3.816) 3.892 5.909 ( 3.787 -0.746 -1.279) 4.066 6.060 ( -0.824 -0.249 -1.955) 2.136 6.121 ( -2.767 1.059 -3.290) 4.427 6.383 ( 5.337 -4.717 3.340) 7.867 6.592 ( -4.264 -6.641 -1.200) 7.983 6.714 ( -1.874 0.435 -0.820) 2.092 6.922 ( -0.781 0.681 0.964) 1.415 6.978 ( -3.793 2.660 2.985) 5.511 7.171 ( 0.701 2.475 -1.231) 2.851 7.678 ( -2.661 -8.477 0.830) 8.924 7.862 ( -0.049 -1.443 2.258) 2.680 7.971 ( 3.278 -8.787 -3.589) 10.042 8.189 ( -1.904 9.427 -1.929) 9.809 8.431 ( 0.589 -2.948 1.069) 3.191 8.780 ( 1.840 1.799 -1.148) 2.818 8.963 ( -0.244 2.127 2.274) 3.123 9.520 ( 0.274 3.118 -2.509) 4.011 9.624 ( 2.678 -3.516 -1.046) 4.542 10.261 ( -0.996 11.167 -0.714) 11.234 10.431 ( 11.371 -0.139 -1.503) 11.471 10.641 ( 0.059 6.534 -0.798) 6.582 10.824 ( -0.631 4.099 1.685) 4.477 10.832 ( -6.724 -4.973 -1.652) 8.525 11.117 ( -7.402 6.409 -0.556) 9.807 11.889 ( -1.042 2.682 2.954) 4.124 12.164 ( 1.108 2.740 1.237) 3.204 12.742 ( 3.774 -7.428 1.333) 8.438 12.782 ( 1.270 -2.401 -0.781) 2.826 12.997 ( -6.017 -0.791 -0.749) 6.115 13.189 ( 0.317 0.625 2.099) 2.213 13.279 ( -1.159 -2.125 -0.341) 2.444 13.600 ( -4.751 2.988 0.571) 5.641 13.969 ( -4.003 -1.059 -0.926) 4.243 14.510 ( 2.599 6.335 1.054) 6.928 14.942 ( 4.906 -15.931 0.510) 16.677 15.416 ( 0.386 -1.140 1.359) 1.815 18.798 ( -5.080 8.113 0.702) 9.598 19.231 ( 1.313 3.922 -2.304) 4.734 19.809 ( -3.939 -8.583 3.592) 10.103 20.304 ( 1.884 -2.080 -1.411) 3.141 21.427 ( -2.071 0.676 0.507) 2.237 22.093 ( 2.570 8.633 -0.560) 9.025 22.361 ( 4.420 -4.060 3.583) 6.990 23.559 ( 6.355 -4.896 0.214) 8.025 23.705 ( -0.422 -1.819 -2.552) 3.162 23.992 ( -0.344 8.364 1.060) 8.438 24.331 ( 0.808 -12.356 -4.677) 13.236 24.770 ( 3.789 -0.195 -5.861) 6.982======================= Grid point 13 (10/116) =======================q-point: (-0.50 0.14 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 102Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.344 ( 0.000 10.552 0.000) 10.552 1.623 ( -0.000 5.060 -0.000) 5.060 1.794 ( 0.000 9.542 0.000) 9.542 2.593 ( 0.000 -1.834 -0.000) 1.834 2.613 ( -0.000 -0.824 0.000) 0.824 2.873 ( -0.000 -4.117 0.000) 4.117 2.967 ( 0.000 -8.574 0.000) 8.574 3.197 ( 0.000 -3.886 0.000) 3.886 3.339 ( 0.000 -5.339 -0.000) 5.339 3.353 ( -0.000 5.156 0.000) 5.156 3.441 ( 0.000 5.521 0.000) 5.521 3.482 ( 0.000 4.667 0.000) 4.667 3.694 ( 0.000 0.024 0.000) 0.024 3.782 ( 0.000 -3.075 0.000) 3.075 4.018 ( -0.000 -0.157 -0.000) 0.157 4.144 ( 0.000 -2.819 -0.000) 2.819 4.255 ( -0.000 9.102 0.000) 9.102 4.396 ( 0.000 8.156 -0.000) 8.156 4.419 ( 0.000 8.628 0.000) 8.628 4.861 ( 0.000 -4.608 0.000) 4.608 5.251 ( -0.000 -6.046 0.000) 6.046 5.269 ( 0.000 0.649 -0.000) 0.649 5.338 ( 0.000 4.214 -0.000) 4.214 5.669 ( 0.000 1.920 -0.000) 1.920 6.000 ( 0.000 -3.486 0.000) 3.486 6.002 ( -0.000 1.007 -0.000) 1.007 6.099 ( 0.000 2.004 -0.000) 2.004 6.482 ( -0.000 -4.835 -0.000) 4.835 6.494 ( 0.000 -7.941 0.000) 7.941 6.691 ( 0.000 1.257 0.000) 1.257 6.873 ( 0.000 -0.334 0.000) 0.334 6.975 ( 0.000 5.277 -0.000) 5.277 7.178 ( 0.000 2.350 0.000) 2.350 7.645 ( 0.000 -7.965 -0.000) 7.965 7.862 ( 0.000 0.289 0.000) 0.289 7.996 ( 0.000 -7.561 0.000) 7.561 8.173 ( 0.000 9.207 -0.000) 9.207 8.439 ( 0.000 -4.232 0.000) 4.232 8.801 ( 0.000 -0.046 0.000) 0.046 8.965 ( 0.000 2.109 -0.000) 2.109 9.519 ( 0.000 3.431 0.000) 3.431 9.649 ( 0.000 -2.651 0.000) 2.651 10.251 ( 0.000 10.137 0.000) 10.137 10.605 ( 0.000 1.118 -0.000) 1.118 10.641 ( 0.000 5.713 0.000) 5.713 10.708 ( -0.000 -6.107 -0.000) 6.107 10.826 ( 0.000 3.295 0.000) 3.295 11.027 ( 0.000 8.803 0.000) 8.803 11.882 ( 0.000 2.688 0.000) 2.688 12.177 ( 0.000 2.736 0.000) 2.736 12.763 ( 0.000 -9.139 0.000) 9.139 12.861 ( 0.000 -2.232 0.000) 2.232 12.879 ( -0.000 1.121 -0.000) 1.121 13.218 ( 0.000 6.440 -0.000) 6.440 13.256 ( 0.000 -8.089 0.000) 8.089 13.557 ( 0.000 2.846 0.000) 2.846 13.925 ( 0.000 -0.945 0.000) 0.945 14.536 ( 0.000 6.604 0.000) 6.604 14.988 ( 0.000 -15.960 0.000) 15.960 15.420 ( 0.000 0.121 0.000) 0.121 18.751 ( 0.000 6.158 0.000) 6.158 19.242 ( 0.000 3.147 0.000) 3.147 19.772 ( 0.000 -9.029 0.000) 9.029 20.320 ( 0.000 -4.387 0.000) 4.387 21.408 ( 0.000 1.261 0.000) 1.261 22.118 ( 0.000 11.341 0.000) 11.341 22.412 ( 0.000 -5.992 0.000) 5.992 23.643 ( 0.000 -3.163 0.000) 3.163 23.675 ( -0.000 -2.366 0.000) 2.366 23.990 ( 0.000 11.342 -0.000) 11.342 24.331 ( 0.000 -14.651 0.000) 14.651 24.798 ( 0.000 0.747 0.000) 0.747======================= Grid point 18 (11/116) =======================q-point: ( 0.00 0.29 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.055 ( 0.000 23.821 0.000) 23.821 1.147 ( 0.000 25.829 0.000) 25.829 1.608 ( 0.000 29.991 0.000) 29.991 2.137 ( 0.000 8.504 0.000) 8.504 2.247 ( 0.000 -3.503 0.000) 3.503 2.505 ( 0.000 -13.477 0.000) 13.477 2.812 ( 0.000 -6.998 0.000) 6.998 3.020 ( 0.000 -11.034 0.000) 11.034 3.169 ( 0.000 2.732 0.000) 2.732 3.170 ( 0.000 0.096 0.000) 0.096 3.237 ( 0.000 1.614 0.000) 1.614 3.541 ( 0.000 0.441 0.000) 0.441 3.700 ( 0.000 2.113 0.000) 2.113 3.927 ( 0.000 3.511 0.000) 3.511 4.028 ( 0.000 1.095 0.000) 1.095 4.130 ( 0.000 1.222 0.000) 1.222 4.480 ( 0.000 2.688 0.000) 2.688 4.621 ( 0.000 2.765 0.000) 2.765 4.621 ( 0.000 1.479 0.000) 1.479 4.689 ( 0.000 -8.900 0.000) 8.900 4.830 ( 0.000 -1.625 0.000) 1.625 5.233 ( 0.000 -2.524 0.000) 2.524 5.322 ( 0.000 6.030 0.000) 6.030 5.584 ( 0.000 5.373 0.000) 5.373 5.835 ( 0.000 -6.013 0.000) 6.013 5.946 ( 0.000 -4.024 0.000) 4.024 6.219 ( 0.000 3.761 0.000) 3.761 6.345 ( 0.000 -1.335 0.000) 1.335 6.459 ( 0.000 6.318 0.000) 6.318 6.653 ( 0.000 4.483 0.000) 4.483 6.777 ( 0.000 2.174 0.000) 2.174 6.866 ( 0.000 -3.100 0.000) 3.100 7.054 ( 0.000 -3.648 0.000) 3.648 7.325 ( 0.000 -11.720 0.000) 11.720 7.532 ( 0.000 2.931 0.000) 2.931 7.796 ( 0.000 -8.301 0.000) 8.301 8.400 ( 0.000 3.341 0.000) 3.341 8.471 ( 0.000 -0.588 0.000) 0.588 8.668 ( 0.000 -4.185 0.000) 4.185 8.926 ( 0.000 -5.501 0.000) 5.501 9.477 ( 0.000 5.246 0.000) 5.246 9.724 ( 0.000 7.623 0.000) 7.623 10.145 ( 0.000 5.674 0.000) 5.674 10.799 ( 0.000 7.346 0.000) 7.346 10.824 ( 0.000 3.429 0.000) 3.429 10.910 ( 0.000 -8.422 0.000) 8.422 11.013 ( 0.000 2.311 0.000) 2.311 11.228 ( 0.000 -6.481 0.000) 6.481 11.902 ( 0.000 5.051 0.000) 5.051 12.168 ( 0.000 5.859 0.000) 5.859 12.434 ( 0.000 -7.446 0.000) 7.446 12.724 ( 0.000 -6.488 0.000) 6.488 12.965 ( 0.000 2.129 0.000) 2.129 13.049 ( 0.000 0.970 0.000) 0.970 13.875 ( 0.000 0.761 0.000) 0.761 13.913 ( 0.000 -0.943 0.000) 0.943 14.122 ( 0.000 0.083 0.000) 0.083 14.189 ( 0.000 -1.225 0.000) 1.225 14.516 ( 0.000 4.393 0.000) 4.393 14.915 ( 0.000 -7.301 0.000) 7.301 19.310 ( 0.000 8.115 0.000) 8.115 19.733 ( 0.000 -5.732 0.000) 5.732 20.422 ( 0.000 8.100 0.000) 8.100 20.648 ( 0.000 -0.173 0.000) 0.173 21.825 ( 0.000 -0.660 0.000) 0.660 21.916 ( 0.000 0.500 0.000) 0.500 21.953 ( 0.000 -2.530 0.000) 2.530 21.975 ( 0.000 -0.267 0.000) 0.267 23.623 ( 0.000 3.686 0.000) 3.686 23.895 ( 0.000 -3.556 0.000) 3.556 24.372 ( 0.000 -0.158 0.000) 0.158 24.398 ( 0.000 -1.014 0.000) 1.014======================= Grid point 19 (12/116) =======================q-point: ( 0.12 0.29 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.146 ( 7.302 21.496 4.826) 23.210 1.325 ( 13.563 21.273 0.060) 25.229 1.805 ( 20.523 22.858 -1.543) 30.758 2.150 ( 0.130 2.845 -2.318) 3.672 2.393 ( 13.655 3.257 4.784) 14.831 2.546 ( 4.268 -13.834 -1.705) 14.577 2.872 ( 4.541 -5.601 -1.101) 7.294 2.980 ( -2.624 -6.586 -3.323) 7.830 3.108 ( -2.299 2.814 1.541) 3.947 3.170 ( -2.420 -2.223 -1.420) 3.580 3.305 ( 5.902 2.228 4.199) 7.578 3.500 ( -3.518 0.381 -2.042) 4.085 3.695 ( -0.575 -0.139 -2.178) 2.257 3.795 ( -6.274 2.118 -2.048) 6.932 4.070 ( 7.008 7.030 -0.138) 9.927 4.222 ( -5.465 0.615 0.586) 5.530 4.404 ( -7.089 -0.993 1.018) 7.230 4.492 ( 7.252 1.250 1.818) 7.580 4.615 ( -1.179 1.477 2.580) 3.198 4.777 ( -1.593 1.381 -3.089) 3.740 4.912 ( 5.744 -1.938 1.052) 6.153 5.092 ( -7.398 1.225 -2.095) 7.786 5.403 ( 3.325 2.169 3.836) 5.520 5.574 ( -0.736 1.761 7.581) 7.817 5.878 ( 1.694 0.219 -10.082) 10.226 5.931 ( 2.310 -7.756 -3.802) 8.941 6.204 ( 0.178 3.998 2.540) 4.740 6.286 ( -2.150 0.457 0.819) 2.346 6.587 ( -4.042 -1.980 2.142) 4.985 6.638 ( 6.261 0.206 4.645) 7.798 6.858 ( 4.871 1.554 -2.436) 5.664 6.937 ( 5.899 -2.385 1.751) 6.599 7.100 ( 5.137 -2.336 -1.477) 5.834 7.389 ( 5.598 -12.685 1.684) 13.967 7.567 ( 4.210 2.616 -0.955) 5.048 7.786 ( -1.471 -6.836 4.081) 8.096 8.413 ( 0.812 3.956 1.271) 4.233 8.466 ( -0.359 1.099 -3.884) 4.052 8.702 ( 3.339 -4.746 -3.427) 6.739 8.922 ( -0.326 -5.803 0.945) 5.889 9.496 ( 2.255 5.100 -1.807) 5.862 9.707 ( -1.553 8.241 0.026) 8.386 10.167 ( 2.484 4.058 -0.162) 4.761 10.696 ( -9.682 5.675 2.949) 11.604 10.801 ( 0.099 7.300 -4.375) 8.511 10.879 ( -0.656 -2.818 -3.535) 4.569 11.003 ( -1.726 -0.194 -3.718) 4.104 11.282 ( 3.119 -5.346 -1.242) 6.313 11.930 ( 0.791 3.518 9.749) 10.395 12.182 ( 1.194 5.396 1.648) 5.767 12.436 ( 0.415 -7.872 2.006) 8.134 12.705 ( -1.396 -6.274 -0.744) 6.470 13.009 ( 2.987 0.987 1.837) 3.643 13.085 ( 2.373 0.325 2.926) 3.781 13.679 ( -12.025 2.906 -3.713) 12.917 13.906 ( -6.511 -2.821 1.488) 7.250 14.114 ( -2.120 -1.125 -1.103) 2.641 14.249 ( 7.266 -4.428 -1.786) 8.694 14.538 ( 3.626 6.612 2.251) 7.870 15.052 ( 10.374 -8.961 0.419) 13.715 19.289 ( -1.841 7.659 -2.229) 8.187 19.689 ( -5.071 -3.658 -4.163) 7.512 20.132 ( -34.952 12.012 10.749) 38.490 20.377 ( -4.907 4.623 -0.407) 6.754 21.610 ( -7.004 1.961 2.705) 7.760 21.902 ( 1.661 -4.468 4.272) 6.402 22.137 ( 11.049 3.111 -3.752) 12.076 22.592 ( 36.677 -13.995 -9.347) 40.354 23.649 ( 2.546 2.865 -1.546) 4.132 23.898 ( 0.121 -4.290 1.531) 4.556 24.342 ( -1.172 1.458 -1.841) 2.625 24.481 ( 6.988 -2.646 -3.839) 8.401======================= Grid point 20 (13/116) =======================q-point: ( 0.25 0.29 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.345 ( 10.775 16.695 7.619) 21.281 1.544 ( 8.149 18.626 1.829) 20.412 2.139 ( 2.730 0.990 -1.905) 3.473 2.256 ( 17.371 11.926 -4.557) 21.558 2.633 ( 5.544 -8.451 -2.126) 10.328 2.658 ( 7.464 0.740 5.049) 9.042 2.883 ( -1.801 -5.300 1.050) 5.695 2.940 ( 2.615 -1.007 -5.744) 6.391 3.137 ( 0.282 0.002 0.917) 0.959 3.192 ( 8.465 2.524 1.191) 8.913 3.401 ( 2.087 -1.530 0.942) 2.754 3.483 ( 3.599 -0.440 1.044) 3.773 3.661 ( -0.760 -3.563 -0.783) 3.726 3.745 ( 0.151 4.317 -6.848) 8.096 4.051 ( -8.256 1.085 2.554) 8.710 4.215 ( 1.786 6.095 -1.433) 6.511 4.323 ( 3.785 0.898 0.986) 4.014 4.545 ( -1.876 2.693 0.935) 3.413 4.699 ( -3.142 4.479 -2.211) 5.901 4.777 ( 6.430 0.801 4.989) 8.178 4.939 ( 5.165 1.474 -1.998) 5.731 5.059 ( 2.045 0.226 0.562) 2.133 5.435 ( -1.488 0.555 6.484) 6.675 5.613 ( 2.398 -1.048 4.320) 5.050 5.851 ( 0.704 -0.410 -6.095) 6.149 6.006 ( 4.107 -4.694 -4.805) 7.874 6.201 ( -1.183 0.895 -3.488) 3.790 6.286 ( 0.687 3.076 4.066) 5.144 6.495 ( -4.411 -7.417 -0.656) 8.654 6.707 ( 0.051 -2.199 3.329) 3.990 6.922 ( 1.825 0.360 1.054) 2.138 7.027 ( 2.402 0.770 2.214) 3.356 7.184 ( 3.311 -0.593 -3.333) 4.736 7.493 ( 2.698 -11.447 3.673) 12.321 7.692 ( 7.971 -1.368 -2.695) 8.525 7.781 ( 0.227 -3.793 6.314) 7.369 8.417 ( -1.631 1.395 -3.321) 3.954 8.432 ( -1.150 6.852 0.225) 6.952 8.741 ( 1.347 -4.239 -3.849) 5.882 8.930 ( 0.737 -5.688 1.715) 5.986 9.551 ( 3.964 4.638 -3.399) 6.984 9.677 ( -1.289 8.534 0.945) 8.682 10.246 ( 5.618 0.389 -0.156) 5.633 10.548 ( -5.717 7.982 0.874) 9.857 10.781 ( -0.841 2.139 -7.054) 7.419 10.851 ( -2.157 0.542 0.685) 2.327 10.952 ( -1.761 3.832 0.281) 4.227 11.298 ( -0.644 -0.206 -3.590) 3.653 11.964 ( -0.201 3.645 7.630) 8.458 12.217 ( 1.589 4.988 2.355) 5.741 12.472 ( 2.413 -9.809 2.417) 10.387 12.688 ( 0.395 -5.379 -0.928) 5.473 13.061 ( 1.243 0.968 2.942) 3.337 13.110 ( -1.135 -1.402 1.381) 2.272 13.459 ( -8.483 4.795 -2.183) 9.986 13.745 ( -8.421 -1.938 0.452) 8.653 14.041 ( -4.422 -0.393 -1.517) 4.692 14.414 ( 8.962 -11.399 -2.012) 14.640 14.638 ( 4.528 6.873 2.803) 8.695 15.229 ( 7.075 -8.699 0.410) 11.221 19.201 ( -8.159 8.683 -1.776) 12.046 19.461 ( -11.596 11.169 -3.660) 16.511 19.748 ( -9.767 -3.353 6.827) 12.379 20.262 ( -6.257 -3.917 0.154) 7.383 21.531 ( -2.268 4.570 2.158) 5.539 22.007 ( 7.170 -5.108 2.324) 9.105 22.313 ( 7.314 7.765 -1.295) 10.746 23.122 ( 20.960 -14.367 -6.466) 26.221 23.692 ( 1.720 1.365 -1.813) 2.848 23.917 ( 1.473 -6.257 2.871) 7.041 24.311 ( -1.257 3.830 -4.465) 6.015 24.616 ( 7.310 -3.873 -3.345) 8.923======================= Grid point 21 (14/116) =======================q-point: ( 0.38 0.29 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.566 ( 7.355 12.401 6.668) 15.885 1.657 ( 4.827 14.354 2.845) 15.409 2.154 ( -2.992 10.886 -2.253) 11.512 2.413 ( 7.205 2.007 -6.864) 10.151 2.693 ( -0.558 -5.357 0.051) 5.386 2.766 ( 2.358 -1.252 3.455) 4.367 2.843 ( -1.749 -5.678 -1.936) 6.249 3.021 ( 3.355 -5.023 -0.796) 6.093 3.184 ( 2.985 -2.920 1.059) 4.308 3.380 ( 10.100 6.656 0.478) 12.106 3.436 ( 1.184 -4.844 0.517) 5.013 3.572 ( 2.584 2.828 3.748) 5.359 3.664 ( 1.643 -1.332 -0.972) 2.328 3.742 ( 1.510 1.399 -8.265) 8.518 3.964 ( -0.755 0.415 3.645) 3.745 4.160 ( -3.954 -1.777 -1.010) 4.451 4.459 ( 4.195 7.877 -1.316) 9.021 4.545 ( 2.393 7.951 3.721) 9.099 4.640 ( -1.498 9.201 -2.497) 9.650 4.782 ( -1.038 -1.350 -0.126) 1.707 5.099 ( 2.199 -3.721 0.015) 4.322 5.177 ( 10.971 1.056 2.261) 11.251 5.419 ( -0.442 2.856 3.172) 4.291 5.669 ( 2.240 -1.110 2.249) 3.362 5.878 ( 2.224 -1.810 0.156) 2.871 6.032 ( -0.109 -2.693 -4.100) 4.906 6.164 ( -0.761 2.375 -3.922) 4.648 6.308 ( 0.789 -0.829 4.449) 4.594 6.416 ( -3.495 -8.767 -3.793) 10.172 6.678 ( -3.685 -4.694 1.940) 6.275 6.934 ( -0.187 2.099 0.830) 2.265 7.057 ( 0.183 3.199 3.003) 4.392 7.221 ( 1.907 1.432 -3.596) 4.315 7.499 ( -2.112 -8.798 2.681) 9.437 7.806 ( 3.775 -3.774 1.778) 5.626 7.839 ( 3.226 -1.541 0.850) 3.675 8.364 ( -1.209 2.678 -4.018) 4.978 8.409 ( -2.212 5.099 1.856) 5.860 8.744 ( 0.274 -4.208 -1.957) 4.649 8.948 ( 0.477 -4.144 1.215) 4.344 9.616 ( 3.456 5.009 -4.317) 7.461 9.666 ( -0.534 7.222 2.813) 7.768 10.368 ( 6.049 -3.224 0.723) 6.892 10.479 ( -1.369 6.067 -0.372) 6.230 10.705 ( -5.031 -3.640 -3.315) 7.039 10.826 ( -0.351 5.512 0.921) 5.600 10.952 ( 1.289 8.750 -0.707) 8.872 11.250 ( -3.016 4.988 -1.591) 6.042 11.969 ( -0.625 4.798 3.309) 5.861 12.250 ( 1.104 5.032 1.417) 5.343 12.520 ( 1.486 -10.899 1.601) 11.116 12.724 ( 3.310 -4.728 -0.133) 5.773 13.013 ( -5.449 1.759 -0.648) 5.763 13.111 ( 0.783 -3.017 1.881) 3.641 13.358 ( -2.087 5.087 -0.946) 5.579 13.617 ( -4.724 -1.189 0.731) 4.926 13.955 ( -3.529 0.380 -1.225) 3.755 14.554 ( 5.525 -15.836 -1.298) 16.822 14.705 ( 1.661 8.042 1.911) 8.431 15.325 ( 2.907 -7.002 0.169) 7.584 19.010 ( -8.145 10.912 0.188) 13.618 19.354 ( -1.048 7.509 -3.310) 8.273 19.621 ( -5.577 -8.307 3.826) 10.712 20.160 ( -3.817 -10.976 -0.490) 11.631 21.518 ( -0.062 7.644 1.304) 7.754 22.158 ( 6.981 -6.881 0.600) 9.820 22.402 ( 2.116 12.164 0.262) 12.350 23.414 ( 11.640 -10.316 -3.997) 16.059 23.685 ( -2.187 0.109 -0.110) 2.193 23.973 ( 2.972 -9.368 2.849) 10.233 24.266 ( -1.916 7.530 -4.303) 8.881 24.724 ( 4.286 -3.957 -1.671) 6.067======================= Grid point 22 (15/116) =======================q-point: (-0.50 0.29 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 102Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.618 ( 0.000 13.648 0.000) 13.648 1.764 ( -0.000 7.352 0.000) 7.352 2.072 ( 0.000 15.892 0.000) 15.892 2.573 ( -0.000 0.493 0.000) 0.493 2.599 ( 0.000 -0.391 -0.000) 0.391 2.791 ( 0.000 -3.182 0.000) 3.182 2.818 ( 0.000 -5.582 0.000) 5.582 3.048 ( 0.000 -8.823 0.000) 8.823 3.215 ( 0.000 -5.185 0.000) 5.185 3.444 ( 0.000 -7.017 0.000) 7.017 3.508 ( 0.000 7.765 -0.000) 7.765 3.576 ( 0.000 6.335 0.000) 6.335 3.709 ( 0.000 -3.032 0.000) 3.032 3.736 ( 0.000 2.342 -0.000) 2.342 4.006 ( 0.000 -0.937 -0.000) 0.937 4.088 ( 0.000 -3.175 0.000) 3.175 4.484 ( 0.000 11.147 0.000) 11.147 4.590 ( -0.000 9.676 -0.000) 9.676 4.626 ( 0.000 9.482 0.000) 9.482 4.776 ( 0.000 -2.186 0.000) 2.186 5.121 ( 0.000 -4.997 0.000) 4.997 5.280 ( 0.000 -0.443 -0.000) 0.443 5.441 ( 0.000 5.296 0.000) 5.296 5.696 ( 0.000 0.181 0.000) 0.181 5.911 ( 0.000 -4.128 0.000) 4.128 6.010 ( 0.000 -1.071 -0.000) 1.071 6.156 ( 0.000 3.040 -0.000) 3.040 6.340 ( -0.000 -5.270 -0.000) 5.270 6.356 ( 0.000 -6.346 0.000) 6.346 6.625 ( 0.000 -6.622 -0.000) 6.622 6.933 ( 0.000 5.184 0.000) 5.184 7.061 ( 0.000 2.634 -0.000) 2.634 7.236 ( 0.000 2.351 0.000) 2.351 7.474 ( 0.000 -8.187 -0.000) 8.187 7.852 ( 0.000 -4.243 -0.000) 4.243 7.867 ( 0.000 0.095 0.000) 0.095 8.360 ( 0.000 -2.183 -0.000) 2.183 8.373 ( -0.000 8.407 0.000) 8.407 8.744 ( 0.000 -4.428 0.000) 4.428 8.954 ( 0.000 -3.492 -0.000) 3.492 9.646 ( -0.000 7.632 0.000) 7.632 9.666 ( 0.000 4.208 -0.000) 4.208 10.425 ( 0.000 2.933 0.000) 2.933 10.497 ( 0.000 -6.509 -0.000) 6.509 10.624 ( 0.000 0.628 0.000) 0.628 10.827 ( 0.000 3.876 0.000) 3.876 10.971 ( 0.000 11.742 -0.000) 11.742 11.208 ( 0.000 7.381 0.000) 7.381 11.967 ( 0.000 5.196 0.000) 5.196 12.264 ( 0.000 5.070 0.000) 5.070 12.536 ( 0.000 -10.659 0.000) 10.659 12.774 ( 0.000 -6.013 0.000) 6.013 12.940 ( 0.000 3.493 -0.000) 3.493 13.121 ( 0.000 -4.197 0.000) 4.197 13.342 ( 0.000 5.266 0.000) 5.266 13.571 ( 0.000 -1.205 0.000) 1.205 13.916 ( 0.000 0.755 0.000) 0.755 14.608 ( 0.000 -18.754 0.000) 18.754 14.721 ( 0.000 10.300 0.000) 10.300 15.352 ( 0.000 -6.238 0.000) 6.238 18.930 ( 0.000 10.167 0.000) 10.167 19.344 ( -0.000 6.577 0.000) 6.577 19.568 ( 0.000 -9.648 -0.000) 9.648 20.121 ( 0.000 -13.419 0.000) 13.419 21.521 ( 0.000 8.830 0.000) 8.830 22.237 ( 0.000 -10.065 -0.000) 10.065 22.415 ( 0.000 16.155 0.000) 16.155 23.548 ( 0.000 -11.048 -0.000) 11.048 23.633 ( 0.000 1.943 0.000) 1.943 24.015 ( 0.000 -12.761 0.000) 12.761 24.233 ( 0.000 11.287 0.000) 11.287 24.764 ( 0.000 -3.836 -0.000) 3.836======================= Grid point 27 (16/116) =======================q-point: ( 0.00 0.43 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.530 ( 0.000 20.477 0.000) 20.477 1.671 ( 0.000 23.352 0.000) 23.352 1.876 ( 0.000 -8.845 0.000) 8.845 2.117 ( 0.000 -17.085 0.000) 17.085 2.337 ( 0.000 9.483 0.000) 9.483 2.355 ( 0.000 10.457 0.000) 10.457 2.634 ( 0.000 -7.192 0.000) 7.192 2.756 ( 0.000 -13.250 0.000) 13.250 3.207 ( 0.000 1.427 0.000) 1.427 3.213 ( 0.000 0.918 0.000) 0.918 3.350 ( 0.000 9.401 0.000) 9.401 3.523 ( 0.000 -4.113 0.000) 4.113 3.780 ( 0.000 4.628 0.000) 4.628 3.884 ( 0.000 -5.289 0.000) 5.289 4.103 ( 0.000 3.646 0.000) 3.646 4.138 ( 0.000 -0.386 0.000) 0.386 4.417 ( 0.000 -1.258 0.000) 1.258 4.502 ( 0.000 -7.720 0.000) 7.720 4.640 ( 0.000 0.966 0.000) 0.966 4.681 ( 0.000 -2.105 0.000) 2.105 4.921 ( 0.000 10.816 0.000) 10.816 5.133 ( 0.000 -7.590 0.000) 7.590 5.498 ( 0.000 8.669 0.000) 8.669 5.666 ( 0.000 -7.972 0.000) 7.972 5.713 ( 0.000 7.109 0.000) 7.109 5.861 ( 0.000 -5.632 0.000) 5.632 6.293 ( 0.000 2.391 0.000) 2.391 6.324 ( 0.000 -0.918 0.000) 0.918 6.598 ( 0.000 6.807 0.000) 6.807 6.736 ( 0.000 -5.567 0.000) 5.567 6.742 ( 0.000 4.163 0.000) 4.163 6.817 ( 0.000 -2.283 0.000) 2.283 7.025 ( 0.000 1.643 0.000) 1.643 7.123 ( 0.000 -7.158 0.000) 7.158 7.575 ( 0.000 1.798 0.000) 1.798 7.644 ( 0.000 -5.290 0.000) 5.290 8.486 ( 0.000 1.681 0.000) 1.681 8.501 ( 0.000 3.292 0.000) 3.292 8.610 ( 0.000 1.484 0.000) 1.484 8.761 ( 0.000 -9.037 0.000) 9.037 9.613 ( 0.000 7.045 0.000) 7.045 9.746 ( 0.000 -4.411 0.000) 4.411 10.379 ( 0.000 14.579 0.000) 14.579 10.679 ( 0.000 -12.665 0.000) 12.665 10.920 ( 0.000 5.387 0.000) 5.387 10.944 ( 0.000 4.913 0.000) 4.913 11.030 ( 0.000 -0.891 0.000) 0.891 11.076 ( 0.000 -6.963 0.000) 6.963 12.035 ( 0.000 7.345 0.000) 7.345 12.196 ( 0.000 -6.443 0.000) 6.443 12.385 ( 0.000 6.293 0.000) 6.293 12.559 ( 0.000 -8.607 0.000) 8.607 13.018 ( 0.000 2.434 0.000) 2.434 13.054 ( 0.000 -0.747 0.000) 0.747 13.890 ( 0.000 0.491 0.000) 0.491 13.898 ( 0.000 -0.427 0.000) 0.427 14.128 ( 0.000 0.790 0.000) 0.790 14.157 ( 0.000 -1.698 0.000) 1.698 14.626 ( 0.000 5.855 0.000) 5.855 14.762 ( 0.000 -6.896 0.000) 6.896 19.476 ( 0.000 7.211 0.000) 7.211 19.613 ( 0.000 -5.832 0.000) 5.832 20.563 ( 0.000 4.968 0.000) 4.968 20.631 ( 0.000 -1.692 0.000) 1.692 21.829 ( 0.000 1.254 0.000) 1.254 21.877 ( 0.000 -2.977 0.000) 2.977 21.946 ( 0.000 0.946 0.000) 0.946 21.965 ( 0.000 -0.713 0.000) 0.713 23.712 ( 0.000 4.533 0.000) 4.533 23.809 ( 0.000 -4.449 0.000) 4.449 24.371 ( 0.000 0.127 0.000) 0.127 24.379 ( 0.000 -0.661 0.000) 0.661======================= Grid point 28 (17/116) =======================q-point: ( 0.12 0.43 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.578 ( 3.847 18.401 3.014) 19.039 1.742 ( 5.519 15.021 0.246) 16.005 1.955 ( 8.030 -5.126 -0.669) 9.550 2.191 ( 7.269 -16.347 -1.756) 17.976 2.374 ( 6.718 13.869 -1.306) 15.466 2.519 ( 12.031 4.925 1.899) 13.139 2.718 ( 6.822 -5.262 0.609) 8.637 2.825 ( 6.576 -8.789 0.250) 10.980 3.139 ( -3.860 1.413 -1.275) 4.304 3.159 ( -4.662 -0.010 0.454) 4.684 3.414 ( 4.266 6.327 1.893) 7.863 3.507 ( -1.986 -1.150 -2.279) 3.234 3.710 ( -5.905 2.343 -3.466) 7.237 3.792 ( -2.893 -3.258 -2.422) 4.985 4.193 ( -0.864 -0.532 -0.061) 1.016 4.197 ( 5.974 2.536 2.022) 6.798 4.345 ( -4.887 -0.280 -1.157) 5.030 4.441 ( 1.233 -5.449 0.042) 5.587 4.671 ( 2.852 4.538 5.175) 7.450 4.798 ( 4.810 -6.748 4.799) 9.576 4.918 ( 0.706 9.047 -1.077) 9.139 5.074 ( -3.862 -4.184 -0.285) 5.702 5.510 ( -0.734 5.573 1.910) 5.937 5.585 ( -3.648 -1.239 5.751) 6.922 5.820 ( 6.468 -0.956 -7.741) 10.133 5.860 ( 2.471 -2.468 -11.000) 11.541 6.275 ( -3.282 2.230 1.181) 4.141 6.305 ( -0.088 0.184 3.135) 3.142 6.564 ( -5.551 2.316 2.270) 6.429 6.645 ( -2.173 -2.584 3.864) 5.131 6.854 ( 5.243 0.896 1.262) 5.467 6.904 ( 6.753 -2.142 -0.279) 7.090 7.091 ( 5.643 1.499 -0.638) 5.873 7.175 ( 4.887 -6.909 0.866) 8.507 7.612 ( 3.500 1.778 1.267) 4.126 7.667 ( 1.717 -3.972 3.058) 5.299 8.505 ( 1.839 3.182 -5.234) 6.396 8.543 ( 3.225 5.491 1.327) 6.505 8.607 ( 0.470 -2.000 -2.641) 3.346 8.754 ( -0.581 -9.133 1.303) 9.244 9.631 ( 1.986 6.924 -0.894) 7.258 9.755 ( 0.944 -3.485 -0.535) 3.650 10.358 ( -1.855 12.964 -0.172) 13.097 10.632 ( -4.403 -11.263 0.293) 12.097 10.877 ( -3.226 5.339 -1.761) 6.481 10.951 ( -1.089 2.119 1.225) 2.679 11.017 ( 1.294 2.579 -1.943) 3.479 11.142 ( 4.995 -6.998 -0.886) 8.643 12.044 ( 0.302 6.895 3.893) 7.924 12.202 ( 0.463 -6.692 1.063) 6.791 12.382 ( -0.303 6.062 2.019) 6.397 12.548 ( -0.791 -8.172 0.283) 8.215 13.049 ( 2.398 2.193 0.651) 3.314 13.083 ( 2.057 -0.835 1.703) 2.798 13.749 ( -9.696 3.693 -2.613) 10.700 13.832 ( -7.628 -3.950 -0.522) 8.606 14.116 ( -1.320 1.430 -0.971) 2.175 14.168 ( 1.166 -3.222 -1.136) 3.610 14.695 ( 6.176 7.796 1.146) 10.011 14.867 ( 8.613 -8.439 0.364) 12.064 19.448 ( -2.484 7.034 -2.060) 7.738 19.583 ( -2.708 -5.718 -2.068) 6.656 20.327 ( -25.347 6.566 4.816) 26.623 20.413 ( -14.535 -1.318 1.368) 14.659 21.679 ( -4.449 4.540 4.214) 7.627 21.792 ( -0.747 -5.661 4.688) 7.388 22.228 ( 18.163 5.483 -6.388) 20.019 22.370 ( 26.928 -8.060 -7.850) 29.184 23.722 ( 0.894 3.876 0.039) 3.978 23.808 ( -0.251 -4.145 0.907) 4.250 24.379 ( 1.363 2.009 -0.533) 2.486 24.427 ( 4.278 -2.461 -1.034) 5.042======================= Grid point 29 (18/116) =======================q-point: ( 0.25 0.43 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.683 ( 5.450 13.807 5.348) 15.778 1.827 ( 2.632 4.205 2.357) 5.492 2.154 ( 12.013 3.693 -2.723) 12.859 2.358 ( 10.025 -12.567 -3.832) 16.527 2.534 ( 6.586 11.420 -1.777) 13.302 2.708 ( 4.700 -3.342 0.952) 5.845 2.817 ( 0.421 2.675 1.958) 3.342 2.907 ( 1.553 -2.911 -2.537) 4.162 3.109 ( 1.454 0.630 2.396) 2.872 3.179 ( 6.431 -4.750 4.248) 9.054 3.458 ( 0.135 3.190 -3.517) 4.750 3.485 ( 3.269 0.246 -0.015) 3.279 3.640 ( 0.818 4.180 -1.643) 4.565 3.771 ( 0.170 -3.785 -4.295) 5.727 4.072 ( -6.852 3.004 0.968) 7.544 4.184 ( -6.312 -6.191 -1.070) 8.906 4.420 ( 10.603 6.689 0.159) 12.537 4.531 ( 4.788 -3.217 1.188) 5.889 4.763 ( 3.854 3.154 1.673) 5.254 4.831 ( -0.873 -0.872 1.576) 2.002 4.973 ( 5.015 3.812 2.353) 6.724 5.055 ( 1.620 -1.734 4.004) 4.654 5.487 ( -1.039 3.759 1.933) 4.353 5.567 ( 0.338 -3.258 1.973) 3.824 5.862 ( 1.732 1.854 -5.789) 6.321 5.922 ( 4.012 -3.308 -6.502) 8.326 6.221 ( -1.420 2.063 -4.109) 4.812 6.303 ( -1.036 -4.804 -2.270) 5.414 6.456 ( -5.502 6.657 5.067) 10.013 6.617 ( -3.362 -6.835 5.470) 9.378 6.943 ( 3.456 2.809 1.651) 4.750 7.016 ( 4.464 -2.821 0.944) 5.365 7.190 ( 4.043 1.992 -0.720) 4.564 7.283 ( 4.571 -7.182 1.580) 8.659 7.703 ( 4.706 0.948 1.147) 4.935 7.725 ( 3.247 -1.526 4.861) 6.041 8.486 ( -2.184 4.933 -5.258) 7.533 8.568 ( -1.872 3.376 -0.843) 3.951 8.639 ( 3.538 -1.855 -2.594) 4.763 8.771 ( 2.028 -8.340 2.150) 8.848 9.681 ( 3.314 6.471 -1.510) 7.425 9.775 ( 1.176 -0.862 -0.585) 1.571 10.327 ( -0.795 8.171 0.069) 8.210 10.534 ( -5.238 -8.967 -0.007) 10.385 10.806 ( -3.175 5.544 -1.795) 6.637 10.903 ( -3.354 -1.888 1.213) 4.035 11.078 ( 4.669 8.173 -1.541) 9.538 11.233 ( 4.394 -5.675 -2.196) 7.506 12.067 ( 0.619 6.251 4.919) 7.978 12.222 ( 1.118 -7.352 2.223) 7.761 12.396 ( 1.214 5.720 2.055) 6.198 12.549 ( 1.088 -7.414 0.305) 7.499 13.086 ( 0.701 1.352 0.908) 1.773 13.105 ( -1.014 -0.258 1.118) 1.531 13.565 ( -7.625 5.149 -1.310) 9.293 13.672 ( -7.517 -4.609 -0.239) 8.821 14.070 ( -2.670 3.465 -1.903) 4.771 14.194 ( 1.932 -8.233 -2.186) 8.735 14.826 ( 6.104 9.587 1.257) 11.434 15.032 ( 7.419 -9.679 0.385) 12.201 19.365 ( -5.614 7.109 -2.202) 9.322 19.500 ( -4.714 -5.077 -3.157) 7.613 19.869 ( -20.331 11.736 4.461) 23.896 20.109 ( -15.227 -9.911 1.543) 18.234 21.672 ( 1.503 8.178 3.064) 8.862 21.854 ( 4.738 -8.492 3.222) 10.244 22.531 ( 14.002 12.234 -4.724) 19.184 22.815 ( 20.217 -14.231 -6.520) 25.569 23.736 ( 0.191 2.742 0.025) 2.749 23.807 ( 0.004 -4.039 1.370) 4.265 24.413 ( 2.119 5.203 -1.237) 5.753 24.522 ( 5.316 -4.927 -0.861) 7.299======================= Grid point 30 (19/116) =======================q-point: ( 0.38 0.43 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.801 ( 4.513 8.584 4.906) 10.868 1.867 ( 1.114 3.602 2.356) 4.446 2.371 ( 9.328 8.401 -1.358) 12.627 2.521 ( 4.597 1.745 -6.580) 8.214 2.549 ( 2.438 -0.195 -3.194) 4.023 2.720 ( -1.560 -6.830 -3.088) 7.656 2.806 ( -2.299 3.510 5.286) 6.749 2.904 ( -2.278 -5.394 2.295) 6.289 3.148 ( 0.536 1.070 2.274) 2.570 3.253 ( 0.556 -8.124 1.454) 8.271 3.551 ( 7.658 4.682 0.001) 8.976 3.598 ( 6.893 -0.810 1.578) 7.117 3.674 ( 1.524 3.770 -0.624) 4.114 3.754 ( -0.258 -1.761 -5.724) 5.994 3.987 ( -1.871 2.493 0.826) 3.224 4.076 ( -4.207 -5.109 -1.985) 6.909 4.602 ( 6.712 4.808 0.979) 8.315 4.640 ( 6.165 1.334 3.005) 6.987 4.792 ( 0.091 3.667 -2.787) 4.607 4.812 ( -1.136 1.862 -0.610) 2.265 5.066 ( 2.354 2.327 2.868) 4.380 5.157 ( 5.827 -3.583 3.669) 7.763 5.507 ( 2.892 5.165 1.152) 6.031 5.613 ( 3.517 -4.184 1.260) 5.609 5.868 ( -0.014 1.624 -1.011) 1.913 5.946 ( 0.094 -4.826 -2.930) 5.647 6.200 ( 0.483 1.604 -5.087) 5.356 6.264 ( -0.886 -4.941 -5.339) 7.328 6.377 ( -4.439 6.361 4.306) 8.871 6.535 ( -5.889 -7.842 3.149) 10.301 7.006 ( 2.644 4.099 1.840) 5.213 7.080 ( 1.480 -1.723 2.072) 3.074 7.241 ( 1.939 1.932 -1.546) 3.144 7.330 ( -0.052 -6.324 1.444) 6.487 7.784 ( 3.316 0.865 1.629) 3.795 7.812 ( 3.551 -1.382 3.093) 4.908 8.415 ( -3.090 4.230 -3.457) 6.276 8.502 ( -3.258 -1.106 -2.631) 4.331 8.691 ( 1.760 2.508 0.131) 3.066 8.818 ( 1.744 -7.178 1.077) 7.465 9.740 ( 2.964 5.568 -1.425) 6.466 9.790 ( 0.273 2.156 0.119) 2.176 10.335 ( 1.462 1.754 0.398) 2.317 10.443 ( -3.904 -6.657 -0.471) 7.732 10.752 ( -1.986 5.841 -0.554) 6.195 10.850 ( -2.022 -2.501 0.192) 3.222 11.165 ( 4.111 9.123 -1.019) 10.058 11.288 ( 1.682 -1.980 -1.354) 2.930 12.089 ( 0.426 6.628 2.861) 7.232 12.251 ( 1.018 -7.799 1.908) 8.093 12.434 ( 1.815 5.803 1.187) 6.195 12.589 ( 2.459 -7.479 0.475) 7.887 13.053 ( -3.483 1.701 -0.642) 3.929 13.078 ( -1.250 -0.821 0.286) 1.522 13.464 ( -2.728 4.955 0.203) 5.660 13.561 ( -3.969 -3.863 0.741) 5.588 14.016 ( -2.005 6.064 -1.657) 6.598 14.224 ( 1.490 -13.300 -1.576) 13.476 14.920 ( 3.155 10.661 0.730) 11.142 15.141 ( 3.677 -9.886 0.222) 10.550 19.230 ( -6.689 9.456 -0.565) 11.597 19.408 ( -3.376 -6.834 -2.825) 8.129 19.604 ( -8.574 10.814 2.902) 14.102 19.883 ( -7.817 -14.049 0.274) 16.080 21.721 ( 2.149 10.800 1.686) 11.140 21.955 ( 4.129 -10.876 1.669) 11.753 22.727 ( 7.082 17.175 -2.381) 18.730 23.103 ( 10.940 -17.532 -3.814) 21.014 23.724 ( -1.282 3.378 0.422) 3.637 23.817 ( 0.478 -5.389 0.772) 5.465 24.446 ( 1.447 8.433 -0.936) 8.608 24.609 ( 3.476 -6.756 -0.459) 7.611======================= Grid point 31 (20/116) =======================q-point: (-0.50 0.43 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 102Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.852 ( 0.000 7.004 0.000) 7.004 1.889 ( 0.000 3.170 0.000) 3.170 2.419 ( 0.000 15.184 0.000) 15.184 2.594 ( 0.000 -0.610 0.000) 0.610 2.607 ( 0.000 1.801 0.000) 1.801 2.693 ( 0.000 -7.239 0.000) 7.239 2.761 ( 0.000 1.313 -0.000) 1.313 2.864 ( 0.000 -7.670 0.000) 7.670 3.156 ( 0.000 0.526 0.000) 0.526 3.259 ( 0.000 -8.489 0.000) 8.489 3.642 ( 0.000 3.978 -0.000) 3.978 3.667 ( 0.000 0.653 0.000) 0.653 3.694 ( 0.000 2.650 0.000) 2.650 3.740 ( 0.000 -1.726 0.000) 1.726 3.989 ( 0.000 -0.179 -0.000) 0.179 4.017 ( 0.000 -2.800 0.000) 2.800 4.678 ( 0.000 6.165 0.000) 6.165 4.727 ( -0.000 1.439 -0.000) 1.439 4.775 ( 0.000 3.986 -0.000) 3.986 4.792 ( -0.000 2.332 0.000) 2.332 5.094 ( 0.000 3.540 0.000) 3.540 5.218 ( 0.000 -5.561 0.000) 5.561 5.558 ( 0.000 5.652 -0.000) 5.652 5.663 ( 0.000 -3.485 0.000) 3.485 5.865 ( 0.000 0.519 0.000) 0.519 5.935 ( 0.000 -5.095 -0.000) 5.095 6.199 ( 0.000 1.419 -0.000) 1.419 6.250 ( 0.000 -3.439 0.000) 3.439 6.330 ( 0.000 4.231 -0.000) 4.231 6.464 ( 0.000 -7.648 -0.000) 7.648 7.043 ( 0.000 4.303 0.000) 4.303 7.090 ( 0.000 -0.074 0.000) 0.074 7.262 ( 0.000 0.743 0.000) 0.743 7.320 ( 0.000 -5.396 0.000) 5.396 7.823 ( 0.000 0.844 -0.000) 0.844 7.855 ( 0.000 -1.396 0.000) 1.396 8.375 ( 0.000 3.551 0.000) 3.551 8.461 ( 0.000 -1.904 0.000) 1.904 8.707 ( 0.000 3.435 0.000) 3.435 8.837 ( 0.000 -6.833 -0.000) 6.833 9.776 ( 0.000 4.415 0.000) 4.415 9.786 ( 0.000 3.998 -0.000) 3.998 10.377 ( 0.000 -3.584 0.000) 3.584 10.380 ( -0.000 -3.286 0.000) 3.286 10.731 ( 0.000 6.236 0.000) 6.236 10.831 ( 0.000 -2.676 0.000) 2.676 11.208 ( 0.000 8.601 0.000) 8.601 11.298 ( 0.000 0.343 0.000) 0.343 12.098 ( 0.000 7.102 0.000) 7.102 12.265 ( 0.000 -7.757 0.000) 7.757 12.457 ( 0.000 6.038 0.000) 6.038 12.620 ( 0.000 -8.053 0.000) 8.053 13.010 ( 0.000 2.943 0.000) 2.943 13.062 ( 0.000 -2.120 0.000) 2.120 13.443 ( 0.000 4.259 0.000) 4.259 13.522 ( 0.000 -3.129 0.000) 3.129 13.993 ( 0.000 7.297 0.000) 7.297 14.237 ( 0.000 -15.270 0.000) 15.270 14.952 ( 0.000 11.043 0.000) 11.043 15.176 ( 0.000 -9.831 0.000) 9.831 19.157 ( 0.000 10.593 0.000) 10.593 19.368 ( 0.000 -9.415 0.000) 9.415 19.529 ( 0.000 11.061 -0.000) 11.061 19.809 ( 0.000 -14.806 0.000) 14.806 21.746 ( 0.000 11.738 0.000) 11.738 22.001 ( 0.000 -11.902 0.000) 11.902 22.792 ( 0.000 19.081 0.000) 19.081 23.207 ( 0.000 -19.316 0.000) 19.316 23.708 ( 0.000 4.690 0.000) 4.690 23.823 ( 0.000 -6.394 0.000) 6.394 24.459 ( 0.000 9.820 0.000) 9.820 24.643 ( 0.000 -7.389 -0.000) 7.389======================= Grid point 63 (21/116) =======================q-point: ( 0.00 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.425 ( -7.985 0.000 20.066) 21.597 0.540 ( -0.992 0.000 25.650) 25.669 0.982 ( -1.465 0.000 46.270) 46.294 1.891 ( 4.765 0.000 -4.782) 6.751 2.375 ( -1.367 0.000 7.565) 7.688 2.797 ( -2.497 0.000 -0.356) 2.522 2.870 ( -0.785 0.000 -2.338) 2.466 3.095 ( -3.704 0.000 1.659) 4.059 3.148 ( 3.456 0.000 -5.719) 6.682 3.190 ( -0.978 0.000 -1.623) 1.895 3.358 ( -5.265 0.000 2.370) 5.774 3.562 ( 4.727 0.000 2.276) 5.246 3.701 ( -9.550 0.000 6.555) 11.583 3.747 ( 1.157 0.000 -1.937) 2.256 3.941 ( 4.225 0.000 -3.335) 5.383 4.138 ( -10.762 0.000 -0.739) 10.787 4.216 ( 25.233 0.000 1.356) 25.269 4.360 ( -0.579 0.000 -1.183) 1.317 4.474 ( 14.487 0.000 -3.464) 14.895 4.715 ( -14.394 0.000 6.678) 15.868 4.848 ( -2.135 0.000 -5.457) 5.859 5.187 ( -5.950 0.000 -5.537) 8.128 5.367 ( 10.435 0.000 -5.197) 11.658 5.451 ( 9.881 0.000 5.069) 11.106 5.922 ( -3.633 0.000 4.373) 5.685 6.044 ( 1.657 0.000 -0.168) 1.666 6.205 ( -0.770 0.000 -4.365) 4.433 6.275 ( -0.251 0.000 -4.734) 4.740 6.415 ( 1.099 0.000 -0.443) 1.185 6.510 ( -4.325 0.000 4.040) 5.918 6.591 ( 2.686 0.000 -1.255) 2.965 6.914 ( 5.171 0.000 -1.901) 5.509 7.255 ( -1.297 0.000 1.112) 1.708 7.571 ( -20.436 0.000 -1.311) 20.478 7.669 ( 0.065 0.000 5.070) 5.070 8.048 ( 0.416 0.000 2.092) 2.133 8.279 ( -1.511 0.000 -0.299) 1.541 8.359 ( 1.262 0.000 -1.904) 2.284 8.630 ( -0.855 0.000 -2.594) 2.731 8.724 ( 0.795 0.000 -4.889) 4.953 9.503 ( 0.559 0.000 -1.376) 1.485 9.585 ( -14.507 0.000 2.746) 14.764 9.887 ( -0.116 0.000 -4.319) 4.321 10.136 ( -0.743 0.000 -2.690) 2.791 10.593 ( 0.291 0.000 1.540) 1.567 10.754 ( 1.227 0.000 -1.219) 1.729 11.150 ( -5.188 0.000 1.005) 5.284 11.352 ( 0.936 0.000 -0.629) 1.128 12.098 ( -0.992 0.000 6.106) 6.186 12.627 ( -1.040 0.000 -0.450) 1.133 12.829 ( -10.685 0.000 -0.842) 10.718 12.860 ( 0.963 0.000 1.019) 1.402 13.088 ( -1.394 0.000 6.189) 6.344 13.791 ( -10.836 0.000 -5.595) 12.196 13.988 ( 11.802 0.000 3.355) 12.269 14.073 ( -26.709 0.000 0.053) 26.709 14.202 ( 0.387 0.000 -0.681) 0.783 14.311 ( 11.863 0.000 -1.058) 11.910 14.432 ( -13.912 0.000 0.649) 13.927 14.609 ( 92.236 0.000 -0.334) 92.237 18.897 ( 1.249 0.000 2.079) 2.425 19.088 ( -2.143 0.000 -0.007) 2.143 20.021 ( -4.213 0.000 3.003) 5.174 20.696 ( 46.824 0.000 -3.608) 46.962 21.651 ( -2.330 0.000 0.913) 2.502 21.898 ( -19.213 0.000 -4.286) 19.685 21.968 ( 6.153 0.000 -0.820) 6.207 22.045 ( -35.611 0.000 0.829) 35.621 23.794 ( -0.520 0.000 0.708) 0.878 23.947 ( -0.336 0.000 -2.427) 2.451 24.264 ( -45.936 0.000 2.375) 45.997 24.375 ( 1.483 0.000 -0.178) 1.494======================= Grid point 64 (22/116) =======================q-point: ( 0.12 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.768 ( 14.694 0.000 19.302) 24.258 0.998 ( 28.723 0.000 17.545) 33.658 1.280 ( 25.870 0.000 28.587) 38.555 2.126 ( 18.134 0.000 -0.345) 18.137 2.359 ( -2.007 0.000 7.862) 8.114 2.842 ( 6.755 0.000 -2.404) 7.170 2.886 ( 2.214 0.000 -4.286) 4.824 2.942 ( -11.762 0.000 -0.170) 11.763 3.187 ( 0.812 0.000 -3.092) 3.197 3.232 ( -1.895 0.000 -3.543) 4.018 3.260 ( 4.590 0.000 0.747) 4.650 3.496 ( -5.034 0.000 2.736) 5.730 3.644 ( -2.192 0.000 1.878) 2.886 3.762 ( 1.682 0.000 -1.408) 2.194 3.920 ( -4.818 0.000 2.477) 5.418 4.019 ( 0.927 0.000 -0.889) 1.284 4.408 ( -2.725 0.000 2.949) 4.016 4.424 ( 8.941 0.000 -2.038) 9.171 4.483 ( -10.609 0.000 5.533) 11.966 4.741 ( 12.241 0.000 -3.223) 12.658 4.760 ( -3.761 0.000 -4.206) 5.642 5.067 ( -4.940 0.000 -3.304) 5.943 5.528 ( 7.003 0.000 -3.403) 7.786 5.623 ( 6.458 0.000 3.349) 7.275 5.849 ( -5.768 0.000 3.444) 6.718 6.095 ( 0.644 0.000 1.803) 1.914 6.217 ( -1.114 0.000 -3.389) 3.568 6.255 ( 2.613 0.000 -3.022) 3.995 6.417 ( 1.731 0.000 -2.672) 3.184 6.679 ( 5.232 0.000 -1.027) 5.332 7.048 ( 6.657 0.000 -0.074) 6.657 7.061 ( 28.386 0.000 -32.235) 42.952 7.173 ( -6.148 0.000 1.089) 6.244 7.359 ( 1.364 0.000 -1.013) 1.699 7.755 ( 6.129 0.000 5.500) 8.235 8.063 ( -0.833 0.000 3.197) 3.304 8.232 ( -2.903 0.000 -0.950) 3.055 8.387 ( 2.117 0.000 -0.897) 2.300 8.589 ( -1.028 0.000 -3.022) 3.192 8.823 ( 9.080 0.000 -7.432) 11.734 9.427 ( -3.583 0.000 6.564) 7.478 9.552 ( 2.979 0.000 -0.140) 2.982 9.918 ( 4.537 0.000 -4.782) 6.592 10.120 ( 0.262 0.000 -3.400) 3.410 10.604 ( 0.386 0.000 1.732) 1.775 10.770 ( 0.685 0.000 -1.244) 1.420 11.059 ( -4.797 0.000 0.399) 4.813 11.331 ( -3.160 0.000 -0.061) 3.160 12.068 ( -3.429 0.000 6.002) 6.913 12.572 ( -15.790 0.000 16.347) 22.728 12.624 ( 1.168 0.000 -0.945) 1.503 12.878 ( 0.509 0.000 1.547) 1.629 13.080 ( -1.187 0.000 6.528) 6.635 13.522 ( -14.184 0.000 -4.435) 14.861 13.545 ( -13.531 0.000 10.754) 17.284 13.990 ( -15.362 0.000 1.284) 15.415 14.163 ( -4.110 0.000 -0.442) 4.133 14.262 ( 6.228 0.000 1.867) 6.502 14.661 ( 16.941 0.000 -3.081) 17.219 15.551 ( 9.849 0.000 -12.979) 16.293 18.887 ( -2.980 0.000 3.560) 4.643 19.066 ( 0.189 0.000 -1.905) 1.914 20.017 ( 3.279 0.000 -0.583) 3.330 20.499 ( -24.422 0.000 19.887) 31.495 21.571 ( -4.772 0.000 -0.318) 4.783 21.954 ( 1.419 0.000 -6.978) 7.120 22.155 ( 10.902 0.000 4.352) 11.738 22.731 ( 65.849 0.000 -56.519) 86.779 23.744 ( -11.008 0.000 12.733) 16.832 23.787 ( -0.351 0.000 0.108) 0.367 24.041 ( 5.819 0.000 -0.414) 5.834 24.421 ( 2.862 0.000 1.017) 3.037======================= Grid point 65 (23/116) =======================q-point: ( 0.25 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.116 ( 14.200 0.000 13.726) 19.750 1.393 ( 11.696 0.000 31.000) 33.133 1.937 ( 19.196 0.000 4.402) 19.694 2.412 ( 12.360 0.000 5.576) 13.559 2.467 ( 10.965 0.000 7.013) 13.015 2.726 ( -4.623 0.000 -4.347) 6.346 2.898 ( 0.930 0.000 -4.391) 4.489 2.976 ( 4.529 0.000 -1.607) 4.805 3.168 ( -0.223 0.000 -7.885) 7.888 3.201 ( 1.561 0.000 -2.613) 3.044 3.404 ( 6.618 0.000 0.746) 6.660 3.522 ( 6.706 0.000 1.894) 6.968 3.569 ( -4.765 0.000 1.283) 4.935 3.779 ( -0.983 0.000 1.154) 1.516 3.929 ( 4.921 0.000 -2.348) 5.453 4.018 ( 1.213 0.000 0.083) 1.216 4.295 ( -6.051 0.000 3.843) 7.168 4.383 ( -3.263 0.000 4.873) 5.865 4.491 ( -4.804 0.000 -2.029) 5.215 4.827 ( 11.957 0.000 -1.451) 12.045 4.935 ( 8.991 0.000 -2.384) 9.302 4.983 ( -2.215 0.000 -2.609) 3.422 5.638 ( 1.106 0.000 6.995) 7.082 5.726 ( 3.129 0.000 2.911) 4.274 5.758 ( -0.596 0.000 -5.439) 5.472 6.059 ( -2.519 0.000 -0.496) 2.567 6.148 ( -4.424 0.000 -2.702) 5.184 6.371 ( 7.152 0.000 1.647) 7.339 6.481 ( 5.027 0.000 -6.642) 8.330 6.727 ( -0.696 0.000 -2.936) 3.018 7.041 ( -5.613 0.000 -0.271) 5.620 7.074 ( -6.250 0.000 -5.425) 8.276 7.146 ( 1.852 0.000 1.140) 2.174 7.553 ( 10.215 0.000 -18.624) 21.242 7.902 ( 6.657 0.000 5.637) 8.723 8.021 ( -4.229 0.000 4.374) 6.084 8.169 ( -2.893 0.000 -1.243) 3.149 8.435 ( 2.660 0.000 0.037) 2.660 8.609 ( 3.975 0.000 -2.377) 4.632 8.949 ( 4.846 0.000 -5.212) 7.117 9.413 ( 0.064 0.000 2.835) 2.836 9.626 ( 4.171 0.000 0.648) 4.221 10.017 ( 5.821 0.000 -3.519) 6.802 10.146 ( 4.612 0.000 -5.173) 6.931 10.617 ( 0.466 0.000 1.902) 1.958 10.771 ( -0.104 0.000 -2.358) 2.360 10.961 ( -5.066 0.000 -0.266) 5.073 11.226 ( -7.740 0.000 0.151) 7.741 12.012 ( -4.019 0.000 6.546) 7.682 12.377 ( -9.205 0.000 16.680) 19.052 12.671 ( 3.925 0.000 -0.716) 3.990 12.887 ( -0.027 0.000 1.326) 1.326 13.092 ( 0.682 0.000 5.058) 5.104 13.242 ( -13.016 0.000 -3.182) 13.399 13.458 ( -1.491 0.000 5.431) 5.632 13.706 ( -12.308 0.000 0.264) 12.311 14.063 ( -5.467 0.000 -0.777) 5.522 14.382 ( 4.569 0.000 0.103) 4.570 14.942 ( 12.451 0.000 -2.608) 12.721 15.523 ( -4.956 0.000 -2.286) 5.458 18.820 ( -4.508 0.000 4.084) 6.083 19.082 ( 2.157 0.000 -3.247) 3.898 20.122 ( 7.255 0.000 -2.351) 7.626 20.230 ( -11.659 0.000 13.106) 17.541 21.485 ( -3.809 0.000 -0.561) 3.850 21.945 ( -0.059 0.000 -6.441) 6.441 22.376 ( 9.334 0.000 7.471) 11.955 23.394 ( 22.051 0.000 -36.231) 42.414 23.687 ( -0.186 0.000 9.409) 9.411 23.780 ( -0.338 0.000 -0.605) 0.693 24.232 ( 14.153 0.000 -9.890) 17.266 24.480 ( 2.599 0.000 1.272) 2.893======================= Grid point 66 (24/116) =======================q-point: ( 0.38 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.326 ( 2.640 0.000 10.782) 11.101 1.684 ( 9.380 0.000 25.866) 27.514 1.939 ( -10.966 0.000 7.861) 13.493 2.505 ( 0.787 0.000 2.148) 2.288 2.748 ( 9.647 0.000 -11.467) 14.985 2.819 ( -1.805 0.000 4.828) 5.155 2.935 ( 3.550 0.000 -8.179) 8.916 3.010 ( 13.663 0.000 3.763) 14.172 3.236 ( 6.980 0.000 -3.920) 8.006 3.248 ( 3.433 0.000 -2.772) 4.412 3.485 ( -3.933 0.000 3.104) 5.010 3.492 ( 1.582 0.000 3.498) 3.839 3.715 ( 10.069 0.000 1.198) 10.141 3.743 ( -2.537 0.000 0.886) 2.687 4.021 ( 3.365 0.000 0.453) 3.396 4.070 ( 3.321 0.000 0.174) 3.326 4.246 ( -0.241 0.000 -0.607) 0.653 4.359 ( -0.651 0.000 5.085) 5.126 4.360 ( -6.805 0.000 1.067) 6.888 4.907 ( -0.745 0.000 -1.790) 1.939 5.089 ( 7.670 0.000 -2.378) 8.030 5.103 ( 10.976 0.000 -4.300) 11.789 5.550 ( -8.505 0.000 5.531) 10.145 5.729 ( -4.153 0.000 1.795) 4.524 5.857 ( 8.433 0.000 -2.238) 8.725 6.048 ( 1.890 0.000 -0.535) 1.964 6.062 ( -3.099 0.000 -2.232) 3.819 6.494 ( 4.550 0.000 1.105) 4.683 6.517 ( 0.810 0.000 -11.146) 11.175 6.647 ( -5.275 0.000 -3.674) 6.428 6.928 ( -5.396 0.000 -1.659) 5.645 6.957 ( -3.737 0.000 -0.835) 3.829 7.168 ( 0.295 0.000 1.580) 1.608 7.617 ( 2.250 0.000 -11.559) 11.776 7.962 ( -2.193 0.000 5.297) 5.733 8.019 ( 3.206 0.000 5.173) 6.086 8.124 ( -1.130 0.000 -1.203) 1.651 8.476 ( 1.385 0.000 -0.188) 1.398 8.704 ( 5.450 0.000 -2.083) 5.834 8.979 ( -0.364 0.000 -1.140) 1.196 9.432 ( 1.155 0.000 0.441) 1.236 9.703 ( 3.162 0.000 2.316) 3.919 10.083 ( 1.947 0.000 -1.369) 2.380 10.283 ( 10.036 0.000 -7.366) 12.449 10.641 ( 1.629 0.000 1.897) 2.501 10.753 ( -0.616 0.000 -4.450) 4.493 10.879 ( -3.013 0.000 1.187) 3.239 11.041 ( -10.851 0.000 0.418) 10.859 11.959 ( -3.314 0.000 6.803) 7.567 12.293 ( -4.330 0.000 11.828) 12.595 12.761 ( 4.886 0.000 -0.103) 4.887 12.886 ( -0.093 0.000 0.407) 0.418 13.020 ( -8.635 0.000 -2.326) 8.943 13.128 ( 1.277 0.000 3.929) 4.131 13.452 ( -1.139 0.000 3.285) 3.476 13.533 ( -5.635 0.000 0.848) 5.699 13.968 ( -3.591 0.000 -0.611) 3.643 14.434 ( 1.237 0.000 -1.726) 2.124 15.122 ( 6.765 0.000 -1.873) 7.019 15.418 ( -4.758 0.000 -1.771) 5.077 18.752 ( -3.439 0.000 3.630) 5.001 19.126 ( 3.248 0.000 -3.672) 4.902 20.069 ( -8.644 0.000 8.965) 12.454 20.257 ( 6.658 0.000 -1.715) 6.875 21.425 ( -2.025 0.000 -0.863) 2.201 21.921 ( -0.227 0.000 -6.880) 6.883 22.529 ( 3.409 0.000 8.012) 8.707 23.578 ( 7.496 0.000 -15.630) 17.334 23.739 ( 2.428 0.000 6.591) 7.024 23.773 ( 0.002 0.000 -0.976) 0.976 24.475 ( 13.506 0.000 -11.979) 18.053 24.518 ( 0.869 0.000 0.451) 0.979======================= Grid point 67 (25/116) =======================q-point: (-0.50 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.307 ( -5.609 0.000 7.546) 9.402 1.665 ( -16.578 0.000 11.120) 19.962 1.930 ( 6.808 0.000 17.780) 19.039 2.556 ( -4.735 0.000 -4.995) 6.883 2.659 ( -0.653 0.000 2.963) 3.034 2.818 ( 4.242 0.000 -8.740) 9.715 3.134 ( 11.659 0.000 1.578) 11.766 3.211 ( 3.261 0.000 -1.860) 3.754 3.301 ( 1.401 0.000 0.195) 1.414 3.356 ( 5.548 0.000 0.664) 5.587 3.420 ( -4.115 0.000 4.296) 5.949 3.457 ( -6.600 0.000 3.295) 7.377 3.701 ( -1.347 0.000 -0.373) 1.397 3.836 ( 0.344 0.000 1.774) 1.807 4.049 ( -0.979 0.000 2.650) 2.825 4.153 ( 5.701 0.000 0.471) 5.720 4.243 ( -5.823 0.000 1.916) 6.130 4.247 ( 0.018 0.000 -1.269) 1.269 4.363 ( -1.067 0.000 3.626) 3.780 4.900 ( 0.405 0.000 -1.940) 1.981 5.215 ( 5.984 0.000 -4.087) 7.246 5.217 ( 0.806 0.000 -5.609) 5.666 5.395 ( -8.536 0.000 4.703) 9.746 5.620 ( -5.077 0.000 -1.635) 5.334 5.971 ( -0.718 0.000 -1.958) 2.085 6.049 ( 5.391 0.000 1.044) 5.491 6.081 ( 0.341 0.000 0.275) 0.438 6.493 ( -5.781 0.000 -4.501) 7.327 6.520 ( 5.487 0.000 -10.225) 11.604 6.583 ( 1.644 0.000 -2.462) 2.961 6.874 ( 1.445 0.000 -1.341) 1.971 6.904 ( -3.211 0.000 0.284) 3.224 7.168 ( -0.917 0.000 1.764) 1.988 7.620 ( 2.067 0.000 -7.751) 8.022 7.990 ( 3.321 0.000 6.220) 7.051 8.046 ( -1.654 0.000 3.949) 4.282 8.121 ( 0.853 0.000 -0.478) 0.978 8.484 ( -0.410 0.000 -0.816) 0.913 8.766 ( 0.607 0.000 -1.671) 1.777 8.945 ( -2.566 0.000 -0.536) 2.621 9.456 ( 1.333 0.000 -0.730) 1.520 9.763 ( 2.340 0.000 4.457) 5.034 10.098 ( 0.144 0.000 -1.329) 1.337 10.434 ( 6.733 0.000 -5.620) 8.771 10.645 ( -5.523 0.000 -1.203) 5.652 10.733 ( 0.017 0.000 -4.185) 4.185 10.865 ( 1.369 0.000 1.493) 2.026 10.892 ( -0.064 0.000 1.937) 1.938 11.922 ( -2.572 0.000 6.587) 7.071 12.262 ( -2.336 0.000 9.563) 9.845 12.817 ( 0.641 0.000 -1.296) 1.446 12.871 ( -4.003 0.000 -0.615) 4.050 12.948 ( 4.485 0.000 0.487) 4.512 13.147 ( -0.582 0.000 2.789) 2.849 13.417 ( -3.406 0.000 1.495) 3.720 13.487 ( 0.261 0.000 1.758) 1.777 13.940 ( 1.046 0.000 0.301) 1.089 14.428 ( -1.008 0.000 -3.309) 3.459 15.196 ( 1.331 0.000 -0.830) 1.568 15.337 ( -2.832 0.000 -3.628) 4.602 18.714 ( -1.372 0.000 2.760) 3.082 19.178 ( 2.858 0.000 -2.728) 3.951 19.948 ( -5.720 0.000 5.283) 7.786 20.352 ( 2.984 0.000 0.735) 3.073 21.404 ( 0.208 0.000 -1.259) 1.276 21.900 ( 0.202 0.000 -7.264) 7.267 22.535 ( -4.886 0.000 5.520) 7.372 23.627 ( 0.547 0.000 -4.557) 4.590 23.779 ( 0.803 0.000 -0.451) 0.921 23.809 ( 3.435 0.000 2.467) 4.229 24.513 ( -1.305 0.000 -0.964) 1.622 24.684 ( 11.182 0.000 -7.122) 13.257======================= Grid point 68 (26/116) =======================q-point: (-0.38 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.187 ( -9.004 0.000 5.707) 10.660 1.353 ( -18.759 0.000 15.104) 24.084 2.079 ( 3.721 0.000 11.500) 12.087 2.343 ( -9.876 0.000 -5.753) 11.430 2.777 ( 6.236 0.000 3.807) 7.306 2.888 ( 2.934 0.000 -3.529) 4.589 3.004 ( -24.139 0.000 5.139) 24.679 3.282 ( -1.636 0.000 -2.764) 3.212 3.298 ( -4.579 0.000 7.914) 9.143 3.371 ( -1.685 0.000 -2.283) 2.837 3.374 ( 7.076 0.000 0.213) 7.079 3.466 ( 3.747 0.000 2.719) 4.629 3.702 ( 1.588 0.000 -1.124) 1.946 3.731 ( -10.003 0.000 2.319) 10.268 4.014 ( -2.241 0.000 0.992) 2.450 4.105 ( -7.297 0.000 1.806) 7.518 4.199 ( -5.555 0.000 -2.056) 5.923 4.345 ( -1.111 0.000 3.908) 4.063 4.345 ( 12.178 0.000 0.794) 12.204 4.897 ( -0.832 0.000 -3.584) 3.679 5.099 ( -9.139 0.000 -3.179) 9.676 5.250 ( -7.380 0.000 3.175) 8.034 5.276 ( 1.567 0.000 -5.693) 5.904 5.551 ( -2.068 0.000 -4.823) 5.248 5.950 ( 1.117 0.000 0.547) 1.243 6.073 ( -0.225 0.000 0.383) 0.444 6.174 ( 5.523 0.000 3.306) 6.437 6.348 ( -6.456 0.000 -5.939) 8.773 6.623 ( 2.971 0.000 -4.929) 5.755 6.671 ( 10.437 0.000 -7.124) 12.637 6.797 ( -7.651 0.000 -1.095) 7.729 6.950 ( 5.249 0.000 -2.093) 5.650 7.140 ( -2.360 0.000 1.727) 2.924 7.676 ( 5.761 0.000 -6.661) 8.806 7.983 ( -5.725 0.000 3.487) 6.703 8.117 ( 7.310 0.000 6.945) 10.083 8.153 ( 2.564 0.000 -0.256) 2.576 8.456 ( -2.169 0.000 -1.150) 2.455 8.707 ( -5.686 0.000 -1.019) 5.776 8.890 ( -2.391 0.000 -2.637) 3.560 9.477 ( 1.097 0.000 -1.664) 1.993 9.832 ( 3.323 0.000 6.228) 7.059 10.083 ( -1.246 0.000 -1.704) 2.111 10.440 ( -11.421 0.000 -2.448) 11.681 10.517 ( 3.199 0.000 -1.610) 3.581 10.725 ( 0.140 0.000 -2.690) 2.694 10.947 ( 6.469 0.000 1.641) 6.674 11.021 ( 9.292 0.000 -0.268) 9.295 11.895 ( -2.207 0.000 6.819) 7.167 12.253 ( -1.613 0.000 10.770) 10.890 12.792 ( -3.663 0.000 -0.867) 3.764 12.815 ( -0.141 0.000 -0.733) 0.747 13.099 ( 10.210 0.000 1.493) 10.319 13.120 ( -2.587 0.000 1.412) 2.947 13.330 ( -5.521 0.000 -0.419) 5.537 13.547 ( 5.327 0.000 1.721) 5.598 14.005 ( 4.841 0.000 1.418) 5.045 14.379 ( -2.972 0.000 -4.363) 5.279 15.167 ( -4.354 0.000 0.451) 4.377 15.277 ( -2.206 0.000 -7.168) 7.500 18.717 ( 1.002 0.000 1.843) 2.098 19.209 ( 0.462 0.000 -0.330) 0.567 19.889 ( -0.987 0.000 1.235) 1.581 20.367 ( -2.261 0.000 3.900) 4.508 21.428 ( 2.700 0.000 -1.358) 3.023 21.890 ( 0.967 0.000 -7.299) 7.363 22.387 ( -10.653 0.000 1.298) 10.732 23.571 ( -5.625 0.000 -0.305) 5.633 23.796 ( 0.780 0.000 0.474) 0.912 23.880 ( 3.363 0.000 -0.993) 3.507 24.468 ( -2.661 0.000 -2.148) 3.420 24.876 ( 10.087 0.000 -1.719) 10.233======================= Grid point 69 (27/116) =======================q-point: (-0.25 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.971 ( -15.477 0.000 8.716) 17.763 1.053 ( -17.232 0.000 23.653) 29.264 2.048 ( -20.112 0.000 8.099) 21.681 2.161 ( -8.042 0.000 -6.860) 10.570 2.429 ( -21.335 0.000 8.663) 23.027 2.899 ( 5.168 0.000 4.557) 6.890 2.980 ( 2.715 0.000 -1.950) 3.342 3.156 ( -9.489 0.000 4.642) 10.563 3.190 ( -6.146 0.000 -2.526) 6.644 3.371 ( 2.359 0.000 -3.071) 3.873 3.413 ( -7.283 0.000 2.382) 7.663 3.502 ( -2.531 0.000 0.879) 2.679 3.628 ( 3.174 0.000 3.924) 5.047 3.736 ( 1.388 0.000 -0.209) 1.404 3.958 ( -7.509 0.000 0.982) 7.573 4.011 ( -1.321 0.000 1.361) 1.896 4.078 ( 0.452 0.000 -5.235) 5.254 4.351 ( 0.339 0.000 2.641) 2.663 4.579 ( 5.891 0.000 0.450) 5.908 4.754 ( -7.156 0.000 -4.768) 8.598 5.039 ( 4.224 0.000 0.239) 4.231 5.115 ( -7.979 0.000 5.094) 9.466 5.281 ( 1.541 0.000 -8.337) 8.478 5.479 ( -4.140 0.000 -5.667) 7.018 5.994 ( 1.459 0.000 3.550) 3.838 6.084 ( 0.353 0.000 0.128) 0.375 6.236 ( -2.454 0.000 -5.390) 5.922 6.271 ( 3.222 0.000 3.193) 4.536 6.608 ( -9.984 0.000 0.231) 9.986 6.641 ( 0.023 0.000 -6.555) 6.555 6.829 ( 6.416 0.000 -9.599) 11.546 6.994 ( -1.378 0.000 -5.945) 6.102 7.126 ( 1.939 0.000 3.860) 4.320 7.783 ( 6.572 0.000 -6.304) 9.107 7.859 ( -7.665 0.000 3.513) 8.432 8.214 ( 3.499 0.000 0.094) 3.500 8.261 ( 3.153 0.000 3.856) 4.982 8.403 ( -2.503 0.000 -1.496) 2.916 8.594 ( -3.340 0.000 -0.840) 3.444 8.839 ( -1.779 0.000 -4.778) 5.098 9.488 ( 0.672 0.000 -2.282) 2.379 9.920 ( 3.284 0.000 4.519) 5.586 10.034 ( -3.491 0.000 -2.470) 4.276 10.247 ( -6.942 0.000 -1.793) 7.170 10.561 ( 1.642 0.000 -0.144) 1.649 10.724 ( 0.529 0.000 -2.131) 2.195 11.108 ( 8.827 0.000 2.734) 9.240 11.189 ( 7.690 0.000 -1.443) 7.824 11.890 ( 0.307 0.000 10.785) 10.790 12.275 ( 0.583 0.000 17.693) 17.703 12.721 ( -3.511 0.000 0.277) 3.522 12.818 ( 0.702 0.000 -0.590) 0.917 13.065 ( -3.002 0.000 -1.032) 3.175 13.212 ( -5.991 0.000 -0.949) 6.066 13.352 ( 15.206 0.000 1.935) 15.328 13.697 ( 9.542 0.000 0.279) 9.546 14.113 ( 5.225 0.000 1.942) 5.575 14.283 ( -5.588 0.000 -4.587) 7.230 15.025 ( -10.737 0.000 1.684) 10.868 15.179 ( -6.002 0.000 -13.451) 14.729 18.762 ( 3.178 0.000 1.169) 3.386 19.191 ( -2.371 0.000 1.689) 2.911 19.923 ( 4.431 0.000 -0.544) 4.465 20.288 ( -7.200 0.000 6.114) 9.446 21.501 ( 5.016 0.000 -0.609) 5.053 21.896 ( 1.867 0.000 -7.028) 7.271 22.167 ( -10.948 0.000 -2.420) 11.213 23.401 ( -11.773 0.000 -2.952) 12.138 23.806 ( -0.023 0.000 1.001) 1.001 23.928 ( 2.046 0.000 -2.619) 3.324 24.409 ( -2.434 0.000 -2.416) 3.429 25.059 ( 8.650 0.000 -2.340) 8.961======================= Grid point 70 (28/116) =======================q-point: (-0.12 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.677 ( -16.722 0.000 17.383) 24.121 0.839 ( -14.628 0.000 29.927) 33.311 1.302 ( -46.125 0.000 18.911) 49.851 1.967 ( -8.622 0.000 -6.752) 10.951 2.349 ( 0.624 0.000 7.217) 7.244 2.917 ( -7.275 0.000 0.873) 7.327 2.944 ( -5.327 0.000 -0.725) 5.376 3.079 ( 2.678 0.000 5.176) 5.828 3.124 ( 1.214 0.000 -5.413) 5.548 3.257 ( -6.387 0.000 -0.717) 6.427 3.407 ( 0.148 0.000 1.075) 1.085 3.462 ( 1.122 0.000 2.527) 2.765 3.726 ( -1.436 0.000 -0.840) 1.664 3.737 ( 3.940 0.000 4.575) 6.038 3.842 ( 0.621 0.000 4.795) 4.835 3.993 ( -4.020 0.000 -0.637) 4.070 4.205 ( 11.426 0.000 -5.073) 12.502 4.346 ( -1.975 0.000 -0.737) 2.108 4.428 ( -7.879 0.000 -2.286) 8.204 4.833 ( 5.201 0.000 -2.214) 5.653 4.953 ( -10.898 0.000 5.800) 12.345 5.196 ( 10.140 0.000 0.378) 10.147 5.295 ( 2.344 0.000 -7.976) 8.313 5.360 ( -5.716 0.000 -3.732) 6.827 5.994 ( -3.001 0.000 4.897) 5.744 6.057 ( -2.019 0.000 -1.389) 2.451 6.246 ( 3.444 0.000 -3.659) 5.025 6.291 ( -2.464 0.000 -0.207) 2.473 6.455 ( -4.472 0.000 -0.884) 4.559 6.597 ( -1.782 0.000 -4.407) 4.753 6.813 ( -7.462 0.000 -11.224) 13.478 6.911 ( -3.099 0.000 -5.650) 6.444 7.210 ( 4.236 0.000 2.652) 4.998 7.727 ( -6.438 0.000 4.060) 7.612 7.859 ( 1.079 0.000 -8.557) 8.625 8.168 ( -11.551 0.000 -3.328) 12.021 8.274 ( 2.096 0.000 0.479) 2.150 8.361 ( -1.059 0.000 -2.236) 2.474 8.613 ( 2.832 0.000 -0.699) 2.917 8.785 ( -2.650 0.000 -6.267) 6.804 9.493 ( 0.656 0.000 -2.301) 2.393 9.901 ( -8.400 0.000 -7.802) 11.465 9.943 ( -4.052 0.000 -3.500) 5.355 10.165 ( -1.836 0.000 -1.966) 2.691 10.582 ( 0.545 0.000 0.948) 1.093 10.734 ( 1.111 0.000 -1.659) 1.996 11.226 ( 0.323 0.000 -1.808) 1.837 11.303 ( 4.449 0.000 -1.317) 4.640 12.031 ( 7.281 0.000 10.856) 13.072 12.597 ( 39.429 0.000 52.049) 65.297 12.662 ( -2.528 0.000 0.204) 2.536 12.837 ( 1.170 0.000 0.208) 1.188 12.989 ( -3.967 0.000 -5.784) 7.014 13.118 ( -3.315 0.000 3.032) 4.492 13.677 ( 16.659 0.000 3.032) 16.932 13.886 ( 7.618 0.000 -3.910) 8.563 14.161 ( -2.890 0.000 -2.713) 3.964 14.200 ( 2.899 0.000 1.911) 3.472 14.764 ( -16.510 0.000 2.310) 16.671 14.892 ( -21.383 0.000 -21.266) 30.158 18.837 ( 3.841 0.000 1.103) 3.996 19.139 ( -3.130 0.000 1.598) 3.515 20.079 ( 13.128 0.000 4.864) 14.000 20.143 ( -8.742 0.000 5.853) 10.520 21.609 ( 5.320 0.000 1.194) 5.452 21.919 ( 2.369 0.000 -6.618) 7.029 21.982 ( -6.088 0.000 -4.073) 7.325 23.039 ( -27.300 0.000 -14.136) 30.743 23.803 ( -0.547 0.000 1.040) 1.175 23.945 ( 0.787 0.000 -3.006) 3.107 24.370 ( -0.728 0.000 -1.607) 1.764 25.070 ( -12.046 0.000 -22.754) 25.746======================= Grid point 71 (29/116) =======================q-point: ( 0.00 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.703 ( -2.629 20.827 11.485) 23.929 0.918 ( -0.823 23.703 18.921) 30.340 1.192 ( -2.676 20.343 34.041) 39.746 1.941 ( 2.819 4.620 -4.804) 7.237 2.401 ( -0.488 1.710 9.677) 9.839 2.718 ( -1.762 -6.951 -1.283) 7.285 2.859 ( -1.764 -1.397 -2.537) 3.391 3.077 ( 2.948 -5.638 -6.431) 9.047 3.116 ( -2.698 0.593 0.323) 2.782 3.211 ( 0.690 0.971 -0.344) 1.240 3.337 ( -3.184 -1.360 3.876) 5.197 3.589 ( -0.079 -5.777 1.154) 5.892 3.674 ( -0.860 1.775 -0.734) 2.104 3.803 ( 2.657 5.987 0.235) 6.554 3.916 ( -8.079 1.036 -4.494) 9.303 4.156 ( 7.472 0.867 2.690) 7.989 4.283 ( 0.266 8.098 -0.952) 8.158 4.504 ( 13.189 2.506 -3.776) 13.946 4.615 ( 2.719 7.152 -10.497) 12.990 4.705 ( -14.442 -1.536 3.804) 15.013 4.859 ( -1.831 0.395 -3.321) 3.813 5.164 ( -6.005 -1.241 -5.911) 8.517 5.357 ( 10.503 -1.766 -0.411) 10.658 5.454 ( 8.327 1.354 -0.469) 8.449 5.925 ( -6.445 0.639 4.516) 7.896 6.043 ( 1.231 -1.292 0.581) 1.876 6.149 ( 0.717 -5.321 -3.792) 6.574 6.259 ( 2.354 3.963 -5.130) 6.897 6.440 ( 2.155 -1.456 2.341) 3.500 6.513 ( 2.745 4.301 -2.084) 5.512 6.706 ( -3.664 6.269 0.202) 7.264 6.899 ( 4.858 -1.473 -1.767) 5.375 7.172 ( -3.953 -6.598 1.623) 7.861 7.440 ( -4.940 -1.450 0.474) 5.170 7.640 ( -0.150 -9.331 3.553) 9.986 7.909 ( 3.394 -6.163 -2.264) 7.391 8.353 ( 1.344 -0.189 -1.773) 2.232 8.425 ( -4.372 3.228 -4.069) 6.789 8.686 ( -2.028 -2.338 -5.638) 6.431 8.864 ( 1.877 10.926 -3.389) 11.593 9.469 ( -1.607 -0.093 3.006) 3.410 9.596 ( -3.628 4.488 3.888) 6.958 10.044 ( -1.694 6.473 -4.200) 7.899 10.349 ( -2.302 14.621 -15.829) 21.671 10.643 ( -1.174 5.176 -0.979) 5.397 10.792 ( 1.129 3.428 -2.414) 4.342 11.111 ( -5.308 -3.400 2.488) 6.777 11.331 ( 1.309 -2.270 -0.336) 2.642 12.123 ( -1.195 2.472 5.500) 6.147 12.553 ( -1.358 -9.487 5.259) 10.932 12.692 ( -4.426 -13.335 12.575) 18.856 12.820 ( -0.480 -3.880 0.788) 3.988 13.067 ( 1.240 -3.061 6.316) 7.128 13.234 ( 19.769 -22.645 30.955) 43.149 13.792 ( -9.675 0.237 -4.961) 10.875 13.988 ( 10.002 -1.052 3.164) 10.543 14.110 ( -2.193 1.338 0.015) 2.569 14.214 ( -2.382 -0.328 0.701) 2.504 14.424 ( 3.084 1.807 -2.153) 4.172 14.930 ( 8.542 0.318 -9.515) 12.791 19.155 ( -2.492 6.408 0.058) 6.876 19.605 ( 1.479 26.467 -21.922) 34.399 20.019 ( 3.030 3.137 -0.739) 4.424 20.672 ( 25.561 -1.529 -1.900) 25.677 21.685 ( 9.518 1.549 -4.510) 10.646 21.888 ( -2.640 -1.067 -4.789) 5.571 21.978 ( -11.681 0.219 0.195) 11.685 22.033 ( -21.570 -0.444 1.409) 21.620 23.685 ( -4.423 -3.293 6.403) 8.450 23.942 ( 1.925 -1.365 -1.275) 2.682 24.347 ( -9.649 2.011 -1.985) 10.055 24.384 ( -8.285 1.125 -0.757) 8.396======================= Grid point 72 (30/116) =======================q-point: ( 0.12 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.999 ( 14.028 16.879 13.249) 25.636 1.163 ( 18.570 14.178 19.889) 30.683 1.442 ( 22.507 15.319 20.697) 34.200 2.115 ( 11.198 0.290 -0.011) 11.202 2.444 ( 4.610 5.585 8.315) 11.026 2.742 ( 3.688 -8.443 -2.944) 9.672 2.856 ( 1.353 -1.889 -3.523) 4.221 3.027 ( -6.609 5.647 -0.316) 8.699 3.076 ( -1.672 -6.770 -3.006) 7.594 3.230 ( -0.453 -1.979 2.810) 3.467 3.295 ( 3.061 2.500 -3.624) 5.362 3.528 ( -5.132 0.426 2.873) 5.897 3.620 ( -1.299 -0.209 -2.688) 2.993 3.782 ( -3.416 -1.864 1.261) 4.091 3.912 ( 5.623 4.110 -0.821) 7.013 4.120 ( -5.249 6.835 -1.620) 8.769 4.427 ( -6.003 0.187 2.344) 6.447 4.454 ( 7.890 2.285 -1.923) 8.436 4.553 ( -4.807 5.949 1.952) 7.894 4.709 ( 3.520 -1.236 -3.301) 4.981 4.838 ( 3.922 5.040 -3.177) 7.133 5.022 ( -6.283 -3.357 -3.538) 7.954 5.530 ( 7.215 -0.749 -1.299) 7.369 5.607 ( 7.439 -0.805 0.525) 7.501 5.822 ( -6.682 -2.213 3.664) 7.936 6.056 ( -0.988 -5.959 -0.386) 6.053 6.190 ( 2.102 -0.122 0.195) 2.115 6.229 ( 0.161 0.880 -3.133) 3.258 6.518 ( 2.385 6.263 -3.206) 7.429 6.700 ( 3.747 -1.909 -6.455) 7.704 6.856 ( 15.753 -6.931 -2.207) 17.351 7.028 ( 6.197 -2.202 0.023) 6.576 7.118 ( 1.586 -3.550 -2.966) 4.891 7.406 ( 3.975 3.088 -4.263) 6.596 7.713 ( 5.307 -9.022 3.372) 10.997 7.938 ( 0.191 -5.381 -0.267) 5.391 8.316 ( -5.108 4.936 -2.527) 7.540 8.383 ( 1.825 0.335 -0.405) 1.899 8.670 ( 1.686 -0.818 -6.158) 6.437 8.903 ( 3.493 6.299 -5.095) 8.822 9.446 ( -1.662 1.966 5.535) 6.104 9.576 ( 0.536 4.986 2.771) 5.730 10.042 ( 3.363 7.555 -5.410) 9.882 10.274 ( -1.248 12.847 -7.912) 15.139 10.626 ( -0.440 2.673 -0.581) 2.771 10.804 ( 0.639 2.256 -2.550) 3.464 11.032 ( -4.109 -1.928 2.049) 4.980 11.315 ( -2.688 -1.677 -0.414) 3.195 12.090 ( -3.444 2.006 5.765) 7.009 12.510 ( -8.165 -5.185 15.825) 18.546 12.613 ( -0.772 -1.864 3.052) 3.659 12.801 ( -1.250 -5.805 0.198) 5.942 13.100 ( 0.818 0.508 5.807) 5.886 13.364 ( -5.130 -11.688 12.813) 18.086 13.554 ( -12.413 2.104 -2.112) 12.765 13.978 ( -11.059 -1.487 0.594) 11.174 14.145 ( -4.026 -1.467 0.423) 4.305 14.285 ( 9.850 -0.298 -0.328) 9.860 14.538 ( 13.665 -5.874 0.312) 14.877 15.240 ( 15.096 -15.830 -6.328) 22.771 19.100 ( -3.123 6.528 -1.468) 7.384 19.364 ( -15.914 23.637 -7.828) 29.551 20.037 ( -0.242 2.900 -0.845) 3.031 20.480 ( -20.224 -1.339 14.805) 25.100 21.602 ( -6.845 2.603 1.013) 7.393 21.938 ( 3.039 -1.171 -7.554) 8.226 22.127 ( 10.581 -2.507 3.628) 11.463 22.515 ( 50.979 -12.996 -31.021) 61.074 23.644 ( -1.246 -0.201 6.620) 6.739 24.000 ( 4.554 -3.095 -1.336) 5.666 24.100 ( -7.252 12.720 -3.703) 15.103 24.436 ( 4.808 0.930 0.121) 4.898======================= Grid point 73 (31/116) =======================q-point: ( 0.25 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.293 ( 12.073 14.699 11.869) 22.421 1.490 ( 9.874 8.685 29.061) 31.897 1.997 ( 17.292 5.852 1.704) 18.335 2.251 ( 5.773 -5.532 5.832) 9.897 2.663 ( 12.619 7.635 5.737) 15.825 2.771 ( 3.236 -2.187 -1.582) 4.214 2.850 ( -1.588 0.188 -3.176) 3.556 2.964 ( -0.003 0.632 -2.789) 2.859 3.039 ( 1.160 -5.349 -2.979) 6.231 3.257 ( 3.799 -0.259 -0.728) 3.877 3.389 ( 4.893 0.283 -3.116) 5.808 3.526 ( 4.841 -0.154 2.213) 5.325 3.583 ( -2.459 1.376 -0.219) 2.827 3.743 ( -1.446 -3.662 0.607) 3.983 4.007 ( 3.345 2.318 -2.545) 4.800 4.064 ( 1.713 7.560 0.287) 7.757 4.303 ( -4.410 0.692 2.007) 4.895 4.439 ( -2.918 5.193 2.327) 6.395 4.553 ( -5.631 4.452 -2.503) 7.603 4.835 ( 11.120 0.716 0.032) 11.144 4.924 ( 0.358 -3.794 -2.882) 4.778 4.968 ( 6.927 2.253 -2.020) 7.559 5.637 ( -0.118 -0.679 7.709) 7.740 5.694 ( -2.909 -2.955 -1.032) 4.273 5.751 ( 7.040 -0.037 -2.592) 7.502 6.029 ( -1.257 -3.576 -2.445) 4.510 6.139 ( -3.574 -0.267 -2.068) 4.138 6.320 ( 5.329 -1.403 1.008) 5.602 6.575 ( 3.649 4.414 -2.051) 6.083 6.670 ( -3.824 -5.661 -8.539) 10.936 6.966 ( 0.237 -2.596 2.919) 3.914 7.064 ( -1.275 -0.834 -1.815) 2.370 7.145 ( 0.311 -0.692 -1.342) 1.542 7.565 ( 9.492 1.475 -10.941) 14.560 7.807 ( 1.996 -9.181 1.471) 9.510 7.947 ( 1.560 -6.585 2.660) 7.271 8.224 ( -3.393 7.183 0.423) 7.955 8.418 ( 1.483 -0.797 -0.383) 1.726 8.699 ( 2.693 2.077 -3.722) 5.042 8.957 ( 3.035 0.785 -5.075) 5.965 9.446 ( 0.223 3.403 4.002) 5.258 9.622 ( 2.866 2.170 3.741) 5.188 10.142 ( 7.988 7.797 -5.786) 12.573 10.252 ( 0.846 9.715 -3.694) 10.428 10.621 ( 0.112 1.087 -0.639) 1.266 10.798 ( -0.320 1.417 -3.639) 3.918 10.951 ( -4.804 -0.189 1.631) 5.077 11.229 ( -5.866 0.132 -0.798) 5.922 12.033 ( -3.982 1.971 5.763) 7.277 12.391 ( -7.474 1.178 15.727) 17.453 12.666 ( 4.481 -1.343 0.934) 4.770 12.780 ( -0.975 -7.895 -0.267) 7.960 13.114 ( -2.614 1.486 4.543) 5.448 13.264 ( -5.867 -2.378 0.106) 6.331 13.373 ( -5.354 -1.399 3.947) 6.797 13.752 ( -9.970 1.975 0.099) 10.164 14.048 ( -5.353 -1.185 -0.457) 5.501 14.431 ( 5.481 3.701 -0.816) 6.664 14.799 ( 11.142 -11.926 0.374) 16.325 15.383 ( 2.861 -10.034 -3.863) 11.126 18.978 ( -9.191 10.939 1.537) 14.370 19.163 ( -2.232 8.150 -3.113) 9.005 20.013 ( -3.375 -6.685 4.792) 8.891 20.292 ( -4.337 2.131 4.722) 6.756 21.500 ( -4.302 1.904 0.837) 4.779 21.969 ( 2.835 2.274 -6.811) 7.720 22.337 ( 8.663 -3.403 6.199) 11.183 23.167 ( 25.346 -14.738 -23.680) 37.687 23.670 ( 1.717 0.957 4.424) 4.841 24.002 ( -2.579 12.196 -2.889) 12.796 24.110 ( 7.216 -8.155 -4.771) 11.888 24.545 ( 6.288 3.180 -1.661) 7.239======================= Grid point 74 (32/116) =======================q-point: ( 0.38 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.466 ( 1.230 12.239 10.624) 16.253 1.746 ( 8.007 5.594 24.417) 26.299 1.999 ( -9.383 5.851 6.474) 12.813 2.394 ( 7.001 -6.317 -0.333) 9.435 2.793 ( -1.312 -1.132 -4.164) 4.510 2.846 ( -6.204 0.458 0.829) 6.276 2.894 ( 5.467 -2.952 -2.339) 6.639 3.019 ( 16.073 3.743 0.414) 16.509 3.137 ( 7.008 -3.967 -1.370) 8.168 3.344 ( 4.586 3.115 -6.861) 8.821 3.458 ( 2.633 -1.342 4.479) 5.366 3.524 ( -3.276 3.025 1.519) 4.710 3.679 ( 5.837 -2.637 2.474) 6.866 3.729 ( 1.698 -2.040 -0.593) 2.720 4.035 ( 1.039 -1.090 2.153) 2.628 4.143 ( 4.051 7.647 0.242) 8.658 4.267 ( -1.135 1.772 -0.282) 2.123 4.414 ( -3.245 6.856 -0.411) 7.596 4.441 ( -1.249 5.322 1.931) 5.798 4.849 ( -0.843 -4.840 -1.728) 5.208 5.075 ( 6.799 -0.774 -4.513) 8.197 5.141 ( 10.468 2.611 -1.718) 10.924 5.522 ( -8.103 -1.871 5.120) 9.766 5.719 ( -0.778 -0.619 1.348) 1.675 5.884 ( 7.251 1.613 -1.456) 7.569 6.001 ( -1.009 -3.749 -3.026) 4.922 6.083 ( -0.316 1.526 -0.722) 1.718 6.409 ( 3.627 -3.693 -2.065) 5.573 6.540 ( -5.118 -8.470 -3.595) 10.529 6.626 ( 0.673 5.460 -5.773) 7.974 6.901 ( -5.259 -1.947 -1.820) 5.896 7.017 ( -2.449 3.944 -0.128) 4.645 7.172 ( 1.960 0.506 1.266) 2.388 7.631 ( 0.667 0.752 -7.072) 7.143 7.809 ( -0.445 -8.170 -0.013) 8.182 8.005 ( 2.640 -6.612 2.431) 7.524 8.199 ( -0.091 8.114 2.759) 8.570 8.431 ( 0.077 -3.048 -1.241) 3.291 8.752 ( 3.301 1.506 -1.515) 3.932 8.978 ( 0.285 -0.461 -2.794) 2.846 9.470 ( 1.114 4.173 2.214) 4.853 9.691 ( 2.522 0.678 5.011) 5.651 10.219 ( 0.992 10.646 -3.068) 11.123 10.360 ( 11.235 4.970 -5.363) 13.404 10.625 ( 0.467 -0.289 -0.615) 0.825 10.773 ( -0.996 1.025 -3.655) 3.924 10.863 ( -4.778 0.051 1.926) 5.152 11.096 ( -6.772 4.285 -1.008) 8.077 11.976 ( -3.424 1.724 5.595) 6.783 12.320 ( -4.138 2.474 11.412) 12.388 12.757 ( -0.185 -6.101 -1.918) 6.397 12.777 ( 5.345 -3.467 2.063) 6.697 12.989 ( -7.747 -0.300 -0.349) 7.760 13.242 ( 0.226 6.776 3.093) 7.452 13.309 ( -2.353 -8.185 3.002) 9.030 13.615 ( -4.709 2.972 0.859) 5.634 13.957 ( -3.424 -0.867 -0.285) 3.544 14.496 ( 1.838 5.372 -2.265) 6.113 14.953 ( 4.742 -13.910 0.577) 14.707 15.389 ( -0.106 -3.310 -3.726) 4.985 18.836 ( -5.655 7.320 2.965) 9.714 19.165 ( 2.210 3.568 -3.753) 5.630 19.930 ( -6.368 -9.304 7.291) 13.427 20.283 ( 1.685 -1.419 -0.607) 2.285 21.437 ( -2.471 2.428 0.675) 3.530 22.006 ( 2.964 7.122 -7.510) 10.766 22.471 ( 2.634 -5.005 7.184) 9.143 23.459 ( 12.009 -7.937 -11.204) 18.241 23.708 ( 0.469 -0.351 3.143) 3.198 23.963 ( -0.804 10.785 -3.531) 11.377 24.237 ( 6.638 -12.320 -2.697) 14.252 24.656 ( 5.820 4.137 -4.230) 8.300======================= Grid point 75 (33/116) =======================q-point: (-0.50 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.435 ( -5.388 11.308 8.034) 14.881 1.722 ( -14.903 5.216 10.274) 18.838 2.004 ( 6.323 6.789 16.666) 19.074 2.530 ( 1.974 -1.945 -3.795) 4.699 2.665 ( -4.227 0.752 3.182) 5.344 2.801 ( 2.397 -1.654 -6.156) 6.810 2.997 ( 4.000 -7.082 1.946) 8.363 3.228 ( 2.696 -3.580 1.852) 4.849 3.267 ( 6.881 -4.204 -1.620) 8.225 3.386 ( 1.336 3.884 -3.791) 5.589 3.423 ( -4.248 -0.225 0.730) 4.316 3.509 ( -2.477 4.666 4.485) 6.930 3.693 ( -0.414 -0.402 -0.026) 0.578 3.801 ( 0.580 -2.692 1.546) 3.158 4.060 ( -1.279 0.860 3.038) 3.407 4.173 ( -0.963 -1.934 2.600) 3.381 4.268 ( 2.648 7.864 1.108) 8.372 4.348 ( -1.908 6.691 -3.529) 7.802 4.456 ( -0.038 7.734 2.451) 8.113 4.845 ( 0.342 -4.440 -1.686) 4.761 5.156 ( 2.772 -3.673 -6.051) 7.602 5.253 ( 1.130 0.767 -3.986) 4.213 5.392 ( -6.511 1.536 4.794) 8.230 5.650 ( -4.477 2.009 -1.529) 5.140 5.949 ( -1.833 -2.446 -2.989) 4.276 6.034 ( 5.645 -0.995 0.960) 5.812 6.113 ( 2.396 2.718 1.267) 3.839 6.423 ( -4.591 -5.758 -4.065) 8.412 6.480 ( 4.126 -4.298 -4.074) 7.218 6.609 ( 0.382 3.144 -5.485) 6.334 6.844 ( 1.383 -2.140 -1.758) 3.096 6.970 ( -2.978 4.349 -0.812) 5.333 7.204 ( 0.692 3.041 2.275) 3.860 7.606 ( -0.034 -1.690 -4.353) 4.670 7.810 ( 0.337 -8.949 -0.538) 8.971 8.049 ( 1.159 -5.252 1.674) 5.633 8.214 ( 0.540 8.069 3.680) 8.885 8.418 ( -0.762 -4.223 -1.846) 4.671 8.799 ( 1.266 0.932 -0.343) 1.609 8.957 ( -1.568 0.205 -2.253) 2.753 9.495 ( 0.800 4.490 1.088) 4.689 9.737 ( 0.454 -0.635 6.173) 6.222 10.225 ( 0.794 9.479 -2.419) 9.815 10.552 ( 8.150 8.355 -5.677) 12.979 10.607 ( -4.222 -3.446 -0.833) 5.513 10.758 ( 1.132 0.627 0.218) 1.312 10.786 ( -1.761 0.304 -0.670) 1.909 11.019 ( 0.368 6.987 -0.681) 7.030 11.934 ( -2.614 1.313 5.233) 5.995 12.288 ( -2.457 2.416 9.222) 9.845 12.735 ( -0.872 -8.814 -2.806) 9.291 12.859 ( -3.158 -1.481 -0.026) 3.488 12.913 ( 4.972 0.583 2.778) 5.725 13.200 ( -3.521 -0.207 -0.732) 3.603 13.326 ( 0.753 -1.183 5.563) 5.737 13.559 ( -1.081 2.406 0.240) 2.649 13.933 ( 1.108 -0.494 0.790) 1.448 14.497 ( -0.716 6.207 -3.681) 7.252 14.993 ( -0.612 -14.799 0.506) 14.820 15.373 ( -0.352 -0.272 -4.239) 4.263 18.777 ( -1.242 5.792 2.394) 6.389 19.208 ( 2.985 2.775 -2.925) 5.017 19.836 ( -4.699 -8.589 5.582) 11.270 20.322 ( 1.889 -4.845 0.001) 5.200 21.407 ( -0.736 2.308 0.055) 2.423 22.033 ( 1.853 10.866 -7.556) 13.364 22.468 ( -4.834 -5.997 5.331) 9.367 23.602 ( 4.503 -1.585 -3.465) 5.899 23.704 ( -0.797 -3.858 1.791) 4.328 23.942 ( -0.295 6.717 -4.226) 7.942 24.341 ( 4.109 -10.451 0.919) 11.267 24.746 ( 4.915 2.034 -4.677) 7.083======================= Grid point 76 (34/116) =======================q-point: (-0.38 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.337 ( -7.161 12.797 6.244) 15.938 1.438 ( -16.870 7.863 13.211) 22.825 2.144 ( 2.874 5.766 11.564) 13.238 2.385 ( -7.881 3.980 -4.135) 9.749 2.732 ( 0.230 -2.778 4.638) 5.411 2.858 ( 3.882 -2.656 -1.970) 5.100 3.052 ( -0.534 -7.729 -0.264) 7.752 3.100 ( -14.577 1.316 5.202) 15.533 3.254 ( -6.672 -4.127 1.440) 7.977 3.329 ( -2.956 -1.344 2.696) 4.221 3.446 ( 2.947 -1.919 -0.598) 3.567 3.506 ( 1.330 1.746 -3.364) 4.017 3.686 ( -1.393 0.889 0.802) 1.837 3.770 ( -0.740 2.262 0.404) 2.414 3.975 ( -5.974 -1.234 3.623) 7.095 4.166 ( -1.923 2.862 1.727) 3.857 4.269 ( -5.015 6.092 -5.023) 9.354 4.370 ( 5.305 4.875 2.843) 7.745 4.474 ( 3.156 8.467 1.683) 9.192 4.834 ( -1.084 -4.975 -3.737) 6.316 5.096 ( -8.092 -0.359 -3.324) 8.755 5.195 ( -3.829 -4.663 -3.007) 6.741 5.308 ( -2.730 3.132 0.691) 4.212 5.576 ( -2.776 1.728 -4.507) 5.568 5.932 ( 1.144 -1.688 0.449) 2.088 6.079 ( 0.947 0.360 -0.036) 1.014 6.205 ( 4.565 2.597 4.310) 6.794 6.291 ( -6.006 -4.723 -5.276) 9.286 6.592 ( 2.172 -2.602 -1.230) 3.606 6.628 ( 6.636 -2.681 -8.236) 10.911 6.874 ( -5.795 5.194 -1.971) 8.028 6.924 ( 5.394 -2.074 -2.790) 6.417 7.208 ( -0.948 5.244 2.292) 5.801 7.633 ( 3.978 -4.012 -4.193) 7.036 7.797 ( -2.175 -10.950 -0.246) 11.167 8.046 ( -2.573 -8.540 1.814) 9.102 8.249 ( 2.225 6.573 2.363) 7.331 8.404 ( 0.348 -1.103 -0.894) 1.462 8.794 ( -1.288 3.293 0.003) 3.536 8.914 ( -1.841 1.407 -3.287) 4.022 9.505 ( 0.107 3.899 -0.134) 3.903 9.749 ( -1.170 -3.297 7.058) 7.878 10.244 ( 2.127 10.178 -2.255) 10.639 10.434 ( -10.296 -1.011 -0.926) 10.387 10.640 ( 2.240 9.336 -1.533) 9.723 10.763 ( 0.699 4.089 -4.016) 5.774 10.876 ( 7.793 -4.371 2.855) 9.380 11.103 ( 7.385 5.501 -1.816) 9.386 11.903 ( -2.154 0.981 5.429) 5.923 12.274 ( -1.929 1.930 10.099) 10.461 12.704 ( -1.729 -8.618 -2.911) 9.259 12.803 ( -1.977 -1.123 1.395) 2.667 13.029 ( 3.521 -1.618 2.187) 4.450 13.146 ( 0.002 -2.493 -1.858) 3.110 13.327 ( -1.283 2.703 4.034) 5.023 13.595 ( 4.870 2.274 0.251) 5.381 13.997 ( 4.673 -0.488 1.916) 5.074 14.451 ( -2.802 6.492 -4.614) 8.443 14.936 ( -5.537 -15.289 0.003) 16.261 15.342 ( -1.846 0.317 -5.217) 5.543 18.805 ( 3.762 7.798 1.301) 8.755 19.250 ( 1.493 3.820 -0.500) 4.132 19.798 ( -0.134 -7.293 2.409) 7.682 20.341 ( -0.471 -3.894 2.146) 4.471 21.413 ( 1.582 0.713 -0.810) 1.915 22.029 ( -0.185 11.352 -6.319) 12.993 22.331 ( -9.487 -5.155 1.057) 10.848 23.560 ( -7.271 -1.311 1.024) 7.459 23.740 ( 2.831 -3.661 0.252) 4.635 23.926 ( 0.019 1.536 -5.070) 5.298 24.391 ( 0.609 -5.347 1.287) 5.533 24.827 ( 4.445 -3.873 -1.587) 6.105======================= Grid point 77 (35/116) =======================q-point: (-0.25 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.163 ( -14.053 11.383 18.085) 25.576 1.185 ( -12.474 15.990 9.772) 22.511 2.128 ( -14.069 7.034 8.111) 17.697 2.218 ( -12.131 5.113 -2.118) 13.334 2.460 ( -16.562 2.256 4.469) 17.302 2.892 ( -0.733 -3.825 3.273) 5.087 2.981 ( 2.673 4.232 0.715) 5.056 3.031 ( -5.081 -9.757 -0.972) 11.043 3.177 ( -1.779 -3.481 4.579) 6.020 3.262 ( -3.574 -3.395 0.633) 4.970 3.397 ( -5.949 -3.746 -2.127) 7.345 3.489 ( -1.596 -0.572 0.131) 1.700 3.699 ( 2.713 1.272 0.118) 2.998 3.782 ( -1.144 3.981 2.834) 5.019 3.929 ( 0.911 1.663 -0.981) 2.135 4.100 ( -5.640 6.120 0.546) 8.341 4.171 ( 1.430 5.855 -4.319) 7.415 4.444 ( 2.210 7.399 2.564) 8.136 4.619 ( 5.300 3.290 -0.486) 6.257 4.709 ( -7.549 -3.665 -5.701) 10.145 4.991 ( 0.836 -2.953 0.652) 3.138 5.109 ( -4.493 -1.847 1.730) 5.157 5.286 ( 0.866 1.087 -5.137) 5.321 5.492 ( -4.652 0.990 -5.364) 7.169 5.980 ( 2.474 -0.947 3.763) 4.601 6.103 ( 0.589 1.550 -0.365) 1.697 6.175 ( -3.332 -4.220 -3.416) 6.370 6.286 ( 1.736 0.528 2.577) 3.152 6.555 ( -3.929 -1.873 -1.934) 4.763 6.674 ( -2.878 -3.398 -10.171) 11.103 6.825 ( 3.152 3.903 -0.447) 5.036 6.973 ( -0.536 -1.899 -5.286) 5.642 7.198 ( -0.024 4.702 1.895) 5.070 7.699 ( -2.115 -10.543 1.979) 10.933 7.735 ( 1.639 -5.672 -6.126) 8.508 7.943 ( -8.646 -15.160 2.137) 17.582 8.299 ( 2.394 2.115 -1.868) 3.701 8.441 ( 2.917 3.229 1.386) 4.567 8.775 ( -0.229 5.675 -0.282) 5.686 8.871 ( -1.288 3.470 -4.771) 6.038 9.500 ( -0.431 2.755 -0.944) 2.944 9.730 ( -2.943 -5.688 6.842) 9.372 10.235 ( -7.015 4.352 -1.759) 8.440 10.315 ( 3.591 7.971 -2.513) 9.096 10.663 ( 0.766 7.374 -0.489) 7.430 10.769 ( 1.011 4.828 -3.640) 6.130 11.055 ( 9.181 -3.949 3.765) 10.680 11.237 ( 5.951 3.105 -3.713) 7.670 11.899 ( 0.696 0.959 9.602) 9.674 12.277 ( -1.170 0.347 15.147) 15.196 12.648 ( -3.138 -7.523 -0.730) 8.184 12.793 ( 0.421 -2.388 0.642) 2.508 13.012 ( -2.826 -2.144 -1.996) 4.070 13.155 ( -2.577 -3.310 0.937) 4.298 13.418 ( 11.331 4.720 2.765) 12.582 13.733 ( 8.803 1.713 -0.333) 8.975 14.102 ( 4.911 -0.821 2.367) 5.513 14.362 ( -4.739 6.911 -4.673) 9.594 14.767 ( -12.149 -15.426 -0.481) 19.641 15.255 ( -5.705 0.007 -7.473) 9.402 18.946 ( 11.330 14.345 -0.791) 18.297 19.259 ( -0.429 6.540 1.306) 6.683 19.843 ( 3.924 -6.183 1.232) 7.426 20.312 ( -3.171 0.630 3.396) 4.689 21.470 ( 4.738 -1.312 -1.205) 5.062 21.983 ( -3.307 5.653 -3.890) 7.617 22.149 ( -7.636 -0.490 -3.870) 8.575 23.351 ( -14.658 -5.326 -2.537) 15.801 23.772 ( -0.188 -2.037 2.440) 3.184 23.917 ( 0.694 -2.008 -4.906) 5.346 24.381 ( -1.365 -1.842 -0.376) 2.323 24.887 ( 0.616 -12.075 0.560) 12.103======================= Grid point 78 (36/116) =======================q-point: (-0.12 0.14 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.957 ( -14.310 19.731 11.305) 26.868 0.987 ( -10.702 13.680 25.362) 30.739 1.493 ( -37.221 17.066 16.517) 44.153 2.050 ( -8.789 6.457 -6.177) 12.534 2.372 ( -0.128 1.479 7.746) 7.887 2.805 ( -6.241 -8.068 0.244) 10.203 2.954 ( -5.565 -1.552 -0.812) 5.834 3.038 ( 1.497 -2.939 -1.909) 3.811 3.123 ( 0.957 1.293 2.991) 3.397 3.236 ( -3.708 -2.081 -1.367) 4.467 3.330 ( 1.629 -5.318 2.215) 5.986 3.521 ( 5.348 0.229 -0.024) 5.353 3.710 ( -4.299 2.894 0.443) 5.202 3.771 ( 1.851 -0.215 2.390) 3.031 3.915 ( 2.358 5.885 -1.659) 6.553 4.107 ( 0.743 7.703 0.918) 7.793 4.268 ( 9.204 4.485 -5.239) 11.501 4.391 ( -9.989 2.019 -2.030) 10.392 4.515 ( 4.174 7.317 -1.937) 8.644 4.822 ( 6.378 -1.164 -1.638) 6.687 4.943 ( -8.852 -1.573 2.528) 9.339 5.153 ( 8.708 -2.867 0.141) 9.169 5.290 ( -0.658 -0.250 -5.507) 5.552 5.381 ( -2.900 1.777 -4.190) 5.397 6.010 ( -1.945 1.853 5.191) 5.845 6.071 ( -2.479 0.886 -1.301) 2.936 6.154 ( 0.457 -6.706 -1.729) 6.940 6.274 ( -2.510 -1.272 -1.759) 3.319 6.493 ( -0.332 1.760 -2.437) 3.025 6.555 ( -6.409 -1.978 -6.268) 9.180 6.840 ( -4.007 2.909 -2.294) 5.457 6.898 ( -3.344 -1.299 -5.396) 6.480 7.208 ( -0.378 -1.596 1.977) 2.569 7.573 ( -8.144 -9.066 1.821) 12.322 7.732 ( -8.523 -13.583 -0.231) 16.037 7.835 ( 3.755 -7.659 -1.867) 8.732 8.331 ( 1.696 0.326 -2.393) 2.951 8.480 ( 0.149 2.492 -1.867) 3.117 8.759 ( -2.345 -0.299 -3.161) 3.947 8.847 ( 0.693 10.018 -4.008) 10.813 9.486 ( -0.716 1.268 -0.216) 1.472 9.672 ( -4.772 -3.240 5.404) 7.903 10.114 ( -4.508 3.899 -1.915) 6.260 10.386 ( 3.660 11.190 -11.470) 16.437 10.667 ( -0.328 6.769 -1.502) 6.942 10.779 ( 1.064 4.660 -3.272) 5.792 11.197 ( 0.730 -2.782 0.545) 2.927 11.280 ( 2.030 -2.169 -3.180) 4.352 12.047 ( 8.663 1.369 11.393) 14.377 12.391 ( 10.846 -13.132 36.681) 40.442 12.595 ( -1.759 -6.088 0.592) 6.364 12.810 ( 0.921 -2.822 0.043) 2.969 12.952 ( -1.828 1.056 -1.205) 2.431 13.097 ( -2.633 -1.457 3.182) 4.380 13.704 ( 15.330 2.173 3.372) 15.847 13.885 ( 4.631 -0.689 -3.776) 6.014 14.175 ( 0.842 -0.619 2.029) 2.283 14.283 ( 0.043 7.174 -1.919) 7.427 14.466 ( -16.792 -10.947 -1.510) 20.102 15.066 ( -10.818 1.105 -9.748) 14.604 19.175 ( 3.281 8.784 0.252) 9.380 19.344 ( 19.634 27.705 -10.999) 35.694 19.934 ( 3.806 -7.310 6.451) 10.466 20.287 ( 3.103 6.897 2.884) 8.094 21.582 ( 6.404 -1.839 -0.334) 6.671 21.891 ( -3.519 -2.433 -4.242) 6.025 22.038 ( -2.967 4.427 -4.449) 6.942 22.907 ( -33.050 -11.217 -9.124) 36.075 23.748 ( -3.109 -3.249 3.886) 5.943 23.923 ( 0.979 -2.139 -2.991) 3.805 24.355 ( -0.621 -0.916 -0.922) 1.440 24.771 ( -14.576 -16.016 -3.103) 21.877======================= Grid point 79 (37/116) =======================q-point: ( 0.00 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.177 ( -1.166 22.733 6.437) 23.656 1.369 ( 0.273 20.232 20.608) 28.880 1.737 ( -3.129 25.493 13.467) 29.001 2.077 ( -0.262 7.411 -4.623) 8.739 2.385 ( 1.617 -4.795 9.919) 11.135 2.530 ( -1.875 -9.379 3.413) 10.155 2.787 ( -0.807 -6.333 -2.033) 6.700 2.928 ( 0.747 -7.706 -6.969) 10.417 3.131 ( -2.440 1.849 -0.881) 3.185 3.240 ( 0.244 1.930 4.390) 4.802 3.314 ( 2.118 -0.095 5.080) 5.505 3.532 ( -1.908 0.482 -0.577) 2.050 3.695 ( -2.247 1.641 -0.182) 2.789 3.907 ( -2.248 1.319 -2.490) 3.605 3.960 ( -2.690 3.915 -3.948) 6.176 4.170 ( 5.743 0.191 2.231) 6.165 4.460 ( 1.495 2.751 -2.171) 3.810 4.570 ( 8.851 6.095 -2.651) 11.069 4.607 ( 2.225 -4.775 -4.959) 7.235 4.642 ( -10.525 -3.160 -0.729) 11.014 4.837 ( 1.666 -2.296 -1.091) 3.039 5.153 ( -3.139 -1.057 -6.525) 7.317 5.351 ( 4.365 3.399 2.016) 5.889 5.502 ( 6.621 2.456 -5.528) 8.968 5.902 ( -3.764 -8.411 -1.309) 9.307 5.925 ( -9.291 -1.748 3.566) 10.104 6.181 ( 5.565 5.860 -0.559) 8.101 6.380 ( 2.968 6.668 -6.249) 9.608 6.418 ( 0.583 -0.423 4.136) 4.198 6.610 ( 5.592 4.331 -3.946) 8.099 6.796 ( -4.334 1.169 0.568) 4.525 6.849 ( 4.244 -2.908 -1.574) 5.380 7.057 ( -3.338 -3.589 1.111) 5.026 7.331 ( 0.635 -10.146 0.825) 10.199 7.516 ( -0.027 -0.305 -1.549) 1.579 7.760 ( 4.226 -7.494 -2.471) 8.952 8.367 ( 0.187 1.829 -1.945) 2.676 8.486 ( -2.407 3.561 0.938) 4.400 8.615 ( -2.690 -4.023 -4.356) 6.511 8.908 ( 0.725 -4.586 -1.922) 5.025 9.540 ( -1.962 5.575 5.355) 7.975 9.764 ( -0.810 8.038 3.597) 8.844 10.152 ( -0.358 5.816 0.427) 5.843 10.568 ( 1.544 6.186 -13.738) 15.146 10.787 ( -0.361 6.556 -3.215) 7.311 10.884 ( -2.991 4.521 -7.049) 8.892 11.029 ( -3.887 -3.476 5.725) 7.743 11.246 ( 1.862 -5.806 0.925) 6.167 12.200 ( -3.335 3.872 5.906) 7.810 12.281 ( 5.103 -7.695 19.489) 21.565 12.497 ( 2.509 -7.462 7.020) 10.548 12.709 ( -0.667 -6.453 -1.121) 6.583 13.019 ( 0.904 0.238 4.902) 4.990 13.110 ( 4.396 -1.017 6.642) 8.030 13.808 ( -7.477 1.314 -4.152) 8.653 13.964 ( 5.297 -1.487 2.654) 6.108 14.128 ( -2.647 0.469 0.612) 2.757 14.202 ( -1.451 -0.845 1.156) 2.038 14.487 ( 2.775 4.056 -2.682) 5.598 14.845 ( 1.363 -6.143 -6.344) 8.935 19.324 ( -2.795 8.829 1.410) 9.367 19.753 ( -4.017 -3.030 1.530) 5.259 20.249 ( 8.384 12.925 -12.553) 19.873 20.640 ( 8.834 -1.670 -2.319) 9.285 21.702 ( 12.695 0.490 -6.476) 14.260 21.845 ( 9.741 -2.987 -6.229) 11.942 21.980 ( -22.228 0.403 2.253) 22.346 22.030 ( -10.663 -0.191 1.722) 10.803 23.682 ( -1.812 2.080 4.570) 5.338 23.896 ( 1.336 -2.832 0.079) 3.133 24.357 ( 1.858 0.053 -0.908) 2.069 24.394 ( -6.783 -0.404 -0.510) 6.815======================= Grid point 80 (38/116) =======================q-point: ( 0.12 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.366 ( 13.631 17.379 7.003) 23.170 1.514 ( 7.882 17.629 21.693) 29.043 1.867 ( 13.045 21.003 8.517) 26.150 2.159 ( 5.842 3.509 1.084) 6.900 2.493 ( 5.020 -11.143 0.414) 12.228 2.550 ( 6.382 1.152 7.451) 9.878 2.818 ( 2.966 -2.041 -3.261) 4.858 2.907 ( -0.557 -8.092 -2.920) 8.621 3.133 ( 1.587 1.357 0.177) 2.095 3.210 ( -3.277 1.211 5.035) 6.128 3.352 ( 1.093 4.167 -0.562) 4.344 3.493 ( -1.568 -1.792 1.994) 3.105 3.640 ( -2.170 -0.143 -2.930) 3.649 3.743 ( -6.592 -0.278 -2.254) 6.972 4.035 ( 6.200 6.200 -3.135) 9.312 4.222 ( -5.012 1.344 -1.011) 5.287 4.410 ( -6.775 -2.760 0.036) 7.316 4.488 ( 4.295 -0.330 -2.043) 4.768 4.681 ( 5.722 3.154 3.003) 7.191 4.690 ( 1.245 4.060 -4.682) 6.320 4.902 ( 2.898 -0.565 -1.993) 3.562 5.022 ( -4.626 4.084 -4.589) 7.690 5.484 ( 6.867 -1.883 2.877) 7.680 5.616 ( 7.246 1.136 -6.150) 9.572 5.758 ( -8.001 -3.852 1.165) 8.956 5.885 ( 1.150 -8.639 0.431) 8.726 6.223 ( -6.376 1.735 -1.957) 6.892 6.290 ( 3.500 4.783 1.427) 6.096 6.580 ( -0.338 -4.607 -4.851) 6.699 6.642 ( 3.230 5.169 -2.595) 6.625 6.856 ( 6.896 1.217 2.939) 7.594 6.960 ( 5.406 -3.842 0.125) 6.633 7.067 ( 5.226 -0.998 -1.851) 5.634 7.393 ( 6.282 -7.908 -1.434) 10.201 7.547 ( 3.527 -0.662 -0.418) 3.613 7.822 ( 2.222 -5.979 -0.418) 6.393 8.358 ( -0.729 0.823 -3.040) 3.233 8.464 ( -0.147 5.969 1.486) 6.153 8.593 ( 2.110 -4.937 -6.022) 8.068 8.914 ( 0.620 -4.632 -1.834) 5.020 9.535 ( -0.220 6.107 5.190) 8.018 9.749 ( -1.526 8.001 3.676) 8.937 10.166 ( 2.087 5.318 -0.249) 5.718 10.545 ( 0.308 10.527 -11.305) 15.450 10.725 ( -4.845 4.497 -3.389) 7.428 10.826 ( 0.126 1.397 -2.953) 3.269 11.014 ( -1.120 0.336 3.294) 3.495 11.249 ( -1.136 -4.888 -0.700) 5.066 12.149 ( -3.662 3.236 6.058) 7.783 12.383 ( 1.202 -5.559 13.852) 14.974 12.532 ( -0.841 -5.179 7.904) 9.487 12.679 ( -1.536 -5.545 -1.482) 5.942 13.076 ( 2.984 -1.443 4.337) 5.458 13.207 ( 0.530 -3.452 8.401) 9.098 13.615 ( -9.992 3.558 -1.772) 10.753 13.922 ( -8.181 -3.916 -0.003) 9.070 14.110 ( -2.490 -1.250 0.728) 2.880 14.220 ( 5.871 -3.567 -1.066) 6.952 14.555 ( 5.730 4.922 -0.517) 7.571 14.993 ( 11.824 -9.050 -5.773) 15.970 19.260 ( -3.685 8.298 -0.477) 9.091 19.624 ( -9.754 2.045 -2.070) 10.179 20.177 ( -13.671 9.046 -4.390) 16.970 20.458 ( -14.571 -0.803 6.015) 15.784 21.671 ( -8.062 3.890 3.199) 9.506 21.923 ( 5.116 -0.212 -6.341) 8.150 22.058 ( 11.042 -3.371 0.587) 11.560 22.297 ( 34.794 -7.991 -15.763) 39.025 23.682 ( 0.401 3.075 4.105) 5.145 23.921 ( 1.280 -3.892 0.589) 4.139 24.280 ( -3.721 5.206 -2.898) 7.025 24.440 ( 5.879 -0.707 -0.457) 5.939======================= Grid point 81 (39/116) =======================q-point: ( 0.25 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.634 ( 11.154 15.355 9.443) 21.199 1.729 ( 6.162 12.870 23.069) 27.126 2.165 ( 10.319 5.278 -0.790) 11.617 2.234 ( 1.122 7.663 6.406) 10.050 2.568 ( 5.577 -12.035 -2.590) 13.515 2.788 ( 9.959 4.560 4.657) 11.902 2.842 ( 0.292 -2.881 -1.345) 3.193 2.912 ( 3.164 -3.711 0.734) 4.932 3.136 ( -0.825 7.009 -1.652) 7.249 3.235 ( 5.490 0.789 3.146) 6.376 3.389 ( 3.513 -1.106 -1.605) 4.017 3.515 ( 3.580 -0.447 1.908) 4.081 3.601 ( -0.777 -2.565 -4.644) 5.362 3.676 ( -0.997 0.942 0.727) 1.552 4.035 ( -3.405 0.775 -3.609) 5.022 4.232 ( 3.016 5.632 2.033) 6.704 4.310 ( -0.052 -0.468 -1.254) 1.339 4.539 ( 1.724 2.102 -1.936) 3.338 4.634 ( -3.382 3.244 -4.012) 6.169 4.824 ( -4.491 -0.762 -1.537) 4.807 4.919 ( 12.335 4.195 0.755) 13.051 5.049 ( 5.036 5.112 -1.070) 7.255 5.586 ( -2.685 -3.483 7.117) 8.366 5.632 ( 0.729 -2.822 -2.862) 4.085 5.757 ( 7.851 0.342 -2.389) 8.214 5.920 ( 1.589 -5.956 -2.794) 6.768 6.124 ( -2.429 -1.143 -3.581) 4.476 6.341 ( 0.969 0.831 0.075) 1.279 6.467 ( -6.423 -5.294 -1.418) 8.443 6.707 ( 2.105 3.467 -3.039) 5.068 6.935 ( -0.267 -1.310 0.594) 1.463 7.051 ( 4.878 -0.700 0.273) 4.935 7.137 ( 1.367 0.516 -1.308) 1.962 7.541 ( 6.356 -11.805 -1.165) 13.458 7.626 ( 4.323 2.494 -1.888) 5.336 7.858 ( 2.260 -3.137 1.064) 4.010 8.323 ( -1.579 1.869 -2.824) 3.737 8.457 ( -1.218 4.300 -0.270) 4.477 8.656 ( 4.794 -3.807 -3.234) 6.923 8.925 ( 1.027 -4.458 -2.055) 5.015 9.561 ( 1.381 7.045 4.687) 8.573 9.742 ( -0.203 7.134 4.716) 8.554 10.242 ( 5.937 2.307 -0.645) 6.402 10.509 ( -2.197 12.823 -4.425) 13.742 10.643 ( -1.569 -2.349 -5.036) 5.774 10.837 ( 1.469 5.491 -2.457) 6.192 10.972 ( -3.922 0.988 1.550) 4.332 11.219 ( -1.091 -1.360 -2.712) 3.224 12.093 ( -3.666 3.570 4.558) 6.852 12.410 ( -2.315 -0.392 12.402) 12.623 12.543 ( 0.051 -7.927 4.239) 8.989 12.670 ( 1.710 -3.302 -0.564) 3.762 13.137 ( 0.057 -0.574 4.059) 4.099 13.148 ( -5.345 -3.387 1.535) 6.511 13.452 ( -6.357 5.565 2.017) 8.686 13.753 ( -7.726 -1.806 0.377) 7.943 14.027 ( -4.949 -0.377 0.151) 4.966 14.388 ( 9.419 -10.581 -0.545) 14.177 14.664 ( 4.568 3.834 -0.041) 5.963 15.177 ( 8.067 -9.213 -5.237) 13.319 19.175 ( -5.758 8.034 -0.493) 9.897 19.382 ( -11.235 9.128 -3.288) 14.844 19.901 ( -11.453 -2.590 6.470) 13.407 20.271 ( -7.967 -4.133 0.886) 9.019 21.585 ( -2.745 6.203 3.175) 7.490 22.019 ( 6.787 0.668 -3.392) 7.617 22.267 ( 9.048 -1.091 -0.253) 9.117 22.870 ( 27.171 -13.196 -16.482) 34.410 23.708 ( 0.732 2.401 3.159) 4.035 23.953 ( 1.841 -6.115 0.350) 6.396 24.225 ( -1.240 8.750 -2.675) 9.234 24.567 ( 6.846 -1.206 -1.426) 7.096======================= Grid point 82 (40/116) =======================q-point: ( 0.38 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.775 ( -1.091 14.867 10.774) 18.393 1.896 ( 4.158 7.703 19.797) 21.646 2.191 ( -5.498 12.087 3.750) 13.798 2.313 ( 9.256 -0.878 -0.342) 9.304 2.669 ( 4.183 -8.436 -1.605) 9.552 2.797 ( -3.337 -3.332 -1.333) 4.901 2.895 ( -0.104 1.636 6.587) 6.788 3.036 ( 5.408 -3.395 1.793) 6.632 3.141 ( 2.570 2.598 -4.663) 5.924 3.355 ( 3.640 -1.595 -5.888) 7.103 3.457 ( 3.952 0.702 3.352) 5.230 3.584 ( 0.690 0.006 -3.473) 3.541 3.651 ( 6.824 1.143 2.212) 7.264 3.678 ( 1.703 -0.012 1.973) 2.606 4.012 ( 1.818 -1.097 0.508) 2.183 4.187 ( -4.834 -3.683 3.538) 7.032 4.410 ( 5.200 9.584 -3.446) 11.435 4.561 ( -1.966 6.531 -4.697) 8.281 4.590 ( 3.402 6.720 0.003) 7.532 4.758 ( -0.903 -1.947 -2.068) 2.980 5.057 ( 3.000 -0.164 -2.958) 4.216 5.207 ( 8.234 3.375 -0.115) 8.900 5.501 ( -3.822 0.166 4.244) 5.714 5.697 ( 2.106 -1.787 1.085) 2.967 5.889 ( 4.495 -2.080 0.220) 4.957 5.914 ( 0.982 -3.115 -6.276) 7.075 6.109 ( 1.567 0.026 -1.856) 2.429 6.325 ( -1.613 -7.948 -4.520) 9.284 6.385 ( -1.540 -0.619 2.351) 2.877 6.683 ( -3.889 -1.563 -1.209) 4.362 6.897 ( -1.897 2.838 -3.672) 5.013 7.082 ( -1.619 1.883 -0.545) 2.542 7.189 ( 4.330 0.891 0.569) 4.457 7.562 ( -2.951 -9.449 3.195) 10.403 7.698 ( 3.242 0.971 -7.292) 8.039 7.918 ( 2.833 -2.231 1.925) 4.088 8.299 ( 0.133 1.091 -2.021) 2.300 8.424 ( -1.621 2.980 -0.337) 3.409 8.726 ( 2.699 -2.677 0.136) 3.804 8.936 ( 0.480 -3.907 -2.294) 4.556 9.609 ( 1.934 8.154 4.163) 9.358 9.763 ( 0.343 5.318 6.025) 8.044 10.382 ( 7.898 -2.250 0.186) 8.215 10.445 ( -2.424 8.124 -2.793) 8.926 10.621 ( -0.373 -0.990 -3.926) 4.066 10.855 ( -0.672 5.728 1.155) 5.882 10.901 ( -0.835 4.970 -3.866) 6.352 11.188 ( -1.305 3.646 -3.330) 5.107 12.036 ( -3.270 3.921 3.319) 6.090 12.386 ( -2.988 2.851 9.442) 10.306 12.541 ( -0.795 -9.729 0.104) 9.762 12.741 ( 4.347 -3.427 1.888) 5.849 13.002 ( -6.156 1.340 -0.467) 6.318 13.160 ( -1.122 -5.087 2.635) 5.838 13.384 ( -1.461 6.306 3.338) 7.283 13.636 ( -4.933 -0.738 1.128) 5.114 13.948 ( -2.778 0.605 0.534) 2.893 14.539 ( 5.964 -11.577 -0.467) 13.032 14.716 ( 0.846 2.828 -0.430) 2.983 15.273 ( 3.660 -7.335 -4.933) 9.567 19.026 ( -7.630 9.732 1.480) 12.455 19.267 ( -0.582 5.561 -4.285) 7.045 19.747 ( -7.312 -6.921 7.283) 12.426 20.151 ( -3.976 -10.180 -0.412) 10.937 21.559 ( -1.320 8.702 2.755) 9.222 22.149 ( 7.007 1.724 -3.598) 8.063 22.382 ( 2.424 1.237 0.563) 2.779 23.254 ( 17.120 -12.309 -11.511) 24.023 23.710 ( -1.667 0.931 2.626) 3.247 23.982 ( 0.765 -7.775 -2.098) 8.089 24.222 ( 1.562 10.101 0.717) 10.246 24.678 ( 4.892 -1.850 -2.522) 5.806======================= Grid point 83 (41/116) =======================q-point: (-0.50 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.725 ( -5.434 14.050 9.472) 17.794 1.869 ( -10.301 7.897 8.818) 15.692 2.205 ( 4.034 11.678 12.354) 17.472 2.508 ( 8.616 0.519 -2.471) 8.978 2.686 ( -5.256 0.862 4.496) 6.970 2.745 ( 2.743 -3.609 -2.981) 5.425 2.885 ( -1.591 -3.406 4.610) 5.948 3.093 ( 0.251 -7.769 3.646) 8.585 3.169 ( 0.514 -4.066 -3.490) 5.383 3.374 ( 0.711 -4.078 -5.537) 6.913 3.483 ( 0.430 2.924 -1.709) 3.414 3.589 ( -1.774 2.094 -0.826) 2.866 3.696 ( -1.127 1.768 2.914) 3.590 3.772 ( 3.679 0.552 0.820) 3.809 4.062 ( -2.886 -1.230 4.411) 5.412 4.116 ( 1.666 -3.404 2.548) 4.566 4.462 ( 1.610 8.962 -2.237) 9.377 4.507 ( -2.315 7.374 -6.668) 10.207 4.648 ( 1.720 9.009 0.610) 9.192 4.765 ( 0.989 -1.825 -1.106) 2.352 5.068 ( -0.562 -3.013 -4.140) 5.151 5.272 ( -1.288 0.683 -1.660) 2.210 5.459 ( -2.908 4.034 2.140) 5.413 5.680 ( -3.353 0.421 -1.250) 3.603 5.874 ( -0.609 -3.809 -2.973) 4.870 6.005 ( 4.605 -2.305 -0.788) 5.210 6.166 ( 3.898 0.677 -0.358) 3.972 6.297 ( -1.388 -3.962 -0.669) 4.251 6.387 ( 2.205 -3.912 -0.198) 4.495 6.615 ( -1.353 -3.915 -0.648) 4.193 6.858 ( -0.072 4.439 -5.508) 7.074 7.038 ( -2.408 1.770 -2.146) 3.679 7.264 ( 2.838 1.814 2.044) 3.940 7.502 ( -3.186 -8.146 2.860) 9.203 7.699 ( -0.277 -0.390 -8.261) 8.275 7.949 ( -1.015 -4.259 1.438) 4.608 8.313 ( 1.949 1.059 -2.625) 3.437 8.411 ( 0.364 4.442 1.962) 4.870 8.768 ( 1.483 -3.129 1.785) 3.895 8.924 ( -0.875 -3.376 -2.775) 4.457 9.650 ( 0.928 9.117 3.780) 9.913 9.773 ( -1.454 3.803 6.841) 7.960 10.400 ( -1.052 4.003 -2.214) 4.694 10.511 ( 0.985 -5.136 0.982) 5.321 10.603 ( 2.699 0.605 -1.847) 3.326 10.823 ( -0.815 1.863 -0.984) 2.259 10.932 ( 2.619 12.617 -3.257) 13.292 11.165 ( 0.841 6.169 -3.532) 7.158 11.987 ( -2.611 3.869 2.492) 5.291 12.356 ( -2.556 3.155 7.385) 8.427 12.519 ( -1.233 -9.577 -1.609) 9.789 12.785 ( -1.299 -5.317 0.835) 5.536 12.963 ( 2.387 2.992 2.209) 4.419 13.122 ( -2.496 -3.815 0.205) 4.563 13.395 ( 0.335 4.482 4.567) 6.407 13.570 ( -1.308 -0.955 0.023) 1.620 13.937 ( 1.304 1.533 2.117) 2.921 14.611 ( 1.620 -11.080 -0.851) 11.230 14.699 ( -2.162 3.235 -0.918) 3.998 15.299 ( 0.611 -6.371 -4.862) 8.038 18.945 ( -0.753 9.510 1.385) 9.640 19.288 ( 3.500 4.227 -4.041) 6.815 19.654 ( -4.233 -7.352 6.752) 10.843 20.122 ( 0.878 -12.916 0.001) 12.946 21.537 ( -1.728 9.352 1.638) 9.650 22.242 ( 2.423 -2.925 -1.920) 4.256 22.367 ( -2.971 8.252 -1.571) 8.910 23.478 ( 8.217 -13.125 -7.126) 17.046 23.660 ( -3.401 1.808 2.532) 4.610 23.959 ( -1.901 -5.111 -3.940) 6.728 24.285 ( 3.580 6.202 3.861) 8.135 24.734 ( 1.688 -2.977 -2.793) 4.417======================= Grid point 84 (42/116) =======================q-point: (-0.38 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.621 ( -10.202 12.138 11.075) 19.341 1.693 ( -7.018 15.027 5.776) 17.562 2.297 ( -0.015 7.853 10.549) 13.151 2.509 ( -3.222 7.649 -0.348) 8.307 2.684 ( -1.331 -1.760 3.378) 4.035 2.784 ( -0.290 -5.007 3.058) 5.874 2.864 ( -1.111 -5.976 0.207) 6.082 3.077 ( -2.269 -5.897 3.893) 7.422 3.142 ( -2.131 -5.136 -1.720) 5.820 3.347 ( -3.643 -5.419 -3.169) 7.258 3.437 ( -7.997 8.030 1.725) 11.463 3.517 ( -0.617 0.719 -1.711) 1.956 3.661 ( -1.398 -1.427 -1.194) 2.327 3.836 ( 4.052 1.809 -0.620) 4.480 3.977 ( -5.202 0.961 6.443) 8.336 4.196 ( 3.301 -0.838 1.649) 3.784 4.410 ( -5.871 6.562 -7.533) 11.588 4.480 ( 1.290 3.915 -1.223) 4.300 4.676 ( 1.707 9.532 1.053) 9.740 4.751 ( -2.314 -1.455 -3.727) 4.622 5.033 ( -0.887 -4.646 -4.371) 6.440 5.151 ( -10.307 0.362 -1.180) 10.380 5.390 ( -3.432 4.376 0.645) 5.598 5.602 ( -3.625 0.389 -3.552) 5.090 5.887 ( 2.362 -1.977 0.451) 3.113 6.067 ( 2.435 -2.432 -0.388) 3.463 6.200 ( -1.139 -2.108 -5.428) 5.934 6.273 ( 0.659 3.637 5.704) 6.796 6.476 ( 4.301 -6.695 0.891) 8.007 6.600 ( -0.330 -2.774 -4.632) 5.409 6.881 ( 2.841 0.264 -3.323) 4.380 6.978 ( -2.057 3.193 -3.981) 5.502 7.300 ( -0.418 2.074 3.131) 3.778 7.470 ( -0.945 -10.294 0.793) 10.368 7.657 ( -1.127 -1.438 -7.991) 8.198 7.876 ( -6.475 -6.508 0.467) 9.192 8.350 ( 2.111 3.804 -3.071) 5.326 8.451 ( 2.709 4.691 3.418) 6.405 8.794 ( 0.554 -2.684 2.361) 3.617 8.892 ( -1.250 -3.688 -3.930) 5.533 9.663 ( -0.687 9.586 3.057) 10.085 9.751 ( -2.640 3.314 7.465) 8.584 10.361 ( -3.985 -2.025 -0.002) 4.469 10.461 ( -1.167 5.657 -1.986) 6.107 10.722 ( 6.924 -3.064 -1.507) 7.720 10.824 ( 1.203 2.402 -0.808) 2.805 10.947 ( -0.004 10.328 -0.190) 10.330 11.219 ( 5.017 4.545 -4.372) 8.058 11.949 ( -2.034 3.542 2.541) 4.810 12.331 ( -2.351 2.787 7.549) 8.384 12.483 ( -1.959 -10.251 -1.915) 10.610 12.739 ( -2.652 -4.966 1.150) 5.746 13.029 ( 1.293 1.018 0.646) 1.768 13.097 ( 0.859 -1.050 0.958) 1.660 13.410 ( 1.202 4.088 3.527) 5.532 13.609 ( 4.951 -0.888 0.130) 5.032 14.000 ( 3.982 1.342 3.228) 5.299 14.593 ( -3.856 -14.771 1.056) 15.302 14.634 ( -3.550 8.836 -3.531) 10.156 15.268 ( -2.542 -6.748 -5.085) 8.823 19.013 ( 7.714 10.957 0.462) 13.408 19.365 ( 4.942 6.643 -2.028) 8.524 19.634 ( 0.723 -7.119 4.755) 8.591 20.173 ( 3.819 -11.473 0.689) 12.111 21.505 ( -1.595 7.651 0.135) 7.816 22.168 ( -9.268 -8.897 1.885) 12.985 22.327 ( -0.304 15.128 -6.685) 16.542 23.439 ( -9.663 -12.496 -1.964) 15.918 23.687 ( 4.460 0.397 -0.048) 4.478 23.901 ( -2.743 -3.033 -3.147) 5.160 24.354 ( 1.917 2.715 3.639) 4.928 24.730 ( -1.387 -5.237 -1.489) 5.618======================= Grid point 85 (43/116) =======================q-point: (-0.25 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.443 ( -10.431 14.886 15.306) 23.763 1.586 ( -7.685 18.730 5.532) 20.988 2.277 ( -2.690 4.191 9.329) 10.575 2.382 ( -20.624 9.860 7.376) 24.020 2.512 ( -8.133 4.157 -5.627) 10.729 2.721 ( -7.779 -12.121 3.780) 14.890 2.860 ( 0.861 -5.078 -1.546) 5.378 3.070 ( 1.239 -0.828 6.044) 6.225 3.128 ( 1.125 0.643 0.015) 1.296 3.182 ( -9.641 -4.918 0.649) 10.843 3.346 ( -3.630 2.497 -2.143) 4.900 3.497 ( -0.341 1.403 1.281) 1.930 3.665 ( 2.506 -1.769 -0.640) 3.134 3.871 ( -4.290 3.061 4.342) 6.828 3.987 ( 7.880 1.762 -1.957) 8.308 4.244 ( -7.965 6.226 -3.751) 10.783 4.255 ( 3.677 1.633 -1.240) 4.210 4.524 ( 3.238 -1.166 -0.760) 3.525 4.634 ( -8.888 -2.184 -8.210) 12.295 4.733 ( 3.857 6.686 0.531) 7.737 4.959 ( -6.099 -1.844 -1.548) 6.556 5.028 ( 1.133 -2.903 -1.171) 3.329 5.352 ( -0.474 4.710 -1.157) 4.874 5.511 ( -4.637 0.718 -4.350) 6.399 5.960 ( 4.212 -0.914 3.365) 5.468 6.083 ( -1.059 -2.864 1.657) 3.474 6.167 ( -0.666 3.581 -5.167) 6.321 6.285 ( -2.049 -0.423 2.584) 3.325 6.497 ( -0.799 -4.560 0.028) 4.630 6.586 ( 0.340 -3.239 -7.278) 7.973 6.893 ( -0.576 -0.490 -1.452) 1.637 6.962 ( 0.058 2.689 -3.598) 4.492 7.256 ( -5.010 -0.086 2.876) 5.777 7.437 ( -3.125 -12.225 -0.649) 12.635 7.629 ( 0.293 -3.821 -7.358) 8.296 7.728 ( -7.453 -4.875 0.694) 8.933 8.368 ( 0.745 4.722 -3.021) 5.655 8.512 ( 1.883 3.513 2.720) 4.825 8.790 ( -2.181 -2.037 0.305) 2.999 8.870 ( 0.727 -4.816 -3.096) 5.772 9.635 ( -3.185 7.364 3.924) 8.931 9.736 ( -0.593 6.039 6.134) 8.628 10.258 ( -5.500 0.035 1.025) 5.595 10.486 ( 3.721 6.428 -4.668) 8.772 10.794 ( 1.308 4.221 -3.066) 5.379 10.870 ( 2.450 1.263 -1.920) 3.359 10.992 ( 5.301 0.808 4.671) 7.112 11.275 ( 0.891 -0.323 -5.699) 5.777 11.942 ( 1.060 3.415 6.535) 7.449 12.305 ( -3.155 2.613 9.507) 10.352 12.440 ( -1.440 -10.395 -0.870) 10.531 12.707 ( -0.837 -5.731 1.057) 5.888 13.019 ( -0.839 2.128 -1.117) 2.545 13.113 ( -1.240 -0.757 1.722) 2.253 13.520 ( 9.423 4.580 3.137) 10.937 13.738 ( 7.713 -1.178 0.004) 7.802 14.091 ( 3.917 0.215 3.244) 5.091 14.469 ( -8.896 -11.697 3.049) 15.008 14.546 ( -4.274 9.301 -5.750) 11.741 15.163 ( -6.776 -7.605 -5.607) 11.627 19.230 ( 12.063 10.731 0.548) 16.155 19.479 ( 10.090 13.837 -2.111) 17.255 19.704 ( 4.479 -6.517 3.278) 8.560 20.261 ( 5.086 -5.786 0.094) 7.704 21.494 ( 1.238 3.911 -1.297) 4.302 21.971 ( -9.994 -6.004 -0.727) 11.682 22.271 ( -3.924 10.920 -5.177) 12.706 23.156 ( -19.210 -12.797 -2.465) 23.214 23.748 ( 0.430 -0.173 2.589) 2.630 23.852 ( -0.591 -2.977 -2.707) 4.067 24.372 ( -0.742 1.332 1.338) 2.029 24.672 ( -4.705 -7.896 0.804) 9.227======================= Grid point 86 (44/116) =======================q-point: (-0.12 0.29 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.317 ( -8.883 17.820 15.879) 25.468 1.411 ( -10.805 20.581 9.719) 25.195 1.930 ( -21.127 20.415 10.799) 31.300 2.217 ( -8.870 9.055 -2.547) 12.929 2.363 ( -3.199 -2.956 7.186) 8.403 2.585 ( -5.295 -11.954 1.972) 13.222 2.867 ( -2.097 -6.445 -1.491) 6.939 2.954 ( -6.664 -6.231 -4.305) 10.088 3.159 ( 3.851 1.757 3.984) 5.813 3.222 ( 3.213 0.829 1.575) 3.673 3.250 ( -3.684 0.247 2.272) 4.336 3.534 ( 2.229 2.168 0.789) 3.207 3.740 ( -0.271 0.598 2.395) 2.483 3.808 ( 3.589 2.838 -0.708) 4.630 4.035 ( -2.910 4.782 -3.470) 6.586 4.217 ( 0.501 1.038 0.160) 1.163 4.345 ( 6.825 1.751 -4.621) 8.427 4.429 ( -2.561 1.780 -3.839) 4.946 4.579 ( 2.020 -1.797 -0.986) 2.878 4.806 ( 2.851 0.062 -0.544) 2.903 4.861 ( -6.855 -5.479 -3.630) 9.497 5.096 ( 6.577 -1.914 -2.206) 7.196 5.353 ( -0.670 6.196 -0.698) 6.271 5.427 ( -0.139 2.305 -5.081) 5.581 6.003 ( -4.059 -5.400 1.830) 6.999 6.061 ( -3.300 1.454 5.501) 6.578 6.119 ( 0.014 3.496 -4.430) 5.643 6.247 ( 1.560 -0.786 -2.024) 2.673 6.522 ( 4.038 0.486 -4.252) 5.884 6.543 ( -3.969 0.735 -2.360) 4.676 6.845 ( -2.797 -2.752 -3.461) 5.233 6.917 ( -4.886 2.307 -0.677) 5.446 7.142 ( -6.183 -3.069 2.765) 7.436 7.363 ( -3.594 -11.952 0.034) 12.481 7.559 ( -4.033 -2.151 -2.255) 5.097 7.694 ( 2.919 -5.824 -3.344) 7.323 8.368 ( 0.291 3.666 -2.359) 4.369 8.524 ( -1.192 2.557 1.278) 3.096 8.709 ( -5.129 -3.712 -2.414) 6.776 8.892 ( 1.540 -4.483 -1.736) 5.048 9.579 ( -3.482 5.687 5.107) 8.399 9.755 ( 0.483 8.039 4.327) 9.143 10.179 ( -2.796 3.569 0.861) 4.614 10.548 ( 4.014 5.024 -9.278) 11.288 10.796 ( 0.126 5.326 -2.775) 6.006 10.898 ( 1.629 4.304 -3.264) 5.642 11.114 ( 1.642 -4.320 4.476) 6.434 11.209 ( -2.819 -4.407 -4.755) 7.069 12.067 ( 8.430 0.528 14.992) 17.208 12.258 ( -4.357 1.290 10.317) 11.274 12.439 ( 1.186 -8.153 2.563) 8.629 12.709 ( 0.529 -6.605 -0.164) 6.628 13.007 ( -0.342 3.092 1.932) 3.662 13.077 ( -1.777 -0.287 1.748) 2.510 13.756 ( 12.622 2.517 3.524) 13.344 13.863 ( 3.654 -1.153 -2.469) 4.558 14.154 ( 1.239 -0.901 2.765) 3.161 14.293 ( -8.975 -4.921 2.251) 10.480 14.462 ( -1.255 7.691 -4.757) 9.130 14.979 ( -9.626 -7.262 -6.107) 13.517 19.346 ( 0.451 8.290 3.032) 8.838 19.771 ( 2.921 -2.541 -0.567) 3.913 19.882 ( 27.542 15.366 -6.717) 32.246 20.384 ( 8.956 1.736 -0.876) 9.165 21.560 ( 5.964 0.220 -2.106) 6.329 21.815 ( -4.414 -4.686 -3.623) 7.387 22.149 ( -7.111 5.871 -2.450) 9.542 22.652 ( -32.354 -11.251 -2.165) 34.322 23.720 ( -3.091 0.583 4.143) 5.202 23.867 ( 1.773 -2.814 -1.179) 3.529 24.351 ( -0.898 0.640 -0.424) 1.182 24.548 ( -8.067 -6.566 1.209) 10.472======================= Grid point 87 (45/116) =======================q-point: ( 0.00 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.640 ( -1.013 20.367 5.257) 21.059 1.789 ( 0.296 18.734 14.177) 23.495 1.993 ( -2.248 -8.492 8.931) 12.527 2.121 ( -1.366 -9.092 1.149) 9.265 2.317 ( -2.180 6.987 -0.569) 7.341 2.442 ( 1.775 1.537 6.682) 7.083 2.627 ( 0.476 -4.449 0.206) 4.479 2.748 ( 2.194 -9.406 -0.636) 9.679 3.209 ( -3.547 3.791 0.513) 5.217 3.255 ( -1.117 -0.816 4.140) 4.365 3.391 ( 2.977 7.756 3.435) 8.990 3.537 ( -2.226 -2.814 1.187) 3.780 3.755 ( -4.222 3.887 -2.176) 6.137 3.850 ( -4.954 -4.833 -3.210) 7.629 4.069 ( 2.055 4.873 -2.502) 5.850 4.149 ( 2.582 -2.531 0.249) 3.624 4.407 ( -0.113 -1.327 -1.017) 1.676 4.475 ( -1.029 -6.303 -2.386) 6.818 4.619 ( 5.483 1.271 -1.922) 5.947 4.672 ( 8.659 -2.094 -1.072) 8.973 4.885 ( -1.526 9.262 -3.620) 10.061 5.074 ( -0.532 -6.666 -5.558) 8.695 5.471 ( 2.923 5.539 -2.286) 6.667 5.537 ( 5.802 -0.210 -6.804) 8.944 5.782 ( -8.485 -0.713 1.424) 8.633 5.854 ( -10.670 -4.814 0.752) 11.730 6.315 ( 5.037 5.655 2.770) 8.063 6.398 ( 1.792 -2.127 4.318) 5.136 6.533 ( 1.336 7.812 -5.410) 9.596 6.687 ( 9.073 -1.398 -4.096) 10.052 6.722 ( -3.907 -1.426 -1.590) 4.453 6.800 ( 1.518 -3.451 -1.867) 4.207 7.040 ( -1.995 2.330 1.879) 3.597 7.142 ( 0.272 -6.897 1.750) 7.121 7.536 ( 1.927 2.133 -3.547) 4.566 7.617 ( 3.441 -5.542 -2.455) 6.970 8.430 ( -2.007 3.823 -2.328) 4.905 8.518 ( -3.255 -4.157 -1.710) 5.550 8.602 ( -0.201 6.580 0.776) 6.629 8.764 ( 0.443 -7.924 -0.160) 7.938 9.676 ( -1.625 6.773 5.606) 8.941 9.801 ( -1.366 -3.869 4.888) 6.382 10.363 ( -0.057 12.527 -1.441) 12.609 10.580 ( 1.050 -5.946 -7.088) 9.311 10.908 ( 1.614 5.324 -3.011) 6.326 10.960 ( -2.777 2.237 -5.531) 6.580 10.994 ( -1.284 0.387 4.405) 4.604 11.099 ( 0.368 -7.319 1.808) 7.548 12.204 ( 0.705 1.855 13.327) 13.474 12.285 ( -1.073 -2.874 7.497) 8.100 12.404 ( 3.443 3.514 2.394) 5.471 12.553 ( 0.531 -7.939 -0.594) 7.979 13.049 ( 0.206 2.026 2.927) 3.566 13.088 ( 1.882 -1.404 3.346) 4.088 13.850 ( -4.500 2.706 -2.459) 5.798 13.915 ( -0.189 -3.031 0.263) 3.049 14.145 ( -1.376 1.292 1.626) 2.491 14.177 ( -0.755 -1.495 1.813) 2.469 14.588 ( 2.085 5.319 -3.531) 6.716 14.710 ( 1.304 -6.171 -4.765) 7.905 19.505 ( -2.881 7.886 2.832) 8.860 19.652 ( -2.983 -5.946 3.686) 7.605 20.469 ( 5.896 7.826 -8.187) 12.768 20.588 ( 4.734 -3.652 -4.586) 7.535 21.722 ( 12.322 1.635 -6.750) 14.145 21.775 ( 11.796 -3.202 -6.744) 13.960 21.997 ( -17.266 1.064 2.462) 17.473 22.019 ( -12.748 -0.867 2.255) 12.975 23.747 ( -0.309 3.668 2.974) 4.732 23.826 ( 0.613 -3.649 1.525) 4.002 24.362 ( 0.680 0.477 -0.623) 1.038 24.378 ( -2.170 -0.913 -0.327) 2.377======================= Grid point 88 (46/116) =======================q-point: ( 0.12 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.731 ( 7.659 16.675 5.059) 19.035 1.872 ( 2.846 14.427 15.957) 21.699 2.050 ( 5.512 -6.434 7.677) 11.433 2.180 ( 5.349 -10.792 1.763) 12.173 2.366 ( 7.229 11.046 -0.037) 13.201 2.577 ( 9.878 -4.449 4.022) 11.556 2.728 ( 7.891 0.257 1.311) 8.003 2.815 ( 3.340 -3.327 -0.349) 4.727 3.147 ( -1.096 2.277 1.774) 3.087 3.210 ( -2.800 -2.123 3.803) 5.178 3.463 ( 1.532 3.260 2.030) 4.135 3.479 ( -4.323 0.414 0.073) 4.343 3.636 ( -5.131 2.293 -3.347) 6.541 3.727 ( -3.250 -3.088 -3.590) 5.743 4.143 ( 2.259 3.481 -4.095) 5.830 4.218 ( 2.922 -1.970 -0.638) 3.581 4.324 ( -5.589 -0.484 -0.672) 5.650 4.418 ( 1.096 -5.508 -2.097) 5.995 4.743 ( 2.661 4.714 0.730) 5.462 4.848 ( 2.629 -4.273 -0.605) 5.054 4.879 ( 6.101 9.739 -2.300) 11.720 5.042 ( 2.029 -4.011 -2.894) 5.346 5.525 ( 1.203 5.725 -0.887) 5.917 5.632 ( 5.074 -0.753 -9.410) 10.718 5.678 ( -5.618 -2.622 1.062) 6.290 5.718 ( 2.227 -6.200 0.929) 6.653 6.274 ( -8.733 3.114 -1.746) 9.435 6.337 ( -3.611 -1.666 -0.003) 3.977 6.584 ( -0.346 5.115 -0.217) 5.132 6.695 ( 2.210 -2.268 0.063) 3.167 6.853 ( 6.786 0.606 -0.241) 6.817 6.898 ( 6.622 -2.220 -0.769) 7.026 7.082 ( 5.448 2.853 -0.001) 6.150 7.199 ( 4.982 -8.035 1.311) 9.544 7.600 ( 5.401 3.804 -2.330) 7.005 7.698 ( 4.764 -5.384 -0.565) 7.211 8.400 ( -0.379 3.215 -3.664) 4.889 8.487 ( 0.521 -4.734 -4.896) 6.830 8.607 ( 0.825 7.443 1.778) 7.697 8.773 ( 0.665 -7.775 0.166) 7.805 9.679 ( 0.312 6.919 5.176) 8.646 9.798 ( -0.243 -3.170 4.355) 5.392 10.343 ( -1.234 10.898 -1.155) 11.028 10.561 ( -1.111 -8.115 -5.595) 9.919 10.853 ( -5.211 9.269 -2.157) 10.850 10.946 ( 3.360 6.661 -3.311) 8.163 11.000 ( -1.700 -2.564 1.774) 3.551 11.108 ( 1.437 -7.877 -0.925) 8.061 12.214 ( -2.426 3.112 8.553) 9.419 12.294 ( -0.132 -3.929 7.246) 8.244 12.468 ( 1.235 1.080 6.786) 6.982 12.557 ( 0.218 -5.795 0.874) 5.865 13.087 ( 2.008 2.207 2.908) 4.167 13.146 ( 1.631 -2.923 4.106) 5.298 13.704 ( -8.143 4.871 -1.331) 9.582 13.817 ( -7.529 -5.504 -0.801) 9.361 14.113 ( -2.608 1.455 0.563) 3.039 14.158 ( -0.935 -2.523 0.056) 2.692 14.679 ( 7.255 6.402 -2.454) 9.982 14.823 ( 9.478 -7.245 -4.322) 12.688 19.434 ( -4.687 7.698 0.698) 9.040 19.574 ( -5.566 -5.192 1.118) 7.693 20.343 ( -17.414 5.955 -3.164) 18.674 20.429 ( -14.494 -2.352 0.012) 14.684 21.768 ( -4.911 5.215 4.153) 8.280 21.880 ( -0.394 -4.566 2.721) 5.330 22.047 ( 18.360 3.049 -9.201) 20.762 22.151 ( 25.133 -6.085 -11.766) 28.410 23.758 ( 0.369 3.865 3.025) 4.922 23.840 ( 0.247 -3.818 1.915) 4.278 24.359 ( 0.546 2.793 -1.232) 3.102 24.410 ( 4.108 -2.014 -0.587) 4.613======================= Grid point 89 (47/116) =======================q-point: ( 0.25 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.911 ( 7.546 10.521 8.818) 15.665 1.972 ( 2.553 7.520 14.748) 16.750 2.194 ( 5.763 0.097 7.239) 9.254 2.305 ( 7.832 -9.879 -0.602) 12.621 2.518 ( 4.093 12.399 0.456) 13.065 2.730 ( 1.310 -7.355 1.337) 7.590 2.863 ( 4.560 1.974 2.914) 5.760 2.883 ( 6.685 0.457 0.337) 6.710 3.178 ( 1.699 1.410 3.167) 3.860 3.249 ( 3.288 -3.766 1.625) 5.257 3.398 ( 0.118 2.690 -1.838) 3.260 3.464 ( 1.745 -3.803 -2.675) 4.966 3.615 ( 2.450 5.210 -0.203) 5.761 3.706 ( 0.631 -1.115 -0.883) 1.556 4.056 ( -5.482 2.363 -2.840) 6.611 4.164 ( -6.281 -7.104 -0.494) 9.495 4.404 ( 10.478 6.257 -1.601) 12.309 4.514 ( 7.282 -3.648 -2.750) 8.596 4.720 ( -1.563 4.664 -4.598) 6.733 4.804 ( -3.103 -2.492 -4.055) 5.681 5.048 ( 7.524 6.835 3.670) 10.808 5.133 ( 5.081 0.546 2.069) 5.513 5.535 ( -0.593 -0.357 2.794) 2.878 5.571 ( -0.430 -2.694 -1.298) 3.021 5.762 ( 6.746 0.432 -3.798) 7.753 5.804 ( 4.758 -4.111 -3.544) 7.218 6.130 ( -4.438 2.501 -4.477) 6.782 6.232 ( -4.949 -6.639 -4.221) 9.295 6.545 ( -3.978 7.540 3.053) 9.055 6.692 ( -3.356 -5.122 1.503) 6.305 6.949 ( 3.628 3.019 -1.105) 4.847 7.018 ( 5.410 -2.604 -0.546) 6.029 7.179 ( 3.615 3.727 -0.225) 5.197 7.310 ( 4.866 -8.801 0.960) 10.102 7.704 ( 4.929 3.979 -1.298) 6.467 7.787 ( 4.379 -3.702 0.449) 5.752 8.377 ( -1.061 3.886 -4.171) 5.799 8.472 ( -0.920 -3.892 -5.644) 6.917 8.659 ( 3.470 5.103 2.301) 6.586 8.796 ( 1.632 -6.884 0.505) 7.092 9.717 ( 2.033 6.931 4.835) 8.692 9.817 ( 0.877 -1.294 4.330) 4.603 10.327 ( 0.163 6.955 -0.070) 6.957 10.506 ( -3.251 -8.597 -2.246) 9.462 10.763 ( -3.023 10.426 -2.545) 11.150 10.931 ( -4.912 -4.696 0.894) 6.854 11.017 ( 4.934 8.379 -3.961) 10.500 11.160 ( 3.965 -4.591 -3.649) 7.079 12.181 ( -2.631 4.816 4.370) 7.015 12.306 ( -0.614 -7.029 4.609) 8.428 12.498 ( 0.061 2.473 7.544) 7.939 12.582 ( 1.862 -4.688 3.220) 5.984 13.108 ( -1.247 0.513 1.072) 1.722 13.133 ( -3.330 -1.185 1.158) 3.719 13.574 ( -5.200 5.648 2.464) 8.063 13.684 ( -5.762 -4.479 1.548) 7.461 14.052 ( -3.170 3.068 0.091) 4.412 14.169 ( 2.161 -8.182 -0.170) 8.465 14.809 ( 6.159 8.089 -2.723) 10.525 14.988 ( 7.990 -8.675 -4.408) 12.591 19.336 ( -5.436 6.990 -0.536) 8.871 19.449 ( -6.861 -2.636 -1.550) 7.512 19.955 ( -18.405 7.179 3.335) 20.035 20.133 ( -15.065 -8.312 0.661) 17.218 21.750 ( 0.495 8.754 4.393) 9.807 21.932 ( 3.800 -7.681 3.882) 9.407 22.365 ( 16.299 9.158 -10.077) 21.238 22.600 ( 23.086 -12.284 -13.139) 29.265 23.769 ( -0.286 3.321 2.771) 4.334 23.847 ( -0.023 -4.114 2.139) 4.637 24.385 ( 2.238 6.527 -1.271) 7.016 24.503 ( 5.252 -4.503 -0.871) 6.973======================= Grid point 90 (48/116) =======================q-point: ( 0.38 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.015 ( -1.922 6.426 11.032) 12.911 2.033 ( -0.253 4.072 15.116) 15.657 2.348 ( 9.696 4.130 -1.657) 10.668 2.447 ( 5.044 2.211 0.093) 5.509 2.524 ( 1.201 3.297 1.960) 4.020 2.706 ( -2.211 -6.234 1.907) 6.884 2.931 ( -1.082 1.790 6.473) 6.802 2.974 ( 0.532 -2.339 3.878) 4.560 3.162 ( -1.744 1.398 -1.089) 2.487 3.254 ( -0.958 -6.629 -1.749) 6.922 3.498 ( 6.504 2.504 -3.882) 7.977 3.543 ( 4.775 -2.122 -6.864) 8.627 3.706 ( 5.631 3.396 3.344) 7.377 3.731 ( 1.839 1.800 3.538) 4.375 3.994 ( 0.301 0.123 -0.520) 0.613 4.061 ( -4.228 -6.199 0.765) 7.543 4.579 ( 6.740 5.788 -3.518) 9.555 4.642 ( 5.051 -0.085 -3.973) 6.427 4.693 ( 1.295 4.459 -4.733) 6.630 4.756 ( -0.111 -0.929 -4.129) 4.234 5.120 ( 0.233 6.115 2.086) 6.465 5.234 ( 2.810 -2.408 2.490) 4.460 5.538 ( 1.699 3.623 1.935) 4.444 5.633 ( 3.784 -4.283 0.954) 5.794 5.836 ( 0.407 -0.848 -2.705) 2.864 5.864 ( 3.997 -2.497 -3.765) 6.032 6.098 ( 2.249 0.513 -4.453) 5.015 6.165 ( 0.118 -5.722 -3.978) 6.969 6.459 ( -5.172 5.741 3.258) 8.386 6.589 ( -6.758 -5.990 2.029) 9.255 6.990 ( 1.178 4.829 -3.303) 5.968 7.076 ( 0.531 -2.713 -2.171) 3.515 7.232 ( 2.475 4.032 0.805) 4.799 7.362 ( 0.135 -8.105 1.551) 8.253 7.764 ( 1.647 4.291 -2.632) 5.296 7.857 ( 2.164 -3.955 -0.282) 4.517 8.347 ( -0.253 4.129 -2.544) 4.856 8.439 ( -0.305 -2.928 -2.982) 4.190 8.720 ( 1.595 3.181 2.326) 4.251 8.826 ( 0.968 -5.789 0.129) 5.870 9.777 ( 2.351 6.727 4.962) 8.683 9.848 ( 0.531 0.875 5.110) 5.212 10.352 ( 2.082 0.999 1.124) 2.568 10.434 ( -3.427 -5.386 -0.309) 6.391 10.720 ( -0.949 7.528 -2.556) 8.007 10.846 ( -3.276 -3.805 -0.803) 5.085 11.104 ( 4.981 8.967 -4.520) 11.209 11.218 ( 2.937 -1.557 -4.532) 5.621 12.142 ( -2.363 6.049 1.904) 6.767 12.296 ( -1.319 -8.396 1.514) 8.632 12.515 ( -0.506 4.778 6.091) 7.757 12.635 ( 1.802 -5.961 3.768) 7.279 13.039 ( -3.416 2.036 -0.628) 4.026 13.086 ( -2.020 -2.468 0.486) 3.226 13.507 ( -2.912 5.129 3.631) 6.926 13.594 ( -4.424 -3.050 2.354) 5.867 14.013 ( -0.754 6.235 1.377) 6.430 14.225 ( 2.847 -13.541 1.798) 13.954 14.889 ( 2.950 9.655 -3.598) 10.718 15.093 ( 4.163 -9.333 -4.656) 11.230 19.219 ( -5.884 7.963 -0.281) 9.905 19.334 ( -3.329 -1.464 -3.477) 5.031 19.703 ( -9.169 4.601 5.664) 11.718 19.903 ( -8.147 -12.028 1.412) 14.596 21.776 ( 0.400 11.165 3.693) 11.766 22.012 ( 2.537 -10.462 3.641) 11.364 22.597 ( 10.244 14.921 -9.137) 20.274 22.939 ( 15.229 -16.436 -11.231) 25.064 23.759 ( -1.475 3.563 2.655) 4.682 23.851 ( -0.309 -4.972 1.980) 5.361 24.428 ( 2.276 8.899 -0.630) 9.207 24.590 ( 3.677 -6.144 -1.254) 7.269======================= Grid point 91 (49/116) =======================q-point: (-0.50 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.959 ( -5.891 7.072 9.867) 13.494 2.003 ( -5.773 3.038 9.351) 11.401 2.466 ( 1.645 11.512 4.261) 12.385 2.562 ( 7.996 4.425 0.368) 9.146 2.642 ( 7.786 -5.309 -1.502) 9.543 2.678 ( -1.426 -3.693 3.297) 5.152 2.856 ( -6.937 1.219 6.740) 9.749 2.938 ( -4.414 -6.101 5.632) 9.403 3.130 ( -1.499 1.310 -2.250) 3.004 3.235 ( -0.660 -7.519 -2.467) 7.941 3.548 ( 0.825 3.053 -3.791) 4.937 3.589 ( 1.664 -0.790 -5.227) 5.542 3.764 ( -1.165 2.062 2.980) 3.806 3.784 ( 1.790 -0.032 0.897) 2.003 4.018 ( -0.854 -0.874 3.601) 3.803 4.051 ( 3.836 -2.755 2.730) 5.456 4.604 ( -1.578 4.063 -7.115) 8.344 4.622 ( -2.324 2.636 -8.932) 9.599 4.763 ( 3.229 2.021 -0.898) 3.914 4.780 ( 1.896 1.191 -1.808) 2.878 5.099 ( -2.818 6.105 0.633) 6.754 5.237 ( -2.816 -4.728 1.118) 5.616 5.556 ( -1.697 5.018 -0.028) 5.297 5.653 ( -2.319 -3.297 -0.670) 4.087 5.835 ( 1.318 1.236 -2.420) 3.020 5.919 ( 2.805 -5.339 -1.442) 6.201 6.156 ( 4.199 1.068 -3.699) 5.696 6.225 ( 6.186 -4.375 -1.745) 7.775 6.388 ( -2.942 3.938 3.945) 6.303 6.498 ( -2.376 -5.908 3.129) 7.095 6.974 ( -1.200 5.136 -5.721) 7.782 7.044 ( -1.979 -1.344 -4.044) 4.699 7.281 ( 1.869 0.720 1.538) 2.525 7.343 ( -2.166 -5.592 2.057) 6.340 7.749 ( -1.728 4.156 -5.076) 6.785 7.851 ( -2.437 -4.986 -2.058) 5.919 8.374 ( 3.422 4.734 -0.443) 5.858 8.462 ( 2.998 -1.605 -0.298) 3.414 8.736 ( -0.459 1.789 2.618) 3.204 8.826 ( -0.974 -5.323 -0.396) 5.425 9.825 ( 0.818 5.940 5.356) 8.040 9.857 ( -1.250 2.625 5.916) 6.592 10.377 ( -2.511 -2.062 0.450) 3.280 10.402 ( 2.383 -4.283 1.563) 5.144 10.707 ( 0.601 6.448 -2.338) 6.886 10.812 ( 0.191 -2.922 -1.955) 3.521 11.166 ( 1.995 7.984 -3.874) 9.096 11.245 ( 1.513 0.547 -4.653) 4.923 12.099 ( -2.364 6.631 0.444) 7.054 12.265 ( -1.924 -8.775 -0.292) 8.988 12.508 ( -1.936 5.830 4.480) 7.603 12.649 ( -1.409 -6.981 2.459) 7.535 13.021 ( 1.375 2.346 1.065) 2.920 13.065 ( -0.105 -2.007 0.401) 2.049 13.478 ( -1.171 3.213 2.969) 4.528 13.534 ( -1.459 -2.200 1.119) 2.867 14.030 ( 1.525 7.839 3.572) 8.748 14.274 ( 1.167 -14.779 3.543) 15.243 14.904 ( -0.161 10.677 -4.495) 11.586 15.123 ( 0.474 -9.721 -4.941) 10.915 19.154 ( 0.168 9.493 -0.206) 9.497 19.313 ( 2.399 -4.115 -3.631) 5.989 19.610 ( -2.621 5.441 5.982) 8.501 19.830 ( -0.138 -13.386 1.834) 13.511 21.770 ( -2.175 11.981 2.302) 12.393 22.028 ( -2.096 -12.035 2.649) 12.499 22.704 ( 3.371 18.460 -7.685) 20.278 23.112 ( 5.263 -19.391 -8.531) 21.829 23.738 ( -1.077 4.767 2.598) 5.535 23.845 ( -0.824 -5.186 1.636) 5.500 24.461 ( 0.987 8.745 0.228) 8.803 24.629 ( 0.578 -6.725 -1.370) 6.888======================= Grid point 92 (50/116) =======================q-point: (-0.38 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.855 ( -7.340 8.920 9.365) 14.871 1.925 ( -3.947 4.148 7.144) 9.156 2.452 ( -6.262 7.022 6.521) 11.447 2.609 ( -4.669 -6.873 4.065) 9.250 2.701 ( -0.300 8.674 6.590) 10.897 2.714 ( -0.619 2.430 -1.651) 3.002 2.779 ( -1.276 -3.355 0.889) 3.698 2.914 ( 2.625 -8.986 3.822) 10.111 3.094 ( -1.089 1.460 -2.285) 2.923 3.198 ( -2.647 -7.312 -3.599) 8.569 3.541 ( -0.798 1.762 -0.465) 1.989 3.559 ( -3.719 1.038 -0.603) 3.908 3.709 ( -3.221 5.737 1.272) 6.701 3.819 ( 1.573 -3.451 -0.010) 3.793 4.017 ( -0.701 3.578 4.002) 5.413 4.123 ( 2.821 -5.280 2.215) 6.383 4.517 ( -5.038 2.954 -8.928) 10.668 4.533 ( -3.438 1.305 -6.110) 7.131 4.766 ( -2.726 1.860 -3.807) 5.038 4.795 ( 0.429 0.378 -2.747) 2.806 5.021 ( -4.392 4.592 -0.472) 6.372 5.128 ( -8.129 -3.470 0.410) 8.848 5.490 ( -3.370 4.924 -0.360) 5.978 5.579 ( -3.782 -2.840 -1.760) 5.046 5.882 ( 3.661 2.223 0.232) 4.290 5.973 ( 2.955 -5.394 -0.126) 6.151 6.222 ( 3.793 3.680 -4.750) 7.106 6.332 ( 3.810 -5.531 -0.994) 6.789 6.367 ( -1.003 4.322 4.835) 6.563 6.490 ( -0.418 -6.363 0.845) 6.433 6.934 ( -0.912 3.777 -4.384) 5.858 7.000 ( -0.828 -1.454 -4.911) 5.188 7.288 ( -2.691 -1.653 2.890) 4.281 7.310 ( -1.160 -3.741 -0.250) 3.924 7.684 ( -2.982 3.128 -5.925) 7.334 7.766 ( -5.007 -4.342 -2.847) 7.213 8.454 ( 4.127 5.811 -0.673) 7.160 8.532 ( 3.640 0.770 0.365) 3.738 8.728 ( -0.902 -1.228 3.309) 3.643 8.789 ( -2.639 -5.140 -0.775) 5.830 9.822 ( -2.942 4.912 6.001) 8.294 9.852 ( -0.839 3.276 5.967) 6.859 10.337 ( -1.670 2.025 0.568) 2.685 10.451 ( 2.536 -6.306 0.166) 6.799 10.740 ( 3.411 5.062 -1.834) 6.373 10.833 ( 2.241 -2.412 -1.830) 3.766 11.148 ( -2.399 7.910 -2.335) 8.589 11.255 ( 0.366 -1.692 -4.300) 4.635 12.057 ( -1.822 6.645 0.340) 6.898 12.228 ( -1.474 -9.212 -0.587) 9.348 12.468 ( -3.302 5.866 4.121) 7.893 12.609 ( -2.923 -6.846 2.125) 7.741 13.059 ( 1.360 1.614 0.015) 2.111 13.086 ( 1.721 -0.673 1.114) 2.158 13.492 ( 2.699 3.734 2.419) 5.204 13.566 ( 4.182 -2.985 1.219) 5.280 14.081 ( 2.214 6.669 4.526) 8.359 14.287 ( -1.106 -12.504 4.327) 13.278 14.858 ( -3.120 10.876 -5.175) 12.442 15.083 ( -3.164 -10.084 -5.211) 11.783 19.236 ( 8.014 9.517 -0.041) 12.441 19.407 ( 7.807 -5.836 -2.423) 10.044 19.630 ( 3.180 9.596 4.737) 11.164 19.895 ( 6.123 -13.769 1.334) 15.128 21.708 ( -4.350 10.866 0.508) 11.715 21.947 ( -6.519 -11.271 0.937) 13.055 22.684 ( -3.390 18.112 -6.005) 19.381 23.083 ( -6.186 -18.955 -5.573) 20.703 23.743 ( 0.755 3.882 2.066) 4.462 23.828 ( -1.450 -3.813 1.468) 4.336 24.463 ( -0.932 6.513 0.714) 6.618 24.605 ( -2.558 -6.484 -0.916) 7.031======================= Grid point 93 (51/116) =======================q-point: (-0.25 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.755 ( -5.665 13.283 11.376) 18.383 1.884 ( -3.094 5.581 7.293) 9.691 2.278 ( -12.653 0.687 8.537) 15.279 2.448 ( -11.936 -12.059 4.393) 17.527 2.577 ( -9.187 7.951 2.000) 12.313 2.686 ( -6.085 5.554 -1.057) 8.306 2.768 ( -1.430 0.243 -2.493) 2.884 2.961 ( -3.622 -9.486 1.334) 10.241 3.101 ( 1.963 -0.078 1.218) 2.311 3.122 ( -0.322 -1.512 0.406) 1.599 3.486 ( -3.607 6.133 0.899) 7.171 3.538 ( 0.773 1.156 3.821) 4.066 3.681 ( 1.062 4.728 2.137) 5.296 3.839 ( -0.688 -6.752 1.886) 7.044 4.041 ( 4.150 5.032 -1.477) 6.688 4.179 ( 2.624 -6.633 -2.363) 7.514 4.384 ( -5.722 5.555 -3.670) 8.779 4.474 ( -1.526 -2.978 -4.080) 5.276 4.645 ( -6.906 3.332 -7.601) 10.797 4.754 ( -3.296 -5.479 -5.568) 8.479 4.952 ( -2.429 4.109 0.318) 4.784 5.020 ( -1.165 -1.100 0.058) 1.603 5.452 ( -0.368 4.113 -1.419) 4.367 5.512 ( -2.563 -1.235 -2.585) 3.844 5.967 ( 3.813 2.228 3.377) 5.559 6.031 ( 2.771 -2.758 3.157) 5.025 6.252 ( -0.689 3.310 -5.785) 6.701 6.290 ( -5.989 0.733 -0.498) 6.054 6.410 ( 3.563 -1.311 1.548) 4.100 6.491 ( 2.390 -5.942 -5.042) 8.151 6.904 ( -2.176 2.505 -1.518) 3.649 6.977 ( -1.446 -2.651 -2.434) 3.878 7.217 ( -5.104 -1.181 2.160) 5.667 7.256 ( -4.313 -4.468 -0.658) 6.245 7.608 ( -2.916 1.490 -5.965) 6.805 7.660 ( -4.549 -2.757 -3.034) 6.123 8.503 ( 1.138 7.521 -3.244) 8.270 8.586 ( 1.514 2.501 1.069) 3.113 8.718 ( -4.546 -4.581 0.101) 6.455 8.731 ( 0.352 -5.759 2.760) 6.396 9.768 ( -4.177 5.725 6.262) 9.457 9.844 ( -1.791 0.324 5.831) 6.108 10.325 ( 0.492 7.642 -0.147) 7.659 10.506 ( 3.464 -6.049 -2.376) 7.365 10.819 ( 4.683 2.402 -1.224) 5.404 10.881 ( 3.002 -1.339 -1.426) 3.583 11.087 ( -2.769 6.358 -0.301) 6.941 11.215 ( -3.465 -4.964 -3.687) 7.088 12.049 ( 1.007 6.679 3.264) 7.502 12.220 ( 0.718 -9.098 1.473) 9.245 12.413 ( -3.314 6.235 3.696) 7.970 12.563 ( -2.084 -7.403 1.703) 7.877 13.071 ( -0.026 2.234 -0.371) 2.265 13.102 ( -0.673 -0.727 0.801) 1.275 13.611 ( 8.457 4.055 2.730) 9.768 13.690 ( 7.700 -3.204 1.490) 8.472 14.131 ( 1.506 3.906 3.958) 5.761 14.259 ( -2.887 -8.006 3.928) 9.373 14.756 ( -5.603 10.136 -5.400) 12.778 14.970 ( -6.758 -9.960 -5.369) 13.179 19.416 ( 8.133 7.485 2.318) 11.294 19.562 ( 6.856 -6.412 1.973) 9.593 19.796 ( 15.036 14.390 -1.624) 20.876 20.074 ( 12.450 -11.394 -1.593) 16.952 21.625 ( -3.349 7.882 -1.356) 8.671 21.806 ( -7.058 -8.717 -1.224) 11.282 22.539 ( -10.048 13.874 -3.764) 17.539 22.849 ( -16.352 -15.106 -3.058) 22.471 23.764 ( 0.243 1.584 2.260) 2.770 23.804 ( -0.974 -1.947 1.071) 2.426 24.430 ( -2.489 3.954 0.397) 4.689 24.533 ( -4.494 -5.589 -0.030) 7.172======================= Grid point 94 (52/116) =======================q-point: (-0.12 0.43 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.697 ( -4.659 17.036 12.056) 21.384 1.815 ( -6.039 15.349 7.657) 18.185 2.073 ( -9.056 -7.021 9.498) 14.883 2.233 ( -9.882 -13.725 1.988) 17.029 2.422 ( -6.726 10.738 1.914) 12.814 2.500 ( -9.978 7.888 1.634) 12.824 2.702 ( -4.561 -7.194 -0.525) 8.534 2.784 ( -7.707 -9.223 -3.242) 12.449 3.188 ( 4.677 1.127 3.590) 6.003 3.206 ( 4.444 -0.677 3.964) 5.993 3.404 ( -4.491 10.423 1.266) 11.420 3.566 ( -0.473 -2.018 3.160) 3.779 3.775 ( 4.265 2.285 2.794) 5.588 3.819 ( 1.697 -1.731 0.124) 2.427 4.114 ( -1.643 2.755 -4.975) 5.919 4.175 ( -0.371 -3.137 -2.406) 3.971 4.349 ( 2.430 0.618 -1.373) 2.859 4.412 ( 0.551 -3.601 -2.854) 4.628 4.562 ( 0.897 2.442 -4.448) 5.153 4.679 ( -2.667 -7.767 -6.022) 10.184 4.920 ( -1.417 7.121 -0.933) 7.321 5.049 ( 3.291 -3.873 -2.784) 5.795 5.464 ( 0.250 2.545 -2.126) 3.325 5.468 ( 1.420 1.333 -4.837) 5.214 5.960 ( -7.910 2.174 4.412) 9.314 6.041 ( -6.910 -3.454 4.403) 8.892 6.210 ( 2.973 3.969 -4.332) 6.585 6.251 ( 5.844 0.222 -0.778) 5.899 6.509 ( 5.723 0.438 -2.493) 6.258 6.554 ( 5.154 -1.774 -4.395) 7.002 6.815 ( -6.027 1.477 -1.859) 6.478 6.896 ( -6.417 -4.237 -0.932) 7.746 7.115 ( -5.431 0.668 1.995) 5.824 7.172 ( -3.495 -5.143 0.788) 6.268 7.545 ( -1.552 0.857 -4.761) 5.080 7.596 ( -0.600 -3.589 -3.594) 5.114 8.482 ( -1.988 6.313 -2.944) 7.244 8.599 ( -0.512 0.760 -1.639) 1.878 8.618 ( -5.225 -0.772 2.675) 5.921 8.751 ( 0.819 -7.529 0.903) 7.627 9.709 ( -3.452 6.398 6.004) 9.429 9.820 ( -2.132 -2.743 5.455) 6.467 10.349 ( 1.635 11.769 -0.973) 11.921 10.560 ( 2.881 -5.485 -5.317) 8.165 10.886 ( 2.252 3.226 -2.463) 4.642 10.934 ( 2.780 -0.358 -1.129) 3.022 11.061 ( -0.744 0.102 2.577) 2.684 11.113 ( -4.837 -3.988 -2.579) 6.779 12.119 ( 3.651 4.829 9.557) 11.313 12.259 ( 1.693 -7.754 6.008) 9.955 12.372 ( -1.149 7.243 1.371) 7.460 12.545 ( -0.053 -8.410 0.147) 8.411 13.060 ( -1.174 1.653 1.679) 2.632 13.077 ( -1.354 -0.066 1.021) 1.697 13.803 ( 9.363 1.886 2.377) 9.842 13.838 ( 5.825 -1.357 0.125) 5.982 14.155 ( -0.093 1.249 2.746) 3.018 14.206 ( -3.104 -3.332 2.460) 5.176 14.631 ( -4.747 8.085 -4.841) 10.552 14.806 ( -7.650 -8.462 -5.261) 12.562 19.515 ( 1.217 7.370 4.193) 8.566 19.656 ( 1.595 -6.048 4.672) 7.807 20.182 ( 23.226 11.046 -8.274) 27.018 20.351 ( 15.983 -4.827 -4.644) 17.330 21.601 ( 2.364 3.634 -3.116) 5.339 21.703 ( -1.825 -5.497 -3.585) 6.812 22.285 ( -14.808 6.925 -0.819) 16.368 22.446 ( -23.885 -8.423 -0.362) 25.329 23.755 ( -1.307 2.320 2.784) 3.853 23.809 ( 0.730 -2.649 1.011) 2.928 24.381 ( -2.175 2.172 -0.285) 3.087 24.444 ( -4.365 -3.775 0.328) 5.781======================= Grid point 119 (53/116) =======================q-point: ( 0.00 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.825 ( -8.276 0.000 18.265) 20.053 1.056 ( -0.850 0.000 23.659) 23.675 1.751 ( 7.863 0.000 -8.340) 11.462 1.896 ( -1.158 0.000 40.994) 41.010 2.362 ( 1.300 0.000 -10.712) 10.790 2.794 ( -4.138 0.000 0.354) 4.153 2.913 ( -1.119 0.000 3.899) 4.057 3.069 ( 2.071 0.000 0.635) 2.167 3.114 ( -4.541 0.000 -1.360) 4.740 3.193 ( -2.713 0.000 3.340) 4.303 3.421 ( -3.457 0.000 4.061) 5.333 3.616 ( 1.679 0.000 0.655) 1.802 3.686 ( -0.155 0.000 -3.098) 3.102 3.799 ( -5.102 0.000 -2.065) 5.504 3.882 ( 2.191 0.000 3.347) 4.001 4.126 ( -11.629 0.000 -0.475) 11.639 4.249 ( 17.670 0.000 1.088) 17.703 4.323 ( -1.080 0.000 -2.352) 2.588 4.425 ( 15.167 0.000 -0.714) 15.184 4.718 ( -2.496 0.000 -6.405) 6.874 4.826 ( -12.474 0.000 3.105) 12.855 5.070 ( -2.858 0.000 -6.220) 6.845 5.287 ( 6.300 0.000 -0.999) 6.378 5.496 ( 7.219 0.000 -0.882) 7.273 5.943 ( -1.900 0.000 -3.209) 3.729 6.023 ( 5.959 0.000 -3.058) 6.697 6.178 ( -0.786 0.000 -2.604) 2.720 6.179 ( -3.670 0.000 2.571) 4.481 6.411 ( -3.313 0.000 0.164) 3.317 6.553 ( 4.600 0.000 -2.309) 5.147 6.598 ( -6.185 0.000 4.337) 7.554 6.858 ( 8.120 0.000 -3.394) 8.801 7.304 ( -2.305 0.000 3.629) 4.300 7.533 ( -10.010 0.000 -2.271) 10.264 7.816 ( 0.261 0.000 8.574) 8.578 8.094 ( 1.041 0.000 1.811) 2.089 8.276 ( -2.192 0.000 0.412) 2.230 8.318 ( 2.316 0.000 -1.610) 2.820 8.522 ( -1.943 0.000 -7.795) 8.034 8.606 ( 1.524 0.000 -5.861) 6.055 9.484 ( 2.036 0.000 -0.034) 2.036 9.670 ( -6.046 0.000 5.417) 8.117 9.769 ( -0.489 0.000 -6.652) 6.669 10.058 ( -0.770 0.000 -4.782) 4.844 10.628 ( 0.496 0.000 1.648) 1.721 10.722 ( 0.924 0.000 -1.713) 1.946 11.188 ( -3.946 0.000 2.510) 4.677 11.332 ( 1.694 0.000 -1.309) 2.141 12.250 ( -1.939 0.000 7.829) 8.066 12.597 ( -0.708 0.000 -2.559) 2.655 12.839 ( -2.454 0.000 1.755) 3.017 12.892 ( 0.872 0.000 1.781) 1.983 13.231 ( 0.236 0.000 7.090) 7.094 13.660 ( -9.605 0.000 -6.876) 11.813 14.052 ( 11.865 0.000 2.744) 12.178 14.080 ( -17.465 0.000 0.786) 17.482 14.183 ( 0.666 0.000 -1.082) 1.271 14.268 ( 14.526 0.000 -2.997) 14.832 14.462 ( -19.881 0.000 2.193) 20.001 14.596 ( 43.624 0.000 -1.054) 43.637 18.954 ( 2.660 0.000 3.154) 4.126 19.084 ( -3.756 0.000 -0.487) 3.787 20.113 ( -8.901 0.000 5.745) 10.594 20.587 ( 27.200 0.000 -6.758) 28.027 21.678 ( -5.026 0.000 1.578) 5.268 21.814 ( -0.332 0.000 -3.590) 3.605 21.951 ( 13.270 0.000 -0.545) 13.282 22.037 ( -30.568 0.000 -1.521) 30.605 23.813 ( -1.234 0.000 1.026) 1.605 23.896 ( 1.622 0.000 -2.171) 2.710 24.313 ( -18.753 0.000 2.087) 18.869 24.370 ( 3.288 0.000 -0.288) 3.301======================= Grid point 120 (54/116) =======================q-point: ( 0.12 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.199 ( 8.137 0.000 21.063) 22.580 1.220 ( 34.293 0.000 9.345) 35.543 2.040 ( 3.403 0.000 36.439) 36.598 2.064 ( 23.965 0.000 -5.452) 24.578 2.357 ( 1.678 0.000 -9.902) 10.043 2.804 ( 4.957 0.000 -0.990) 5.055 2.948 ( 1.099 0.000 10.267) 10.326 2.963 ( -12.121 0.000 1.258) 12.186 3.124 ( 2.911 0.000 -4.223) 5.129 3.142 ( -2.614 0.000 -0.638) 2.690 3.352 ( -1.774 0.000 6.900) 7.125 3.556 ( -4.246 0.000 2.193) 4.779 3.688 ( -4.408 0.000 1.866) 4.787 3.693 ( 2.848 0.000 -5.159) 5.892 3.940 ( -6.463 0.000 0.553) 6.487 3.971 ( 0.859 0.000 -3.615) 3.716 4.377 ( 9.021 0.000 -2.276) 9.304 4.459 ( 3.371 0.000 1.264) 3.601 4.580 ( -12.107 0.000 3.553) 12.617 4.664 ( -0.896 0.000 -5.323) 5.398 4.706 ( 12.039 0.000 -0.061) 12.039 4.989 ( -3.444 0.000 -4.122) 5.371 5.434 ( 9.014 0.000 -3.514) 9.674 5.616 ( 6.302 0.000 -3.670) 7.293 5.929 ( -3.064 0.000 1.095) 3.254 6.127 ( -3.293 0.000 -1.509) 3.622 6.143 ( -0.606 0.000 -1.768) 1.869 6.195 ( 10.765 0.000 -0.159) 10.766 6.342 ( -2.664 0.000 -4.012) 4.816 6.638 ( 3.678 0.000 -2.333) 4.355 6.672 ( 12.702 0.000 -7.063) 14.534 7.009 ( 6.335 0.000 -3.442) 7.210 7.231 ( -5.198 0.000 4.682) 6.995 7.390 ( -3.950 0.000 1.622) 4.270 7.908 ( 5.823 0.000 8.645) 10.423 8.126 ( 0.280 0.000 2.634) 2.648 8.226 ( -3.321 0.000 0.644) 3.383 8.370 ( 3.564 0.000 -0.238) 3.572 8.480 ( 0.537 0.000 -7.493) 7.513 8.658 ( 5.793 0.000 -8.349) 10.162 9.541 ( 3.251 0.000 1.655) 3.648 9.613 ( -1.963 0.000 8.353) 8.580 9.788 ( 4.603 0.000 -7.253) 8.591 10.038 ( 0.312 0.000 -4.401) 4.412 10.639 ( 0.304 0.000 1.512) 1.542 10.723 ( -0.304 0.000 -2.771) 2.787 11.100 ( -5.672 0.000 3.055) 6.443 11.321 ( -2.694 0.000 -0.907) 2.843 12.219 ( -3.306 0.000 7.957) 8.616 12.597 ( 1.644 0.000 -1.833) 2.462 12.780 ( -5.399 0.000 6.615) 8.539 12.906 ( 0.063 0.000 0.801) 0.804 13.252 ( -1.288 0.000 9.094) 9.185 13.426 ( -12.160 0.000 -4.590) 12.998 13.690 ( -15.064 0.000 3.960) 15.576 13.998 ( -17.187 0.000 -0.727) 17.202 14.147 ( -4.275 0.000 -1.131) 4.422 14.293 ( 3.852 0.000 1.083) 4.002 14.592 ( 17.552 0.000 -3.448) 17.887 15.261 ( 20.553 0.000 -12.534) 24.073 18.978 ( -1.636 0.000 4.921) 5.186 19.027 ( -1.626 0.000 -1.923) 2.519 20.023 ( -0.856 0.000 1.108) 1.401 20.748 ( -11.932 0.000 3.951) 12.569 21.575 ( -5.257 0.000 0.711) 5.304 21.730 ( 4.260 0.000 -11.253) 12.032 22.122 ( 29.421 0.000 -12.035) 31.787 22.257 ( 15.969 0.000 5.760) 16.976 23.790 ( -1.323 0.000 0.112) 1.328 23.895 ( -2.521 0.000 2.141) 3.307 24.094 ( -3.638 0.000 5.064) 6.236 24.444 ( 3.744 0.000 1.251) 3.948======================= Grid point 121 (55/116) =======================q-point: ( 0.25 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.440 ( 9.305 0.000 16.457) 18.905 1.870 ( 24.966 0.000 8.345) 26.323 2.193 ( 2.185 0.000 20.735) 20.850 2.374 ( 3.025 0.000 -6.858) 7.495 2.523 ( 20.955 0.000 -4.650) 21.465 2.706 ( -12.011 0.000 5.269) 13.115 2.958 ( 10.863 0.000 -1.599) 10.980 3.000 ( 1.974 0.000 14.046) 14.184 3.043 ( -7.827 0.000 -2.695) 8.278 3.142 ( 2.244 0.000 -2.347) 3.247 3.455 ( 7.624 0.000 4.613) 8.911 3.574 ( 4.655 0.000 2.664) 5.364 3.607 ( -2.897 0.000 2.562) 3.868 3.777 ( 4.952 0.000 -2.334) 5.475 3.864 ( 0.075 0.000 -2.334) 2.335 3.985 ( 3.197 0.000 -3.858) 5.011 4.380 ( -8.888 0.000 3.855) 9.688 4.451 ( -2.797 0.000 -2.450) 3.718 4.470 ( -1.279 0.000 3.086) 3.341 4.756 ( 11.990 0.000 -5.433) 13.164 4.904 ( 8.562 0.000 -0.791) 8.598 4.917 ( -2.885 0.000 -3.158) 4.278 5.602 ( 8.352 0.000 -4.813) 9.639 5.727 ( 5.540 0.000 -2.707) 6.166 5.836 ( -5.702 0.000 7.370) 9.318 6.048 ( -4.127 0.000 -0.715) 4.189 6.100 ( -3.427 0.000 -1.833) 3.887 6.296 ( -0.310 0.000 -10.125) 10.129 6.389 ( 8.299 0.000 -0.164) 8.301 6.645 ( -2.279 0.000 -3.943) 4.554 6.853 ( 6.223 0.000 -10.285) 12.021 7.017 ( -4.410 0.000 -2.712) 5.177 7.194 ( 0.343 0.000 4.471) 4.484 7.397 ( 3.682 0.000 -0.618) 3.734 8.056 ( 6.026 0.000 8.526) 10.440 8.098 ( -3.569 0.000 2.964) 4.640 8.157 ( -3.531 0.000 0.532) 3.570 8.440 ( 2.885 0.000 0.728) 2.976 8.520 ( 5.487 0.000 -6.309) 8.361 8.760 ( 6.738 0.000 -10.899) 12.814 9.572 ( -1.309 0.000 8.871) 8.967 9.670 ( 5.001 0.000 4.573) 6.777 9.901 ( 8.924 0.000 -7.449) 11.625 10.049 ( 1.950 0.000 -4.006) 4.456 10.651 ( 0.503 0.000 1.240) 1.338 10.692 ( -1.759 0.000 -4.219) 4.571 10.998 ( -5.317 0.000 2.957) 6.084 11.220 ( -7.438 0.000 -0.688) 7.470 12.175 ( -3.601 0.000 8.834) 9.539 12.655 ( 4.645 0.000 -1.181) 4.793 12.664 ( -8.608 0.000 10.694) 13.728 12.895 ( -1.144 0.000 -0.843) 1.421 13.178 ( -11.866 0.000 -2.763) 12.183 13.229 ( -2.526 0.000 7.146) 7.579 13.551 ( -2.500 0.000 3.853) 4.593 13.700 ( -11.493 0.000 -1.168) 11.552 14.044 ( -5.389 0.000 -1.096) 5.500 14.362 ( 2.343 0.000 -2.018) 3.092 14.884 ( 13.128 0.000 -2.797) 13.423 15.406 ( 1.005 0.000 -7.521) 7.588 18.927 ( -4.721 0.000 5.947) 7.593 19.013 ( 0.995 0.000 -3.360) 3.504 20.079 ( 6.087 0.000 -1.961) 6.395 20.486 ( -14.240 0.000 10.401) 17.634 21.484 ( -4.211 0.000 0.703) 4.269 21.747 ( 1.213 0.000 -11.583) 11.646 22.563 ( 12.056 0.000 10.724) 16.135 22.746 ( 33.805 0.000 -23.402) 41.115 23.763 ( -1.254 0.000 -1.079) 1.654 23.856 ( -1.549 0.000 5.921) 6.121 24.142 ( 6.099 0.000 -0.803) 6.152 24.507 ( 2.083 0.000 1.465) 2.547======================= Grid point 122 (56/116) =======================q-point: ( 0.38 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.580 ( -0.602 0.000 12.987) 13.001 2.120 ( -3.029 0.000 7.351) 7.951 2.204 ( -2.270 0.000 15.674) 15.837 2.502 ( 11.164 0.000 -5.153) 12.296 2.529 ( -2.867 0.000 -1.247) 3.127 2.797 ( -3.845 0.000 -2.664) 4.677 2.931 ( 7.579 0.000 4.279) 8.703 3.099 ( 3.430 0.000 4.401) 5.580 3.187 ( 11.622 0.000 -0.216) 11.624 3.225 ( 5.652 0.000 1.285) 5.796 3.555 ( -2.001 0.000 3.164) 3.744 3.601 ( 4.128 0.000 7.419) 8.490 3.752 ( -3.594 0.000 0.002) 3.594 3.754 ( 9.584 0.000 2.553) 9.918 4.001 ( 9.901 0.000 -2.254) 10.154 4.060 ( 4.644 0.000 -1.906) 5.020 4.256 ( -4.940 0.000 1.302) 5.109 4.366 ( -4.200 0.000 -1.146) 4.353 4.460 ( -0.764 0.000 4.397) 4.463 4.857 ( -1.560 0.000 -2.811) 3.215 4.967 ( 9.665 0.000 -8.235) 12.697 5.041 ( 5.894 0.000 -2.548) 6.421 5.622 ( -5.214 0.000 1.161) 5.341 5.743 ( -5.127 0.000 -0.181) 5.130 5.865 ( 6.074 0.000 2.860) 6.714 6.015 ( 2.458 0.000 -3.073) 3.935 6.028 ( -2.409 0.000 -0.568) 2.475 6.261 ( 0.865 0.000 -11.450) 11.482 6.491 ( 1.975 0.000 -1.556) 2.514 6.543 ( -6.021 0.000 -5.515) 8.165 6.895 ( 1.611 0.000 -4.067) 4.374 6.900 ( -5.399 0.000 -1.075) 5.505 7.223 ( 0.768 0.000 4.066) 4.138 7.467 ( 3.018 0.000 -3.427) 4.567 8.047 ( -1.492 0.000 2.925) 3.283 8.104 ( -1.579 0.000 -0.270) 1.602 8.165 ( 2.097 0.000 8.512) 8.766 8.474 ( 0.539 0.000 0.146) 0.559 8.627 ( 6.333 0.000 -5.572) 8.436 8.829 ( 3.442 0.000 -11.134) 11.654 9.567 ( -2.023 0.000 10.210) 10.408 9.783 ( 4.495 0.000 5.431) 7.050 10.045 ( 3.714 0.000 -2.344) 4.392 10.108 ( 8.898 0.000 -9.132) 12.750 10.647 ( -0.807 0.000 -4.871) 4.937 10.667 ( 0.541 0.000 0.673) 0.863 10.921 ( -3.268 0.000 2.387) 4.047 11.043 ( -9.709 0.000 -0.195) 9.711 12.136 ( -3.160 0.000 9.826) 10.322 12.542 ( -6.572 0.000 11.084) 12.886 12.742 ( 3.321 0.000 -2.837) 4.368 12.876 ( 0.645 0.000 -0.834) 1.054 12.978 ( -7.230 0.000 -1.614) 7.408 13.210 ( -1.335 0.000 2.856) 3.152 13.534 ( -1.669 0.000 4.939) 5.213 13.555 ( -3.860 0.000 1.075) 4.007 13.957 ( -2.704 0.000 -0.203) 2.712 14.369 ( -0.428 0.000 -4.487) 4.508 15.079 ( 7.729 0.000 -2.109) 8.012 15.348 ( -3.972 0.000 -4.336) 5.881 18.850 ( -4.550 0.000 5.599) 7.214 19.043 ( 3.135 0.000 -4.226) 5.262 20.218 ( 8.208 0.000 -2.239) 8.508 20.266 ( -11.665 0.000 9.346) 14.947 21.418 ( -2.753 0.000 0.479) 2.795 21.729 ( 0.606 0.000 -10.623) 10.640 22.745 ( 2.257 0.000 12.942) 13.138 23.224 ( 21.752 0.000 -17.132) 27.689 23.745 ( 0.213 0.000 -1.752) 1.765 23.857 ( -0.744 0.000 3.890) 3.960 24.301 ( 10.858 0.000 -4.660) 11.816 24.524 ( -0.682 0.000 0.246) 0.725======================= Grid point 123 (57/116) =======================q-point: (-0.50 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.515 ( -8.001 0.000 11.910) 14.348 1.959 ( -12.640 0.000 14.262) 19.057 2.224 ( 0.017 0.000 4.233) 4.233 2.437 ( -8.371 0.000 -5.785) 10.176 2.698 ( 8.926 0.000 2.377) 9.237 2.753 ( 3.819 0.000 5.893) 7.022 3.139 ( 0.620 0.000 -3.551) 3.605 3.156 ( 11.540 0.000 0.062) 11.541 3.324 ( 3.632 0.000 1.306) 3.860 3.379 ( 7.908 0.000 1.374) 8.027 3.518 ( -3.302 0.000 4.472) 5.559 3.577 ( -10.053 0.000 7.789) 12.718 3.686 ( -2.551 0.000 -0.669) 2.637 3.884 ( 1.146 0.000 2.775) 3.002 4.109 ( -1.968 0.000 2.951) 3.547 4.162 ( 7.097 0.000 -0.109) 7.098 4.210 ( 1.213 0.000 -2.339) 2.635 4.275 ( -5.618 0.000 0.702) 5.662 4.456 ( -1.312 0.000 5.177) 5.341 4.828 ( -0.877 0.000 -5.109) 5.184 5.066 ( 2.532 0.000 -7.971) 8.364 5.103 ( 1.674 0.000 -6.616) 6.824 5.509 ( -6.867 0.000 6.234) 9.274 5.595 ( -7.574 0.000 -0.328) 7.581 5.901 ( -0.467 0.000 -4.567) 4.591 6.060 ( 1.418 0.000 -2.990) 3.309 6.102 ( 7.826 0.000 4.170) 8.868 6.325 ( 8.911 0.000 -6.923) 11.284 6.374 ( -8.179 0.000 -6.231) 10.283 6.497 ( -0.078 0.000 -5.633) 5.634 6.849 ( 0.529 0.000 -0.806) 0.964 6.894 ( -1.620 0.000 -1.149) 1.986 7.236 ( -0.833 0.000 4.761) 4.833 7.498 ( 2.187 0.000 -4.058) 4.609 8.080 ( 4.021 0.000 2.579) 4.777 8.093 ( 0.367 0.000 -0.426) 0.562 8.183 ( -2.540 0.000 7.450) 7.872 8.469 ( -0.861 0.000 -0.317) 0.917 8.695 ( 1.571 0.000 -5.409) 5.633 8.830 ( 0.057 0.000 -9.701) 9.701 9.547 ( -3.030 0.000 9.027) 9.522 9.866 ( 2.669 0.000 5.097) 5.753 10.056 ( -0.361 0.000 -2.785) 2.809 10.280 ( 9.093 0.000 -8.797) 12.651 10.620 ( -6.794 0.000 -1.071) 6.878 10.652 ( 2.359 0.000 -3.134) 3.923 10.896 ( 0.580 0.000 1.487) 1.596 10.927 ( 0.012 0.000 1.191) 1.191 12.113 ( -2.324 0.000 11.087) 11.328 12.484 ( -2.588 0.000 10.738) 11.046 12.739 ( -0.981 0.000 -6.060) 6.139 12.862 ( -2.030 0.000 -1.065) 2.292 12.977 ( 5.814 0.000 2.476) 6.319 13.174 ( -3.021 0.000 -0.830) 3.132 13.492 ( -4.368 0.000 5.427) 6.967 13.535 ( 0.826 0.000 2.683) 2.807 13.957 ( 2.449 0.000 1.638) 2.946 14.328 ( -1.982 0.000 -6.175) 6.486 15.175 ( 2.746 0.000 -1.010) 2.926 15.251 ( -4.624 0.000 -4.101) 6.181 18.793 ( -2.727 0.000 4.659) 5.399 19.105 ( 4.322 0.000 -4.206) 6.031 20.085 ( -9.413 0.000 7.308) 11.916 20.362 ( 6.501 0.000 -0.165) 6.503 21.384 ( -0.730 0.000 -0.221) 0.763 21.716 ( 1.084 0.000 -9.602) 9.663 22.705 ( -9.725 0.000 10.806) 14.538 23.508 ( 11.626 0.000 -7.610) 13.896 23.768 ( 2.243 0.000 -0.532) 2.306 23.824 ( -3.253 0.000 -1.218) 3.473 24.485 ( -2.944 0.000 -1.653) 3.376 24.521 ( 13.020 0.000 -6.883) 14.728======================= Grid point 124 (58/116) =======================q-point: (-0.38 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.385 ( -8.897 0.000 12.681) 15.491 1.762 ( -12.434 0.000 20.657) 24.110 2.232 ( 0.027 0.000 0.811) 0.811 2.236 ( -9.619 0.000 -3.947) 10.397 2.864 ( 7.289 0.000 2.737) 7.786 2.885 ( 6.094 0.000 6.128) 8.643 3.084 ( -9.523 0.000 -1.335) 9.616 3.274 ( -17.398 0.000 4.886) 18.071 3.322 ( 2.349 0.000 -4.825) 5.366 3.344 ( -2.741 0.000 0.597) 2.805 3.443 ( 0.068 0.000 4.309) 4.310 3.530 ( 3.385 0.000 3.703) 5.017 3.684 ( 2.739 0.000 -0.119) 2.742 3.794 ( -9.716 0.000 3.377) 10.286 4.033 ( -3.909 0.000 0.708) 3.973 4.147 ( -6.989 0.000 1.922) 7.249 4.158 ( -7.507 0.000 -2.101) 7.796 4.360 ( 12.687 0.000 0.075) 12.687 4.444 ( -1.544 0.000 5.666) 5.872 4.753 ( -5.428 0.000 -9.800) 11.203 5.033 ( -2.755 0.000 -2.996) 4.070 5.083 ( -0.300 0.000 -9.080) 9.085 5.397 ( -6.815 0.000 7.762) 10.330 5.490 ( -3.545 0.000 -0.546) 3.587 5.939 ( 5.046 0.000 -1.388) 5.233 6.062 ( 0.700 0.000 -1.862) 1.989 6.207 ( -6.669 0.000 -7.103) 9.743 6.255 ( 5.955 0.000 4.430) 7.422 6.486 ( 0.988 0.000 -7.987) 8.048 6.512 ( 10.036 0.000 -6.004) 11.695 6.811 ( -6.350 0.000 1.348) 6.492 6.880 ( 2.004 0.000 -3.773) 4.273 7.223 ( -1.640 0.000 5.752) 5.981 7.556 ( 5.328 0.000 -4.992) 7.301 8.088 ( -4.250 0.000 5.233) 6.741 8.145 ( 0.429 0.000 0.909) 1.005 8.197 ( 6.503 0.000 1.106) 6.596 8.437 ( -2.406 0.000 -0.273) 2.422 8.654 ( -3.679 0.000 -4.554) 5.855 8.780 ( -2.500 0.000 -7.855) 8.243 9.507 ( -2.951 0.000 5.304) 6.069 9.923 ( 1.915 0.000 2.756) 3.356 10.026 ( -1.796 0.000 -3.807) 4.209 10.320 ( -4.986 0.000 -7.836) 9.288 10.513 ( 0.478 0.000 0.270) 0.549 10.685 ( 1.034 0.000 -1.060) 1.481 10.977 ( 7.363 0.000 1.438) 7.502 11.016 ( 7.043 0.000 -0.370) 7.053 12.115 ( -0.758 0.000 13.014) 13.036 12.512 ( 2.401 0.000 12.707) 12.932 12.701 ( -0.924 0.000 -6.147) 6.216 12.845 ( -0.201 0.000 1.234) 1.250 13.089 ( -4.786 0.000 -3.711) 6.056 13.131 ( 9.743 0.000 1.790) 9.906 13.404 ( -6.126 0.000 6.232) 8.738 13.595 ( 4.366 0.000 2.673) 5.119 14.046 ( 5.495 0.000 2.804) 6.169 14.261 ( -3.020 0.000 -6.851) 7.487 15.136 ( -6.188 0.000 -5.719) 8.426 15.177 ( -2.664 0.000 0.679) 2.749 18.775 ( -0.246 0.000 3.633) 3.641 19.175 ( 3.536 0.000 -2.915) 4.583 19.956 ( -5.124 0.000 4.616) 6.897 20.451 ( 1.722 0.000 3.749) 4.126 21.395 ( 2.298 0.000 -1.351) 2.666 21.718 ( 1.885 0.000 -8.493) 8.700 22.464 ( -16.459 0.000 6.149) 17.570 23.593 ( -5.310 0.000 2.033) 5.686 23.766 ( 2.252 0.000 -10.441) 10.681 23.812 ( 1.767 0.000 1.079) 2.071 24.413 ( -3.420 0.000 -3.120) 4.629 24.736 ( 10.626 0.000 -9.009) 13.931======================= Grid point 125 (59/116) =======================q-point: (-0.25 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.238 ( -10.487 0.000 15.942) 19.082 1.598 ( -12.155 0.000 24.462) 27.316 2.042 ( -10.057 0.000 -4.348) 10.957 2.198 ( -7.368 0.000 3.931) 8.350 2.597 ( -28.327 0.000 7.318) 29.257 2.990 ( 2.128 0.000 3.867) 4.414 2.991 ( 2.727 0.000 2.207) 3.508 3.157 ( -4.589 0.000 1.050) 4.708 3.214 ( -6.992 0.000 0.394) 7.003 3.286 ( 2.111 0.000 -4.284) 4.775 3.438 ( -8.378 0.000 0.083) 8.378 3.544 ( -0.996 0.000 3.041) 3.200 3.670 ( -0.559 0.000 -0.230) 0.604 3.759 ( 3.327 0.000 2.528) 4.178 3.949 ( -10.249 0.000 -3.454) 10.815 4.016 ( 2.454 0.000 1.158) 2.714 4.078 ( -0.060 0.000 4.735) 4.735 4.420 ( -2.803 0.000 3.862) 4.772 4.531 ( -8.474 0.000 -6.388) 10.613 4.642 ( 9.564 0.000 -4.602) 10.614 5.009 ( 2.278 0.000 -3.235) 3.957 5.064 ( 0.446 0.000 -7.447) 7.461 5.291 ( -6.168 0.000 7.260) 9.526 5.424 ( -3.682 0.000 0.748) 3.757 6.033 ( 3.424 0.000 0.238) 3.432 6.067 ( -3.416 0.000 -2.948) 4.512 6.109 ( 2.227 0.000 -5.257) 5.709 6.334 ( 0.367 0.000 2.391) 2.419 6.484 ( 1.175 0.000 -8.188) 8.271 6.558 ( -4.738 0.000 -3.217) 5.727 6.754 ( 1.389 0.000 1.780) 2.258 6.860 ( -2.684 0.000 -6.350) 6.894 7.232 ( 1.142 0.000 6.037) 6.144 7.656 ( 5.772 0.000 -6.230) 8.493 7.974 ( -7.893 0.000 7.395) 10.816 8.200 ( 3.913 0.000 -1.319) 4.129 8.270 ( -1.208 0.000 -1.987) 2.326 8.380 ( -3.124 0.000 -0.314) 3.140 8.573 ( -1.873 0.000 -1.894) 2.664 8.704 ( -2.569 0.000 -8.042) 8.442 9.473 ( -1.481 0.000 1.705) 2.259 9.930 ( -2.456 0.000 -0.853) 2.600 9.954 ( -4.509 0.000 -5.011) 6.741 10.171 ( -5.457 0.000 -5.304) 7.610 10.565 ( 2.781 0.000 0.399) 2.809 10.693 ( 0.460 0.000 -0.932) 1.040 11.142 ( 7.415 0.000 1.198) 7.511 11.156 ( 7.150 0.000 -1.716) 7.353 12.168 ( 2.002 0.000 13.600) 13.747 12.666 ( -1.072 0.000 -4.999) 5.113 12.703 ( 15.186 0.000 19.010) 24.331 12.850 ( 0.154 0.000 2.620) 2.624 12.981 ( -4.710 0.000 -4.416) 6.456 13.310 ( -5.124 0.000 8.034) 9.530 13.380 ( 15.561 0.000 0.687) 15.576 13.709 ( 6.329 0.000 0.690) 6.366 14.162 ( 5.090 0.000 2.777) 5.799 14.171 ( -4.095 0.000 -5.900) 7.182 14.951 ( -11.693 0.000 -8.018) 14.178 15.067 ( -9.461 0.000 2.538) 9.795 18.805 ( 2.347 0.000 2.793) 3.648 19.205 ( -0.308 0.000 -0.614) 0.687 19.943 ( 3.667 0.000 1.838) 4.102 20.435 ( -5.395 0.000 7.745) 9.439 21.473 ( 6.389 0.000 -1.893) 6.663 21.739 ( 2.713 0.000 -7.404) 7.886 22.153 ( -15.512 0.000 1.316) 15.568 23.335 ( -19.334 0.000 -5.172) 20.014 23.821 ( 3.950 0.000 -6.448) 7.561 23.834 ( 0.163 0.000 1.722) 1.729 24.349 ( -1.854 0.000 -3.352) 3.830 24.839 ( 1.938 0.000 -12.918) 13.063======================= Grid point 126 (60/116) =======================q-point: (-0.12 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.093 ( -8.974 0.000 21.179) 23.002 1.288 ( -30.036 0.000 15.520) 33.808 1.816 ( -9.620 0.000 -7.508) 12.203 1.913 ( -15.357 0.000 34.521) 37.783 2.370 ( -0.507 0.000 -6.969) 6.988 2.928 ( -7.655 0.000 0.372) 7.664 2.992 ( -5.064 0.000 -3.753) 6.303 3.043 ( -1.821 0.000 7.486) 7.704 3.190 ( 1.549 0.000 4.374) 4.641 3.232 ( -8.936 0.000 -0.597) 8.956 3.400 ( 5.953 0.000 -2.275) 6.373 3.542 ( 1.703 0.000 4.123) 4.461 3.726 ( 5.382 0.000 -6.455) 8.404 3.728 ( -5.044 0.000 1.477) 5.256 3.931 ( 9.785 0.000 2.834) 10.187 4.059 ( -8.623 0.000 7.285) 11.288 4.152 ( 10.701 0.000 0.417) 10.709 4.336 ( -6.900 0.000 -0.152) 6.902 4.346 ( -2.894 0.000 -5.832) 6.511 4.763 ( 1.387 0.000 -3.863) 4.104 5.012 ( -5.826 0.000 -1.977) 6.153 5.090 ( 4.673 0.000 -8.410) 9.622 5.228 ( -0.836 0.000 3.236) 3.342 5.383 ( 1.228 0.000 3.147) 3.378 5.997 ( -1.341 0.000 -4.696) 4.884 6.035 ( -3.525 0.000 -1.347) 3.774 6.163 ( 2.949 0.000 -3.323) 4.442 6.268 ( -5.717 0.000 -0.400) 5.731 6.468 ( -3.442 0.000 2.534) 4.275 6.496 ( 2.424 0.000 -5.051) 5.602 6.740 ( -5.206 0.000 1.573) 5.439 6.791 ( -0.520 0.000 -5.590) 5.614 7.287 ( 2.094 0.000 4.601) 5.055 7.695 ( -1.726 0.000 -7.418) 7.616 7.854 ( -6.078 0.000 7.931) 9.992 8.147 ( -7.523 0.000 -0.033) 7.523 8.268 ( 3.173 0.000 -1.191) 3.389 8.323 ( -2.470 0.000 -0.570) 2.534 8.566 ( 0.222 0.000 -4.723) 4.728 8.634 ( -2.225 0.000 -7.368) 7.696 9.463 ( 0.200 0.000 0.057) 0.208 9.813 ( -8.361 0.000 -0.513) 8.377 9.840 ( -4.614 0.000 -6.006) 7.574 10.094 ( -1.702 0.000 -4.778) 5.072 10.607 ( 1.332 0.000 1.273) 1.842 10.705 ( 1.069 0.000 -1.185) 1.596 11.222 ( 0.441 0.000 1.063) 1.151 11.270 ( 5.005 0.000 -1.794) 5.317 12.237 ( 0.806 0.000 9.864) 9.897 12.629 ( -1.429 0.000 -3.514) 3.794 12.867 ( 0.853 0.000 2.415) 2.561 12.888 ( -2.931 0.000 -2.837) 4.079 13.197 ( 7.607 0.000 5.386) 9.320 13.407 ( 34.795 0.000 24.305) 42.444 13.723 ( 18.755 0.000 0.451) 18.760 13.789 ( 0.096 0.000 -4.829) 4.830 14.112 ( 1.641 0.000 -1.748) 2.398 14.248 ( 3.008 0.000 2.424) 3.863 14.615 ( -20.494 0.000 -7.581) 21.851 14.821 ( -16.661 0.000 3.372) 16.999 18.876 ( 3.904 0.000 2.451) 4.610 19.161 ( -3.689 0.000 0.321) 3.703 20.136 ( 16.659 0.000 0.343) 16.662 20.295 ( -10.762 0.000 8.688) 13.831 21.628 ( 9.082 0.000 0.350) 9.089 21.778 ( 3.186 0.000 -6.308) 7.066 21.910 ( -8.395 0.000 -2.468) 8.750 22.796 ( -34.699 0.000 -10.325) 36.202 23.831 ( -0.903 0.000 1.601) 1.838 23.866 ( 2.375 0.000 -3.816) 4.495 24.331 ( 0.931 0.000 -2.204) 2.393 24.686 ( -14.195 0.000 -11.601) 18.333======================= Grid point 127 (61/116) =======================q-point: ( 0.00 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.980 ( -4.770 13.615 14.339) 20.340 1.307 ( -2.263 19.683 18.770) 27.292 1.798 ( 5.432 4.676 -6.604) 9.746 1.987 ( -1.144 8.273 36.690) 37.629 2.449 ( 1.780 7.303 -8.800) 11.573 2.715 ( -3.378 -7.288 1.807) 8.234 2.872 ( -2.069 -3.615 1.184) 4.330 2.994 ( 1.346 -5.375 2.084) 5.920 3.113 ( -1.870 -0.760 -1.027) 2.265 3.243 ( -2.089 4.008 3.353) 5.628 3.416 ( -2.359 -0.265 3.524) 4.249 3.565 ( -0.736 -3.874 -0.899) 4.044 3.731 ( -0.895 2.556 2.003) 3.369 3.801 ( 1.103 -0.780 -5.848) 6.002 3.845 ( -4.067 0.656 4.191) 5.877 4.182 ( -1.458 2.455 -0.017) 2.855 4.263 ( 6.006 4.918 -1.077) 7.837 4.427 ( 7.125 3.363 -4.526) 9.086 4.476 ( 6.326 5.009 -2.441) 8.430 4.716 ( -6.221 -1.884 -3.645) 7.452 4.802 ( -6.052 -1.378 -1.177) 6.317 5.032 ( -2.865 -2.911 -7.260) 8.330 5.310 ( 5.545 2.253 -0.436) 6.001 5.472 ( 6.735 -2.006 -0.028) 7.027 5.948 ( -2.290 -1.193 -2.861) 3.853 6.050 ( 5.636 2.353 -1.194) 6.223 6.114 ( -1.833 -3.500 -0.390) 3.970 6.183 ( -1.711 0.738 -0.478) 1.924 6.422 ( -3.033 1.243 -1.879) 3.778 6.513 ( 5.091 -0.650 0.940) 5.218 6.703 ( -4.826 5.780 0.209) 7.533 6.848 ( 7.805 -1.014 -2.943) 8.403 7.232 ( -4.904 -6.109 4.209) 8.893 7.455 ( -5.097 -3.764 0.119) 6.337 7.711 ( 1.074 -11.096 3.542) 11.697 7.892 ( 3.321 -9.519 -0.151) 10.083 8.315 ( 1.836 0.171 -1.532) 2.398 8.396 ( -2.671 5.643 0.692) 6.281 8.544 ( -2.598 0.114 -6.969) 7.438 8.778 ( 0.830 9.651 -5.353) 11.067 9.526 ( 1.104 5.090 3.196) 6.111 9.700 ( -3.003 4.258 5.972) 7.926 9.918 ( -2.463 11.407 -7.043) 13.631 10.154 ( -0.365 7.509 -6.598) 10.003 10.633 ( -0.459 1.151 0.119) 1.245 10.738 ( 0.942 1.166 -2.705) 3.092 11.173 ( -3.499 -1.385 3.274) 4.988 11.318 ( 1.536 -1.502 -0.966) 2.355 12.262 ( -1.646 1.167 7.213) 7.490 12.585 ( 0.091 -1.296 -0.661) 1.457 12.764 ( -1.313 -6.278 1.707) 6.637 12.866 ( -0.577 -2.982 2.041) 3.660 13.198 ( 0.547 -2.867 6.603) 7.219 13.619 ( -4.736 -7.618 -3.837) 9.756 13.840 ( 8.034 -17.858 15.187) 24.781 14.047 ( 9.112 -1.461 2.475) 9.554 14.118 ( -5.947 1.823 0.869) 6.280 14.231 ( -0.787 -0.188 0.745) 1.100 14.372 ( 2.848 0.474 -1.935) 3.476 14.732 ( 7.328 1.018 -8.957) 11.618 19.159 ( -3.606 8.585 0.514) 9.326 19.312 ( 4.119 23.953 -7.328) 25.385 20.086 ( -5.704 -2.093 5.602) 8.265 20.577 ( 20.851 -1.040 -6.756) 21.943 21.650 ( -2.659 -2.018 0.161) 3.341 21.790 ( 5.128 -2.264 -4.246) 7.032 21.972 ( 2.551 1.522 -0.290) 2.985 22.037 ( -23.092 0.173 -0.921) 23.111 23.778 ( -1.802 -1.553 3.151) 3.948 23.909 ( 2.212 0.167 -1.753) 2.828 24.335 ( -10.308 1.147 0.443) 10.381 24.373 ( -0.710 0.294 -0.512) 0.924======================= Grid point 128 (62/116) =======================q-point: ( 0.12 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.286 ( 21.926 8.498 12.121) 26.455 1.439 ( 13.878 17.516 13.479) 26.098 2.046 ( 16.983 0.684 1.895) 17.103 2.117 ( 4.261 6.300 27.310) 28.349 2.462 ( 3.500 6.793 -9.144) 11.916 2.733 ( 4.568 -6.071 0.966) 7.659 2.893 ( 1.579 -3.613 7.679) 8.632 2.996 ( -3.825 -0.432 -2.633) 4.663 3.067 ( -3.891 0.197 3.490) 5.231 3.216 ( 0.790 3.907 -2.726) 4.829 3.345 ( -3.352 -0.304 7.904) 8.591 3.568 ( 0.489 -1.702 -2.903) 3.400 3.586 ( -5.200 -0.995 1.742) 5.573 3.807 ( -1.889 0.754 0.910) 2.228 3.881 ( 1.998 0.029 -1.404) 2.442 4.054 ( -5.209 5.708 -4.467) 8.926 4.392 ( 5.116 1.283 -3.627) 6.402 4.483 ( 0.650 -0.888 3.007) 3.202 4.554 ( -4.276 1.143 -2.125) 4.910 4.688 ( 4.730 0.368 0.252) 4.751 4.755 ( 4.944 5.249 -4.555) 8.530 4.943 ( -3.421 -3.971 -3.754) 6.447 5.442 ( 8.353 0.619 -3.539) 9.093 5.601 ( 6.547 -1.578 -2.536) 7.196 5.894 ( -4.007 -3.724 1.258) 5.613 6.056 ( -3.543 -4.791 -0.069) 5.959 6.130 ( -0.049 -0.566 -3.225) 3.275 6.245 ( 7.270 4.094 2.951) 8.850 6.375 ( 0.844 1.895 -8.372) 8.625 6.614 ( 0.209 -1.424 -1.312) 1.947 6.759 ( 13.424 6.319 -5.429) 15.799 6.995 ( 6.193 -1.342 -2.859) 6.951 7.144 ( -4.250 -5.843 4.685) 8.611 7.390 ( -1.553 0.021 1.169) 1.944 7.788 ( 5.058 -11.438 3.428) 12.967 7.946 ( 2.046 -8.466 0.564) 8.728 8.307 ( -2.677 2.831 0.465) 3.924 8.382 ( 0.855 2.743 0.162) 2.877 8.527 ( 3.318 0.103 -6.000) 6.857 8.786 ( 1.817 8.306 -6.201) 10.524 9.566 ( 1.563 3.237 5.061) 6.208 9.679 ( -0.853 6.305 7.545) 9.869 9.906 ( 3.388 10.018 -7.307) 12.854 10.145 ( 1.277 8.792 -5.643) 10.525 10.623 ( -0.607 -0.659 0.316) 0.950 10.738 ( -0.049 0.797 -3.187) 3.285 11.097 ( -5.147 -0.197 3.522) 6.240 11.306 ( -2.567 -1.564 -0.663) 3.078 12.229 ( -3.614 0.913 7.206) 8.113 12.602 ( 2.190 0.344 -0.726) 2.332 12.735 ( -3.021 -4.702 4.975) 7.483 12.836 ( -3.196 -5.037 2.563) 6.492 13.242 ( 1.270 -1.582 7.570) 7.838 13.415 ( -11.255 -1.964 -3.774) 12.032 13.657 ( -14.471 -1.699 7.097) 16.207 13.969 ( -12.699 -2.349 -1.608) 13.014 14.157 ( -5.886 0.535 0.401) 5.924 14.289 ( 8.094 -1.916 0.777) 8.353 14.530 ( 15.374 -3.727 -0.894) 15.845 15.062 ( 18.104 -13.274 -9.270) 24.288 19.087 ( -3.363 7.016 0.030) 7.781 19.260 ( -7.051 19.252 -2.412) 20.644 20.028 ( -0.645 0.641 0.407) 0.997 20.666 ( -10.965 -6.504 2.797) 13.052 21.630 ( -5.448 4.537 1.184) 7.188 21.718 ( 4.152 -0.710 -10.025) 10.874 22.094 ( 26.995 -2.555 -10.587) 29.109 22.228 ( 14.450 -2.727 5.114) 15.569 23.761 ( -0.915 -0.646 3.997) 4.151 23.940 ( 1.321 0.800 -2.791) 3.190 24.136 ( -6.580 4.526 3.790) 8.839 24.449 ( 4.709 0.248 0.959) 4.812======================= Grid point 129 (63/116) =======================q-point: ( 0.25 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.582 ( 9.079 11.869 15.102) 21.246 1.924 ( 22.667 4.941 4.245) 23.585 2.210 ( -1.209 2.807 23.067) 23.269 2.317 ( 6.175 -1.707 -1.251) 6.528 2.605 ( 11.982 3.830 -6.971) 14.381 2.815 ( -4.350 -1.371 2.756) 5.329 2.873 ( 3.095 4.250 1.253) 5.404 2.980 ( 5.085 -2.836 2.967) 6.534 3.018 ( -1.741 -0.899 7.404) 7.659 3.192 ( -0.953 3.115 -4.045) 5.193 3.429 ( 7.434 -1.575 6.032) 9.702 3.576 ( -0.364 -1.247 -0.749) 1.499 3.587 ( 5.251 0.415 3.517) 6.334 3.763 ( -2.851 -3.636 1.405) 4.829 3.929 ( 5.595 3.645 -4.566) 8.089 4.018 ( 2.684 5.201 -4.913) 7.641 4.369 ( -5.990 -0.450 3.631) 7.019 4.458 ( 0.966 1.069 -0.860) 1.678 4.502 ( -4.795 1.861 -2.772) 5.843 4.791 ( 7.721 2.874 -3.496) 8.950 4.850 ( 1.116 -3.757 -4.048) 5.635 4.954 ( 7.038 2.750 0.197) 7.559 5.588 ( 6.271 -1.180 -4.111) 7.590 5.716 ( 6.085 -1.085 -2.984) 6.863 5.814 ( -4.067 -2.284 6.834) 8.274 5.979 ( -3.529 -4.576 -2.184) 6.178 6.106 ( -1.679 -0.509 -1.199) 2.125 6.286 ( -0.686 0.087 -5.930) 5.970 6.454 ( 6.020 3.598 -4.811) 8.505 6.579 ( -2.393 -3.457 -1.225) 4.379 6.950 ( 5.589 6.397 -7.447) 11.296 6.994 ( -4.880 -2.089 -1.529) 5.524 7.148 ( 2.737 -2.743 2.960) 4.876 7.422 ( 4.528 1.887 -1.965) 5.284 7.874 ( 1.192 -11.354 3.746) 12.015 7.987 ( 2.350 -8.403 1.337) 8.827 8.262 ( -1.536 4.836 2.343) 5.589 8.391 ( 0.446 -0.649 -2.500) 2.621 8.617 ( 6.010 2.146 -3.251) 7.162 8.814 ( 3.034 4.894 -7.174) 9.199 9.603 ( 0.093 3.169 8.663) 9.225 9.723 ( 3.128 5.242 6.699) 9.063 10.002 ( 8.460 8.636 -7.573) 14.266 10.164 ( 1.950 9.688 -4.612) 10.905 10.612 ( -0.517 -2.266 -0.470) 2.372 10.720 ( -0.687 1.390 -3.159) 3.519 11.002 ( -5.367 0.420 2.810) 6.073 11.217 ( -6.270 -0.495 -0.625) 6.320 12.173 ( -4.072 -0.001 7.477) 8.514 12.658 ( -5.885 -1.049 7.696) 9.745 12.667 ( 3.210 1.106 0.631) 3.453 12.781 ( -1.883 -8.427 0.418) 8.645 13.165 ( -11.026 -0.364 -0.745) 11.058 13.308 ( 0.936 2.516 5.443) 6.069 13.456 ( -7.921 -3.758 2.863) 9.223 13.749 ( -8.052 2.176 -0.293) 8.346 14.042 ( -5.640 -0.115 -0.249) 5.647 14.396 ( 3.541 2.578 -2.513) 5.050 14.800 ( 11.636 -7.694 -0.152) 13.951 15.257 ( 5.371 -11.329 -7.253) 14.485 19.026 ( -4.456 6.703 2.222) 8.350 19.109 ( -5.299 9.574 -1.337) 11.024 20.049 ( 2.207 -2.644 -0.410) 3.468 20.431 ( -12.034 -4.848 6.791) 14.644 21.531 ( -4.479 4.391 2.359) 6.701 21.771 ( 3.744 2.455 -11.147) 12.012 22.501 ( 11.189 -5.496 9.443) 15.639 22.681 ( 31.981 -5.640 -19.550) 37.905 23.764 ( -0.062 0.531 3.006) 3.053 23.926 ( -1.467 3.726 -2.758) 4.862 24.120 ( 3.103 0.181 2.979) 4.305 24.537 ( 3.804 1.803 0.392) 4.228======================= Grid point 130 (64/116) =======================q-point: ( 0.38 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.713 ( -1.163 11.835 12.368) 17.158 2.132 ( -3.201 0.234 5.035) 5.971 2.254 ( 1.697 5.868 15.093) 16.282 2.412 ( 5.629 -3.246 5.897) 8.775 2.626 ( -1.313 3.976 -8.313) 9.308 2.822 ( -3.650 1.117 1.149) 3.987 2.954 ( 3.379 -0.463 3.221) 4.691 3.028 ( 9.621 -1.876 0.608) 9.821 3.181 ( 6.206 -3.247 4.310) 8.224 3.218 ( 5.973 1.459 -2.528) 6.648 3.534 ( -2.044 -1.642 1.332) 2.941 3.608 ( 4.721 0.079 6.279) 7.856 3.720 ( -1.287 -2.331 1.332) 2.977 3.746 ( 7.955 -0.549 3.100) 8.555 4.037 ( 4.487 -1.806 -2.120) 5.280 4.112 ( 8.521 8.792 -3.373) 12.700 4.299 ( -3.041 2.776 2.391) 4.761 4.374 ( -5.345 1.149 -2.745) 6.118 4.491 ( 1.195 2.742 1.947) 3.569 4.800 ( -0.911 -4.821 -2.682) 5.592 4.958 ( 6.820 0.210 -6.425) 9.372 5.088 ( 5.666 3.166 -3.204) 7.238 5.598 ( -3.902 -1.260 2.350) 4.726 5.742 ( -3.836 -0.488 0.081) 3.868 5.857 ( 4.852 -1.122 -0.202) 4.984 5.946 ( 1.925 -4.201 -2.644) 5.324 6.076 ( 0.135 2.261 0.111) 2.268 6.257 ( 1.293 -0.392 -10.018) 10.109 6.480 ( -3.294 -4.527 -1.954) 5.929 6.544 ( -0.357 4.199 -2.614) 4.959 6.875 ( -5.629 -2.095 -0.687) 6.046 6.967 ( -0.248 4.961 -4.291) 6.564 7.219 ( 3.017 -0.101 3.279) 4.457 7.493 ( 2.663 2.239 -4.309) 5.538 7.865 ( -1.789 -11.424 3.941) 12.216 8.031 ( 1.528 -5.811 0.505) 6.030 8.267 ( 0.621 3.164 2.798) 4.269 8.388 ( -0.001 -2.629 -2.508) 3.633 8.714 ( 4.725 3.081 -2.178) 6.046 8.848 ( 2.183 2.118 -7.729) 8.306 9.623 ( -0.998 5.132 10.501) 11.731 9.812 ( 3.245 3.006 6.695) 8.024 10.143 ( 3.918 8.414 -4.220) 10.196 10.216 ( 8.573 8.652 -8.147) 14.653 10.604 ( 0.245 -2.317 -1.681) 2.873 10.704 ( -0.081 1.999 -2.361) 3.095 10.907 ( -5.275 -0.735 2.355) 5.823 11.078 ( -6.751 2.625 -0.878) 7.297 12.122 ( -3.409 -0.900 8.144) 8.875 12.556 ( -6.025 1.145 10.266) 11.959 12.688 ( -1.178 -6.839 -4.961) 8.530 12.822 ( 5.050 -1.896 1.929) 5.729 12.977 ( -6.801 0.307 -0.787) 6.853 13.291 ( -4.961 4.106 0.987) 6.515 13.402 ( 1.589 -5.288 5.383) 7.711 13.642 ( -4.372 2.801 1.908) 5.532 13.959 ( -2.386 0.262 0.695) 2.499 14.420 ( 0.267 4.401 -4.981) 6.652 14.967 ( 5.395 -10.136 0.760) 11.507 15.281 ( 0.334 -5.563 -6.022) 8.205 18.918 ( -6.031 5.953 4.790) 9.734 19.083 ( 1.904 3.652 -4.023) 5.757 20.070 ( -2.488 -8.922 5.010) 10.530 20.281 ( -3.121 -3.021 0.859) 4.428 21.466 ( -3.078 5.138 2.401) 6.452 21.808 ( 3.439 6.785 -10.656) 13.092 22.667 ( 2.023 -6.923 11.757) 13.793 23.160 ( 22.602 -5.929 -15.830) 28.224 23.765 ( -0.568 0.727 1.179) 1.496 23.887 ( -1.776 2.478 -2.886) 4.198 24.234 ( 7.200 -2.509 1.993) 7.881 24.592 ( 2.205 3.649 -2.175) 4.786======================= Grid point 131 (65/116) =======================q-point: (-0.50 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.641 ( -7.669 11.219 11.233) 17.631 1.999 ( -11.389 3.647 13.790) 18.253 2.303 ( 0.445 7.137 5.628) 9.100 2.450 ( -5.056 1.086 -3.996) 6.535 2.680 ( 7.806 -1.023 2.243) 8.186 2.778 ( 2.002 1.606 5.468) 6.040 3.022 ( 1.303 -4.698 0.478) 4.899 3.230 ( 10.143 -2.319 -0.662) 10.426 3.257 ( 3.710 -3.104 -1.948) 5.215 3.356 ( 5.860 -1.739 1.768) 6.363 3.441 ( -7.776 -3.865 2.274) 8.976 3.630 ( -4.829 1.774 5.605) 7.608 3.701 ( -1.939 2.034 1.551) 3.209 3.841 ( -0.136 -3.520 2.449) 4.290 4.101 ( 2.312 0.713 0.137) 2.423 4.230 ( -3.912 2.862 0.115) 4.849 4.256 ( 0.164 1.478 -2.853) 3.217 4.296 ( 2.541 4.653 1.185) 5.432 4.517 ( 0.352 5.360 3.382) 6.347 4.778 ( -1.316 -3.903 -4.905) 6.405 5.023 ( 2.217 -2.566 -5.929) 6.831 5.134 ( 0.421 1.892 -6.930) 7.196 5.510 ( -6.038 0.846 6.332) 8.790 5.622 ( -6.840 1.820 -0.750) 7.118 5.876 ( 0.183 -2.300 -3.879) 4.514 6.024 ( 3.826 -2.578 -2.434) 5.216 6.145 ( 5.958 2.295 1.504) 6.559 6.319 ( 6.911 -0.664 -6.758) 9.688 6.353 ( -6.862 -1.162 -3.637) 7.852 6.525 ( -0.309 2.744 -3.750) 4.657 6.822 ( 0.573 -2.282 -0.196) 2.361 6.936 ( -2.395 2.959 -2.390) 4.495 7.270 ( 1.034 2.636 4.036) 4.930 7.502 ( 0.579 0.647 -4.430) 4.515 7.858 ( -0.237 -13.445 4.026) 14.037 8.053 ( 0.867 -4.209 -0.755) 4.363 8.276 ( -0.585 0.495 1.300) 1.508 8.383 ( 0.305 -1.100 -0.942) 1.480 8.778 ( 1.927 3.617 -1.783) 4.470 8.843 ( -0.255 1.081 -7.496) 7.578 9.618 ( -2.722 6.691 10.013) 12.346 9.867 ( 0.371 1.058 6.070) 6.173 10.158 ( 0.947 7.940 -3.806) 8.856 10.393 ( 9.291 9.118 -9.572) 16.159 10.593 ( -3.245 -2.099 -0.358) 3.881 10.685 ( -0.287 2.212 -3.538) 4.182 10.848 ( 0.419 -1.265 3.458) 3.706 11.000 ( -0.225 4.227 -1.149) 4.386 12.091 ( -2.363 -1.528 9.338) 9.753 12.499 ( -2.716 1.280 10.061) 10.499 12.644 ( -1.176 -8.068 -5.862) 10.042 12.850 ( -1.628 -1.346 -1.109) 2.385 12.984 ( 5.673 1.399 3.879) 7.013 13.183 ( -5.633 -0.926 -1.287) 5.852 13.460 ( 0.916 0.062 6.559) 6.623 13.573 ( -2.273 1.168 1.128) 2.793 13.966 ( 2.474 1.013 2.754) 3.838 14.387 ( -1.640 5.295 -6.716) 8.708 15.013 ( -0.909 -11.828 1.523) 11.960 15.263 ( -0.249 -1.757 -5.886) 6.147 18.846 ( -2.540 4.879 4.109) 6.866 19.133 ( 4.283 2.589 -4.126) 6.486 19.978 ( -7.025 -8.113 7.607) 13.155 20.310 ( 4.122 -6.020 -1.474) 7.443 21.423 ( -2.000 4.867 1.859) 5.581 21.841 ( 2.963 10.258 -10.056) 14.667 22.631 ( -8.918 -6.699 10.329) 15.202 23.476 ( 14.237 -4.267 -9.516) 17.648 23.735 ( -4.084 -2.847 1.104) 5.100 23.843 ( -0.988 1.955 -4.402) 4.917 24.371 ( 4.792 -3.583 2.066) 6.330 24.629 ( 3.855 3.784 -5.884) 7.987======================= Grid point 132 (66/116) =======================q-point: (-0.38 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.525 ( -7.552 12.306 11.615) 18.531 1.817 ( -11.722 5.005 19.605) 23.384 2.287 ( -8.038 4.912 -4.485) 10.434 2.319 ( -0.360 7.427 2.605) 7.879 2.853 ( 7.506 -1.137 4.445) 8.797 2.869 ( 2.234 -1.479 5.947) 6.523 3.020 ( -0.526 -5.350 -2.196) 5.807 3.219 ( -16.556 -2.505 3.850) 17.181 3.267 ( -4.128 -5.875 2.311) 7.543 3.382 ( 0.353 2.206 -6.275) 6.661 3.436 ( 1.021 -0.998 3.264) 3.562 3.479 ( -1.698 -3.435 4.838) 6.172 3.720 ( -0.078 1.076 2.921) 3.114 3.768 ( -3.955 -0.235 -0.187) 3.967 4.070 ( -5.154 2.212 4.484) 7.181 4.140 ( -6.415 1.955 -6.774) 9.532 4.197 ( -2.030 1.367 0.162) 2.453 4.412 ( 6.793 3.885 0.954) 7.884 4.530 ( 0.380 7.141 3.725) 8.063 4.687 ( -5.423 -5.009 -9.531) 12.056 5.041 ( 0.539 -0.849 -2.366) 2.570 5.059 ( -4.584 -0.797 -7.326) 8.679 5.408 ( -6.308 1.255 6.953) 9.471 5.513 ( -4.103 1.904 -0.968) 4.626 5.915 ( 4.602 -1.888 -2.035) 5.375 6.059 ( 1.638 -0.707 -1.945) 2.640 6.167 ( -5.079 -3.145 -5.777) 8.310 6.302 ( 3.488 3.645 4.577) 6.812 6.432 ( 4.224 -1.668 -9.096) 10.167 6.556 ( 4.421 0.965 -2.472) 5.156 6.850 ( -4.747 2.827 -0.491) 5.547 6.862 ( 2.125 -1.366 -2.693) 3.693 7.276 ( -1.497 4.200 4.191) 6.119 7.528 ( 3.741 -2.268 -5.061) 6.690 7.855 ( -2.132 -15.128 4.760) 16.002 8.052 ( -1.350 -8.145 -0.990) 8.315 8.254 ( -1.225 -0.733 -1.017) 1.753 8.405 ( 2.060 3.376 0.133) 3.958 8.766 ( -1.612 4.929 -3.219) 6.103 8.813 ( -0.998 2.069 -5.210) 5.694 9.577 ( -3.723 7.029 7.058) 10.635 9.867 ( -1.846 -1.043 4.303) 4.797 10.173 ( 1.497 8.978 -4.415) 10.117 10.383 ( -7.714 3.838 -5.033) 9.979 10.570 ( 3.751 5.156 -3.706) 7.375 10.697 ( 1.059 1.360 -1.821) 2.507 10.944 ( 7.426 -1.351 3.306) 8.240 11.059 ( 5.926 2.714 -2.113) 6.852 12.090 ( -0.575 -1.907 11.288) 11.463 12.514 ( 1.237 0.054 11.441) 11.508 12.615 ( -0.110 -7.432 -5.254) 9.102 12.832 ( -0.506 -1.623 0.941) 1.943 13.048 ( -4.098 -2.106 -1.316) 4.792 13.145 ( 6.130 0.635 2.443) 6.629 13.427 ( -4.017 1.976 4.831) 6.586 13.617 ( 5.092 1.349 1.929) 5.610 14.053 ( 5.027 0.810 3.614) 6.244 14.323 ( -2.793 5.602 -7.428) 9.714 14.947 ( -6.287 -11.844 1.111) 13.455 15.226 ( -2.461 -0.939 -5.357) 5.969 18.848 ( 1.900 6.576 2.830) 7.407 19.213 ( 4.582 3.471 -2.906) 6.441 19.888 ( -3.599 -5.548 5.654) 8.701 20.383 ( 2.691 -6.649 1.509) 7.330 21.405 ( 0.069 2.702 0.549) 2.758 21.862 ( 2.064 11.554 -8.927) 14.746 22.408 ( -15.530 -5.313 6.199) 17.546 23.581 ( -11.544 -5.255 -2.122) 12.860 23.673 ( 8.750 -3.412 -5.870) 11.076 23.834 ( 0.309 0.984 -1.773) 2.051 24.398 ( -1.500 -0.531 -0.369) 1.633 24.721 ( 6.289 -1.578 -7.069) 9.592======================= Grid point 133 (67/116) =======================q-point: (-0.25 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.405 ( -8.838 14.106 13.523) 21.446 1.665 ( -11.089 6.062 23.142) 26.368 2.112 ( -9.160 6.510 -4.949) 12.279 2.295 ( -6.174 8.539 4.429) 11.431 2.614 ( -24.817 1.016 8.053) 26.110 2.938 ( -0.019 -4.474 -0.669) 4.524 2.988 ( -5.217 -4.189 4.093) 7.843 3.072 ( -0.606 -1.152 3.594) 3.823 3.200 ( 3.245 -3.758 -1.920) 5.323 3.296 ( -5.442 2.889 0.848) 6.219 3.396 ( -7.917 -4.946 1.872) 9.521 3.508 ( 0.483 -2.445 2.631) 3.624 3.675 ( 1.839 -0.528 -1.487) 2.424 3.803 ( 2.136 4.271 0.080) 4.776 3.943 ( -9.249 0.789 -1.502) 9.403 4.063 ( 2.675 3.883 0.442) 4.736 4.153 ( -0.741 4.861 0.816) 4.984 4.493 ( -2.407 3.119 -1.415) 4.186 4.526 ( -7.130 -0.607 -5.634) 9.108 4.623 ( 9.413 1.103 -1.568) 9.606 4.953 ( -1.483 -3.500 -4.430) 5.838 5.062 ( 0.912 -1.851 -4.027) 4.525 5.317 ( -4.680 2.423 6.076) 8.043 5.434 ( -4.267 1.055 0.257) 4.403 5.996 ( 2.386 -2.659 -2.278) 4.237 6.074 ( -1.299 -0.212 -3.792) 4.013 6.101 ( 2.890 -0.235 -1.459) 3.246 6.322 ( -3.225 -1.570 -0.792) 3.673 6.465 ( 1.771 -0.018 -5.422) 5.704 6.558 ( -3.924 -0.649 -0.366) 3.995 6.816 ( 1.422 4.336 -0.254) 4.570 6.856 ( -2.212 -0.151 -4.827) 5.312 7.262 ( -0.566 2.329 3.991) 4.655 7.598 ( 4.167 -4.924 -6.149) 8.911 7.792 ( -5.537 -13.748 5.618) 15.850 7.971 ( -6.780 -15.051 0.587) 16.518 8.249 ( 1.343 1.248 -2.218) 2.877 8.444 ( 1.438 4.403 -1.199) 4.784 8.724 ( -1.981 2.595 -4.859) 5.854 8.778 ( -0.517 7.709 -3.486) 8.476 9.530 ( -2.520 6.484 4.060) 8.055 9.822 ( -3.699 -1.667 2.690) 4.868 10.149 ( -4.012 9.435 -5.675) 11.719 10.247 ( -2.949 5.217 -4.441) 7.459 10.619 ( 1.978 4.646 -2.745) 5.748 10.709 ( 0.905 1.801 -1.883) 2.759 11.114 ( 8.383 -1.989 1.692) 8.780 11.168 ( 4.752 0.561 -2.038) 5.201 12.148 ( 3.028 -1.492 12.290) 12.745 12.592 ( 1.018 -5.901 -1.880) 6.276 12.651 ( 7.522 -5.742 14.020) 16.915 12.826 ( -0.506 -2.582 2.245) 3.459 12.967 ( -1.955 0.731 -1.121) 2.369 13.235 ( -1.219 -3.761 6.017) 7.200 13.466 ( 10.158 5.162 1.545) 11.499 13.736 ( 6.077 1.576 0.697) 6.317 14.160 ( 4.617 0.066 2.820) 5.411 14.241 ( -3.219 5.964 -6.177) 9.170 14.769 ( -12.571 -11.028 0.645) 16.735 15.117 ( -7.559 -0.647 -5.129) 9.158 18.942 ( 7.306 11.558 0.589) 13.686 19.271 ( 1.313 5.952 -0.420) 6.110 19.899 ( 4.007 -3.717 3.357) 6.414 20.399 ( -2.398 -3.687 4.827) 6.530 21.443 ( 4.259 -0.717 -1.045) 4.443 21.869 ( 0.853 9.970 -6.830) 12.115 22.115 ( -14.375 -3.632 1.027) 14.863 23.264 ( -20.381 -7.231 -7.233) 22.804 23.793 ( 5.010 -1.487 -2.481) 5.785 23.829 ( -0.600 -0.542 -0.201) 0.833 24.352 ( -2.077 0.537 -2.161) 3.045 24.770 ( -0.247 -5.566 -8.356) 10.043======================= Grid point 134 (68/116) =======================q-point: (-0.12 0.14 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.246 ( -14.169 12.085 15.270) 24.083 1.440 ( -18.014 13.288 17.366) 28.332 1.890 ( -10.231 6.884 -7.316) 14.339 2.020 ( -15.475 9.548 30.227) 35.275 2.436 ( 0.669 5.671 -4.939) 7.550 2.823 ( -7.407 -8.318 0.987) 11.182 2.952 ( -0.787 -5.707 -2.365) 6.228 3.010 ( -7.690 -1.063 5.801) 9.691 3.184 ( -5.231 -3.414 -1.144) 6.350 3.241 ( 0.107 3.575 4.281) 5.579 3.374 ( 5.132 -2.175 -0.021) 5.574 3.541 ( 2.900 -0.393 3.927) 4.898 3.709 ( -2.354 1.177 -1.441) 3.000 3.825 ( 0.317 4.959 -5.884) 7.702 3.855 ( 4.608 -2.688 4.998) 7.310 4.141 ( -3.560 4.427 0.490) 5.702 4.200 ( 10.489 4.019 0.603) 11.249 4.323 ( -5.048 -0.387 -5.333) 7.353 4.480 ( -1.519 8.807 -0.705) 8.965 4.759 ( 3.448 -1.040 -3.958) 5.352 4.937 ( -3.245 -6.481 -3.183) 7.916 5.057 ( 1.626 -2.501 -7.923) 8.466 5.269 ( -1.777 3.624 3.594) 5.405 5.381 ( 0.513 -0.041 2.528) 2.580 5.988 ( -0.022 -1.608 -4.642) 4.913 6.057 ( -3.353 1.993 -1.530) 4.190 6.131 ( 0.272 -2.371 -1.591) 2.868 6.229 ( -3.184 -2.392 -1.354) 4.206 6.454 ( -0.586 -1.645 -1.757) 2.477 6.505 ( -2.188 2.456 1.377) 3.566 6.779 ( -0.994 -0.545 -5.429) 5.546 6.815 ( -3.553 4.534 0.081) 5.761 7.272 ( -0.452 -1.777 3.887) 4.298 7.580 ( -5.671 -8.574 -3.349) 10.812 7.724 ( -2.261 -10.773 3.169) 11.455 7.859 ( -2.347 -13.460 1.907) 13.796 8.280 ( 2.170 0.723 -2.164) 3.149 8.441 ( -1.256 4.673 -1.465) 5.056 8.642 ( -4.536 1.185 -6.430) 7.957 8.777 ( 0.840 9.766 -3.935) 10.563 9.510 ( -0.495 5.941 2.844) 6.605 9.753 ( -3.813 0.788 3.191) 5.034 10.026 ( -5.823 10.063 -5.982) 13.075 10.195 ( -1.576 7.473 -7.081) 10.415 10.636 ( 0.432 2.848 -0.993) 3.047 10.723 ( 1.149 1.811 -2.234) 3.097 11.207 ( -0.407 -1.555 0.867) 1.827 11.253 ( 5.421 -1.666 -0.632) 5.706 12.239 ( 1.895 0.322 8.818) 9.025 12.589 ( -0.083 -3.854 -1.458) 4.122 12.782 ( -0.414 -8.299 0.911) 8.360 12.856 ( 1.086 -3.742 2.374) 4.563 13.159 ( 15.181 -3.398 9.646) 18.304 13.227 ( 8.793 -8.615 17.634) 21.506 13.750 ( 15.630 1.997 -0.500) 15.765 13.806 ( 0.793 1.111 -2.104) 2.508 14.201 ( 1.312 5.885 -2.078) 6.378 14.246 ( 4.321 0.119 1.531) 4.586 14.463 ( -18.629 -7.427 0.920) 20.076 14.901 ( -12.567 0.721 -5.774) 13.848 19.120 ( 9.926 17.806 -3.255) 20.644 19.261 ( -1.387 9.854 0.056) 9.951 20.064 ( 9.817 -5.074 4.692) 12.005 20.338 ( -2.023 2.155 3.015) 4.222 21.567 ( 8.404 -3.451 -1.187) 9.162 21.827 ( -5.438 0.386 -1.687) 5.706 21.928 ( -1.750 3.737 -5.373) 6.775 22.721 ( -33.348 -6.525 -8.939) 35.136 23.806 ( -1.697 -1.463 2.050) 3.037 23.865 ( 3.061 -0.253 -2.112) 3.728 24.327 ( 0.379 -0.151 -1.759) 1.806 24.631 ( -11.596 -4.361 -6.792) 14.129======================= Grid point 135 (69/116) =======================q-point: ( 0.00 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.337 ( -2.736 18.670 8.844) 20.839 1.743 ( -0.511 19.571 13.473) 23.766 1.948 ( 1.406 8.798 -4.752) 10.098 2.207 ( -2.212 10.399 26.868) 28.895 2.503 ( -3.786 -11.447 2.336) 12.281 2.616 ( 3.016 6.459 -2.167) 7.451 2.743 ( 0.081 -8.624 -4.405) 9.685 2.881 ( 0.530 -5.128 9.705) 10.989 3.113 ( -1.943 2.256 -1.338) 3.264 3.340 ( 0.876 5.027 4.200) 6.609 3.411 ( 0.351 -0.323 3.096) 3.132 3.527 ( -4.620 0.709 1.566) 4.929 3.728 ( -0.069 -1.092 3.738) 3.894 3.799 ( -7.721 -0.288 -6.981) 10.413 3.912 ( 0.895 4.095 -1.376) 4.412 4.203 ( 3.654 -0.565 0.635) 3.751 4.380 ( 9.016 2.259 -5.337) 10.719 4.510 ( -3.928 -2.017 -3.690) 5.755 4.519 ( 3.821 6.867 -2.390) 8.214 4.622 ( -3.604 -5.186 -0.686) 6.353 4.761 ( 2.618 -2.739 -5.657) 6.809 4.983 ( -1.287 -1.950 -9.887) 10.159 5.380 ( 2.200 3.910 0.640) 4.532 5.432 ( 4.473 -1.218 -0.523) 4.665 5.859 ( -4.569 -5.443 -0.543) 7.127 6.003 ( -3.563 -4.617 2.580) 6.377 6.193 ( 9.307 7.935 -1.402) 12.311 6.246 ( -2.132 4.957 -5.218) 7.506 6.447 ( -5.270 0.850 -1.667) 5.592 6.544 ( 8.231 3.279 -0.407) 8.869 6.785 ( -5.045 0.931 -1.291) 5.290 6.806 ( 7.700 -3.147 -2.259) 8.620 7.119 ( -5.205 -3.338 4.636) 7.728 7.371 ( -1.104 -6.793 2.603) 7.358 7.470 ( 1.916 -7.014 -2.325) 7.634 7.710 ( 4.677 -8.271 -2.774) 9.898 8.338 ( 0.493 2.230 -0.657) 2.377 8.481 ( -1.850 1.719 -3.089) 3.990 8.555 ( -3.774 1.839 1.081) 4.335 8.843 ( 0.816 -2.450 -4.314) 5.028 9.676 ( -1.482 7.403 7.464) 10.616 9.859 ( -1.228 8.609 5.229) 10.147 10.143 ( -1.295 8.397 -1.827) 8.690 10.327 ( 1.133 8.398 -9.367) 12.631 10.703 ( -0.872 5.359 -4.022) 6.757 10.765 ( -0.607 1.632 -4.703) 5.015 11.131 ( -2.110 -2.485 4.197) 5.314 11.259 ( 1.123 -4.325 0.183) 4.473 12.304 ( -1.445 3.009 5.210) 6.188 12.533 ( 1.969 -3.686 6.738) 7.928 12.618 ( 0.016 -6.174 0.245) 6.178 12.746 ( 0.262 -8.187 4.909) 9.549 13.136 ( 0.207 -1.977 6.026) 6.345 13.334 ( 7.727 -10.693 11.120) 17.254 13.742 ( -4.186 1.117 -0.391) 4.350 14.003 ( 1.943 -3.484 0.810) 4.070 14.152 ( -5.616 1.710 1.883) 6.165 14.235 ( -1.550 0.134 1.913) 2.465 14.415 ( 4.438 3.101 -3.864) 6.651 14.677 ( 1.921 -4.472 -9.154) 10.367 19.371 ( -4.864 10.885 3.258) 12.359 19.739 ( -0.110 11.469 -4.794) 12.432 20.071 ( 3.314 3.432 -1.370) 4.964 20.536 ( 11.508 -2.934 -7.385) 13.985 21.613 ( 1.824 -1.220 -2.180) 3.094 21.723 ( 8.134 -3.725 -5.106) 10.301 22.002 ( -9.237 1.228 0.377) 9.326 22.044 ( -11.695 0.271 -0.279) 11.702 23.776 ( -1.074 1.221 4.081) 4.393 23.897 ( 1.481 -1.156 -0.109) 1.882 24.345 ( 0.252 0.044 -0.274) 0.375 24.377 ( -5.003 -0.199 -1.033) 5.112======================= Grid point 136 (70/116) =======================q-point: ( 0.12 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.522 ( 15.247 13.078 8.038) 21.636 1.861 ( 9.539 20.227 10.881) 24.870 2.113 ( 14.093 5.566 -1.079) 15.191 2.283 ( 1.333 6.846 24.374) 25.352 2.458 ( -0.296 -8.473 -2.475) 8.832 2.690 ( 4.910 4.491 -0.249) 6.659 2.799 ( 4.781 -5.723 -0.757) 7.496 2.932 ( 1.228 -2.919 10.799) 11.253 3.120 ( 2.082 1.905 -1.458) 3.176 3.318 ( -5.687 3.413 -0.014) 6.632 3.362 ( -1.399 4.311 7.712) 8.946 3.509 ( 0.746 -1.788 -1.768) 2.623 3.605 ( -6.015 0.301 -1.151) 6.131 3.727 ( -2.348 -4.288 1.865) 5.233 3.952 ( 1.890 3.667 -4.147) 5.850 4.171 ( -3.435 3.874 -4.025) 6.558 4.384 ( -0.263 -3.167 -4.790) 5.749 4.446 ( -2.604 -1.913 0.220) 3.239 4.593 ( 0.754 1.427 -3.994) 4.308 4.718 ( 10.635 3.821 -0.302) 11.304 4.847 ( 3.558 -2.378 -2.471) 4.942 4.896 ( -0.575 4.858 -7.571) 9.014 5.460 ( 6.150 1.119 -3.014) 6.940 5.550 ( 7.015 -2.904 -0.725) 7.627 5.777 ( -3.965 -6.038 1.055) 7.300 5.950 ( -2.739 -6.018 4.286) 7.880 6.135 ( -5.418 1.611 -5.319) 7.761 6.337 ( -2.672 1.128 0.114) 2.902 6.416 ( 8.537 5.023 -6.543) 11.871 6.611 ( -2.160 1.449 -1.119) 2.832 6.866 ( 12.318 2.475 -3.717) 13.102 6.948 ( 5.430 -3.241 -0.886) 6.386 7.068 ( -0.328 -0.662 3.348) 3.429 7.373 ( 1.482 -2.836 0.253) 3.210 7.543 ( 5.521 -8.172 -0.271) 9.866 7.789 ( 3.825 -7.189 -2.841) 8.625 8.331 ( -1.179 1.062 0.140) 1.593 8.434 ( -1.403 0.127 -4.677) 4.884 8.551 ( 2.608 3.332 3.016) 5.197 8.852 ( 1.302 -1.810 -3.922) 4.512 9.682 ( -0.298 6.825 8.262) 10.720 9.849 ( -1.070 7.707 5.926) 9.781 10.134 ( 1.503 9.475 -3.461) 10.199 10.354 ( 3.809 9.822 -7.095) 12.701 10.648 ( -3.513 3.054 -3.176) 5.635 10.753 ( 0.624 1.765 -3.691) 4.138 11.089 ( -3.577 -0.870 3.394) 5.007 11.245 ( -2.232 -4.413 0.029) 4.946 12.261 ( -4.192 2.179 5.197) 7.023 12.578 ( -0.706 -7.307 6.025) 9.497 12.611 ( 1.723 -1.197 -1.718) 2.712 12.738 ( -3.013 -4.511 6.277) 8.296 13.181 ( 2.076 -3.133 5.590) 6.736 13.332 ( -7.708 -5.010 1.122) 9.261 13.658 ( -7.095 1.566 6.026) 9.440 13.907 ( -8.269 -3.766 -1.247) 9.172 14.150 ( -3.390 -1.503 3.312) 4.972 14.204 ( 6.119 -3.171 -0.304) 6.899 14.527 ( 7.732 2.779 -1.868) 8.425 14.836 ( 12.829 -7.904 -8.616) 17.358 19.273 ( -5.522 9.842 1.698) 11.412 19.595 ( -11.864 9.017 -1.113) 14.943 20.077 ( -2.370 5.043 -3.879) 6.790 20.520 ( -10.332 -6.675 -0.519) 12.312 21.717 ( 8.119 1.152 -9.720) 12.717 21.743 ( -6.266 5.543 3.295) 8.992 22.018 ( 23.085 -4.466 -9.099) 25.212 22.146 ( 10.151 -4.887 4.363) 12.081 23.777 ( -0.140 1.895 4.352) 4.749 23.920 ( 1.114 -1.841 -0.728) 2.272 24.247 ( -4.031 4.946 -0.271) 6.386 24.441 ( 5.441 -1.159 0.378) 5.576======================= Grid point 137 (71/116) =======================q-point: ( 0.25 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.830 ( 12.783 9.448 9.551) 18.545 2.112 ( 9.742 12.962 3.200) 16.527 2.311 ( -0.015 4.481 18.734) 19.262 2.364 ( 3.038 7.215 6.883) 10.425 2.546 ( 10.427 -9.604 0.545) 14.187 2.750 ( -0.688 1.609 -2.669) 3.192 2.903 ( 8.238 -2.880 -1.178) 8.806 3.001 ( 0.461 -0.369 11.143) 11.159 3.099 ( -1.554 8.396 -0.813) 8.577 3.244 ( -2.420 1.408 -2.943) 4.062 3.407 ( 5.131 -0.803 4.143) 6.643 3.522 ( 0.736 -4.897 -2.106) 5.381 3.594 ( 4.469 0.746 4.133) 6.132 3.703 ( -0.388 0.182 2.073) 2.117 3.943 ( 0.986 -0.158 -4.580) 4.687 4.194 ( 6.072 8.519 -5.582) 11.858 4.339 ( -3.811 -4.542 3.188) 6.732 4.464 ( 4.425 -0.662 -5.157) 6.827 4.536 ( -3.972 1.389 -5.267) 6.741 4.748 ( -3.353 -2.973 -4.546) 6.383 4.918 ( 6.422 7.260 -1.545) 9.815 5.034 ( 9.334 4.881 -0.402) 10.540 5.562 ( 3.664 -1.074 -2.204) 4.408 5.675 ( 5.626 -3.182 -1.328) 6.598 5.742 ( 1.139 -3.524 2.388) 4.407 5.896 ( -3.811 -3.516 0.429) 5.203 6.064 ( -0.412 -3.084 -1.875) 3.633 6.257 ( -3.015 -4.621 -6.969) 8.889 6.472 ( -2.267 2.443 1.463) 3.640 6.624 ( 3.587 4.955 -3.951) 7.282 6.941 ( -3.990 -2.509 -0.817) 4.784 7.039 ( 4.879 0.792 -2.096) 5.368 7.126 ( 3.602 1.200 1.171) 3.973 7.449 ( 6.204 -1.112 -4.188) 7.567 7.643 ( 3.173 -7.154 1.546) 7.977 7.845 ( 3.289 -5.563 -2.251) 6.844 8.301 ( -1.774 0.825 0.326) 1.984 8.404 ( -0.406 0.165 -4.121) 4.144 8.647 ( 5.475 2.063 2.184) 6.245 8.867 ( 1.230 -0.825 -3.099) 3.435 9.715 ( 1.127 6.932 8.977) 11.398 9.864 ( 0.704 6.642 7.112) 9.757 10.196 ( 6.227 7.569 -4.136) 10.638 10.404 ( 1.965 12.138 -4.994) 13.271 10.571 ( -2.586 -2.173 -2.063) 3.958 10.762 ( 1.386 4.125 -4.124) 5.995 11.008 ( -5.517 -0.464 1.754) 5.808 11.189 ( -3.081 -2.317 -0.618) 3.904 12.187 ( -4.574 1.492 4.570) 6.636 12.540 ( -2.620 -9.361 -0.759) 9.750 12.669 ( -3.302 -1.597 6.106) 7.123 12.695 ( 3.019 0.698 4.208) 5.226 13.145 ( -9.817 -1.846 -1.407) 10.087 13.228 ( 0.649 -5.281 4.017) 6.667 13.529 ( -6.433 6.553 4.125) 10.067 13.766 ( -5.697 -0.367 1.060) 5.806 14.044 ( -5.503 0.483 1.354) 5.688 14.387 ( 8.706 -6.591 0.221) 10.922 14.654 ( 5.192 -1.471 -0.300) 5.404 15.032 ( 9.054 -9.118 -8.154) 15.219 19.180 ( -4.488 7.851 0.692) 9.070 19.338 ( -12.547 9.495 -0.771) 15.754 19.986 ( -5.468 -2.398 1.725) 6.215 20.297 ( -10.905 -7.340 1.318) 13.211 21.665 ( -2.636 7.983 4.540) 9.554 21.856 ( 8.440 5.434 -10.082) 14.227 22.351 ( 9.162 -8.055 7.057) 14.094 22.524 ( 28.023 -8.871 -15.246) 33.112 23.786 ( -0.435 1.528 3.506) 3.849 23.933 ( 0.392 -1.871 -1.974) 2.748 24.215 ( 0.653 7.149 1.517) 7.337 24.548 ( 5.133 -1.134 -0.462) 5.277======================= Grid point 138 (72/116) =======================q-point: ( 0.38 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.023 ( -0.073 14.951 12.367) 19.403 2.155 ( -0.639 3.586 1.198) 3.835 2.383 ( 2.853 0.089 11.105) 11.466 2.435 ( 1.837 10.068 14.063) 17.393 2.636 ( -1.381 -4.936 -1.821) 5.440 2.790 ( 4.097 -0.601 1.659) 4.461 2.970 ( 0.677 3.027 -0.296) 3.115 3.050 ( 2.328 1.117 -2.701) 3.737 3.114 ( 1.686 -2.207 5.357) 6.034 3.233 ( 2.671 -0.751 -3.138) 4.189 3.497 ( 0.018 -2.340 -0.114) 2.342 3.548 ( 3.211 -5.341 0.023) 6.232 3.683 ( 3.276 -0.013 0.853) 3.385 3.778 ( 5.560 3.415 6.974) 9.550 4.005 ( 5.660 -0.994 -0.932) 5.822 4.273 ( -4.446 -6.001 3.982) 8.464 4.305 ( 6.127 8.076 -7.031) 12.336 4.431 ( -3.886 2.984 -7.346) 8.830 4.562 ( 5.840 3.528 -2.589) 7.298 4.708 ( 0.445 -2.350 -2.236) 3.274 5.000 ( 2.489 4.419 -2.217) 5.535 5.168 ( 4.412 4.442 -3.382) 7.116 5.585 ( -1.116 -0.236 3.698) 3.870 5.721 ( -0.713 -1.530 0.558) 1.778 5.802 ( 1.435 -3.568 -3.864) 5.451 5.872 ( 4.194 -2.510 -1.547) 5.127 6.082 ( 2.147 -2.391 -0.462) 3.247 6.211 ( 1.064 -4.933 -6.239) 8.024 6.423 ( -2.649 1.324 1.672) 3.401 6.639 ( -1.204 3.010 -2.669) 4.199 6.838 ( -5.104 -0.113 -1.372) 5.287 7.042 ( -2.122 1.334 -3.323) 4.162 7.223 ( 5.055 0.531 2.435) 5.636 7.533 ( 3.244 -1.524 -6.099) 7.074 7.647 ( -2.963 -5.414 3.421) 7.057 7.907 ( 3.098 -5.592 -2.905) 7.022 8.273 ( -0.914 0.454 -0.271) 1.056 8.399 ( 0.947 0.818 -2.368) 2.678 8.743 ( 3.560 0.908 1.429) 3.942 8.879 ( 0.651 -0.284 -2.518) 2.616 9.771 ( 1.348 8.151 10.327) 13.225 9.906 ( 0.839 5.236 7.745) 9.386 10.337 ( 7.394 6.150 -4.979) 10.830 10.382 ( -0.052 6.970 -3.257) 7.693 10.564 ( 1.318 -1.381 -1.399) 2.367 10.775 ( 0.698 5.326 -6.150) 8.166 10.902 ( -4.635 0.532 1.953) 5.058 11.130 ( -2.493 1.763 -2.286) 3.814 12.119 ( -3.649 0.995 4.601) 5.956 12.484 ( -2.477 -9.616 -2.788) 10.314 12.597 ( -4.480 1.607 7.273) 8.692 12.791 ( 3.425 -2.240 2.215) 4.653 12.992 ( -3.982 1.149 -0.467) 4.171 13.214 ( -3.376 -6.225 2.340) 7.458 13.468 ( -0.673 6.358 3.727) 7.401 13.670 ( -5.457 0.068 2.214) 5.890 13.981 ( -1.152 2.317 2.971) 3.940 14.505 ( 3.838 -0.360 -3.514) 5.216 14.723 ( 1.835 -7.818 2.053) 8.289 15.136 ( 4.370 -7.800 -7.777) 11.850 19.072 ( -7.120 7.846 2.895) 10.984 19.186 ( -1.679 5.589 -3.440) 6.774 19.893 ( -5.524 -6.994 6.160) 10.834 20.138 ( -4.885 -9.420 -0.878) 10.648 21.636 ( -2.260 10.283 4.788) 11.566 21.988 ( 7.949 9.354 -10.158) 15.933 22.484 ( 1.667 -9.178 8.527) 12.638 22.969 ( 21.703 -12.011 -14.844) 28.907 23.772 ( -2.122 0.806 2.740) 3.558 23.918 ( -1.010 -0.205 -3.429) 3.581 24.275 ( 4.151 5.784 3.750) 8.047 24.625 ( 3.111 -0.802 -2.481) 4.059======================= Grid point 139 (73/116) =======================q-point: (-0.50 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.939 ( -7.385 15.238 10.100) 19.716 2.104 ( -8.483 5.821 12.643) 16.301 2.475 ( 3.532 3.289 -0.813) 4.894 2.500 ( -0.686 8.292 10.254) 13.205 2.664 ( 5.937 -0.897 -1.095) 6.103 2.795 ( -0.751 0.026 5.657) 5.706 2.967 ( -2.823 -0.753 2.320) 3.731 3.112 ( 3.970 -4.821 -0.782) 6.294 3.167 ( 2.668 -6.096 1.972) 6.941 3.282 ( 1.511 -5.304 -2.701) 6.141 3.428 ( -3.604 1.977 -1.900) 4.528 3.612 ( 1.801 -3.017 3.921) 5.265 3.755 ( 2.402 0.284 -0.517) 2.474 3.804 ( -5.335 2.423 4.580) 7.437 4.115 ( 4.492 0.086 0.110) 4.494 4.203 ( -3.479 -4.130 4.834) 7.247 4.325 ( -3.340 3.741 -10.491) 11.628 4.388 ( 2.982 2.104 -4.657) 5.916 4.646 ( 2.907 5.471 -0.575) 6.222 4.725 ( 0.112 0.066 -2.736) 2.739 4.997 ( -1.523 1.751 -1.864) 2.976 5.197 ( -0.251 3.722 -5.210) 6.407 5.536 ( -4.970 1.219 4.936) 7.110 5.658 ( -5.298 1.245 -0.482) 5.463 5.812 ( 1.789 -3.120 -2.646) 4.465 5.963 ( 4.545 -3.118 -3.418) 6.486 6.129 ( 1.615 -3.690 -2.087) 4.537 6.277 ( 6.563 -3.711 -4.169) 8.616 6.379 ( -1.634 3.638 2.265) 4.587 6.598 ( -1.880 2.643 -1.684) 3.655 6.780 ( 0.441 -0.294 -0.959) 1.096 6.976 ( -3.405 0.237 -3.770) 5.085 7.311 ( 3.121 0.706 2.516) 4.070 7.538 ( -0.716 1.563 -6.616) 6.836 7.588 ( -3.333 -9.623 4.930) 11.314 7.921 ( -0.948 -7.268 -3.638) 8.183 8.272 ( 0.978 2.003 -0.952) 2.423 8.427 ( 2.426 2.079 -1.227) 3.422 8.797 ( 1.883 -0.501 0.865) 2.132 8.866 ( -1.344 0.197 -1.949) 2.376 9.808 ( -1.110 10.129 10.843) 14.879 9.924 ( -1.335 4.058 7.450) 8.588 10.332 ( 0.082 6.867 -4.397) 8.155 10.519 ( 6.711 -1.775 -2.296) 7.312 10.554 ( -2.023 1.040 -1.574) 2.766 10.736 ( -0.479 2.350 -6.589) 7.011 10.903 ( 3.263 6.998 0.949) 7.780 11.087 ( -0.463 3.678 -3.649) 5.201 12.074 ( -2.459 0.441 5.533) 6.071 12.433 ( -1.728 -9.505 -3.222) 10.184 12.550 ( -2.513 2.152 7.063) 7.800 12.796 ( -1.700 -3.812 -0.070) 4.175 13.025 ( 4.526 1.844 3.425) 5.968 13.130 ( -4.484 -2.935 0.414) 5.374 13.500 ( 0.911 2.631 4.743) 5.500 13.576 ( -2.872 -0.478 0.610) 2.975 14.012 ( 2.554 3.749 5.326) 6.996 14.523 ( -0.111 5.251 -6.971) 8.728 14.737 ( -1.381 -11.521 4.068) 12.296 15.165 ( 1.030 -7.096 -7.631) 10.471 18.986 ( -1.795 7.870 2.580) 8.475 19.204 ( 3.981 3.549 -3.973) 6.651 19.808 ( -4.893 -6.820 7.631) 11.344 20.112 ( 2.017 -11.534 -1.265) 11.777 21.594 ( -3.481 10.561 4.008) 11.820 22.092 ( 5.552 11.778 -10.049) 16.448 22.451 ( -7.484 -8.517 8.060) 13.910 23.260 ( 11.832 -15.533 -13.231) 23.587 23.721 ( -3.423 2.208 2.986) 5.050 23.885 ( -1.111 1.208 -3.022) 3.439 24.370 ( 3.626 3.008 4.190) 6.305 24.657 ( 1.406 -1.164 -4.457) 4.816======================= Grid point 140 (74/116) =======================q-point: (-0.38 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.843 ( -5.704 15.916 9.904) 19.595 1.960 ( -9.666 7.952 16.948) 21.068 2.436 ( -4.777 8.973 -3.828) 10.862 2.506 ( -0.691 8.566 5.548) 10.229 2.796 ( 1.311 -3.947 5.236) 6.687 2.831 ( 2.720 -2.530 1.853) 4.151 2.909 ( -4.706 -4.458 5.136) 8.270 3.119 ( -2.060 -5.691 -0.025) 6.053 3.156 ( -4.051 -4.477 2.500) 6.535 3.295 ( 1.157 -9.078 -1.609) 9.292 3.429 ( 2.856 2.584 -5.598) 6.795 3.539 ( -10.580 5.520 7.634) 14.167 3.684 ( -4.408 -0.277 4.269) 6.143 3.822 ( 4.660 1.805 -0.744) 5.053 4.101 ( -5.505 0.344 4.018) 6.823 4.193 ( -3.465 0.244 -5.590) 6.581 4.219 ( 0.180 2.322 -6.961) 7.340 4.435 ( 3.218 -3.151 -3.210) 5.531 4.629 ( -7.192 1.253 -6.179) 9.564 4.692 ( 1.409 6.206 0.233) 6.368 4.971 ( -0.791 -1.716 -1.764) 2.585 5.111 ( -6.946 3.223 -2.424) 8.032 5.444 ( -5.147 2.073 4.362) 7.059 5.554 ( -4.691 1.429 -0.539) 4.933 5.876 ( 5.090 -1.426 -1.815) 5.589 6.027 ( 3.306 -2.312 -3.229) 5.167 6.097 ( -2.685 -2.665 -3.893) 5.428 6.360 ( 0.683 -1.326 -3.271) 3.595 6.409 ( 3.843 0.520 0.356) 3.895 6.566 ( -1.274 0.708 -0.179) 1.469 6.833 ( 3.713 -0.422 -0.600) 3.785 6.904 ( -1.940 1.432 -3.040) 3.880 7.347 ( -0.599 0.987 1.990) 2.301 7.497 ( -0.545 0.618 -5.856) 5.914 7.546 ( -3.079 -12.696 4.461) 13.804 7.851 ( -5.167 -8.836 -2.547) 10.548 8.294 ( 1.433 4.152 -1.988) 4.822 8.480 ( 3.150 2.833 -1.278) 4.425 8.814 ( -1.293 -0.940 -2.294) 2.796 8.829 ( -0.600 0.448 0.654) 0.994 9.787 ( -3.497 11.256 8.431) 14.492 9.905 ( -2.648 4.389 7.228) 8.861 10.339 ( 1.233 4.406 -3.275) 5.626 10.423 ( -7.028 1.776 -0.760) 7.289 10.652 ( 5.723 0.282 -5.918) 8.238 10.746 ( 2.238 2.727 -4.877) 6.019 10.974 ( 3.414 4.657 2.141) 6.159 11.116 ( 4.208 2.408 -4.564) 6.658 12.062 ( -0.356 -0.147 7.396) 7.406 12.407 ( 0.113 -9.691 -2.851) 10.102 12.538 ( -1.308 0.956 8.804) 8.952 12.765 ( -1.632 -4.430 1.127) 4.854 13.031 ( -2.634 0.492 -0.415) 2.711 13.150 ( 3.497 -0.544 3.567) 5.024 13.479 ( -0.492 2.910 2.621) 3.947 13.632 ( 5.539 -0.069 2.214) 5.965 14.092 ( 3.637 3.177 5.597) 7.392 14.473 ( -2.465 7.049 -8.445) 11.273 14.688 ( -5.216 -10.938 4.766) 13.022 15.130 ( -2.477 -7.498 -7.676) 11.013 19.030 ( 5.868 9.765 1.172) 11.452 19.306 ( 7.238 4.560 -3.285) 9.163 19.766 ( -1.340 -4.845 7.023) 8.637 20.182 ( 4.702 -11.543 -0.010) 12.464 21.530 ( -3.799 8.569 2.491) 9.699 22.138 ( 1.915 10.962 -9.233) 14.460 22.258 ( -13.617 -5.545 5.384) 15.657 23.297 ( -5.201 -17.675 -11.452) 21.693 23.710 ( 2.321 3.834 2.420) 5.094 23.858 ( -1.232 1.065 -1.199) 2.022 24.412 ( -0.459 1.849 1.963) 2.735 24.664 ( 0.704 -3.693 -4.367) 5.762======================= Grid point 141 (75/116) =======================q-point: (-0.25 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.753 ( -7.556 17.073 9.992) 21.176 1.842 ( -8.092 10.189 19.519) 23.458 2.307 ( -7.843 11.435 -5.449) 14.898 2.504 ( -2.471 8.832 4.661) 10.288 2.608 ( -18.496 -2.098 10.163) 21.208 2.778 ( -6.953 -10.018 0.757) 12.217 2.835 ( -5.256 -6.907 2.247) 8.965 3.130 ( -3.032 0.822 1.126) 3.338 3.148 ( 5.048 0.203 0.018) 5.052 3.236 ( -4.492 -8.568 4.617) 10.719 3.369 ( -4.625 4.875 1.645) 6.918 3.505 ( 2.301 2.943 1.238) 3.936 3.669 ( 3.311 1.358 2.260) 4.232 3.891 ( -1.929 2.414 -1.663) 3.509 3.986 ( -3.420 2.419 -1.764) 4.546 4.120 ( 1.596 0.122 -2.746) 3.179 4.239 ( 1.650 2.640 -2.896) 4.253 4.428 ( -6.824 -3.664 -10.066) 12.701 4.520 ( 2.552 -2.293 -0.641) 3.490 4.726 ( 2.007 3.011 -1.176) 3.805 4.887 ( -6.095 -0.833 -3.529) 7.092 5.020 ( -1.384 -0.494 -0.581) 1.580 5.380 ( -2.483 3.091 3.537) 5.313 5.464 ( -4.792 1.508 0.012) 5.024 5.953 ( 1.787 -0.696 -3.322) 3.836 6.060 ( 3.021 -0.804 -3.758) 4.888 6.097 ( 3.292 -0.248 -1.430) 3.598 6.278 ( -7.256 -2.461 -4.152) 8.715 6.477 ( 1.309 -0.012 -1.574) 2.048 6.519 ( -1.685 -2.637 1.797) 3.609 6.857 ( -2.043 1.145 -2.223) 3.229 6.908 ( 1.768 3.225 -0.809) 3.766 7.298 ( -4.198 0.315 1.673) 4.530 7.473 ( -3.461 -9.714 -0.807) 10.343 7.502 ( -0.175 -7.681 -0.504) 7.700 7.723 ( -6.493 -8.180 -0.971) 10.489 8.311 ( 1.024 4.564 -2.156) 5.150 8.522 ( 1.304 2.836 -2.155) 3.793 8.755 ( -3.684 0.206 -1.623) 4.031 8.835 ( 0.664 -1.227 -1.237) 1.864 9.739 ( -3.437 10.754 6.226) 12.893 9.873 ( -2.313 6.373 6.381) 9.310 10.278 ( -5.778 1.092 0.356) 5.891 10.370 ( 1.111 7.357 -6.100) 9.621 10.706 ( 1.870 2.445 -5.693) 6.472 10.778 ( 2.262 3.857 -5.141) 6.813 11.072 ( 6.043 -1.400 2.143) 6.562 11.169 ( 1.457 -0.732 -2.868) 3.300 12.124 ( 4.664 -0.276 9.154) 10.277 12.422 ( 1.841 -8.795 -1.194) 9.065 12.547 ( -0.612 -2.985 11.519) 11.915 12.741 ( -1.318 -5.243 2.473) 5.945 13.012 ( 1.207 2.742 0.371) 3.019 13.176 ( -1.734 -2.160 3.976) 4.846 13.573 ( 9.320 4.822 1.747) 10.638 13.755 ( 5.785 0.059 1.667) 6.020 14.172 ( 2.890 1.293 4.202) 5.261 14.388 ( -3.464 6.254 -7.748) 10.543 14.561 ( -9.167 -7.130 4.635) 12.505 15.017 ( -6.985 -7.914 -7.948) 13.213 19.219 ( 13.037 12.828 -1.226) 18.331 19.438 ( 6.372 9.047 -1.551) 11.174 19.811 ( 4.512 -3.726 5.777) 8.222 20.269 ( 3.703 -8.476 0.739) 9.279 21.483 ( -0.810 4.477 0.434) 4.571 21.986 ( -13.838 -6.730 2.354) 15.566 22.123 ( -1.261 11.999 -8.310) 14.650 23.030 ( -18.280 -13.940 -9.414) 24.842 23.785 ( 3.697 0.839 1.327) 4.016 23.829 ( -1.467 0.609 0.455) 1.652 24.377 ( -2.635 1.752 -0.716) 3.245 24.640 ( -2.747 -6.233 -3.171) 7.513======================= Grid point 142 (76/116) =======================q-point: (-0.12 0.29 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.549 ( -16.540 15.928 9.836) 24.980 1.763 ( -5.266 15.559 16.556) 23.323 2.085 ( -11.242 10.666 -7.167) 17.074 2.269 ( -13.155 11.440 21.048) 27.330 2.546 ( 0.510 -0.223 3.973) 4.011 2.617 ( -5.804 -7.442 0.681) 9.462 2.796 ( -1.104 -7.642 -3.017) 8.290 2.939 ( -10.889 -6.771 4.273) 13.515 3.173 ( -2.252 3.659 -0.410) 4.316 3.302 ( 2.318 1.696 5.038) 5.799 3.339 ( 3.210 0.282 2.076) 3.833 3.559 ( 1.987 2.876 3.680) 5.075 3.758 ( -4.817 2.460 -2.602) 6.002 3.820 ( 7.179 0.825 3.731) 8.133 3.934 ( -2.311 3.477 -5.713) 7.076 4.210 ( -6.739 0.888 -2.928) 7.401 4.249 ( 8.712 -1.236 -3.063) 9.317 4.332 ( 5.904 2.030 -4.628) 7.771 4.571 ( 1.281 -2.146 0.013) 2.499 4.750 ( 0.954 -4.798 -4.135) 6.405 4.778 ( -5.882 -0.876 -4.182) 7.270 5.000 ( 0.466 -2.317 -6.349) 6.775 5.371 ( -0.220 4.964 2.265) 5.461 5.388 ( -1.347 0.928 0.798) 1.820 5.945 ( -1.496 -1.198 -3.973) 4.411 6.069 ( -5.783 -1.900 0.015) 6.087 6.111 ( 1.048 1.537 -3.355) 3.836 6.215 ( 4.737 1.042 -1.501) 5.077 6.444 ( -0.274 0.523 -1.782) 1.877 6.554 ( 0.126 0.964 2.543) 2.722 6.757 ( -4.001 -0.539 -4.476) 6.027 6.897 ( -3.784 2.167 -0.774) 4.429 7.213 ( -5.369 -2.956 3.956) 7.295 7.401 ( -3.080 -9.993 2.556) 10.765 7.483 ( -1.608 -7.180 -3.433) 8.120 7.653 ( 0.690 -7.477 -1.468) 7.651 8.325 ( 1.012 3.714 -1.597) 4.167 8.517 ( -0.941 2.591 -2.381) 3.643 8.658 ( -5.743 0.363 -0.857) 5.818 8.842 ( 0.590 -2.243 -3.310) 4.041 9.697 ( -2.661 8.822 6.312) 11.169 9.861 ( -0.819 8.663 5.416) 10.250 10.189 ( -3.276 4.666 -0.324) 5.710 10.354 ( -0.430 7.367 -8.896) 11.559 10.714 ( 0.727 3.741 -4.684) 6.038 10.788 ( 0.266 4.149 -5.546) 6.931 11.155 ( -0.941 -3.232 0.438) 3.394 11.197 ( 4.543 -3.588 1.871) 6.084 12.261 ( 4.841 1.846 6.335) 8.184 12.467 ( 2.551 -6.586 4.327) 8.283 12.587 ( 1.497 -7.661 7.714) 10.974 12.731 ( -0.525 -7.319 3.941) 8.329 13.108 ( 8.322 -0.507 7.538) 11.240 13.143 ( -2.218 -1.702 4.799) 5.554 13.784 ( 6.662 1.428 -2.200) 7.159 13.843 ( 6.108 1.876 1.925) 6.674 14.225 ( 1.020 -0.709 3.765) 3.964 14.307 ( -4.285 -0.214 -2.908) 5.183 14.390 ( -6.132 3.002 0.505) 6.846 14.822 ( -9.891 -6.784 -8.497) 14.698 19.409 ( 1.930 10.740 2.729) 11.248 19.596 ( 13.545 16.841 -8.438) 23.201 19.961 ( 7.510 -3.793 6.498) 10.630 20.341 ( 5.868 -2.322 -2.563) 6.811 21.523 ( 5.225 -0.380 -1.346) 5.409 21.766 ( -8.391 -4.789 -0.883) 9.702 22.059 ( -2.876 7.183 -5.557) 9.526 22.555 ( -27.398 -8.416 -6.460) 29.381 23.795 ( -1.781 0.484 2.935) 3.467 23.857 ( 2.674 -0.450 0.245) 2.723 24.334 ( -0.899 0.912 -1.210) 1.762 24.531 ( -7.382 -4.791 -2.177) 9.066======================= Grid point 143 (77/116) =======================q-point: ( 0.00 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.734 ( -2.687 18.040 4.717) 18.839 2.039 ( -0.950 -5.195 -2.880) 6.016 2.121 ( 0.825 13.539 13.813) 19.360 2.293 ( -5.342 0.964 7.166) 8.990 2.348 ( 0.144 -1.621 8.784) 8.934 2.502 ( 0.958 -11.662 -1.862) 11.848 2.726 ( 3.107 2.716 3.238) 5.246 2.782 ( 3.437 -3.524 10.597) 11.685 3.239 ( -4.627 8.295 2.525) 9.828 3.376 ( -1.578 -3.661 6.238) 7.403 3.465 ( 2.818 6.374 3.036) 7.602 3.558 ( -3.063 -0.188 0.262) 3.079 3.717 ( -5.223 0.480 -0.570) 5.276 3.763 ( -8.491 -2.750 -3.948) 9.759 4.007 ( 2.148 5.146 -3.488) 6.578 4.132 ( 2.519 -5.874 -2.418) 6.833 4.374 ( 2.062 -0.409 -1.923) 2.849 4.419 ( -0.804 -4.382 -2.047) 4.903 4.566 ( 8.320 1.678 -3.034) 9.013 4.639 ( 11.936 -2.422 -1.897) 12.326 4.767 ( -3.573 7.086 -7.459) 10.891 4.914 ( -1.582 -5.096 -9.361) 10.775 5.424 ( 2.948 0.635 -1.914) 3.572 5.437 ( 1.700 0.289 -2.369) 2.930 5.805 ( -7.658 1.488 2.128) 8.086 5.893 ( -6.855 -5.436 2.224) 9.027 6.339 ( 2.482 4.657 -2.862) 6.004 6.373 ( 7.328 3.574 -6.989) 10.739 6.484 ( -4.855 5.559 2.240) 7.713 6.623 ( 10.678 1.711 -0.876) 10.850 6.693 ( -1.033 -5.256 -0.977) 5.445 6.747 ( -0.039 -4.137 -2.714) 4.948 7.106 ( -3.022 1.982 4.219) 5.555 7.198 ( -0.426 -6.718 3.800) 7.730 7.443 ( 3.073 2.435 -5.107) 6.438 7.546 ( 4.416 -6.815 -4.432) 9.251 8.404 ( -1.732 3.517 -0.248) 3.928 8.469 ( -3.180 -2.204 -2.114) 4.408 8.631 ( -1.180 4.825 1.590) 5.216 8.746 ( 0.326 -5.598 -1.516) 5.809 9.824 ( -2.021 6.422 8.202) 10.611 9.928 ( -2.222 -2.342 6.863) 7.585 10.325 ( -0.012 8.635 -2.238) 8.921 10.435 ( 1.097 -0.225 -6.622) 6.716 10.819 ( 1.824 4.471 -5.099) 7.023 10.830 ( -1.428 3.703 -6.312) 7.457 11.080 ( -1.156 -1.348 3.579) 3.996 11.139 ( -0.185 -6.133 1.679) 6.362 12.392 ( -2.525 5.081 2.851) 6.350 12.467 ( -0.586 -1.624 9.925) 10.074 12.518 ( 4.329 -3.163 2.291) 5.830 12.566 ( 2.613 -7.402 6.583) 10.245 13.133 ( 0.710 1.469 4.965) 5.227 13.191 ( 3.614 -4.100 6.114) 8.201 13.798 ( -4.454 4.012 -2.208) 6.388 13.903 ( -3.003 -5.400 -1.549) 6.370 14.193 ( -2.887 1.946 2.935) 4.554 14.226 ( -1.837 -1.023 2.845) 3.538 14.492 ( 3.817 3.968 -5.319) 7.656 14.580 ( 2.609 -4.394 -7.217) 8.843 19.593 ( -5.221 9.512 5.633) 12.226 19.758 ( -5.182 -5.489 6.196) 9.766 20.261 ( 8.467 10.500 -10.824) 17.295 20.441 ( 7.913 -6.333 -9.178) 13.674 21.607 ( 5.385 0.797 -3.911) 6.703 21.648 ( 7.622 -2.993 -4.962) 9.575 22.026 ( -10.823 1.014 0.556) 10.885 22.042 ( -9.564 -0.459 0.215) 9.577 23.817 ( -0.134 2.305 3.353) 4.070 23.863 ( 0.617 -1.958 1.779) 2.716 24.349 ( 0.416 0.447 -0.636) 0.882 24.364 ( -2.180 -0.859 -0.945) 2.527======================= Grid point 144 (78/116) =======================q-point: ( 0.12 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.820 ( 8.214 14.696 4.807) 17.508 2.121 ( 6.303 -11.600 1.384) 13.275 2.221 ( 5.985 10.524 11.106) 16.429 2.310 ( 6.904 5.469 2.794) 9.240 2.406 ( 3.886 2.712 10.474) 11.497 2.618 ( 8.996 -10.933 -0.795) 14.180 2.817 ( 3.674 5.747 3.290) 7.573 2.899 ( 3.815 -1.728 12.821) 13.488 3.178 ( -0.355 5.201 0.382) 5.227 3.299 ( -5.405 -3.969 4.158) 7.890 3.483 ( -6.805 1.986 -0.225) 7.092 3.500 ( -3.774 0.892 1.334) 4.101 3.600 ( -1.761 1.598 0.066) 2.379 3.665 ( 0.998 -2.500 -0.858) 2.825 4.038 ( 0.055 5.334 -5.170) 7.428 4.176 ( 2.558 -5.250 -3.388) 6.752 4.303 ( -3.251 -0.207 -2.031) 3.839 4.369 ( -0.582 -4.467 -1.929) 4.901 4.674 ( -3.142 5.448 -6.537) 9.071 4.777 ( -2.309 -3.560 -5.847) 7.224 4.843 ( 15.531 6.240 -1.494) 16.805 4.946 ( 10.604 -1.849 -5.778) 12.217 5.486 ( 3.915 0.977 -2.927) 4.985 5.502 ( 5.160 -1.202 -2.182) 5.730 5.706 ( -3.254 0.635 3.295) 4.674 5.801 ( -3.146 -7.020 4.744) 9.037 6.202 ( -9.557 4.233 -4.767) 11.488 6.291 ( -8.380 -3.715 -4.482) 10.204 6.574 ( 5.212 7.299 -0.556) 8.986 6.649 ( 1.021 0.720 -3.365) 3.590 6.857 ( 7.869 -1.972 -2.598) 8.519 6.870 ( 9.026 -3.264 1.088) 9.659 7.109 ( 2.613 4.166 2.793) 5.655 7.236 ( 3.284 -7.549 2.518) 8.609 7.521 ( 6.520 3.801 -4.919) 9.009 7.639 ( 6.092 -6.690 -4.984) 10.330 8.368 ( -1.832 2.149 0.356) 2.846 8.411 ( -1.850 -1.737 -2.099) 3.293 8.646 ( 2.004 5.213 1.986) 5.928 8.763 ( 1.755 -5.480 -0.862) 5.818 9.825 ( -0.301 6.183 8.402) 10.436 9.918 ( -0.787 -1.571 6.752) 6.976 10.313 ( -0.144 8.146 -1.797) 8.343 10.448 ( 1.796 -2.872 -4.855) 5.920 10.766 ( -3.264 8.543 -5.258) 10.549 10.843 ( 2.291 3.771 -5.887) 7.358 11.053 ( -2.870 -1.593 2.700) 4.250 11.119 ( -1.547 -6.709 1.344) 7.015 12.324 ( -4.641 3.828 3.193) 6.811 12.425 ( -3.807 -5.924 3.164) 7.720 12.602 ( 3.102 0.217 4.331) 5.331 12.643 ( 1.596 -3.772 7.503) 8.548 13.160 ( -0.174 1.511 3.792) 4.085 13.229 ( -2.407 -4.431 2.860) 5.797 13.713 ( -3.622 3.551 2.401) 5.612 13.807 ( -4.425 -5.112 0.172) 6.764 14.138 ( -2.869 0.855 1.915) 3.554 14.167 ( -3.345 -1.445 0.791) 3.729 14.605 ( 7.791 4.209 -4.324) 9.855 14.703 ( 9.803 -5.163 -6.801) 13.000 19.478 ( -7.425 8.919 3.502) 12.121 19.626 ( -9.274 -4.232 3.729) 10.855 20.232 ( -8.192 8.036 -6.816) 13.347 20.385 ( -10.178 -6.413 -4.406) 12.811 21.770 ( 11.059 3.791 -8.294) 14.334 21.837 ( 4.246 0.665 -1.749) 4.640 21.939 ( 12.719 -0.051 -3.514) 13.196 22.030 ( 5.471 -5.732 3.576) 8.693 23.827 ( 0.035 2.520 3.180) 4.058 23.877 ( 0.344 -2.151 1.487) 2.637 24.336 ( 0.432 3.512 -0.869) 3.643 24.401 ( 3.982 -2.590 -0.295) 4.760======================= Grid point 145 (79/116) =======================q-point: ( 0.25 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.019 ( 10.201 9.544 4.512) 14.680 2.229 ( 5.417 -8.154 4.162) 10.638 2.390 ( 3.718 4.202 9.189) 10.767 2.441 ( 2.231 0.825 12.270) 12.499 2.562 ( 7.280 11.147 5.691) 14.479 2.749 ( 2.410 -4.549 -0.355) 5.160 2.901 ( 7.625 4.351 1.920) 8.986 2.989 ( 2.901 -1.800 9.617) 10.205 3.195 ( -1.606 1.876 -2.557) 3.555 3.239 ( -2.502 -1.939 -1.649) 3.569 3.373 ( -0.338 -1.372 -1.505) 2.065 3.402 ( -2.363 -4.235 -0.817) 4.918 3.670 ( 5.817 4.754 4.825) 8.928 3.726 ( 3.959 -0.011 2.371) 4.615 3.978 ( -2.387 4.692 -3.625) 6.391 4.151 ( -3.725 -10.368 -1.181) 11.080 4.348 ( 7.089 5.283 -4.391) 9.871 4.430 ( 6.295 -2.666 -5.047) 8.497 4.598 ( -1.881 4.322 -6.417) 7.963 4.689 ( -2.812 -3.558 -6.291) 7.755 5.078 ( 7.298 6.475 -1.007) 9.809 5.130 ( 8.951 2.314 -1.750) 9.410 5.550 ( 2.585 0.088 -0.339) 2.609 5.587 ( 3.673 -3.794 1.002) 5.375 5.711 ( 3.266 1.086 -0.102) 3.444 5.793 ( 0.429 -5.794 2.087) 6.173 6.043 ( -4.453 2.101 -3.598) 6.099 6.134 ( -5.226 -5.753 -4.950) 9.215 6.578 ( -2.765 5.973 0.105) 6.583 6.674 ( -0.146 -1.704 -2.881) 3.350 6.924 ( 0.814 1.994 -0.906) 2.336 6.998 ( 3.682 -3.673 -1.067) 5.309 7.191 ( 3.955 4.741 1.545) 6.365 7.325 ( 4.622 -7.600 0.622) 8.917 7.641 ( 5.925 3.791 -4.536) 8.370 7.736 ( 5.068 -4.863 -5.095) 8.677 8.336 ( -1.530 2.294 0.127) 2.760 8.383 ( -0.470 -1.838 -2.609) 3.226 8.712 ( 3.602 3.898 2.675) 5.944 8.803 ( 2.197 -4.302 0.284) 4.839 9.863 ( 1.646 6.161 8.572) 10.684 9.941 ( 1.077 -0.338 7.313) 7.400 10.323 ( 1.705 6.040 -0.492) 6.296 10.462 ( 0.116 -6.187 -1.636) 6.401 10.685 ( -2.981 11.774 -5.003) 13.136 10.857 ( -0.011 -1.139 -7.222) 7.311 10.995 ( -2.168 2.920 1.391) 3.894 11.112 ( 0.717 -5.088 -0.978) 5.230 12.243 ( -4.328 3.900 1.946) 6.142 12.358 ( -3.460 -7.127 0.313) 7.928 12.654 ( -0.043 0.361 5.535) 5.547 12.682 ( 1.520 -1.688 5.885) 6.308 13.115 ( -5.339 0.192 -0.536) 5.369 13.151 ( -3.490 -2.617 0.727) 4.422 13.658 ( -3.836 5.168 4.774) 8.013 13.738 ( -4.120 -2.380 3.418) 5.859 14.075 ( -2.584 2.967 2.300) 4.558 14.193 ( 4.392 -8.366 2.854) 9.870 14.725 ( 5.478 5.737 -5.037) 9.396 14.862 ( 8.044 -7.133 -7.259) 12.972 19.343 ( -6.843 7.005 1.207) 9.867 19.439 ( -10.170 -0.665 0.496) 10.204 19.997 ( -12.287 4.077 0.652) 12.962 20.134 ( -12.964 -7.739 -0.635) 15.112 21.851 ( 0.985 8.783 5.125) 10.217 21.961 ( 8.416 1.509 -3.623) 9.286 22.210 ( 11.890 -2.191 -1.255) 12.155 22.322 ( 22.331 -9.398 -12.441) 27.235 23.830 ( -0.690 2.522 2.618) 3.701 23.885 ( 0.009 -2.505 1.312) 2.828 24.367 ( 2.677 6.652 -0.323) 7.178 24.487 ( 4.618 -4.485 -0.624) 6.468======================= Grid point 146 (80/116) =======================q-point: ( 0.38 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.214 ( 6.661 6.480 5.767) 10.937 2.327 ( -6.685 2.501 10.859) 12.994 2.379 ( 5.385 2.401 4.306) 7.301 2.487 ( 0.328 -4.972 5.321) 7.290 2.662 ( 1.320 9.061 10.370) 13.834 2.789 ( 1.017 -1.985 5.640) 6.065 3.026 ( 0.537 2.042 0.773) 2.248 3.055 ( 2.056 -0.450 1.937) 2.861 3.114 ( -3.371 2.153 -1.489) 4.268 3.185 ( -1.390 -3.411 -3.612) 5.159 3.423 ( 4.347 -2.819 -2.736) 5.859 3.441 ( 5.510 -3.805 -1.218) 6.806 3.751 ( 0.047 5.409 0.490) 5.432 3.829 ( 4.044 -0.118 5.060) 6.479 4.001 ( 5.125 0.931 1.667) 5.469 4.090 ( -1.492 -8.324 1.898) 8.666 4.432 ( 2.300 3.701 -10.578) 11.441 4.467 ( -1.058 0.222 -10.828) 10.882 4.634 ( 6.377 3.041 -2.340) 7.443 4.681 ( 3.580 -1.335 -2.437) 4.532 5.145 ( 0.692 7.855 0.370) 7.894 5.240 ( 2.641 0.437 -1.692) 3.167 5.586 ( 0.594 1.019 2.385) 2.661 5.654 ( 2.485 -4.553 0.467) 5.208 5.765 ( 1.050 0.838 -2.452) 2.796 5.819 ( 3.045 -3.069 -1.016) 4.441 6.025 ( 2.512 -0.440 -2.282) 3.422 6.089 ( 2.078 -5.397 -3.502) 6.761 6.510 ( -3.591 5.444 1.790) 6.763 6.618 ( -4.013 -4.087 0.723) 5.773 6.904 ( -1.857 5.215 -4.008) 6.834 7.010 ( -1.551 -3.989 -3.783) 5.712 7.265 ( 3.220 3.930 2.129) 5.509 7.388 ( 1.437 -7.436 0.736) 7.609 7.689 ( 0.294 4.654 -3.961) 6.119 7.794 ( 2.000 -5.094 -5.238) 7.575 8.319 ( 0.251 3.301 -0.133) 3.314 8.383 ( 1.553 -2.189 -2.394) 3.596 8.777 ( 1.881 2.450 2.955) 4.274 8.839 ( 1.011 -2.937 1.048) 3.278 9.933 ( 2.469 6.141 9.418) 11.511 9.990 ( 1.017 1.292 8.324) 8.485 10.375 ( 3.387 1.161 0.839) 3.678 10.433 ( -2.508 -3.280 0.257) 4.137 10.641 ( -0.200 8.246 -5.066) 9.680 10.789 ( -3.672 -4.608 -5.565) 8.105 11.012 ( 3.232 7.931 -3.077) 9.101 11.129 ( 1.358 -2.528 -3.696) 4.679 12.173 ( -3.288 4.185 1.262) 5.469 12.297 ( -2.663 -7.488 -1.270) 8.048 12.643 ( -2.194 2.763 5.191) 6.276 12.718 ( -0.040 -4.074 3.432) 5.327 13.032 ( -1.632 2.667 0.066) 3.128 13.104 ( -1.858 -4.163 1.256) 4.729 13.586 ( -4.067 4.409 3.146) 6.773 13.651 ( -5.665 -1.844 2.792) 6.579 14.080 ( 1.579 7.450 5.288) 9.271 14.299 ( 4.405 -12.652 5.225) 14.380 14.782 ( 2.182 7.731 -6.269) 10.190 14.960 ( 4.224 -8.607 -7.789) 12.353 19.222 ( -5.970 5.647 0.607) 8.240 19.276 ( -4.977 1.369 -2.043) 5.552 19.815 ( -7.183 0.773 4.704) 8.621 19.931 ( -7.183 -8.938 1.044) 11.514 21.874 ( -0.696 11.556 5.729) 12.917 22.082 ( 3.907 -5.132 1.523) 6.627 22.412 ( 9.254 7.083 -6.195) 13.198 22.676 ( 17.158 -14.627 -13.183) 26.117 23.816 ( -1.376 3.118 2.515) 4.236 23.884 ( -0.505 -2.735 0.967) 2.945 24.425 ( 2.936 7.350 0.376) 7.923 24.561 ( 3.007 -5.063 -1.503) 6.078======================= Grid point 147 (81/116) =======================q-point: (-0.50 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.201 ( -7.406 7.269 10.553) 14.801 2.219 ( -6.780 4.013 11.850) 14.230 2.531 ( 8.685 3.214 1.499) 9.381 2.612 ( 9.510 -3.837 -0.778) 10.285 2.675 ( -2.645 6.646 9.000) 11.496 2.777 ( -3.454 -2.642 5.584) 7.078 2.977 ( -5.529 1.864 3.541) 6.825 3.045 ( -3.236 -4.660 3.825) 6.843 3.074 ( 0.142 1.634 -2.705) 3.164 3.166 ( -0.839 -5.554 -3.722) 6.739 3.489 ( 2.663 3.495 -1.870) 4.775 3.552 ( 4.515 -2.273 3.184) 5.974 3.754 ( 1.771 1.242 -1.693) 2.747 3.823 ( -4.418 -2.923 2.191) 5.733 4.107 ( 2.533 -0.356 3.207) 4.102 4.121 ( 2.645 -1.831 4.075) 5.192 4.384 ( -3.187 1.624 -13.265) 13.739 4.399 ( -1.295 -0.177 -11.884) 11.956 4.722 ( 2.327 2.190 -2.516) 4.067 4.745 ( 1.721 0.282 -1.578) 2.353 5.119 ( -3.427 8.040 1.191) 8.821 5.239 ( -2.295 -1.532 -1.170) 2.997 5.570 ( -3.029 2.688 1.629) 4.365 5.646 ( -3.658 -3.060 0.073) 4.770 5.788 ( 3.077 2.118 -1.635) 4.078 5.880 ( 3.667 -4.976 -2.221) 6.568 6.078 ( 2.831 0.788 -3.351) 4.457 6.163 ( 5.286 -5.993 -4.057) 8.962 6.477 ( -0.677 4.990 4.451) 6.721 6.576 ( -0.910 -3.867 3.777) 5.481 6.848 ( -1.408 5.224 -5.507) 7.720 6.943 ( -3.030 -3.204 -5.245) 6.853 7.320 ( 1.468 1.101 2.097) 2.786 7.391 ( -1.247 -6.005 2.042) 6.464 7.646 ( -2.959 5.532 -4.116) 7.503 7.774 ( -2.322 -6.474 -4.765) 8.367 8.352 ( 3.024 4.617 -1.344) 5.680 8.430 ( 3.770 -2.031 -2.774) 5.103 8.801 ( -0.184 1.254 3.265) 3.502 8.842 ( -1.018 -2.088 1.747) 2.906 9.993 ( 0.183 5.788 10.499) 11.990 10.012 ( -1.099 3.173 8.693) 9.319 10.390 ( -1.903 0.129 0.398) 1.949 10.437 ( 1.749 -4.230 1.595) 4.847 10.630 ( 0.847 5.763 -5.037) 7.701 10.733 ( 0.344 -2.926 -6.190) 6.855 11.070 ( 3.267 6.443 -4.384) 8.450 11.136 ( 0.806 0.176 -5.224) 5.289 12.122 ( -2.398 4.151 1.694) 5.084 12.247 ( -2.057 -7.507 -1.431) 7.914 12.612 ( -2.345 3.538 4.845) 6.441 12.701 ( -2.048 -4.709 2.025) 5.520 13.054 ( 2.277 1.106 2.012) 3.234 13.081 ( -0.648 -1.662 1.118) 2.105 13.545 ( -1.457 1.402 2.978) 3.600 13.564 ( -2.242 -0.608 1.589) 2.815 14.142 ( 2.408 8.712 7.128) 11.511 14.376 ( 1.618 -12.713 5.841) 14.084 14.776 ( -0.631 9.240 -7.242) 11.757 14.983 ( 0.592 -9.614 -8.262) 12.691 19.153 ( -0.246 7.035 0.244) 7.043 19.245 ( 2.368 -0.862 -2.800) 3.767 19.738 ( -2.552 1.354 5.838) 6.514 19.870 ( 0.219 -10.068 1.619) 10.200 21.844 ( -4.156 12.524 4.909) 14.079 22.103 ( -2.872 -10.678 3.954) 11.743 22.518 ( 3.893 14.962 -8.781) 17.780 22.886 ( 7.920 -18.444 -12.430) 23.610 23.798 ( -1.087 4.225 2.834) 5.202 23.873 ( -0.779 -2.369 0.813) 2.623 24.471 ( 1.395 5.826 0.792) 6.043 24.590 ( 0.538 -4.821 -2.288) 5.363======================= Grid point 148 (82/116) =======================q-point: (-0.38 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.118 ( -4.560 7.656 11.060) 14.203 2.122 ( -5.924 6.120 13.448) 15.919 2.612 ( -5.920 1.790 7.644) 9.833 2.641 ( -0.325 8.095 -2.755) 8.557 2.701 ( -3.366 -4.477 3.811) 6.775 2.766 ( 0.853 -2.231 -1.185) 2.666 2.867 ( -6.734 1.627 6.649) 9.602 3.004 ( -0.204 -8.179 3.331) 8.834 3.075 ( 1.609 -0.841 0.804) 1.986 3.122 ( -1.982 -5.042 -3.273) 6.330 3.529 ( 2.297 6.034 -1.284) 6.583 3.601 ( -1.224 0.208 5.349) 5.491 3.745 ( -3.240 3.484 3.176) 5.720 3.809 ( 3.754 -2.710 0.088) 4.631 4.092 ( -3.807 0.470 1.711) 4.200 4.147 ( -2.301 -3.455 -0.885) 4.244 4.285 ( -1.580 3.103 -12.226) 12.712 4.351 ( 0.208 -3.479 -9.954) 10.547 4.682 ( -5.920 2.560 -3.614) 7.393 4.729 ( -2.110 -1.518 -3.196) 4.120 5.042 ( -4.244 6.544 2.005) 8.053 5.142 ( -6.971 -1.480 0.640) 7.155 5.498 ( -3.958 3.096 1.268) 5.183 5.557 ( -4.457 -1.524 -0.093) 4.711 5.874 ( 5.677 1.762 -1.127) 6.051 5.950 ( 3.972 -4.565 -1.981) 6.367 6.103 ( 1.445 3.634 -5.583) 6.817 6.232 ( 2.837 -7.591 -6.691) 10.509 6.475 ( -2.006 3.947 4.604) 6.388 6.552 ( -3.510 -2.632 3.052) 5.345 6.858 ( 3.210 2.391 -2.157) 4.547 6.904 ( 1.161 -1.361 -3.871) 4.264 7.324 ( -1.798 -1.208 1.600) 2.693 7.357 ( -3.097 -4.796 3.254) 6.571 7.568 ( -3.607 5.060 -4.599) 7.731 7.691 ( -4.576 -6.493 -3.925) 8.860 8.406 ( 2.695 5.678 -2.955) 6.945 8.497 ( 3.642 -1.958 -3.691) 5.543 8.793 ( -1.647 0.124 2.889) 3.328 8.818 ( -1.871 -1.447 2.517) 3.454 9.978 ( -3.690 6.028 8.654) 11.173 10.020 ( -1.620 3.540 9.715) 10.466 10.352 ( -2.290 1.525 0.613) 2.819 10.443 ( -0.213 -3.855 -0.997) 3.988 10.670 ( 4.534 4.107 -4.968) 7.881 10.758 ( 3.410 -2.309 -5.517) 6.884 11.087 ( -0.274 4.691 -3.023) 5.587 11.144 ( 1.361 -0.394 -5.372) 5.556 12.099 ( -0.262 3.763 3.255) 4.983 12.220 ( -0.082 -7.464 -0.320) 7.471 12.580 ( -2.724 3.035 5.958) 7.220 12.664 ( -2.423 -4.687 2.853) 5.998 13.062 ( -0.176 2.223 0.162) 2.235 13.115 ( 1.581 -2.469 1.490) 3.289 13.548 ( 2.740 3.379 2.716) 5.129 13.609 ( 4.679 -2.131 2.757) 5.834 14.201 ( 1.358 7.213 6.853) 10.041 14.392 ( -1.617 -10.311 5.291) 11.701 14.719 ( -3.062 9.662 -7.515) 12.618 14.936 ( -2.913 -10.226 -8.594) 13.671 19.230 ( 8.159 8.353 -0.388) 11.683 19.350 ( 9.071 -1.935 -2.694) 9.658 19.746 ( 1.496 4.361 5.687) 7.321 19.929 ( 4.847 -11.410 1.632) 12.504 21.746 ( -6.862 11.353 3.281) 13.665 21.995 ( -8.948 -11.736 3.701) 15.215 22.513 ( -1.597 17.291 -9.471) 19.780 22.900 ( -2.988 -18.922 -11.157) 22.168 23.798 ( 0.220 3.947 2.906) 4.906 23.858 ( -1.104 -1.405 1.164) 2.133 24.475 ( -1.268 3.981 0.392) 4.197 24.571 ( -1.608 -4.798 -2.169) 5.505======================= Grid point 149 (83/116) =======================q-point: (-0.25 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.064 ( -5.419 10.397 15.248) 19.234 2.081 ( -3.033 10.854 10.568) 15.449 2.450 ( -13.444 -6.065 4.724) 15.487 2.499 ( -10.440 -7.086 0.555) 12.630 2.601 ( -8.520 7.581 1.513) 11.504 2.696 ( -5.264 2.350 1.590) 5.980 2.755 ( -5.049 1.029 3.109) 6.018 2.954 ( -8.817 -12.734 -0.756) 15.507 3.160 ( 7.130 0.545 3.611) 8.011 3.175 ( 5.425 -0.413 3.336) 6.382 3.531 ( -3.589 8.284 1.924) 9.231 3.597 ( 1.805 3.197 2.205) 4.282 3.746 ( 2.754 5.397 5.090) 7.913 3.865 ( -0.887 -4.678 1.091) 4.885 4.016 ( -1.257 0.444 -1.499) 2.006 4.064 ( -1.691 -3.890 -7.824) 8.900 4.276 ( 2.179 1.744 -6.565) 7.133 4.340 ( -0.272 -4.236 -8.444) 9.451 4.531 ( -5.919 3.638 -2.785) 7.485 4.644 ( -4.741 -6.474 -4.333) 9.120 4.969 ( -3.988 4.829 1.047) 6.349 5.027 ( -4.416 -0.395 0.364) 4.449 5.439 ( -2.436 2.665 0.590) 3.658 5.482 ( -3.285 -0.583 -0.165) 3.340 5.979 ( 4.526 2.789 -2.219) 5.760 6.035 ( 6.236 -1.885 -2.863) 7.116 6.113 ( 1.394 2.418 -5.359) 6.043 6.201 ( -4.311 -4.841 -6.975) 9.523 6.455 ( 0.436 -0.348 2.323) 2.389 6.478 ( -3.578 -1.732 2.402) 4.644 6.895 ( -0.913 2.213 0.647) 2.480 6.937 ( 1.026 -0.852 -1.105) 1.732 7.267 ( -4.135 -2.062 1.837) 4.973 7.283 ( -5.316 -4.331 4.074) 7.976 7.487 ( -2.964 3.032 -5.442) 6.898 7.584 ( -4.844 -5.604 -3.905) 8.373 8.432 ( 0.938 6.200 -3.185) 7.033 8.536 ( 1.454 -2.464 -4.387) 5.237 8.751 ( -3.442 0.629 2.618) 4.370 8.790 ( -1.760 -2.395 1.731) 3.439 9.918 ( -4.654 6.688 7.818) 11.292 10.000 ( -3.002 1.108 8.623) 9.198 10.317 ( -0.784 5.495 -0.751) 5.601 10.444 ( 0.738 -2.586 -3.446) 4.371 10.749 ( 4.449 3.198 -5.306) 7.628 10.815 ( 3.618 -1.173 -5.021) 6.299 11.077 ( 0.493 1.957 -0.751) 2.153 11.133 ( -1.208 -2.564 -2.878) 4.039 12.153 ( 4.846 3.153 5.462) 7.953 12.257 ( 3.914 -6.514 1.741) 7.797 12.537 ( -3.609 2.091 7.344) 8.446 12.622 ( -2.936 -5.366 3.964) 7.289 13.072 ( 1.169 2.830 0.354) 3.082 13.129 ( -0.361 -2.448 1.495) 2.891 13.668 ( 8.079 3.988 2.609) 9.380 13.734 ( 6.724 -2.102 2.681) 7.538 14.228 ( -0.351 4.204 5.041) 6.573 14.346 ( -4.386 -6.436 3.756) 8.647 14.619 ( -4.807 8.754 -6.749) 12.054 14.821 ( -6.216 -9.850 -8.590) 14.472 19.445 ( 12.565 8.314 0.141) 15.067 19.559 ( 12.230 -0.936 -1.733) 12.388 19.826 ( 5.655 7.673 3.819) 10.268 20.053 ( 7.575 -11.421 -0.249) 13.707 21.620 ( -5.929 8.099 1.084) 10.096 21.809 ( -10.101 -9.166 1.534) 13.726 22.405 ( -6.774 14.050 -8.292) 17.665 22.715 ( -12.689 -15.059 -9.049) 21.672 23.817 ( 0.654 1.674 2.653) 3.204 23.839 ( -1.203 -0.145 1.850) 2.211 24.428 ( -3.136 3.228 -0.590) 4.539 24.517 ( -3.435 -5.118 -1.313) 6.302======================= Grid point 150 (84/116) =======================q-point: (-0.12 0.43 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.901 ( -13.670 16.702 7.406) 22.818 2.077 ( -1.194 13.772 12.284) 18.493 2.210 ( -12.894 -7.698 1.493) 15.091 2.325 ( -3.496 -8.423 6.859) 11.411 2.438 ( -9.047 6.366 3.136) 11.498 2.590 ( -6.470 -2.599 2.962) 7.575 2.708 ( -0.890 -0.631 0.683) 1.287 2.765 ( -7.019 -7.151 5.303) 11.337 3.266 ( 1.970 3.125 4.061) 5.490 3.306 ( 5.742 -0.893 4.821) 7.550 3.456 ( -3.447 10.187 2.455) 11.031 3.622 ( -1.710 -1.138 2.061) 2.910 3.787 ( -3.019 2.132 -2.243) 4.323 3.848 ( 2.447 -0.237 3.609) 4.367 3.997 ( 0.119 3.606 -5.711) 6.755 4.110 ( 2.868 -6.749 -3.494) 8.123 4.271 ( 1.253 2.234 -5.924) 6.454 4.331 ( 5.991 -2.509 -4.117) 7.690 4.504 ( 2.128 -1.224 -1.510) 2.882 4.571 ( -1.307 -7.071 -3.924) 8.192 4.878 ( -5.461 5.498 -2.986) 8.305 4.964 ( -1.700 -2.137 -4.873) 5.586 5.407 ( -0.605 1.475 -0.857) 1.810 5.435 ( -1.135 -0.062 -0.496) 1.241 5.966 ( -6.792 2.809 -2.823) 7.874 6.025 ( -6.283 -2.354 -2.452) 7.143 6.169 ( 7.579 4.106 -2.398) 8.947 6.234 ( 9.973 -0.619 -2.211) 10.234 6.461 ( 2.009 1.163 -0.990) 2.524 6.514 ( 4.489 -3.679 0.667) 5.842 6.792 ( -8.837 3.599 -0.276) 9.546 6.880 ( -6.807 -3.617 -0.377) 7.717 7.177 ( -5.089 -0.127 3.933) 6.433 7.221 ( -2.694 -4.937 4.154) 6.992 7.433 ( -0.533 1.265 -5.775) 5.936 7.514 ( -0.316 -5.655 -4.392) 7.167 8.429 ( -0.409 5.509 -2.014) 5.880 8.525 ( -1.363 -2.592 -3.670) 4.695 8.681 ( -4.077 2.572 2.395) 5.382 8.760 ( -1.335 -4.367 -0.370) 4.581 9.857 ( -3.752 6.696 7.806) 10.948 9.961 ( -3.193 -1.640 7.480) 8.297 10.319 ( 0.939 8.490 -1.895) 8.749 10.442 ( 0.382 -0.941 -5.770) 5.858 10.797 ( 2.255 4.272 -5.426) 7.265 10.851 ( 1.353 0.461 -6.077) 6.242 11.092 ( -0.723 -1.702 0.518) 1.921 11.114 ( 1.226 -3.425 2.082) 4.191 12.309 ( 8.408 2.451 5.762) 10.483 12.371 ( 6.151 -3.094 4.279) 8.106 12.489 ( -3.362 -0.232 8.584) 9.222 12.575 ( -2.951 -6.714 3.976) 8.342 13.112 ( 2.583 0.431 3.100) 4.058 13.122 ( -0.684 -0.560 3.158) 3.279 13.823 ( 4.441 2.153 -0.350) 4.948 13.859 ( 5.765 -0.657 1.723) 6.053 14.223 ( -1.069 0.846 3.458) 3.717 14.261 ( -4.378 -2.432 2.375) 5.542 14.512 ( -3.570 6.659 -5.725) 9.480 14.663 ( -6.718 -7.553 -8.051) 12.923 19.615 ( 2.467 8.487 5.142) 10.225 19.753 ( 5.272 -3.354 3.295) 7.064 20.024 ( 15.034 10.462 -5.406) 19.097 20.232 ( 12.276 -7.854 -6.151) 15.819 21.555 ( -0.096 3.299 -1.214) 3.517 21.652 ( -5.217 -5.452 -1.141) 7.632 22.216 ( -10.027 7.582 -5.072) 13.556 22.380 ( -18.615 -7.959 -5.202) 20.903 23.818 ( -0.918 1.403 2.906) 3.355 23.844 ( 0.762 -0.908 2.086) 2.399 24.368 ( -2.323 2.403 -0.922) 3.467 24.436 ( -4.273 -3.947 -0.936) 5.892======================= Grid point 175 (85/116) =======================q-point: ( 0.00 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.176 ( -8.397 0.000 15.292) 17.446 1.407 ( 4.461 0.000 -0.494) 4.488 1.660 ( 3.653 0.000 10.261) 10.892 2.032 ( 0.646 0.000 -18.862) 18.873 2.642 ( 1.545 0.000 29.045) 29.086 2.819 ( -4.910 0.000 2.096) 5.339 2.886 ( 3.590 0.000 -3.261) 4.850 3.032 ( -3.987 0.000 -8.092) 9.021 3.184 ( -2.674 0.000 6.971) 7.467 3.282 ( -2.551 0.000 2.612) 3.651 3.455 ( 4.742 0.000 -2.653) 5.434 3.475 ( 1.190 0.000 -10.288) 10.357 3.699 ( -5.845 0.000 4.773) 7.546 3.766 ( 4.837 0.000 -0.722) 4.891 4.008 ( -5.744 0.000 6.195) 8.448 4.103 ( -6.761 0.000 -2.453) 7.192 4.248 ( 12.464 0.000 -0.354) 12.469 4.270 ( -2.463 0.000 -2.324) 3.387 4.471 ( 10.787 0.000 4.947) 11.867 4.592 ( -3.854 0.000 -5.944) 7.084 4.852 ( -7.202 0.000 1.046) 7.277 4.929 ( 1.210 0.000 -6.394) 6.507 5.339 ( 1.144 0.000 4.867) 5.000 5.438 ( 2.515 0.000 -4.074) 4.788 5.875 ( -3.608 0.000 -1.454) 3.890 5.916 ( 6.005 0.000 -5.126) 7.895 6.192 ( 1.731 0.000 2.413) 2.970 6.224 ( -2.497 0.000 0.235) 2.508 6.437 ( -6.881 0.000 2.538) 7.334 6.499 ( 6.285 0.000 -2.916) 6.929 6.689 ( -7.650 0.000 4.356) 8.803 6.778 ( 8.605 0.000 -4.175) 9.564 7.394 ( -1.118 0.000 4.544) 4.680 7.476 ( -3.578 0.000 -3.301) 4.869 7.994 ( -0.263 0.000 7.599) 7.604 8.099 ( 1.511 0.000 -2.080) 2.571 8.300 ( 0.923 0.000 0.813) 1.230 8.328 ( 0.159 0.000 4.525) 4.528 8.363 ( -2.117 0.000 -5.992) 6.355 8.466 ( 0.527 0.000 -7.561) 7.580 9.520 ( 1.745 0.000 3.666) 4.060 9.629 ( -1.087 0.000 -6.433) 6.524 9.801 ( -2.211 0.000 6.825) 7.174 9.941 ( 0.147 0.000 -6.397) 6.399 10.659 ( 0.450 0.000 1.396) 1.467 10.688 ( 0.058 0.000 -1.488) 1.490 11.245 ( -2.999 0.000 2.794) 4.098 11.297 ( 2.303 0.000 -2.127) 3.135 12.402 ( -2.043 0.000 6.627) 6.935 12.521 ( 0.814 0.000 -4.737) 4.806 12.888 ( 0.298 0.000 2.386) 2.405 12.915 ( -0.096 0.000 0.024) 0.099 13.374 ( 3.361 0.000 6.674) 7.473 13.514 ( -7.053 0.000 -6.955) 9.906 14.100 ( 13.795 0.000 1.761) 13.907 14.107 ( -20.739 0.000 1.361) 20.784 14.163 ( 2.458 0.000 -0.398) 2.490 14.199 ( 8.822 0.000 -3.298) 9.418 14.514 ( -22.330 0.000 2.629) 22.484 14.564 ( 28.339 0.000 -2.021) 28.411 19.018 ( 3.927 0.000 2.799) 4.822 19.064 ( -4.406 0.000 -1.582) 4.681 20.255 ( -14.124 0.000 7.809) 16.139 20.426 ( 19.791 0.000 -8.352) 21.481 21.713 ( -7.013 0.000 1.766) 7.232 21.753 ( 5.405 0.000 -2.275) 5.864 21.955 ( 20.837 0.000 1.060) 20.864 21.993 ( -26.390 0.000 -2.322) 26.492 23.835 ( -2.054 0.000 1.078) 2.320 23.860 ( 2.448 0.000 -1.390) 2.815 24.347 ( -10.025 0.000 1.121) 10.087 24.363 ( 5.829 0.000 -0.499) 5.851======================= Grid point 176 (86/116) =======================q-point: ( 0.12 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.411 ( 23.974 0.000 8.623) 25.478 1.590 ( 8.282 0.000 13.571) 15.899 1.936 ( 23.633 0.000 -3.795) 23.935 2.015 ( 3.109 0.000 -18.394) 18.655 2.745 ( -0.670 0.000 26.990) 26.998 2.805 ( 2.554 0.000 0.547) 2.612 2.927 ( -4.376 0.000 -5.998) 7.425 3.014 ( 8.486 0.000 -1.913) 8.699 3.179 ( 0.989 0.000 6.630) 6.703 3.184 ( -8.361 0.000 4.430) 9.462 3.504 ( 4.706 0.000 -8.636) 9.835 3.528 ( 3.200 0.000 2.707) 4.192 3.587 ( -3.057 0.000 0.227) 3.065 3.728 ( -4.992 0.000 2.269) 5.484 3.916 ( -6.234 0.000 -0.238) 6.238 3.983 ( -5.597 0.000 5.006) 7.509 4.336 ( 8.824 0.000 -1.715) 8.989 4.419 ( 4.450 0.000 -5.489) 7.067 4.516 ( -1.124 0.000 -9.431) 9.498 4.640 ( -2.957 0.000 2.419) 3.820 4.750 ( 3.972 0.000 4.805) 6.234 4.921 ( -0.853 0.000 -1.551) 1.770 5.417 ( 5.584 0.000 1.254) 5.723 5.504 ( 6.082 0.000 -6.447) 8.863 5.875 ( 2.881 0.000 -3.081) 4.218 6.036 ( 4.910 0.000 -4.439) 6.619 6.156 ( -4.412 0.000 -0.049) 4.412 6.242 ( 4.284 0.000 2.431) 4.926 6.308 ( -6.930 0.000 2.027) 7.220 6.593 ( 3.128 0.000 -2.227) 3.840 6.631 ( 1.986 0.000 1.220) 2.331 6.917 ( 5.329 0.000 -5.108) 7.381 7.363 ( -3.297 0.000 7.739) 8.412 7.412 ( -2.117 0.000 0.083) 2.119 8.072 ( 5.492 0.000 5.902) 8.062 8.154 ( 3.073 0.000 -0.987) 3.227 8.274 ( -2.777 0.000 4.507) 5.294 8.309 ( -0.587 0.000 -7.316) 7.340 8.399 ( 4.261 0.000 3.472) 5.496 8.483 ( 3.468 0.000 -8.131) 8.840 9.597 ( 4.867 0.000 4.197) 6.427 9.634 ( 3.715 0.000 -7.178) 8.082 9.798 ( -0.472 0.000 8.854) 8.867 9.941 ( 1.750 0.000 -4.783) 5.093 10.665 ( -0.014 0.000 1.013) 1.013 10.671 ( -1.481 0.000 -2.137) 2.600 11.168 ( -5.567 0.000 3.204) 6.424 11.294 ( -2.211 0.000 -1.653) 2.761 12.383 ( -2.165 0.000 7.552) 7.857 12.540 ( 2.699 0.000 -3.902) 4.745 12.883 ( -1.778 0.000 3.216) 3.675 12.899 ( -1.359 0.000 -1.405) 1.955 13.343 ( -9.184 0.000 -3.317) 9.764 13.442 ( -0.383 0.000 9.062) 9.070 13.740 ( -14.504 0.000 1.420) 14.573 13.943 ( -19.827 0.000 -5.044) 20.459 14.118 ( -4.387 0.000 -1.470) 4.626 14.305 ( 0.210 0.000 -0.027) 0.212 14.531 ( 18.235 0.000 -1.969) 18.341 15.048 ( 19.285 0.000 -8.186) 20.951 18.983 ( -2.975 0.000 -2.281) 3.749 19.077 ( 0.541 0.000 4.306) 4.340 20.059 ( -6.421 0.000 2.269) 6.810 20.694 ( 6.265 0.000 -7.654) 9.891 21.602 ( -9.394 0.000 -1.406) 9.499 21.604 ( -5.162 0.000 2.180) 5.603 21.966 ( 16.725 0.000 -4.935) 17.437 22.400 ( 22.496 0.000 8.048) 23.893 23.793 ( -2.543 0.000 0.261) 2.557 23.896 ( 1.533 0.000 -1.071) 1.870 24.200 ( -5.216 0.000 4.494) 6.884 24.476 ( 5.040 0.000 2.020) 5.430======================= Grid point 177 (87/116) =======================q-point: ( 0.25 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.767 ( 5.326 0.000 14.203) 15.169 1.898 ( 19.533 0.000 -5.847) 20.390 2.051 ( 6.269 0.000 -11.146) 12.788 2.360 ( 15.089 0.000 -9.531) 17.847 2.765 ( -3.114 0.000 22.188) 22.405 2.829 ( 1.233 0.000 2.705) 2.973 2.936 ( 3.229 0.000 2.507) 4.088 3.039 ( -1.998 0.000 0.735) 2.129 3.110 ( 2.182 0.000 -0.493) 2.237 3.277 ( 4.006 0.000 9.129) 9.969 3.574 ( 2.741 0.000 -4.610) 5.364 3.608 ( 6.454 0.000 7.874) 10.181 3.686 ( 11.222 0.000 -4.991) 12.282 3.695 ( 1.850 0.000 5.550) 5.850 3.866 ( 3.226 0.000 -5.511) 6.386 3.886 ( -5.966 0.000 6.122) 8.549 4.351 ( -2.972 0.000 -7.968) 8.504 4.418 ( -4.312 0.000 -1.031) 4.434 4.521 ( -3.537 0.000 2.506) 4.335 4.624 ( 10.748 0.000 -6.407) 12.513 4.883 ( -2.693 0.000 0.373) 2.719 4.898 ( 6.551 0.000 0.448) 6.566 5.540 ( 6.200 0.000 -1.715) 6.433 5.625 ( 7.707 0.000 -6.821) 10.292 5.913 ( 1.002 0.000 -0.686) 1.215 6.027 ( -4.124 0.000 -1.043) 4.254 6.075 ( -3.022 0.000 -0.602) 3.081 6.186 ( -5.656 0.000 2.348) 6.124 6.371 ( 6.565 0.000 -0.976) 6.637 6.584 ( -3.356 0.000 -2.165) 3.994 6.732 ( 6.458 0.000 -1.833) 6.713 6.933 ( -1.534 0.000 -4.935) 5.168 7.333 ( -1.930 0.000 8.359) 8.579 7.400 ( 0.811 0.000 -0.409) 0.908 8.144 ( -3.544 0.000 1.565) 3.874 8.155 ( -0.509 0.000 1.982) 2.047 8.279 ( 2.816 0.000 9.911) 10.303 8.353 ( 7.089 0.000 -9.303) 11.697 8.474 ( 1.925 0.000 2.665) 3.288 8.544 ( 4.959 0.000 -9.077) 10.344 9.711 ( 4.373 0.000 5.757) 7.229 9.729 ( 8.341 0.000 -8.574) 11.962 9.839 ( 2.284 0.000 9.864) 10.125 9.977 ( 2.590 0.000 -2.954) 3.928 10.618 ( -2.957 0.000 -2.693) 4.000 10.669 ( 0.258 0.000 0.624) 0.675 11.062 ( -5.882 0.000 2.926) 6.570 11.199 ( -7.100 0.000 -1.300) 7.218 12.362 ( -2.338 0.000 8.873) 9.176 12.597 ( 3.806 0.000 -5.232) 6.470 12.829 ( -5.175 0.000 5.292) 7.402 12.865 ( -1.131 0.000 -1.142) 1.608 13.124 ( -11.905 0.000 -2.960) 12.268 13.345 ( -8.410 0.000 3.418) 9.078 13.636 ( -0.287 0.000 4.470) 4.480 13.642 ( -8.057 0.000 -4.735) 9.345 14.026 ( -4.174 0.000 -0.241) 4.181 14.303 ( -0.718 0.000 -3.485) 3.558 14.838 ( 13.496 0.000 -1.303) 13.559 15.253 ( 5.245 0.000 -6.675) 8.489 18.943 ( -0.292 0.000 -3.426) 3.438 19.054 ( -4.166 0.000 5.952) 7.265 20.036 ( 3.630 0.000 -2.235) 4.263 20.627 ( -9.214 0.000 2.513) 9.550 21.520 ( -4.254 0.000 2.849) 5.120 21.527 ( 0.306 0.000 -7.993) 7.999 22.398 ( 28.000 0.000 -11.542) 30.285 22.824 ( 16.585 0.000 14.334) 21.921 23.738 ( -2.852 0.000 -1.161) 3.079 23.908 ( -0.107 0.000 -0.443) 0.456 24.181 ( 1.808 0.000 3.888) 4.288 24.548 ( 1.273 0.000 2.710) 2.994======================= Grid point 178 (88/116) =======================q-point: ( 0.38 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.842 ( -2.024 0.000 11.872) 12.043 2.035 ( 4.396 0.000 -16.601) 17.173 2.192 ( 4.103 0.000 0.353) 4.119 2.421 ( -1.339 0.000 -8.281) 8.388 2.814 ( 1.564 0.000 19.490) 19.553 2.840 ( -2.825 0.000 5.417) 6.109 2.983 ( 7.498 0.000 0.652) 7.526 3.118 ( -0.680 0.000 -2.585) 2.673 3.233 ( 11.356 0.000 3.797) 11.974 3.338 ( 0.451 0.000 7.632) 7.645 3.594 ( 0.516 0.000 -0.092) 0.524 3.697 ( -1.878 0.000 -1.631) 2.487 3.798 ( 7.476 0.000 -0.286) 7.482 3.848 ( 0.114 0.000 10.975) 10.975 3.949 ( 15.331 0.000 -1.016) 15.365 3.987 ( 8.456 0.000 -3.062) 8.994 4.285 ( -7.456 0.000 1.282) 7.566 4.290 ( -0.803 0.000 -6.086) 6.139 4.531 ( 1.883 0.000 2.221) 2.912 4.750 ( 2.350 0.000 -8.450) 8.771 4.859 ( 2.366 0.000 0.197) 2.374 4.986 ( 2.331 0.000 -2.109) 3.144 5.616 ( 2.110 0.000 -2.308) 3.127 5.711 ( 0.247 0.000 -3.808) 3.816 5.883 ( -3.647 0.000 0.244) 3.655 5.932 ( -2.242 0.000 -3.630) 4.266 6.083 ( 3.998 0.000 2.951) 4.969 6.141 ( 1.096 0.000 2.658) 2.875 6.426 ( -0.884 0.000 -3.586) 3.693 6.462 ( -7.925 0.000 -2.606) 8.343 6.827 ( 3.778 0.000 -1.936) 4.245 6.875 ( -2.307 0.000 -1.385) 2.691 7.334 ( -0.357 0.000 6.120) 6.130 7.422 ( 1.261 0.000 -2.095) 2.445 8.088 ( -1.660 0.000 1.174) 2.033 8.121 ( -2.384 0.000 2.011) 3.119 8.361 ( 1.107 0.000 9.896) 9.958 8.475 ( 7.237 0.000 -8.765) 11.367 8.493 ( -0.188 0.000 2.073) 2.082 8.601 ( 3.273 0.000 -9.532) 10.078 9.775 ( 0.286 0.000 8.787) 8.792 9.894 ( 10.594 0.000 -10.493) 14.911 9.933 ( 2.985 0.000 8.951) 9.436 10.006 ( 1.303 0.000 -2.142) 2.507 10.566 ( -0.538 0.000 -2.876) 2.926 10.674 ( -0.571 0.000 0.108) 0.581 10.968 ( -4.263 0.000 2.008) 4.712 11.032 ( -8.568 0.000 -0.925) 8.618 12.348 ( -1.857 0.000 10.193) 10.360 12.616 ( 0.022 0.000 -8.972) 8.972 12.733 ( -5.656 0.000 7.137) 9.107 12.857 ( -1.841 0.000 -2.427) 3.046 12.958 ( -0.712 0.000 0.445) 0.840 13.224 ( -4.770 0.000 -1.305) 4.946 13.566 ( -0.518 0.000 -0.408) 0.659 13.634 ( -1.887 0.000 3.300) 3.801 13.983 ( -0.309 0.000 3.458) 3.471 14.255 ( -2.525 0.000 -6.207) 6.701 15.045 ( 8.312 0.000 -0.878) 8.359 15.261 ( -1.877 0.000 -3.650) 4.104 18.953 ( 2.441 0.000 -4.449) 5.075 18.974 ( -5.324 0.000 6.071) 8.075 20.156 ( 8.818 0.000 -3.842) 9.619 20.431 ( -11.492 0.000 5.974) 12.952 21.456 ( -3.266 0.000 3.348) 4.677 21.521 ( 1.380 0.000 -8.537) 8.648 22.896 ( 25.796 0.000 -14.208) 29.450 23.066 ( 1.797 0.000 17.680) 17.771 23.701 ( 0.736 0.000 -2.460) 2.568 23.882 ( -2.762 0.000 -1.117) 2.979 24.278 ( 6.933 0.000 1.858) 7.178 24.536 ( -3.007 0.000 1.150) 3.220======================= Grid point 179 (89/116) =======================q-point: (-0.50 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.782 ( -6.729 0.000 13.481) 15.067 2.052 ( 1.488 0.000 -10.801) 10.903 2.220 ( -0.443 0.000 5.850) 5.867 2.329 ( -5.699 0.000 -4.762) 7.427 2.884 ( 0.994 0.000 8.668) 8.725 2.885 ( 4.984 0.000 5.859) 7.692 3.075 ( -2.944 0.000 -2.089) 3.610 3.119 ( 5.896 0.000 -3.741) 6.983 3.364 ( 0.590 0.000 2.404) 2.476 3.396 ( 5.584 0.000 -0.219) 5.588 3.592 ( -0.529 0.000 2.676) 2.727 3.635 ( -2.797 0.000 -1.531) 3.189 3.803 ( -8.721 0.000 10.187) 13.410 3.929 ( 3.430 0.000 -0.167) 3.434 4.135 ( 7.881 0.000 -1.836) 8.092 4.148 ( -4.463 0.000 -2.269) 5.006 4.176 ( 3.138 0.000 2.659) 4.113 4.248 ( -3.465 0.000 -3.360) 4.826 4.574 ( 0.823 0.000 6.061) 6.116 4.702 ( -3.780 0.000 -6.329) 7.372 4.941 ( 4.559 0.000 -2.796) 5.348 4.970 ( -2.179 0.000 -5.024) 5.477 5.613 ( -6.534 0.000 1.879) 6.798 5.625 ( -1.054 0.000 3.007) 3.186 5.833 ( -0.188 0.000 0.560) 0.591 5.945 ( 2.855 0.000 -7.433) 7.963 6.216 ( 6.718 0.000 6.413) 9.288 6.249 ( 9.489 0.000 -0.731) 9.517 6.272 ( -9.482 0.000 -3.092) 9.974 6.362 ( -3.181 0.000 -7.061) 7.745 6.846 ( -0.980 0.000 0.511) 1.105 6.866 ( 0.565 0.000 -1.307) 1.424 7.346 ( -0.334 0.000 5.123) 5.134 7.431 ( 0.777 0.000 -3.103) 3.198 8.091 ( -0.775 0.000 0.525) 0.936 8.103 ( 2.938 0.000 -0.125) 2.941 8.365 ( -3.601 0.000 9.463) 10.125 8.489 ( -0.976 0.000 2.853) 3.015 8.550 ( 2.427 0.000 -8.027) 8.386 8.616 ( 1.528 0.000 -9.396) 9.519 9.771 ( -4.247 0.000 11.320) 12.091 9.968 ( -0.182 0.000 -6.519) 6.522 9.969 ( -0.723 0.000 4.891) 4.944 10.094 ( 8.042 0.000 -8.042) 11.373 10.604 ( -6.430 0.000 -0.380) 6.441 10.609 ( 4.866 0.000 -1.036) 4.975 10.924 ( -0.031 0.000 1.128) 1.128 10.938 ( 0.168 0.000 -0.143) 0.221 12.354 ( -0.684 0.000 11.596) 11.616 12.576 ( -0.679 0.000 -9.471) 9.496 12.681 ( -1.472 0.000 7.908) 8.044 12.808 ( 0.021 0.000 -4.303) 4.303 13.046 ( 5.751 0.000 3.829) 6.909 13.124 ( -5.192 0.000 -3.461) 6.240 13.586 ( -2.735 0.000 2.284) 3.563 13.586 ( 1.123 0.000 1.873) 2.184 14.030 ( 3.422 0.000 5.783) 6.719 14.180 ( -2.893 0.000 -7.784) 8.304 15.163 ( 4.120 0.000 0.016) 4.120 15.184 ( -4.957 0.000 -2.140) 5.399 18.899 ( -3.896 0.000 5.348) 6.616 19.008 ( 4.551 0.000 -5.056) 6.803 20.230 ( -10.813 0.000 6.255) 12.492 20.330 ( 9.698 0.000 -3.164) 10.201 21.414 ( -2.032 0.000 3.488) 4.037 21.531 ( 2.090 0.000 -7.616) 7.898 22.975 ( -14.787 0.000 14.744) 20.882 23.284 ( 17.986 0.000 -13.830) 22.688 23.762 ( 4.771 0.000 0.184) 4.775 23.783 ( -7.129 0.000 -1.868) 7.369 24.440 ( 8.988 0.000 -1.087) 9.054 24.450 ( -5.335 0.000 -1.482) 5.537======================= Grid point 180 (90/116) =======================q-point: (-0.38 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.689 ( -7.170 0.000 16.134) 17.656 2.032 ( -1.736 0.000 -2.171) 2.780 2.190 ( -7.900 0.000 -0.553) 7.920 2.225 ( -1.354 0.000 7.295) 7.419 2.936 ( 3.339 0.000 0.581) 3.389 2.995 ( -3.644 0.000 -3.910) 5.345 3.011 ( 5.225 0.000 5.176) 7.355 3.154 ( -0.009 0.000 -11.157) 11.157 3.297 ( -11.929 0.000 -1.664) 12.044 3.454 ( 0.562 0.000 -2.871) 2.926 3.502 ( -11.039 0.000 9.333) 14.456 3.627 ( 2.542 0.000 4.631) 5.283 3.717 ( 1.156 0.000 3.748) 3.922 3.862 ( -10.451 0.000 3.113) 10.904 4.014 ( -7.386 0.000 -3.190) 8.046 4.125 ( -4.842 0.000 -6.986) 8.500 4.163 ( -4.458 0.000 4.246) 6.157 4.322 ( 10.948 0.000 -3.009) 11.354 4.579 ( -6.653 0.000 -4.452) 8.006 4.580 ( -2.542 0.000 7.460) 7.881 4.925 ( 0.071 0.000 -5.653) 5.653 4.980 ( -0.321 0.000 -1.609) 1.641 5.532 ( -3.104 0.000 4.155) 5.186 5.571 ( -6.149 0.000 8.566) 10.545 5.908 ( 6.897 0.000 -0.939) 6.961 5.968 ( 1.780 0.000 -6.534) 6.772 6.108 ( -5.926 0.000 -2.030) 6.264 6.304 ( 0.046 0.000 -9.220) 9.220 6.348 ( 4.315 0.000 4.288) 6.083 6.440 ( 8.720 0.000 -1.032) 8.781 6.822 ( -1.868 0.000 -1.443) 2.360 6.843 ( -2.289 0.000 1.647) 2.820 7.347 ( -1.017 0.000 5.297) 5.394 7.455 ( 3.131 0.000 -5.199) 6.069 8.105 ( 2.356 0.000 -0.689) 2.454 8.177 ( 4.069 0.000 -2.606) 4.832 8.283 ( -7.294 0.000 9.154) 11.705 8.465 ( -2.673 0.000 3.520) 4.420 8.537 ( -0.766 0.000 -6.174) 6.222 8.597 ( -1.184 0.000 -8.648) 8.729 9.676 ( -7.812 0.000 10.012) 12.699 9.925 ( -2.285 0.000 -5.918) 6.344 9.966 ( -0.665 0.000 1.786) 1.906 10.134 ( -2.168 0.000 -9.774) 10.011 10.526 ( 0.264 0.000 1.094) 1.126 10.675 ( 1.204 0.000 -0.127) 1.210 11.001 ( 5.396 0.000 -1.120) 5.511 11.007 ( 7.849 0.000 1.371) 7.968 12.389 ( 0.429 0.000 12.564) 12.572 12.546 ( 0.320 0.000 -8.658) 8.664 12.739 ( 5.487 0.000 8.670) 10.261 12.835 ( 3.101 0.000 -2.586) 4.038 13.007 ( -5.211 0.000 -3.672) 6.374 13.178 ( 7.468 0.000 2.594) 7.906 13.522 ( -3.657 0.000 4.160) 5.539 13.645 ( 3.404 0.000 1.678) 3.795 14.106 ( -2.250 0.000 -7.553) 7.881 14.130 ( 4.723 0.000 5.317) 7.112 15.055 ( -8.023 0.000 -2.089) 8.291 15.203 ( -0.507 0.000 1.935) 2.001 18.860 ( -1.428 0.000 4.389) 4.615 19.091 ( 5.203 0.000 -5.017) 7.227 20.061 ( -7.823 0.000 5.120) 9.349 20.496 ( 7.382 0.000 -0.153) 7.384 21.402 ( 0.007 0.000 2.750) 2.750 21.559 ( 2.882 0.000 -6.487) 7.098 22.639 ( -22.340 0.000 10.517) 24.692 23.452 ( -1.890 0.000 -18.309) 18.406 23.646 ( -1.056 0.000 2.671) 2.872 23.843 ( 2.741 0.000 1.955) 3.367 24.341 ( -4.590 0.000 -3.606) 5.837 24.589 ( 6.443 0.000 -4.505) 7.862======================= Grid point 181 (91/116) =======================q-point: (-0.25 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 116Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.596 ( -7.575 0.000 17.817) 19.360 1.937 ( -10.390 0.000 3.707) 11.032 1.988 ( -13.748 0.000 -0.824) 13.773 2.196 ( -3.487 0.000 1.832) 3.939 2.774 ( -18.328 0.000 7.304) 19.730 2.998 ( -9.363 0.000 -0.656) 9.386 3.033 ( -4.019 0.000 -1.567) 4.313 3.106 ( 11.553 0.000 -6.305) 13.161 3.154 ( 4.185 0.000 -5.742) 7.105 3.371 ( -7.779 0.000 11.421) 13.818 3.402 ( -5.541 0.000 -3.905) 6.778 3.604 ( -7.850 0.000 2.734) 8.312 3.662 ( -5.649 0.000 0.416) 5.664 3.790 ( 5.089 0.000 -1.167) 5.222 3.849 ( -6.770 0.000 -4.303) 8.022 4.101 ( 5.336 0.000 -7.425) 9.143 4.142 ( 1.200 0.000 10.211) 10.281 4.385 ( -7.834 0.000 -1.897) 8.060 4.509 ( -6.799 0.000 4.743) 8.290 4.576 ( 10.555 0.000 -2.626) 10.876 4.935 ( -2.847 0.000 -3.093) 4.204 4.935 ( 1.860 0.000 -4.530) 4.897 5.460 ( -7.326 0.000 8.551) 11.260 5.484 ( -3.583 0.000 3.830) 5.244 5.944 ( -2.591 0.000 -5.222) 5.829 6.022 ( 3.471 0.000 -0.606) 3.523 6.073 ( 2.367 0.000 -0.435) 2.406 6.315 ( 3.653 0.000 -7.864) 8.672 6.359 ( -4.018 0.000 0.386) 4.037 6.545 ( 2.028 0.000 1.403) 2.466 6.753 ( -4.192 0.000 -3.470) 5.442 6.829 ( -0.062 0.000 4.704) 4.705 7.350 ( 0.179 0.000 4.530) 4.534 7.510 ( 3.920 0.000 -8.007) 8.915 8.154 ( -8.088 0.000 9.413) 12.410 8.171 ( 4.077 0.000 -1.165) 4.240 8.209 ( -0.536 0.000 -3.186) 3.231 8.409 ( -3.801 0.000 3.661) 5.278 8.478 ( -3.194 0.000 -8.234) 8.832 8.551 ( -0.867 0.000 -5.095) 5.169 9.565 ( -5.546 0.000 6.724) 8.716 9.836 ( -5.265 0.000 -6.127) 8.078 9.932 ( -3.627 0.000 1.202) 3.821 10.031 ( -3.562 0.000 -8.190) 8.931 10.580 ( 3.324 0.000 1.150) 3.517 10.680 ( 0.070 0.000 -0.466) 0.471 11.116 ( 6.499 0.000 -2.218) 6.867 11.169 ( 6.915 0.000 1.447) 7.065 12.426 ( -0.617 0.000 10.854) 10.872 12.534 ( 0.726 0.000 -7.503) 7.538 12.872 ( 0.330 0.000 -1.319) 1.359 12.883 ( 1.907 0.000 -0.091) 1.910 13.022 ( 13.201 0.000 7.409) 15.138 13.381 ( 13.569 0.000 -0.589) 13.582 13.497 ( 0.852 0.000 8.920) 8.960 13.707 ( 2.063 0.000 -1.570) 2.592 14.061 ( -0.098 0.000 -3.963) 3.964 14.227 ( 3.679 0.000 3.516) 5.089 14.846 ( -13.236 0.000 -2.389) 13.450 15.138 ( -7.727 0.000 4.425) 8.904 18.871 ( 1.414 0.000 3.411) 3.692 19.159 ( 2.374 0.000 -3.819) 4.497 19.988 ( 0.161 0.000 2.346) 2.351 20.585 ( -0.065 0.000 5.764) 5.764 21.446 ( 4.753 0.000 0.290) 4.762 21.605 ( 3.654 0.000 -5.348) 6.477 22.225 ( -21.248 0.000 5.656) 21.988 23.132 ( -21.588 0.000 -13.941) 25.698 23.732 ( 5.201 0.000 -1.398) 5.386 23.876 ( 0.084 0.000 2.099) 2.100 24.270 ( -1.243 0.000 -4.233) 4.412 24.637 ( -0.343 0.000 -6.424) 6.434======================= Grid point 182 (92/116) =======================q-point: (-0.12 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 112Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.483 ( -9.159 0.000 10.345) 13.817 1.565 ( -28.149 0.000 10.993) 30.220 1.704 ( -11.117 0.000 2.437) 11.381 2.102 ( -2.850 0.000 -14.324) 14.605 2.577 ( -4.693 0.000 24.266) 24.716 2.893 ( -2.506 0.000 -3.817) 4.566 2.942 ( -5.935 0.000 0.939) 6.009 3.144 ( -5.265 0.000 -6.982) 8.745 3.239 ( -4.374 0.000 6.252) 7.630 3.292 ( -0.691 0.000 -0.412) 0.804 3.332 ( 8.042 0.000 -0.697) 8.073 3.504 ( -1.719 0.000 -5.948) 6.191 3.639 ( 3.602 0.000 0.507) 3.637 3.758 ( -2.351 0.000 0.095) 2.353 3.943 ( 11.798 0.000 -1.431) 11.885 4.155 ( -5.009 0.000 -7.913) 9.365 4.253 ( 5.849 0.000 8.201) 10.073 4.264 ( 0.651 0.000 7.041) 7.071 4.350 ( -9.160 0.000 2.550) 9.508 4.691 ( -1.453 0.000 -2.860) 3.208 4.901 ( 2.819 0.000 -9.010) 9.441 4.940 ( -1.181 0.000 -3.044) 3.265 5.358 ( -4.889 0.000 7.426) 8.890 5.431 ( -1.646 0.000 0.877) 1.865 5.887 ( -1.047 0.000 -4.318) 4.443 5.995 ( -5.922 0.000 -0.736) 5.968 6.135 ( 3.436 0.000 0.570) 3.483 6.271 ( -3.236 0.000 -0.253) 3.246 6.393 ( 5.792 0.000 -4.888) 7.579 6.535 ( -3.566 0.000 3.310) 4.866 6.689 ( 0.538 0.000 -4.067) 4.103 6.812 ( -4.487 0.000 4.655) 6.465 7.378 ( 1.111 0.000 3.419) 3.595 7.534 ( 0.336 0.000 -8.204) 8.211 8.036 ( -6.049 0.000 8.793) 10.673 8.138 ( -4.578 0.000 -1.228) 4.740 8.247 ( 3.480 0.000 -0.152) 3.484 8.353 ( -2.867 0.000 3.736) 4.709 8.412 ( -1.053 0.000 -8.163) 8.231 8.506 ( -2.126 0.000 -5.939) 6.307 9.509 ( -1.842 0.000 4.416) 4.785 9.709 ( -5.026 0.000 -6.241) 8.013 9.851 ( -4.494 0.000 3.559) 5.733 9.968 ( -0.969 0.000 -7.269) 7.334 10.634 ( 1.801 0.000 1.435) 2.302 10.684 ( 0.523 0.000 -0.873) 1.017 11.227 ( 5.355 0.000 -2.456) 5.891 11.256 ( 1.465 0.000 1.910) 2.408 12.423 ( -2.077 0.000 7.515) 7.797 12.526 ( 0.466 0.000 -6.122) 6.140 12.869 ( 0.668 0.000 0.771) 1.020 12.908 ( 0.646 0.000 0.792) 1.022 13.280 ( 6.420 0.000 3.121) 7.139 13.621 ( 2.663 0.000 -7.939) 8.374 13.758 ( 12.746 0.000 -0.310) 12.750 13.770 ( 25.857 0.000 12.072) 28.536 14.097 ( 4.085 0.000 0.312) 4.097 14.290 ( 2.486 0.000 1.454) 2.880 14.525 ( -18.730 0.000 -1.669) 18.804 14.910 ( -17.450 0.000 5.319) 18.243 18.931 ( 3.694 0.000 2.690) 4.570 19.145 ( -2.750 0.000 -2.034) 3.420 20.110 ( 12.519 0.000 -2.316) 12.731 20.495 ( -11.427 0.000 10.286) 15.375 21.615 ( 13.292 0.000 -1.380) 13.363 21.669 ( 4.332 0.000 -4.143) 5.994 21.898 ( -12.951 0.000 1.491) 13.036 22.587 ( -29.928 0.000 -9.778) 31.485 23.809 ( 3.337 0.000 -1.577) 3.691 23.866 ( -1.449 0.000 1.677) 2.216 24.277 ( 3.083 0.000 -3.068) 4.349 24.537 ( -7.859 0.000 -4.223) 8.922======================= Grid point 183 (93/116) =======================q-point: ( 0.00 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.273 ( -5.966 9.037 13.467) 17.281 1.511 ( 4.470 8.431 -6.905) 11.779 1.796 ( 0.206 12.162 14.869) 19.211 2.157 ( 1.586 10.308 -17.066) 20.000 2.670 ( 1.444 2.031 24.152) 24.281 2.768 ( -5.191 -4.355 4.962) 8.399 2.821 ( 3.007 -5.548 -2.896) 6.944 3.031 ( -3.009 0.005 -6.010) 6.721 3.147 ( -2.152 -2.118 6.864) 7.499 3.312 ( 2.258 1.895 -2.695) 3.994 3.400 ( -0.173 -1.536 0.245) 1.565 3.534 ( 0.381 2.056 -7.840) 8.114 3.698 ( -6.495 0.330 4.688) 8.017 3.778 ( 5.716 1.314 -1.249) 5.997 3.987 ( -5.866 -2.021 8.495) 10.520 4.140 ( -4.054 2.131 -4.892) 6.701 4.253 ( 15.247 2.088 1.025) 15.424 4.319 ( -6.574 3.150 -4.990) 8.834 4.505 ( 8.740 2.540 4.371) 10.096 4.616 ( -3.657 1.778 -5.369) 6.735 4.788 ( -6.578 -5.540 0.642) 8.624 4.870 ( 2.153 -5.221 -7.140) 9.103 5.362 ( 0.257 1.985 4.270) 4.716 5.440 ( 2.983 0.051 -2.800) 4.092 5.899 ( -2.534 1.664 -0.288) 3.045 5.959 ( 4.240 3.831 -5.433) 7.885 6.138 ( 1.061 -4.135 2.289) 4.844 6.180 ( -1.128 -3.173 -1.326) 3.620 6.441 ( -6.507 0.554 3.145) 7.248 6.503 ( 6.084 0.520 -2.074) 6.449 6.728 ( -7.428 2.719 2.129) 8.191 6.784 ( 8.540 0.219 -3.072) 9.078 7.335 ( -3.572 -5.050 5.150) 8.049 7.425 ( -0.583 -3.852 -3.103) 4.981 7.792 ( -0.641 -13.949 4.147) 14.567 7.867 ( 2.653 -12.684 -2.604) 13.218 8.308 ( 2.093 0.910 1.219) 2.588 8.370 ( -1.911 1.236 -4.208) 4.784 8.507 ( -1.736 8.471 4.713) 9.848 8.643 ( 0.568 9.061 -7.247) 11.616 9.616 ( 1.120 9.022 5.551) 10.652 9.746 ( -0.184 9.789 -6.016) 11.491 9.863 ( -2.919 6.332 6.295) 9.394 10.013 ( 0.543 6.172 -7.207) 9.504 10.649 ( -0.217 -0.641 1.335) 1.497 10.686 ( 0.423 -0.270 -2.190) 2.247 11.238 ( -2.454 -0.767 2.895) 3.872 11.289 ( 1.879 -0.917 -1.913) 2.834 12.406 ( -1.657 0.278 6.469) 6.684 12.524 ( 0.912 0.184 -4.710) 4.801 12.828 ( -0.149 -4.986 3.656) 6.185 12.880 ( 0.147 -3.228 -0.919) 3.359 13.337 ( 2.707 -3.066 6.842) 7.971 13.484 ( -5.555 -2.909 -7.211) 9.556 14.049 ( 1.979 -8.154 4.625) 9.581 14.083 ( 5.652 -3.012 0.558) 6.429 14.151 ( -8.113 2.034 2.445) 8.714 14.212 ( 6.746 1.507 -2.805) 7.460 14.408 ( -3.017 -4.354 5.723) 7.798 14.558 ( 4.524 -2.718 -7.956) 9.548 19.180 ( -3.064 11.432 1.498) 11.930 19.221 ( 3.130 15.512 -2.607) 16.038 20.232 ( -11.468 -2.185 8.137) 14.230 20.411 ( 16.326 -1.533 -8.739) 18.581 21.671 ( -6.141 -3.289 1.652) 7.160 21.717 ( 6.792 -3.134 -2.820) 7.994 21.977 ( 11.602 1.643 0.858) 11.749 22.006 ( -18.438 1.039 -1.739) 18.549 23.831 ( -1.114 0.095 2.162) 2.434 23.872 ( 1.568 0.745 -1.820) 2.515 24.349 ( -6.181 0.065 0.700) 6.221 24.362 ( 2.775 -0.091 -0.544) 2.829======================= Grid point 184 (94/116) =======================q-point: ( 0.12 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.488 ( 20.757 7.031 8.349) 23.452 1.708 ( 10.833 9.727 5.685) 15.630 1.959 ( 13.907 5.305 1.226) 14.935 2.174 ( 6.640 10.530 -15.223) 19.665 2.728 ( 0.651 -2.620 8.594) 9.008 2.784 ( 1.416 -0.173 17.763) 17.820 2.907 ( 1.141 -3.319 -4.375) 5.608 2.999 ( 4.496 -0.676 -0.719) 4.603 3.132 ( -1.174 0.133 0.941) 1.511 3.275 ( -5.673 4.842 8.829) 11.558 3.439 ( 5.047 -3.321 -9.421) 11.192 3.527 ( -0.068 -1.010 3.077) 3.239 3.596 ( -2.119 -0.061 2.475) 3.258 3.805 ( -0.663 5.812 -1.215) 5.974 3.906 ( -5.282 -1.260 3.697) 6.569 3.987 ( -8.569 1.079 0.975) 8.692 4.298 ( 6.555 -2.830 -5.752) 9.168 4.458 ( -0.806 3.246 -6.487) 7.298 4.554 ( 3.813 0.422 1.550) 4.137 4.633 ( -4.274 1.349 -3.657) 5.784 4.729 ( 6.748 -1.386 2.835) 7.450 4.887 ( 1.599 -3.087 -1.201) 3.678 5.422 ( 5.113 0.457 0.816) 5.198 5.513 ( 5.390 0.608 -5.278) 7.568 5.882 ( 0.895 -0.344 -0.798) 1.247 5.997 ( -0.578 -2.162 -3.338) 4.019 6.148 ( -1.935 -2.489 1.732) 3.597 6.209 ( 3.767 -0.545 -4.019) 5.535 6.341 ( -2.035 2.495 3.523) 4.772 6.617 ( -2.742 -0.570 1.325) 3.098 6.663 ( 8.712 4.847 -3.900) 10.705 6.922 ( 5.099 0.291 -3.870) 6.408 7.271 ( -3.590 -5.911 6.683) 9.617 7.416 ( -0.402 -0.935 0.963) 1.402 7.842 ( 4.656 -15.100 1.596) 15.882 7.935 ( 4.183 -12.148 -2.202) 13.036 8.319 ( -1.401 1.132 -4.638) 4.975 8.328 ( -0.642 1.216 1.989) 2.418 8.535 ( 2.646 7.534 5.455) 9.671 8.653 ( 2.361 9.322 -6.059) 11.366 9.674 ( 2.954 6.891 5.623) 9.372 9.749 ( 3.053 10.241 -7.542) 13.080 9.861 ( -0.061 5.587 9.204) 10.767 10.027 ( 2.783 7.677 -5.549) 9.873 10.634 ( -1.483 -1.648 0.540) 2.282 10.685 ( 0.025 0.301 -1.642) 1.670 11.165 ( -5.486 -0.363 2.816) 6.177 11.285 ( -2.046 -0.979 -1.285) 2.607 12.373 ( -3.285 -0.781 6.184) 7.045 12.551 ( 2.886 0.635 -3.656) 4.701 12.807 ( -2.166 -6.076 1.557) 6.636 12.873 ( -1.507 -2.359 1.060) 2.993 13.332 ( -8.451 -1.130 -3.649) 9.274 13.405 ( 1.402 -3.920 7.549) 8.621 13.745 ( -17.641 0.369 1.572) 17.715 13.904 ( -12.682 -2.107 -4.709) 13.691 14.154 ( -5.614 2.247 -0.493) 6.067 14.308 ( 1.660 -0.269 0.546) 1.768 14.510 ( 16.824 -1.529 -0.855) 16.915 14.897 ( 17.939 -11.883 -5.983) 22.334 19.088 ( -4.730 9.117 -0.156) 10.272 19.246 ( -2.128 13.991 0.589) 14.164 20.055 ( -6.128 -0.459 2.007) 6.464 20.617 ( 3.186 -6.619 -6.482) 9.796 21.558 ( -2.410 -0.914 -3.126) 4.051 21.702 ( -8.151 5.625 3.461) 10.491 21.940 ( 16.769 -2.444 -5.190) 17.723 22.361 ( 20.190 -3.535 7.470) 21.816 23.813 ( -1.391 1.557 1.316) 2.468 23.890 ( 0.813 -0.273 -2.060) 2.231 24.215 ( -4.730 1.518 3.595) 6.132 24.476 ( 5.453 -0.261 1.711) 5.721======================= Grid point 185 (95/116) =======================q-point: ( 0.25 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.870 ( 8.738 7.783 8.861) 14.678 1.932 ( 14.148 4.942 -0.174) 14.987 2.126 ( 5.983 6.337 -8.719) 12.328 2.406 ( 13.105 3.779 -9.721) 16.748 2.756 ( -1.564 0.389 17.478) 17.552 2.879 ( 4.603 2.446 3.351) 6.196 2.904 ( 4.292 -3.620 3.752) 6.753 3.021 ( -6.180 -0.046 2.908) 6.830 3.120 ( 1.130 0.960 -2.281) 2.721 3.270 ( 2.883 -0.342 10.569) 10.961 3.502 ( 4.154 -3.186 -5.920) 7.903 3.586 ( 4.573 -3.212 4.217) 7.001 3.673 ( 7.258 0.641 4.653) 8.645 3.833 ( 2.819 5.043 3.359) 6.683 3.855 ( 0.748 -0.568 -1.252) 1.565 3.870 ( -1.037 1.731 -3.847) 4.344 4.361 ( -1.783 -0.308 -7.511) 7.726 4.397 ( -0.461 -0.089 -4.024) 4.052 4.484 ( -3.684 -2.410 2.834) 5.235 4.712 ( 7.293 6.440 -4.342) 10.655 4.798 ( -0.157 -5.123 0.248) 5.132 4.959 ( 4.974 2.697 0.417) 5.673 5.538 ( 5.895 -0.151 -1.502) 6.086 5.619 ( 6.969 -0.411 -6.170) 9.317 5.892 ( -1.245 -3.723 1.059) 4.066 5.957 ( -1.652 -2.116 -0.737) 2.784 6.090 ( -3.317 -1.390 0.504) 3.631 6.172 ( -3.549 -0.082 -1.496) 3.852 6.425 ( 5.589 4.232 0.086) 7.011 6.567 ( -3.088 -1.879 -0.113) 3.617 6.811 ( 6.354 6.189 -4.733) 10.054 6.934 ( -2.254 0.159 -3.756) 4.384 7.257 ( 0.252 -4.412 6.285) 7.683 7.423 ( 0.963 0.311 0.912) 1.362 7.936 ( 2.737 -13.900 1.927) 14.297 7.994 ( 2.516 -11.550 -1.124) 11.874 8.303 ( 0.953 -0.512 -5.047) 5.162 8.312 ( -0.801 1.441 2.784) 3.236 8.614 ( 3.578 6.870 2.859) 8.257 8.690 ( 2.772 8.500 -4.355) 9.945 9.755 ( 3.513 4.223 5.810) 7.996 9.833 ( 7.957 9.252 -8.218) 14.712 9.908 ( 2.012 5.892 10.209) 11.957 10.074 ( 2.736 8.690 -3.573) 9.786 10.596 ( -2.226 -1.663 -0.902) 2.922 10.680 ( -0.046 0.610 -0.695) 0.926 11.058 ( -5.951 -0.389 2.469) 6.454 11.199 ( -6.345 -0.159 -1.075) 6.437 12.327 ( -3.130 -2.703 6.921) 8.063 12.586 ( 0.953 -2.285 -5.966) 6.459 12.788 ( 0.990 -4.575 1.191) 4.830 12.818 ( -4.826 -1.188 4.504) 6.707 13.120 ( -11.404 -0.509 -3.263) 11.873 13.423 ( -3.447 4.421 4.176) 6.990 13.472 ( -6.901 -6.748 -1.557) 9.777 13.747 ( -3.669 3.427 0.322) 5.031 14.043 ( -4.646 1.545 0.798) 4.960 14.331 ( 0.274 2.303 -3.688) 4.357 14.795 ( 12.377 -3.921 -0.293) 12.987 15.120 ( 7.003 -11.240 -5.261) 14.250 19.015 ( -2.130 6.461 -2.205) 7.152 19.153 ( -7.180 8.427 4.230) 11.851 20.021 ( 2.070 -1.411 -2.112) 3.276 20.523 ( -9.283 -8.655 1.530) 12.784 21.555 ( 2.194 2.715 -7.754) 8.503 21.607 ( -3.594 7.293 4.140) 9.124 22.361 ( 26.977 -3.528 -11.195) 29.420 22.744 ( 14.914 -7.136 13.203) 21.158 23.779 ( -2.142 3.238 -0.978) 4.004 23.888 ( -0.649 -1.387 -1.377) 2.059 24.202 ( 2.007 2.144 4.513) 5.384 24.559 ( 2.153 0.497 1.844) 2.878======================= Grid point 186 (96/116) =======================q-point: ( 0.38 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.953 ( -2.355 10.040 10.260) 14.547 2.091 ( 5.979 4.348 -11.712) 13.850 2.236 ( 4.596 4.517 -0.142) 6.446 2.447 ( -2.346 2.572 -7.915) 8.647 2.811 ( 1.214 0.187 17.259) 17.303 2.885 ( -4.526 3.656 4.664) 7.457 3.004 ( 5.823 1.281 0.288) 5.969 3.071 ( 4.153 -5.984 3.104) 7.918 3.154 ( 5.821 -3.068 0.018) 6.580 3.346 ( 1.098 -1.027 5.916) 6.104 3.558 ( 1.349 -2.655 1.197) 3.209 3.642 ( -0.129 -4.009 -1.940) 4.456 3.803 ( 4.661 -1.811 3.997) 6.402 3.866 ( 2.874 2.088 7.953) 8.710 3.937 ( 6.848 -1.584 -6.446) 9.537 4.032 ( 11.984 4.963 -2.680) 13.245 4.269 ( -3.981 -0.064 -5.715) 6.965 4.360 ( -1.786 4.310 1.811) 5.005 4.511 ( 3.729 -1.954 0.035) 4.210 4.743 ( -1.804 -2.207 -3.705) 4.674 4.855 ( 5.511 2.091 -1.472) 6.075 5.023 ( 1.191 2.565 -2.427) 3.726 5.616 ( 2.374 0.145 -1.682) 2.913 5.702 ( 0.846 -0.333 -3.661) 3.772 5.847 ( -0.871 -3.935 -1.742) 4.390 5.913 ( -3.095 -1.275 1.194) 3.554 6.097 ( 4.255 0.099 -1.414) 4.485 6.128 ( 0.068 0.557 2.416) 2.480 6.464 ( -4.236 0.849 0.441) 4.343 6.485 ( -2.761 3.147 -3.243) 5.296 6.863 ( -2.840 -0.761 -0.701) 3.022 6.875 ( 1.939 3.656 -3.532) 5.441 7.304 ( 2.457 -1.647 4.514) 5.397 7.444 ( 0.612 0.913 -1.404) 1.783 7.945 ( -1.150 -11.155 3.570) 11.769 8.026 ( 0.686 -9.331 -1.452) 9.468 8.302 ( 0.069 -3.196 0.533) 3.241 8.333 ( 1.698 -1.041 -2.184) 2.956 8.680 ( 3.047 6.781 -0.317) 7.441 8.728 ( 1.811 7.532 -3.172) 8.371 9.833 ( 2.039 5.129 8.144) 9.838 9.970 ( 3.784 5.162 3.773) 7.429 10.008 ( 8.760 8.114 -3.997) 12.592 10.089 ( -0.340 7.332 -3.079) 7.959 10.564 ( 0.185 -0.232 -1.805) 1.829 10.677 ( -0.673 0.158 -0.543) 0.879 10.958 ( -4.876 -0.685 2.432) 5.492 11.054 ( -7.087 1.723 -1.499) 7.446 12.298 ( -2.094 -3.945 8.377) 9.493 12.546 ( -1.929 -6.410 -8.410) 10.749 12.731 ( -5.022 -0.216 6.361) 8.107 12.834 ( 0.193 -1.417 -1.729) 2.243 12.966 ( -0.397 0.824 0.400) 0.998 13.279 ( -6.999 2.960 -2.016) 7.862 13.489 ( 2.907 -3.605 2.404) 5.218 13.682 ( -4.270 2.163 1.078) 4.906 14.007 ( 0.299 2.358 4.615) 5.191 14.297 ( -1.963 3.700 -6.564) 7.787 14.984 ( 7.053 -5.733 0.673) 9.114 15.168 ( 0.312 -8.013 -4.125) 9.018 18.997 ( 1.098 4.028 -3.540) 5.474 19.028 ( -6.448 4.841 4.948) 9.460 20.096 ( 5.736 -5.145 -2.285) 8.037 20.334 ( -10.083 -8.192 3.550) 13.468 21.542 ( -2.893 7.592 4.421) 9.249 21.600 ( 3.050 6.938 -8.121) 11.108 22.840 ( 24.459 -5.469 -13.381) 28.411 22.964 ( 2.406 -9.019 15.503) 18.096 23.744 ( -0.150 3.610 -2.588) 4.444 23.851 ( -3.023 -2.018 -1.092) 3.795 24.301 ( 6.295 2.187 3.937) 7.740 24.564 ( -1.698 1.825 -0.311) 2.512======================= Grid point 187 (97/116) =======================q-point: (-0.50 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.890 ( -6.361 9.628 12.479) 16.997 2.130 ( 0.747 6.755 -7.696) 10.267 2.278 ( 0.289 5.418 3.337) 6.370 2.364 ( -4.228 3.122 -3.811) 6.492 2.870 ( 0.985 -1.161 8.484) 8.620 2.891 ( 3.823 0.457 4.147) 5.659 3.037 ( -2.279 -2.043 2.057) 3.688 3.145 ( 4.704 0.933 -6.003) 7.683 3.287 ( 4.408 -6.292 3.235) 8.335 3.352 ( 0.067 -4.643 -2.280) 5.173 3.541 ( -3.554 -3.019 6.186) 7.746 3.646 ( 2.055 0.431 -3.013) 3.672 3.827 ( -6.473 1.259 8.518) 10.772 3.914 ( -0.277 -1.657 3.758) 4.116 4.041 ( 5.209 -2.990 -4.432) 7.464 4.113 ( -1.905 -1.595 -7.119) 7.540 4.290 ( -3.038 4.011 1.588) 5.276 4.307 ( 3.918 3.809 -0.141) 5.466 4.593 ( 3.035 1.691 3.722) 5.092 4.671 ( -5.143 -2.130 -4.348) 7.063 4.943 ( 3.279 0.611 -1.115) 3.517 4.994 ( -1.409 2.344 -5.598) 6.231 5.622 ( -3.845 1.569 2.509) 4.852 5.633 ( -3.040 0.314 1.890) 3.593 5.824 ( -1.299 -1.280 0.842) 2.008 5.926 ( 4.358 -2.208 -6.492) 8.125 6.166 ( 0.219 -2.079 0.946) 2.294 6.208 ( 5.954 -1.537 -3.435) 7.043 6.352 ( -2.977 4.639 2.837) 6.199 6.436 ( -0.279 4.688 -4.617) 6.586 6.837 ( -0.473 -0.835 1.556) 1.828 6.882 ( -0.317 1.114 -2.587) 2.834 7.359 ( 1.419 0.921 4.086) 4.422 7.430 ( -0.766 -0.026 -2.954) 3.052 7.947 ( 0.235 -12.158 4.178) 12.858 8.021 ( -0.141 -7.745 -2.611) 8.174 8.295 ( -1.574 -4.063 1.869) 4.741 8.355 ( 1.436 -1.343 -2.710) 3.348 8.724 ( 0.156 6.262 -2.427) 6.718 8.733 ( 0.951 7.370 -2.193) 7.748 9.859 ( -3.354 7.814 11.939) 14.658 9.982 ( -2.947 3.059 4.374) 6.097 10.070 ( 0.669 6.610 -4.216) 7.869 10.171 ( 8.382 7.177 -10.850) 15.476 10.598 ( -1.746 -0.433 0.855) 1.992 10.628 ( 0.486 1.022 -2.058) 2.349 10.915 ( 0.815 0.146 2.948) 3.062 10.968 ( -0.698 1.974 -2.060) 2.938 12.297 ( -0.719 -4.570 10.014) 11.031 12.492 ( -0.694 -6.925 -8.494) 10.981 12.684 ( -1.464 0.267 7.316) 7.466 12.801 ( -0.036 -0.730 -3.902) 3.970 13.067 ( 6.464 1.583 3.934) 7.731 13.140 ( -6.705 0.537 -2.883) 7.319 13.564 ( 2.947 -0.558 3.138) 4.341 13.593 ( -3.821 -0.219 0.234) 3.834 14.064 ( 3.221 3.103 6.778) 8.121 14.228 ( -2.633 4.342 -8.310) 9.738 15.061 ( -0.759 -8.112 3.190) 8.750 15.147 ( 0.260 -4.525 -5.043) 6.781 18.941 ( -3.708 3.828 4.835) 7.196 19.041 ( 4.401 2.995 -4.719) 7.114 20.132 ( -7.389 -7.804 6.855) 12.747 20.251 ( 6.251 -7.191 -4.332) 10.467 21.496 ( -3.225 7.528 5.298) 9.754 21.642 ( 3.556 9.300 -8.624) 13.172 22.892 ( -13.067 -7.701 14.506) 20.988 23.209 ( 16.433 -7.643 -15.184) 23.643 23.753 ( -4.197 -0.586 0.864) 4.325 23.779 ( 1.435 1.129 -1.889) 2.627 24.430 ( 2.878 0.905 3.539) 4.650 24.517 ( 0.232 3.271 -4.847) 5.852======================= Grid point 188 (98/116) =======================q-point: (-0.38 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.800 ( -6.762 9.913 14.397) 18.742 2.091 ( -3.441 5.128 0.873) 6.237 2.253 ( -6.125 5.295 2.942) 8.614 2.289 ( -0.896 6.431 0.069) 6.493 2.933 ( 3.515 -2.546 -1.846) 4.716 2.957 ( -1.354 -0.094 3.303) 3.571 3.021 ( 3.244 0.220 3.550) 4.814 3.164 ( -0.468 -0.747 -9.875) 9.914 3.230 ( -9.927 -4.102 -4.687) 11.719 3.367 ( -1.739 -6.131 3.201) 7.132 3.505 ( -2.799 -4.039 4.879) 6.925 3.625 ( -4.680 2.714 3.939) 6.692 3.746 ( 0.618 1.779 3.096) 3.624 3.839 ( -7.520 -1.316 4.850) 9.044 3.995 ( -6.482 -1.654 -5.773) 8.836 4.127 ( 1.170 -1.828 -6.499) 6.852 4.161 ( -5.044 2.413 2.896) 6.297 4.399 ( 3.305 5.420 -1.997) 6.655 4.523 ( -6.611 -3.847 -2.797) 8.145 4.638 ( 0.051 3.651 5.303) 6.439 4.912 ( -2.639 -0.393 -5.669) 6.266 5.009 ( 0.679 1.903 -0.997) 2.253 5.543 ( -3.579 1.097 3.544) 5.155 5.570 ( -6.081 0.103 8.155) 10.173 5.862 ( 4.843 -2.960 -2.529) 6.214 5.983 ( 2.764 -0.026 -4.863) 5.594 6.088 ( -4.323 -1.691 -1.411) 4.852 6.253 ( 0.942 -1.873 -7.570) 7.855 6.402 ( 3.554 4.117 4.327) 6.950 6.501 ( 5.659 2.700 -2.510) 6.754 6.832 ( -0.846 1.186 0.247) 1.478 6.852 ( -1.732 0.556 0.480) 1.882 7.355 ( -2.096 0.613 1.826) 2.847 7.439 ( 2.273 -1.368 -2.767) 3.833 7.960 ( -1.024 -14.566 4.599) 15.309 8.012 ( -0.297 -9.727 -2.665) 10.090 8.255 ( -2.554 -1.715 1.805) 3.567 8.374 ( 1.329 0.459 -3.118) 3.420 8.691 ( -1.637 7.015 -1.910) 7.453 8.734 ( -0.830 7.040 -2.916) 7.665 9.769 ( -7.933 8.279 10.494) 15.543 9.925 ( -3.715 2.527 0.531) 4.524 10.081 ( 0.911 7.599 -3.325) 8.344 10.209 ( -1.967 6.453 -10.668) 12.622 10.539 ( 0.496 0.851 0.329) 1.039 10.676 ( 1.159 0.105 -0.430) 1.240 10.995 ( 5.135 -0.215 0.299) 5.148 11.025 ( 7.129 1.313 -0.045) 7.249 12.328 ( 0.635 -4.925 10.571) 11.679 12.477 ( 1.465 -6.018 -6.852) 9.237 12.728 ( 3.753 -0.946 7.900) 8.797 12.822 ( 2.610 -1.300 -2.173) 3.637 13.001 ( -5.367 -0.160 -2.502) 5.924 13.216 ( 7.502 2.452 3.702) 8.717 13.498 ( -4.298 -1.359 1.605) 4.785 13.666 ( 4.864 1.416 2.239) 5.539 14.130 ( -0.289 2.573 -1.964) 3.250 14.180 ( 1.979 4.208 -0.184) 4.654 14.977 ( -7.505 -6.701 1.424) 10.162 15.143 ( -1.074 -5.726 -1.958) 6.146 18.918 ( 0.154 5.201 3.706) 6.388 19.134 ( 6.249 3.778 -4.645) 8.654 20.009 ( -5.846 -4.460 5.506) 9.186 20.389 ( 7.368 -8.998 -1.226) 11.694 21.454 ( -2.307 5.236 4.487) 7.272 21.684 ( 3.224 10.251 -7.829) 13.295 22.583 ( -21.181 -5.272 10.599) 24.265 23.321 ( -2.861 -11.551 -17.301) 20.998 23.683 ( 0.524 3.350 2.881) 4.449 23.831 ( 2.185 -0.580 0.725) 2.374 24.373 ( -4.679 2.516 -2.402) 5.831 24.597 ( 4.923 0.253 -3.916) 6.295======================= Grid point 189 (99/116) =======================q-point: (-0.25 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.707 ( -7.562 9.719 14.556) 19.066 1.970 ( -11.252 4.105 2.119) 12.164 2.100 ( -11.591 8.240 5.082) 15.102 2.262 ( -2.034 6.373 -2.779) 7.244 2.791 ( -15.800 1.290 6.241) 17.036 2.928 ( -8.722 -5.422 0.208) 10.272 3.043 ( -4.484 -0.556 0.196) 4.522 3.086 ( 8.485 0.050 -4.621) 9.662 3.180 ( 3.284 1.203 -6.529) 7.407 3.298 ( -6.571 -5.014 8.697) 11.998 3.415 ( -4.542 -0.520 -2.324) 5.129 3.582 ( -3.370 -1.659 3.345) 5.030 3.687 ( -5.819 1.914 2.808) 6.739 3.802 ( 2.551 1.336 -0.937) 3.029 3.854 ( -4.881 1.123 -3.715) 6.236 4.101 ( 4.216 -0.169 -9.329) 10.239 4.171 ( 0.588 1.879 7.762) 8.008 4.342 ( -6.736 -2.630 -1.482) 7.381 4.537 ( 5.311 -0.795 -1.154) 5.493 4.627 ( -1.919 6.475 2.878) 7.341 4.853 ( -1.341 -4.138 -4.353) 6.154 4.988 ( -2.053 1.201 -2.666) 3.573 5.469 ( -6.326 0.969 7.787) 10.079 5.485 ( -3.919 0.100 3.573) 5.304 5.949 ( -1.091 -2.030 -1.251) 2.622 5.954 ( 2.693 -1.584 -5.357) 6.202 6.103 ( 3.547 0.274 0.032) 3.558 6.232 ( -0.942 -3.814 -5.585) 6.828 6.427 ( -1.833 3.703 -0.038) 4.132 6.567 ( 1.945 0.307 0.292) 1.991 6.770 ( -5.151 2.012 -1.031) 5.626 6.861 ( 1.018 2.657 2.872) 4.042 7.330 ( -0.459 -1.602 1.023) 1.956 7.474 ( 2.127 -3.081 -5.129) 6.350 7.912 ( -5.167 -14.832 5.091) 16.511 7.971 ( -3.853 -14.674 -0.284) 15.174 8.232 ( 0.130 1.462 1.087) 1.826 8.388 ( 1.234 2.200 -3.915) 4.658 8.649 ( -2.959 6.802 -1.062) 7.494 8.699 ( -1.056 8.355 -4.290) 9.451 9.657 ( -5.651 8.611 7.689) 12.853 9.845 ( -4.007 2.702 -1.248) 4.991 10.051 ( -3.906 9.082 -2.321) 10.155 10.110 ( -3.187 6.319 -8.617) 11.151 10.586 ( 2.928 0.503 -0.290) 2.985 10.682 ( 0.231 0.331 -0.743) 0.846 11.103 ( 6.150 -1.116 -1.875) 6.525 11.173 ( 6.363 0.127 1.399) 6.516 12.372 ( 0.872 -4.173 7.492) 8.620 12.506 ( 2.586 -3.303 -3.244) 5.303 12.801 ( -0.352 -5.410 0.486) 5.443 12.868 ( 1.753 -1.507 0.181) 2.319 13.023 ( 10.638 0.204 5.803) 12.120 13.377 ( 4.871 -4.495 6.606) 9.358 13.476 ( 5.855 3.402 -0.670) 6.805 13.752 ( 2.881 2.688 0.342) 3.955 14.100 ( 0.722 3.346 -4.908) 5.984 14.249 ( 2.650 1.996 3.918) 5.134 14.785 ( -12.724 -4.982 0.723) 13.683 15.061 ( -7.633 -7.116 0.037) 10.435 18.970 ( 4.323 8.676 1.945) 9.886 19.234 ( 4.479 6.585 -3.088) 8.542 19.967 ( 1.054 -1.874 3.024) 3.711 20.495 ( 2.140 -7.768 3.715) 8.873 21.449 ( 1.337 1.481 2.220) 2.985 21.724 ( 3.206 9.294 -6.620) 11.853 22.188 ( -20.615 -3.602 5.850) 21.729 23.035 ( -19.590 -8.722 -13.825) 25.514 23.759 ( 4.527 2.391 0.197) 5.124 23.857 ( 0.169 -1.238 1.629) 2.053 24.291 ( -2.213 1.868 -3.745) 4.734 24.626 ( -1.047 -1.267 -4.975) 5.239======================= Grid point 190 (100/116) =======================q-point: (-0.12 0.14 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.542 ( -16.078 6.452 11.299) 20.684 1.659 ( -17.203 7.709 -1.701) 18.928 1.855 ( -11.365 12.134 11.533) 20.234 2.198 ( -1.139 8.461 -13.722) 16.161 2.615 ( -4.362 3.357 20.618) 21.340 2.815 ( -3.194 -5.578 -0.490) 6.447 2.931 ( -8.365 -2.834 1.213) 8.915 3.119 ( -4.527 -2.374 -5.757) 7.699 3.193 ( -4.745 -3.145 7.318) 9.272 3.238 ( 5.707 -0.466 -4.141) 7.066 3.395 ( 0.837 1.390 2.983) 3.395 3.547 ( 0.526 3.491 -7.894) 8.648 3.659 ( 3.479 1.491 0.662) 3.843 3.773 ( -2.777 1.969 0.793) 3.495 3.939 ( 11.260 -0.280 1.306) 11.339 4.131 ( -5.381 -1.987 -5.054) 7.645 4.185 ( 0.785 -2.653 -0.742) 2.864 4.300 ( 5.199 3.736 7.378) 9.768 4.501 ( -6.401 8.720 2.767) 11.165 4.673 ( 1.917 -2.720 -4.086) 5.269 4.837 ( 1.559 -4.989 -6.377) 8.245 4.910 ( -4.862 -2.386 -4.108) 6.797 5.384 ( -4.064 2.162 6.128) 7.664 5.430 ( -1.719 -0.092 1.590) 2.343 5.907 ( -0.210 1.579 -2.943) 3.347 5.985 ( -1.451 -1.072 -2.875) 3.394 6.122 ( -0.540 -1.334 1.281) 1.927 6.211 ( -0.816 -3.679 -1.110) 3.929 6.409 ( 2.181 1.116 -2.722) 3.662 6.574 ( -4.240 3.173 4.194) 6.756 6.678 ( 0.450 -0.972 -3.980) 4.122 6.849 ( -4.071 2.767 2.845) 5.686 7.342 ( 0.885 -2.945 1.594) 3.464 7.470 ( -1.327 -5.322 -5.573) 7.819 7.826 ( -4.006 -13.711 4.552) 14.992 7.884 ( -4.035 -14.937 0.879) 15.497 8.260 ( 2.159 1.377 0.703) 2.655 8.396 ( 0.380 2.099 -3.552) 4.143 8.569 ( -4.664 7.899 0.848) 9.212 8.668 ( -0.728 8.557 -6.388) 10.703 9.605 ( -1.834 9.129 6.046) 11.102 9.779 ( -2.012 5.719 -2.728) 6.648 9.943 ( -5.824 8.866 0.602) 10.625 10.044 ( -1.352 6.053 -8.013) 10.133 10.632 ( 1.639 -0.157 0.456) 1.709 10.685 ( 0.263 0.142 -1.329) 1.362 11.209 ( 4.727 -1.526 -1.249) 5.122 11.257 ( 1.957 -0.318 1.213) 2.325 12.400 ( 0.138 -1.723 5.643) 5.902 12.530 ( 0.532 -0.201 -3.446) 3.493 12.800 ( 1.157 -5.759 1.290) 6.014 12.883 ( -0.042 -2.302 0.425) 2.341 13.258 ( 5.867 -1.859 3.646) 7.153 13.508 ( 8.111 -10.367 1.821) 13.288 13.715 ( 15.615 0.114 2.313) 15.786 13.821 ( 9.177 2.794 1.908) 9.781 14.155 ( 4.991 3.875 -1.129) 6.419 14.295 ( 1.943 0.338 1.859) 2.711 14.490 ( -17.770 -2.461 1.294) 17.986 14.835 ( -15.577 -6.867 -0.253) 17.025 19.086 ( 6.952 13.148 -0.364) 14.877 19.261 ( -1.398 10.054 -0.420) 10.160 20.095 ( 11.994 -1.370 -1.192) 12.131 20.454 ( -8.356 -3.897 7.854) 12.112 21.542 ( 8.086 -3.012 -0.818) 8.667 21.784 ( 5.202 6.895 -3.867) 9.463 21.869 ( -12.474 -2.684 1.155) 12.811 22.534 ( -27.403 -4.746 -8.961) 29.219 23.827 ( 2.265 1.477 -0.231) 2.714 23.854 ( -0.437 -0.680 1.270) 1.506 24.281 ( 2.305 0.460 -2.687) 3.570 24.527 ( -7.422 -1.111 -3.438) 8.254======================= Grid point 191 (101/116) =======================q-point: ( 0.00 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.533 ( -3.587 14.478 9.770) 17.830 1.731 ( 3.212 11.758 -8.829) 15.050 2.096 ( -1.053 13.991 14.025) 19.839 2.373 ( -0.602 7.103 -11.510) 13.538 2.595 ( 0.408 -8.071 2.533) 8.469 2.659 ( 0.648 -9.050 -3.285) 9.649 2.770 ( -0.742 3.635 21.021) 21.346 3.042 ( -0.071 -0.166 -5.417) 5.420 3.144 ( -1.943 3.840 11.090) 11.895 3.352 ( 4.679 2.740 -7.506) 9.259 3.419 ( -0.465 2.878 4.423) 5.297 3.551 ( -3.331 -0.330 -6.881) 7.652 3.721 ( -8.981 1.612 5.474) 10.640 3.815 ( 7.134 1.530 -0.677) 7.328 3.931 ( -5.726 -2.644 6.955) 9.389 4.131 ( 1.693 -3.385 -8.797) 9.577 4.321 ( 16.091 3.442 1.714) 16.544 4.410 ( -14.563 4.990 -5.648) 16.397 4.531 ( 3.100 -2.005 3.841) 5.328 4.630 ( 5.439 -0.472 -1.402) 5.636 4.651 ( -2.396 -6.214 -1.352) 6.795 4.766 ( -1.203 -2.709 -9.568) 10.016 5.406 ( -1.026 1.460 1.701) 2.465 5.431 ( 3.095 -0.948 -0.478) 3.272 5.899 ( -3.687 -1.805 4.448) 6.053 6.014 ( 0.675 -3.025 -3.965) 5.032 6.107 ( 4.081 5.413 -0.887) 6.837 6.162 ( -0.469 2.478 -4.214) 4.910 6.466 ( -4.365 2.083 3.346) 5.881 6.531 ( 4.169 2.301 -2.037) 5.179 6.760 ( -3.767 -0.560 -0.437) 3.833 6.771 ( 5.358 -1.638 -1.163) 5.722 7.232 ( -4.788 -3.474 5.848) 8.318 7.347 ( 2.732 -2.853 -4.693) 6.134 7.507 ( -1.455 -12.102 5.393) 13.329 7.626 ( 3.609 -10.320 -5.350) 12.171 8.348 ( 1.356 2.852 1.696) 3.584 8.404 ( -2.187 1.885 -3.459) 4.505 8.626 ( -2.054 3.080 4.817) 6.075 8.737 ( 1.107 0.421 -5.535) 5.661 9.839 ( -0.749 9.609 7.787) 12.391 9.948 ( 0.562 8.272 0.499) 8.306 10.084 ( -3.732 12.212 -0.849) 12.798 10.170 ( 2.671 8.094 -6.293) 10.595 10.653 ( -0.509 1.695 -0.403) 1.815 10.683 ( 0.177 0.477 -2.981) 3.024 11.205 ( -1.254 -2.575 2.870) 4.055 11.248 ( 0.951 -3.179 -1.291) 3.560 12.415 ( -1.116 0.690 5.336) 5.495 12.519 ( 1.268 -0.834 -4.485) 4.735 12.712 ( -0.476 -5.057 5.887) 7.775 12.788 ( 0.656 -5.166 -1.060) 5.314 13.268 ( 1.271 -2.764 6.597) 7.264 13.392 ( -0.976 -5.382 -4.157) 6.870 13.855 ( 5.789 -7.076 8.523) 12.498 13.982 ( -3.460 -6.412 -3.256) 7.980 14.206 ( -7.652 2.892 3.137) 8.761 14.261 ( 4.730 2.489 -0.877) 5.416 14.369 ( -0.559 -0.076 1.623) 1.718 14.488 ( 2.638 -3.013 -8.388) 9.295 19.461 ( -6.034 14.001 5.342) 16.155 19.593 ( 5.872 17.095 -7.352) 19.513 20.164 ( -6.828 -4.113 8.022) 11.309 20.354 ( 10.644 -4.044 -9.611) 14.900 21.601 ( -3.303 -2.903 0.760) 4.462 21.639 ( 6.013 -3.722 -2.954) 7.664 22.010 ( 0.663 1.330 0.598) 1.602 22.028 ( -7.693 0.850 -1.004) 7.804 23.846 ( -0.346 1.179 2.641) 2.913 23.885 ( 0.711 0.449 -1.159) 1.432 24.345 ( 0.521 -0.369 0.296) 0.704 24.357 ( -2.325 -0.444 -0.811) 2.502======================= Grid point 192 (102/116) =======================q-point: ( 0.12 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.688 ( 13.981 11.204 7.871) 19.570 1.939 ( 17.188 11.277 -5.607) 21.308 2.164 ( 4.835 12.331 10.364) 16.818 2.333 ( 1.261 1.802 -8.480) 8.760 2.659 ( 6.688 -3.276 -0.522) 7.465 2.762 ( 6.143 -8.806 -1.522) 10.845 2.821 ( -1.235 4.441 21.178) 21.674 3.030 ( 2.111 2.652 -4.884) 5.945 3.167 ( 0.629 2.102 2.920) 3.653 3.371 ( -5.539 3.222 4.379) 7.761 3.418 ( 1.829 2.466 -3.995) 5.038 3.482 ( -1.443 -2.678 -1.173) 3.260 3.604 ( -1.451 1.363 5.677) 6.016 3.843 ( -4.769 -4.523 8.261) 10.556 3.901 ( 0.106 2.820 -0.394) 2.850 4.066 ( -7.276 5.761 -5.090) 10.585 4.227 ( 4.365 -3.860 -8.966) 10.693 4.475 ( -4.957 -3.803 0.380) 6.259 4.527 ( -1.961 -0.887 -2.106) 3.011 4.680 ( 4.426 0.151 -2.012) 4.864 4.734 ( 5.985 2.809 -5.782) 8.783 4.829 ( 10.291 -0.478 0.463) 10.313 5.434 ( 3.963 0.631 -0.231) 4.020 5.513 ( 5.116 -1.070 -2.863) 5.960 5.832 ( -3.746 -3.189 4.676) 6.787 5.988 ( -2.702 0.430 -2.749) 3.878 6.071 ( -1.549 -3.823 1.107) 4.271 6.209 ( -1.599 -0.018 -6.068) 6.275 6.427 ( 4.124 5.704 1.986) 7.314 6.599 ( -4.040 -0.757 0.229) 4.116 6.761 ( 10.769 3.363 -5.177) 12.413 6.920 ( 5.878 -0.568 -1.487) 6.089 7.179 ( -2.089 -2.094 6.323) 6.981 7.380 ( 1.047 -1.817 -0.750) 2.228 7.548 ( 4.900 -11.908 1.339) 12.946 7.694 ( 4.734 -10.418 -6.089) 12.962 8.349 ( -1.906 1.967 -2.390) 3.635 8.363 ( -0.725 1.971 2.195) 3.038 8.644 ( 2.064 2.994 5.273) 6.406 8.764 ( 2.768 1.297 -4.262) 5.245 9.847 ( -0.321 8.312 6.635) 10.641 9.976 ( 1.993 7.146 2.342) 7.780 10.042 ( -0.041 12.268 -0.844) 12.297 10.233 ( 4.991 10.322 -4.932) 12.481 10.614 ( -2.897 0.208 -0.077) 2.905 10.690 ( 0.704 0.842 -1.844) 2.146 11.145 ( -4.953 -1.740 1.875) 5.575 11.241 ( -1.766 -3.448 -0.465) 3.902 12.358 ( -4.902 -0.340 3.718) 6.161 12.535 ( -0.125 -3.085 -3.551) 4.706 12.687 ( -0.897 -3.545 2.502) 4.431 12.813 ( 0.422 -3.172 1.284) 3.448 13.288 ( -4.941 -4.632 1.057) 6.855 13.295 ( -3.299 -3.353 -0.277) 4.712 13.747 ( -10.119 0.109 0.744) 10.147 13.886 ( -6.865 -0.332 -0.278) 6.879 14.188 ( -3.955 0.737 0.445) 4.048 14.264 ( 4.275 -3.663 4.899) 7.463 14.494 ( 10.758 0.332 -0.901) 10.801 14.667 ( 12.735 -7.922 -6.615) 16.392 19.327 ( -8.132 12.363 3.391) 15.181 19.563 ( -7.645 13.440 -2.092) 15.603 20.042 ( -4.607 -0.384 0.374) 4.638 20.446 ( -1.428 -8.799 -5.808) 10.639 21.563 ( 2.622 1.440 -4.677) 5.552 21.816 ( 1.442 2.158 2.190) 3.396 21.878 ( 10.055 -0.532 -3.030) 10.515 22.261 ( 14.410 -5.601 6.413) 16.737 23.845 ( -0.543 1.349 1.950) 2.432 23.893 ( 0.442 0.407 -1.730) 1.831 24.262 ( -2.533 2.789 1.524) 4.064 24.455 ( 5.522 -1.861 0.965) 5.906======================= Grid point 193 (103/116) =======================q-point: ( 0.25 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.982 ( 12.466 5.402 4.308) 14.253 2.192 ( 7.144 15.629 1.947) 17.294 2.274 ( 4.185 6.314 -1.728) 7.770 2.480 ( 13.978 2.434 -6.963) 15.805 2.758 ( -0.400 -5.949 2.637) 6.519 2.833 ( -1.628 6.220 17.640) 18.775 2.867 ( 7.812 -4.564 1.150) 9.120 3.082 ( -0.736 2.811 -0.076) 2.907 3.161 ( -0.486 2.556 -4.012) 4.782 3.252 ( -3.794 -0.829 7.790) 8.704 3.433 ( 2.026 -4.668 -7.065) 8.707 3.516 ( 2.953 -2.497 6.207) 7.313 3.682 ( 3.857 1.066 3.839) 5.545 3.807 ( 0.861 -0.855 8.230) 8.319 3.878 ( 1.381 2.052 -1.298) 2.793 4.038 ( 4.659 8.330 -8.277) 12.633 4.324 ( 5.809 -4.215 -6.504) 9.686 4.374 ( -4.892 -4.325 -4.695) 8.042 4.449 ( -2.751 0.807 0.614) 2.932 4.683 ( -0.263 -4.618 -1.032) 4.739 4.874 ( 6.465 8.114 -2.166) 10.598 5.017 ( 7.463 3.248 -1.107) 8.214 5.534 ( 5.565 -0.218 -1.426) 5.748 5.606 ( 5.823 -1.204 -4.659) 7.554 5.793 ( -1.967 -3.741 3.274) 5.346 5.931 ( -2.965 -1.185 1.765) 3.648 6.047 ( -0.923 -2.698 -0.072) 2.852 6.137 ( -1.972 -3.956 -2.441) 5.050 6.507 ( -1.292 1.926 1.788) 2.929 6.553 ( 2.680 2.763 -3.029) 4.898 6.891 ( 1.253 0.451 -3.417) 3.668 6.971 ( 1.028 3.017 -3.214) 4.527 7.201 ( 2.570 -0.419 5.154) 5.774 7.405 ( 2.182 -1.741 -0.830) 2.912 7.665 ( 5.469 -10.401 0.505) 11.762 7.761 ( 3.719 -9.652 -5.504) 11.717 8.316 ( -0.878 1.611 -1.917) 2.653 8.346 ( -1.400 1.668 2.312) 3.176 8.717 ( 3.462 3.056 3.905) 6.047 8.806 ( 2.390 2.288 -2.665) 4.248 9.883 ( 2.435 7.283 5.934) 9.705 10.035 ( 2.513 6.449 6.499) 9.494 10.086 ( 5.252 11.370 -3.227) 12.934 10.304 ( 2.695 11.720 -4.359) 12.792 10.556 ( -2.481 -2.196 0.435) 3.342 10.693 ( 0.132 1.111 -1.886) 2.193 11.042 ( -5.765 -1.240 1.522) 6.090 11.179 ( -4.255 -2.068 -0.569) 4.765 12.275 ( -4.379 -1.738 3.592) 5.924 12.472 ( -4.069 -7.229 -4.837) 9.603 12.721 ( 2.554 -1.760 0.628) 3.165 12.803 ( -1.483 -0.664 3.509) 3.867 13.098 ( -9.634 -1.290 -2.949) 10.157 13.283 ( -0.670 -7.348 0.839) 7.426 13.587 ( -6.984 7.407 1.323) 10.266 13.795 ( -3.299 1.286 1.267) 3.761 14.086 ( -3.894 2.448 3.052) 5.520 14.373 ( 3.754 0.542 -2.120) 4.345 14.680 ( 7.889 -6.184 2.883) 10.431 14.866 ( 9.044 -10.431 -6.794) 15.387 19.190 ( -6.000 9.325 0.275) 11.092 19.353 ( -12.040 8.908 1.987) 15.109 19.983 ( -1.668 -1.776 -1.809) 3.034 20.311 ( -9.507 -10.412 -0.223) 14.101 21.647 ( 7.007 6.019 -7.794) 12.087 21.792 ( -1.692 9.503 6.247) 11.498 22.248 ( 24.005 -6.922 -10.534) 27.113 22.547 ( 11.182 -10.759 10.851) 18.934 23.834 ( -1.051 1.433 0.917) 2.000 23.884 ( -0.853 1.203 -2.460) 2.868 24.272 ( 2.570 4.273 3.489) 6.085 24.547 ( 3.382 -1.857 0.473) 3.887======================= Grid point 194 (104/116) =======================q-point: ( 0.38 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.167 ( 4.338 5.673 0.187) 7.144 2.255 ( 1.399 14.396 7.197) 16.156 2.367 ( 5.398 6.191 -3.283) 8.846 2.533 ( -4.572 5.261 -6.704) 9.671 2.814 ( 0.170 -1.756 12.621) 12.744 2.914 ( 7.346 -3.688 8.693) 11.964 2.957 ( -1.461 1.245 -1.105) 2.215 3.015 ( -0.142 0.009 0.426) 0.449 3.151 ( 0.335 1.442 0.079) 1.483 3.266 ( -0.341 -6.215 1.036) 6.310 3.476 ( 4.434 -5.042 -3.083) 7.389 3.582 ( 1.222 -1.687 5.081) 5.492 3.731 ( 2.386 -2.084 5.518) 6.363 3.918 ( 4.148 1.984 5.571) 7.224 3.955 ( 6.214 2.959 -5.365) 8.726 4.131 ( 4.592 3.611 -8.415) 10.244 4.260 ( -1.580 -1.451 -6.259) 6.617 4.347 ( -3.125 -7.989 1.385) 8.689 4.515 ( 7.889 4.291 -0.891) 9.024 4.684 ( 0.423 -1.895 -0.018) 1.942 4.968 ( 3.699 7.605 -1.048) 8.522 5.091 ( 1.141 4.259 -3.142) 5.414 5.620 ( 3.331 -0.075 -1.363) 3.600 5.694 ( 3.144 -1.415 -3.767) 5.106 5.763 ( -0.836 -2.424 0.807) 2.688 5.872 ( -3.031 -2.142 2.328) 4.381 6.082 ( 4.363 -1.755 -2.452) 5.304 6.119 ( -0.107 -3.282 1.386) 3.564 6.465 ( -2.301 1.388 2.242) 3.499 6.580 ( -0.289 4.402 -2.927) 5.294 6.832 ( -3.969 -1.338 0.496) 4.217 6.952 ( -1.886 1.967 -4.752) 5.478 7.286 ( 4.292 0.059 3.606) 5.606 7.442 ( 1.410 -1.114 -2.723) 3.263 7.720 ( -0.395 -8.490 3.330) 9.129 7.808 ( 2.719 -9.177 -6.115) 11.358 8.298 ( -1.025 1.658 1.794) 2.649 8.337 ( 0.585 0.762 -1.914) 2.142 8.782 ( 2.258 3.202 2.129) 4.459 8.838 ( 1.366 2.732 -1.590) 3.443 9.971 ( 4.293 7.422 7.090) 11.126 10.098 ( 0.845 6.222 10.255) 12.025 10.210 ( 7.573 9.305 -6.245) 13.526 10.286 ( -1.992 10.059 -5.154) 11.477 10.547 ( 1.637 -1.723 -0.859) 2.527 10.677 ( -1.609 -0.082 -2.335) 2.837 10.949 ( -3.657 0.175 2.567) 4.472 11.087 ( -4.462 0.895 -1.981) 4.963 12.219 ( -2.589 -2.828 4.736) 6.094 12.384 ( -2.879 -7.684 -6.146) 10.252 12.719 ( -2.707 -0.897 3.822) 4.769 12.804 ( -0.771 -1.824 -1.482) 2.474 12.991 ( 0.959 1.667 0.616) 2.019 13.245 ( -4.394 -5.241 0.289) 6.846 13.514 ( -0.082 4.891 0.864) 4.967 13.707 ( -6.126 0.166 0.584) 6.156 14.086 ( 1.774 5.188 7.204) 9.053 14.394 ( 0.057 4.763 -6.681) 8.205 14.806 ( 3.652 -10.318 5.318) 12.169 14.972 ( 4.240 -9.378 -7.382) 12.666 19.110 ( -1.868 6.150 -1.819) 6.680 19.156 ( -8.384 6.415 2.852) 10.935 19.968 ( 0.487 -6.062 0.063) 6.082 20.130 ( -8.286 -10.023 0.885) 13.035 21.750 ( 1.261 11.368 1.881) 11.591 21.791 ( 3.531 10.474 -3.908) 11.724 22.664 ( 19.944 -10.764 -11.097) 25.235 22.718 ( 3.197 -13.301 10.695) 17.364 23.811 ( -1.456 1.793 0.758) 2.431 23.850 ( -1.531 2.539 -2.761) 4.051 24.363 ( 5.015 3.467 4.384) 7.509 24.580 ( 0.171 -0.732 -1.620) 1.786======================= Grid point 195 (105/116) =======================q-point: (-0.50 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.148 ( -5.154 13.300 10.077) 17.464 2.292 ( -2.282 7.571 1.700) 8.088 2.440 ( 1.105 8.052 -4.386) 9.235 2.453 ( 1.307 5.843 -1.796) 6.251 2.845 ( -0.159 -0.860 8.239) 8.285 2.898 ( 0.700 0.099 2.613) 2.707 3.000 ( -1.272 -1.767 3.481) 4.106 3.124 ( 6.933 -4.120 -3.489) 8.787 3.151 ( 0.352 -4.462 1.319) 4.666 3.220 ( -2.511 -6.828 -3.602) 8.118 3.498 ( -4.974 -0.497 7.762) 9.232 3.650 ( 6.790 -0.253 -4.714) 8.270 3.796 ( 0.527 -2.665 8.618) 9.036 3.922 ( -5.152 1.945 6.328) 8.389 4.022 ( 1.308 0.317 -9.290) 9.387 4.103 ( -0.698 0.326 -9.502) 9.534 4.282 ( -3.877 -4.472 2.291) 6.346 4.314 ( 4.252 -3.743 -1.637) 5.896 4.641 ( 3.695 2.561 0.528) 4.526 4.670 ( -2.402 2.436 -2.155) 4.043 5.000 ( -1.016 5.418 2.114) 5.904 5.080 ( 0.448 5.615 -5.304) 7.737 5.635 ( -3.111 -0.221 3.454) 4.653 5.665 ( -3.358 1.423 0.546) 3.688 5.781 ( 0.319 -1.929 0.947) 2.172 5.867 ( 4.170 -2.673 -5.460) 7.372 6.113 ( -1.768 -3.583 0.985) 4.115 6.172 ( 4.924 -3.027 -4.485) 7.317 6.455 ( 0.766 5.211 4.123) 6.689 6.538 ( -1.645 5.015 -3.715) 6.455 6.810 ( 1.301 -1.714 3.140) 3.807 6.890 ( -2.627 -0.847 -4.248) 5.066 7.367 ( 2.653 -0.365 2.738) 3.830 7.431 ( -1.564 -0.159 -3.777) 4.091 7.701 ( -2.206 -9.061 5.715) 10.938 7.820 ( 0.320 -8.889 -5.594) 10.507 8.285 ( -0.970 1.944 2.323) 3.181 8.360 ( 2.653 0.814 -4.317) 5.132 8.817 ( 0.616 2.775 1.210) 3.089 8.841 ( -0.496 2.986 -1.022) 3.195 10.060 ( 0.871 9.264 10.822) 14.272 10.085 ( -5.586 6.848 9.619) 13.062 10.220 ( 0.580 7.175 -6.058) 9.408 10.351 ( 6.615 7.862 -11.868) 15.698 10.574 ( -3.346 -2.069 2.016) 4.420 10.629 ( 1.837 -1.386 -3.496) 4.185 10.946 ( 2.448 2.851 2.888) 4.739 11.014 ( -1.614 2.189 -3.476) 4.414 12.202 ( -0.875 -3.618 6.440) 7.438 12.331 ( -0.702 -7.251 -5.862) 9.350 12.689 ( -1.263 0.080 5.522) 5.665 12.772 ( -0.548 -2.067 -2.486) 3.279 13.091 ( 5.854 0.428 2.673) 6.449 13.128 ( -5.872 -1.358 -0.862) 6.088 13.570 ( 3.726 0.894 1.979) 4.313 13.588 ( -4.803 -0.039 0.162) 4.806 14.160 ( 2.780 5.942 8.646) 10.853 14.350 ( -1.801 6.776 -9.182) 11.553 14.849 ( -1.051 -11.054 6.470) 12.851 15.000 ( 1.137 -8.799 -7.906) 11.883 19.049 ( -2.913 5.951 3.382) 7.439 19.124 ( 3.721 4.360 -3.747) 6.848 19.955 ( -4.406 -7.852 6.291) 10.983 20.061 ( 3.317 -9.643 -3.760) 10.869 21.708 ( -4.940 11.797 6.994) 14.577 21.882 ( 5.688 12.580 -9.605) 16.818 22.669 ( -9.961 -12.372 12.633) 20.294 22.960 ( 11.895 -14.869 -14.898) 24.177 23.779 ( -2.127 2.902 2.555) 4.413 23.830 ( 0.443 3.012 -2.470) 3.921 24.460 ( 2.215 1.613 4.556) 5.317 24.558 ( -0.284 0.427 -4.848) 4.875======================= Grid point 196 (106/116) =======================q-point: (-0.38 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.062 ( -6.386 13.248 10.190) 17.892 2.223 ( -5.040 6.836 5.793) 10.281 2.401 ( -3.704 8.623 2.860) 9.811 2.480 ( 0.235 10.145 -6.138) 11.860 2.863 ( -0.586 -3.416 2.328) 4.175 2.935 ( -2.448 -4.567 4.310) 6.739 3.005 ( 1.422 -1.237 2.555) 3.175 3.085 ( -0.623 -3.163 -4.555) 5.581 3.208 ( -1.677 -4.860 -2.524) 5.728 3.218 ( 1.921 -4.679 0.376) 5.071 3.392 ( -4.807 -2.285 2.672) 5.955 3.703 ( -5.101 2.790 0.145) 5.816 3.770 ( -2.410 1.422 5.711) 6.360 3.851 ( -1.116 2.222 4.122) 4.814 3.978 ( -2.942 0.427 -6.959) 7.567 4.081 ( 0.830 -2.396 -5.459) 6.019 4.194 ( -5.192 -0.420 1.390) 5.391 4.374 ( 1.919 -7.796 -1.906) 8.252 4.537 ( -7.569 5.099 -2.704) 9.519 4.692 ( 0.907 0.425 -0.309) 1.049 4.952 ( -3.939 5.050 0.129) 6.406 5.069 ( -1.732 4.093 -0.998) 4.555 5.552 ( -5.053 -0.148 4.932) 7.063 5.590 ( -5.112 0.752 4.177) 6.644 5.817 ( 3.681 -0.722 -3.290) 4.990 5.947 ( 4.565 -2.784 -4.156) 6.772 6.051 ( -3.534 -1.785 -0.435) 3.983 6.216 ( 0.807 -3.444 -6.660) 7.541 6.480 ( 0.855 2.393 2.467) 3.542 6.545 ( 1.153 3.063 -0.929) 3.402 6.851 ( 0.093 -0.493 -0.615) 0.793 6.869 ( 2.763 1.252 2.213) 3.755 7.369 ( -3.128 0.665 -3.356) 4.636 7.401 ( 0.314 -2.062 0.563) 2.160 7.672 ( -3.020 -10.923 6.668) 13.149 7.787 ( -2.630 -9.539 -3.243) 10.413 8.278 ( -0.071 3.003 0.660) 3.075 8.404 ( 2.955 1.437 -5.017) 5.997 8.803 ( -1.827 3.397 0.625) 3.907 8.825 ( -1.081 2.128 -0.869) 2.540 9.973 ( -6.992 9.249 7.611) 13.870 10.048 ( -4.332 9.050 6.529) 11.970 10.248 ( 2.477 7.380 -3.852) 8.686 10.356 ( -3.615 6.040 -8.747) 11.228 10.535 ( 2.382 -1.505 -1.498) 3.191 10.679 ( 2.032 -0.136 -1.851) 2.752 10.998 ( 2.592 0.662 -1.134) 2.905 11.056 ( 5.769 1.420 -0.067) 5.942 12.223 ( 1.067 -4.108 7.246) 8.397 12.329 ( 2.130 -6.917 -3.855) 8.200 12.704 ( 0.480 -1.191 6.176) 6.308 12.776 ( 1.197 -2.910 -0.185) 3.152 13.013 ( -3.320 1.392 -1.195) 3.793 13.219 ( 4.337 -2.644 2.615) 5.712 13.513 ( -0.763 3.176 0.828) 3.370 13.686 ( 5.955 0.131 2.322) 6.393 14.214 ( -0.270 5.223 2.958) 6.009 14.297 ( -0.219 6.528 -5.164) 8.326 14.802 ( -5.596 -9.034 5.955) 12.182 14.969 ( -2.294 -10.091 -7.210) 12.612 19.063 ( 3.640 7.966 2.052) 8.995 19.232 ( 8.297 4.829 -3.790) 10.321 19.901 ( -2.082 -4.843 5.557) 7.659 20.165 ( 7.023 -11.104 -1.600) 13.236 21.616 ( -6.163 9.619 5.900) 12.857 21.939 ( 2.923 12.706 -9.283) 16.005 22.421 ( -18.046 -9.289 10.030) 22.640 23.011 ( -2.542 -16.544 -14.920) 22.423 23.772 ( 0.949 4.486 3.185) 5.583 23.840 ( 0.722 1.436 -0.637) 1.729 24.428 ( -4.264 2.432 -1.039) 5.018 24.582 ( 2.011 -1.776 -2.477) 3.652======================= Grid point 197 (107/116) =======================q-point: (-0.25 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.963 ( -7.358 13.135 8.278) 17.181 2.106 ( -9.662 8.437 3.618) 13.327 2.280 ( -10.635 8.516 6.041) 14.904 2.449 ( -1.089 9.385 -7.353) 11.972 2.776 ( -8.701 -6.625 3.512) 11.486 2.801 ( -8.147 -2.961 2.223) 8.949 2.983 ( -7.545 -4.835 9.239) 12.871 3.120 ( 0.102 0.059 -0.997) 1.004 3.167 ( 3.539 -2.497 -5.604) 7.082 3.247 ( -0.672 1.332 1.457) 2.086 3.357 ( 0.925 -1.214 0.276) 1.551 3.595 ( -2.637 2.594 2.040) 4.224 3.739 ( -2.204 3.637 1.343) 4.460 3.847 ( -0.282 2.367 -0.609) 2.460 3.891 ( -3.119 1.480 -1.661) 3.831 4.078 ( 1.831 -1.862 -11.282) 11.581 4.189 ( 2.670 -0.474 5.859) 6.456 4.298 ( -6.316 -2.415 -0.650) 6.793 4.496 ( 2.910 -2.387 -2.036) 4.279 4.694 ( -0.221 -3.795 -1.533) 4.099 4.848 ( -6.407 6.606 -0.083) 9.204 5.006 ( -4.697 1.317 -0.268) 4.885 5.478 ( -3.973 -0.084 4.713) 6.164 5.501 ( -5.104 0.967 3.682) 6.367 5.883 ( 3.563 -1.518 -3.879) 5.481 5.962 ( -0.817 0.071 -3.375) 3.474 6.070 ( 5.345 -2.248 -1.775) 6.064 6.170 ( -3.333 -3.526 -4.486) 6.607 6.496 ( -2.042 1.981 2.279) 3.645 6.537 ( 1.045 -1.570 -0.521) 1.957 6.837 ( -3.760 3.749 1.007) 5.405 6.921 ( 1.420 2.373 1.656) 3.223 7.303 ( -2.020 -0.480 -3.134) 3.759 7.396 ( -0.811 -3.820 -0.969) 4.024 7.612 ( -4.942 -12.289 6.240) 14.642 7.699 ( -5.356 -10.381 -0.813) 11.709 8.288 ( 0.894 3.743 0.079) 3.849 8.436 ( 1.739 1.850 -5.110) 5.706 8.759 ( -3.277 3.254 1.552) 4.872 8.792 ( -1.545 1.316 -2.963) 3.591 9.879 ( -4.573 10.015 6.222) 12.646 9.978 ( -3.407 10.040 3.182) 11.070 10.231 ( -3.364 3.777 -6.513) 8.247 10.266 ( -2.571 10.015 -1.749) 10.487 10.592 ( 3.243 -0.052 -3.703) 4.922 10.699 ( 0.954 1.296 -2.309) 2.815 11.071 ( 4.965 -1.716 -1.274) 5.406 11.162 ( 4.434 -1.432 0.960) 4.758 12.285 ( 3.368 -3.344 4.901) 6.823 12.397 ( 5.286 -6.048 0.017) 8.032 12.699 ( -2.350 -3.452 3.141) 5.226 12.812 ( 1.036 -3.914 2.895) 4.977 13.037 ( 6.441 1.280 2.303) 6.959 13.256 ( -0.456 -5.510 3.154) 6.365 13.594 ( 8.118 6.233 0.401) 10.243 13.794 ( 3.891 1.073 1.479) 4.298 14.184 ( -0.021 4.377 -5.375) 6.932 14.308 ( 0.091 3.311 2.761) 4.312 14.667 ( -10.008 -5.648 5.001) 12.532 14.858 ( -7.278 -10.987 -6.305) 14.610 19.198 ( 9.669 11.705 -0.619) 15.195 19.401 ( 9.055 8.048 -2.190) 12.311 19.918 ( 2.720 -2.199 4.273) 5.522 20.292 ( 5.168 -10.640 1.303) 11.900 21.524 ( -4.046 5.546 3.823) 7.858 21.946 ( 0.585 10.024 -8.143) 12.928 22.076 ( -18.529 -5.721 6.082) 20.323 22.794 ( -14.832 -13.079 -12.369) 23.324 23.820 ( 2.581 2.814 1.889) 4.260 23.847 ( -0.039 0.665 1.017) 1.216 24.341 ( -3.452 2.703 -2.750) 5.176 24.576 ( -2.241 -3.440 -2.396) 4.753======================= Grid point 198 (108/116) =======================q-point: (-0.12 0.29 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.750 ( -17.176 12.376 8.427) 22.786 1.867 ( -12.165 11.247 -5.652) 17.505 2.118 ( -5.859 11.146 11.048) 16.752 2.406 ( -0.116 9.029 -10.976) 14.212 2.635 ( -6.403 -5.788 3.128) 9.181 2.702 ( -2.338 -3.963 8.086) 9.304 2.835 ( -10.849 -3.135 9.502) 14.759 3.052 ( -1.900 -4.839 1.684) 5.465 3.195 ( -4.072 5.397 2.226) 7.118 3.271 ( 5.457 3.257 -4.198) 7.617 3.398 ( 1.300 0.279 3.942) 4.160 3.619 ( 1.177 2.364 -7.175) 7.646 3.691 ( 1.760 1.769 -0.837) 2.632 3.835 ( -3.611 2.495 1.813) 4.749 3.954 ( 8.117 2.638 6.016) 10.442 4.083 ( 1.378 -3.069 -9.423) 10.005 4.139 ( -2.084 -1.920 -3.673) 4.639 4.365 ( 8.060 0.930 6.437) 10.357 4.560 ( 3.757 -4.705 -1.871) 6.305 4.677 ( -3.064 -1.110 -1.812) 3.729 4.704 ( -7.381 -0.309 -2.253) 7.724 4.877 ( -7.245 -0.612 -4.463) 8.531 5.419 ( -2.284 -0.017 1.421) 2.690 5.439 ( -2.621 1.507 3.874) 4.914 5.919 ( 0.757 -1.045 1.022) 1.646 5.977 ( 3.869 1.719 -7.345) 8.478 6.076 ( -3.345 -2.828 0.858) 4.464 6.174 ( 3.239 0.107 -1.827) 3.720 6.442 ( -1.630 2.021 0.390) 2.626 6.609 ( 5.510 -1.833 1.093) 5.908 6.690 ( -9.967 3.990 -0.206) 10.738 6.896 ( -4.785 1.069 0.699) 4.953 7.281 ( -0.408 -2.135 -0.139) 2.178 7.355 ( -2.720 -4.427 -1.954) 5.551 7.544 ( -3.496 -12.182 5.728) 13.908 7.611 ( -1.948 -10.700 -2.051) 11.068 8.313 ( 1.609 3.579 0.594) 3.969 8.439 ( -0.121 1.889 -4.281) 4.681 8.686 ( -4.551 3.102 2.935) 6.240 8.754 ( -0.978 0.386 -5.010) 5.120 9.837 ( -1.712 10.084 6.773) 12.268 9.946 ( -0.756 10.257 1.387) 10.378 10.159 ( -2.403 6.336 -3.172) 7.482 10.191 ( -3.528 9.944 -4.995) 11.674 10.635 ( 2.131 0.851 -2.258) 3.219 10.699 ( -0.244 1.511 -2.761) 3.157 11.163 ( 4.180 -2.759 0.024) 5.008 11.227 ( 1.860 -2.790 0.969) 3.491 12.368 ( 3.510 -0.979 3.414) 4.993 12.499 ( 3.560 -2.832 -0.202) 4.553 12.674 ( 0.180 -4.816 2.986) 5.670 12.810 ( -1.598 -4.638 1.806) 5.227 13.214 ( 5.011 -2.011 3.994) 6.717 13.294 ( 6.885 -7.982 5.198) 11.753 13.741 ( 4.109 2.149 -0.727) 4.694 13.880 ( 8.101 2.055 0.998) 8.417 14.221 ( 3.325 1.986 -3.032) 4.918 14.299 ( -0.441 -0.066 1.725) 1.782 14.452 ( -12.959 -0.858 3.892) 13.558 14.656 ( -11.003 -8.586 -6.096) 15.230 19.407 ( 11.374 15.337 -3.751) 19.459 19.517 ( 2.054 12.846 1.405) 13.085 20.053 ( 10.389 -2.528 1.102) 10.749 20.333 ( -2.162 -7.341 3.226) 8.305 21.512 ( 2.791 0.343 0.605) 2.877 21.779 ( -12.052 -5.233 2.051) 13.298 21.941 ( 1.271 7.406 -5.377) 9.240 22.406 ( -20.792 -6.794 -7.400) 23.092 23.846 ( -0.365 0.509 2.014) 2.109 23.866 ( 1.556 1.400 0.372) 2.126 24.301 ( 0.407 1.474 -1.909) 2.446 24.484 ( -6.101 -2.869 -1.925) 7.012======================= Grid point 199 (109/116) =======================q-point: ( 0.00 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.841 ( -2.678 13.096 5.465) 14.441 1.953 ( 1.237 5.820 -5.058) 7.809 2.344 ( 1.168 7.872 7.615) 11.015 2.354 ( -5.492 -3.043 2.658) 6.818 2.441 ( 0.930 -9.709 -2.452) 10.057 2.486 ( 2.080 -4.276 -1.625) 5.025 2.872 ( 1.785 5.638 11.096) 12.574 2.985 ( 2.908 -4.538 3.446) 6.397 3.321 ( -5.295 10.250 5.792) 12.909 3.436 ( 2.663 3.226 -1.438) 4.423 3.479 ( 1.803 1.457 -0.674) 2.414 3.511 ( -3.202 -3.393 -5.102) 6.914 3.755 ( -8.380 1.722 6.500) 10.744 3.804 ( -3.012 -2.364 5.200) 6.458 3.924 ( 1.158 2.390 -3.578) 4.456 4.019 ( 3.844 -6.044 -8.210) 10.895 4.374 ( 0.840 1.318 2.943) 3.332 4.429 ( -1.700 -4.767 2.657) 5.716 4.487 ( 5.274 2.957 -4.346) 7.447 4.561 ( 7.918 -3.193 -6.752) 10.885 4.660 ( 0.916 3.451 -0.194) 3.576 4.730 ( -4.819 -2.181 -6.860) 8.663 5.406 ( 0.980 -0.456 0.077) 1.084 5.414 ( 0.447 -0.842 -0.532) 1.091 5.876 ( -4.126 0.605 4.161) 5.891 5.927 ( -1.701 -3.794 0.229) 4.164 6.233 ( 1.221 3.935 -4.371) 6.007 6.240 ( 2.284 3.007 -4.495) 5.870 6.548 ( 0.870 5.975 3.137) 6.804 6.604 ( 0.201 4.511 -2.000) 4.938 6.689 ( 8.684 -5.777 0.602) 10.448 6.707 ( -6.921 -4.538 -1.125) 8.352 7.207 ( -3.421 1.266 5.351) 6.476 7.291 ( -0.510 -6.151 2.826) 6.788 7.340 ( 2.086 0.937 -2.585) 3.452 7.435 ( 3.560 -7.234 -6.035) 10.072 8.413 ( -0.048 2.629 0.920) 2.786 8.436 ( -1.813 0.606 -1.223) 2.269 8.666 ( -1.147 1.405 1.800) 2.556 8.707 ( 0.599 -2.334 -2.060) 3.170 9.994 ( -1.268 5.231 7.280) 9.054 10.050 ( -1.518 0.607 3.223) 3.613 10.274 ( -0.628 5.545 -1.850) 5.879 10.311 ( 1.903 2.849 -4.883) 5.965 10.726 ( 0.001 3.810 -2.782) 4.717 10.728 ( 0.368 3.230 -2.939) 4.383 11.138 ( -0.453 -2.647 1.956) 3.323 11.158 ( -0.024 -4.314 0.040) 4.314 12.443 ( -0.884 1.992 2.316) 3.180 12.488 ( 0.290 -1.967 -1.900) 2.750 12.644 ( 0.628 -0.913 5.305) 5.419 12.681 ( 1.429 -4.148 1.998) 4.821 13.242 ( 1.071 0.449 4.828) 4.966 13.287 ( 1.737 -3.799 1.524) 4.446 13.785 ( -0.112 0.227 1.530) 1.550 13.848 ( -4.031 -5.316 -3.519) 7.543 14.262 ( -4.297 2.171 3.539) 5.975 14.289 ( -1.232 -0.135 2.592) 2.873 14.390 ( 3.043 1.883 -3.385) 4.926 14.435 ( 3.352 -2.226 -6.092) 7.301 19.734 ( -6.348 10.955 7.612) 14.773 19.854 ( -0.210 3.662 -0.455) 3.696 20.100 ( 1.364 1.442 -0.828) 2.151 20.234 ( 7.770 -7.253 -9.967) 14.571 21.561 ( 0.221 -0.668 -0.668) 0.970 21.576 ( 3.532 -2.019 -2.073) 4.566 22.032 ( -3.062 0.680 0.209) 3.144 22.038 ( -3.887 0.087 -0.389) 3.908 23.873 ( 0.073 1.157 1.848) 2.182 23.888 ( 0.186 -0.241 0.369) 0.479 24.339 ( 0.703 -0.064 -0.162) 0.725 24.345 ( -1.471 -0.544 -0.699) 1.717======================= Grid point 200 (110/116) =======================q-point: ( 0.12 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.939 ( 8.668 11.789 6.390) 15.967 2.122 ( 14.412 -0.161 -1.575) 14.499 2.293 ( 1.011 2.855 -0.301) 3.044 2.395 ( 4.791 4.656 5.646) 8.747 2.548 ( 8.599 -5.317 -0.711) 10.135 2.606 ( 7.513 -5.159 -0.351) 9.120 2.952 ( 2.929 6.117 7.590) 10.179 3.052 ( 3.553 -2.320 -4.659) 6.302 3.233 ( -5.445 5.900 6.549) 10.362 3.365 ( -6.770 -4.548 3.377) 8.828 3.478 ( -0.992 2.108 -2.503) 3.420 3.484 ( -5.670 1.912 1.917) 6.283 3.660 ( 1.190 3.536 5.393) 6.558 3.742 ( -1.867 -4.420 6.857) 8.369 3.964 ( 0.154 4.268 -1.459) 4.513 4.085 ( 4.093 -5.701 -4.324) 8.243 4.224 ( -4.487 4.907 -5.609) 8.699 4.346 ( -4.536 -6.753 -1.016) 8.199 4.532 ( -1.919 2.611 -5.592) 6.463 4.624 ( -2.218 -4.910 -7.509) 9.242 4.812 ( 15.186 4.231 -1.059) 15.800 4.859 ( 12.795 0.524 -1.643) 12.911 5.445 ( 3.778 0.534 -1.231) 4.009 5.472 ( 4.722 -2.106 -1.478) 5.377 5.809 ( -3.878 1.723 6.187) 7.502 5.900 ( -1.800 -6.135 4.401) 7.762 6.105 ( -7.688 4.721 -3.695) 9.749 6.188 ( -7.291 -2.413 -4.054) 8.684 6.545 ( 3.531 4.082 -2.520) 5.957 6.588 ( -2.348 -0.601 -2.278) 3.326 6.811 ( 10.416 2.622 -1.348) 10.825 6.884 ( 8.532 -3.157 0.125) 9.098 7.192 ( 0.306 3.327 4.938) 5.962 7.307 ( 0.397 -6.745 4.134) 7.921 7.408 ( 6.769 1.036 -5.622) 8.860 7.504 ( 5.602 -7.157 -7.577) 11.832 8.391 ( -2.199 1.589 -0.076) 2.715 8.400 ( -1.600 0.959 2.342) 2.994 8.691 ( 2.740 2.123 2.272) 4.145 8.743 ( 3.174 -2.400 -1.049) 4.115 9.996 ( -0.340 5.356 6.740) 8.616 10.055 ( 0.681 0.284 5.603) 5.652 10.263 ( 0.766 7.733 -2.555) 8.180 10.361 ( 3.961 -0.300 -3.568) 5.339 10.678 ( -3.192 5.930 -2.279) 7.109 10.738 ( 0.402 1.917 -3.227) 3.775 11.097 ( -3.698 -1.554 1.330) 4.226 11.142 ( -1.729 -5.060 0.684) 5.390 12.371 ( -5.492 1.815 1.342) 5.938 12.440 ( -4.673 -4.519 -0.652) 6.533 12.674 ( 2.038 1.653 1.160) 2.869 12.737 ( 2.242 -3.805 1.304) 4.605 13.217 ( -4.533 -0.884 0.911) 4.708 13.239 ( -5.223 -2.337 -1.574) 5.934 13.772 ( -0.741 2.463 2.207) 3.389 13.844 ( -0.029 -3.608 3.036) 4.715 14.190 ( -1.567 0.187 2.426) 2.894 14.208 ( -3.914 -1.369 4.225) 5.920 14.517 ( 7.786 1.602 -3.628) 8.738 14.562 ( 8.873 -2.887 -6.220) 11.214 19.574 ( -10.858 10.163 5.585) 15.887 19.712 ( -12.281 -1.004 3.748) 12.879 20.091 ( -2.537 6.113 -5.911) 8.874 20.259 ( -3.470 -8.689 -7.030) 11.703 21.622 ( 7.851 4.113 -5.156) 10.254 21.730 ( 12.424 -5.666 -5.094) 14.574 21.989 ( 1.586 6.733 4.753) 8.392 22.131 ( 7.618 -6.536 5.592) 11.490 23.874 ( -0.403 1.351 1.027) 1.745 23.895 ( 0.319 -0.460 0.123) 0.573 24.329 ( 0.984 3.359 0.276) 3.511 24.400 ( 4.036 -3.171 0.285) 5.141======================= Grid point 201 (111/116) =======================q-point: ( 0.25 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.127 ( 8.188 8.031 5.761) 12.835 2.290 ( 4.904 -5.619 2.676) 7.923 2.491 ( 11.803 10.141 -1.900) 15.677 2.546 ( 9.258 4.350 4.514) 11.181 2.693 ( 0.869 -0.328 -1.604) 1.853 2.743 ( 10.962 -5.846 0.654) 12.441 2.997 ( -0.778 6.086 5.688) 8.366 3.076 ( -0.494 -2.481 -5.668) 6.206 3.151 ( -2.813 0.510 -1.284) 3.134 3.247 ( -6.440 -4.464 4.527) 9.050 3.377 ( -2.913 2.703 1.823) 4.372 3.457 ( -0.506 -3.614 8.540) 9.288 3.753 ( 3.585 4.564 2.640) 6.376 3.805 ( 6.028 -0.309 4.612) 7.596 3.946 ( 1.091 5.144 0.663) 5.300 4.125 ( 0.383 -10.079 -0.174) 10.088 4.197 ( 1.426 4.790 -9.709) 10.920 4.292 ( -0.388 -3.680 -8.519) 9.288 4.502 ( 1.853 3.543 -2.044) 4.491 4.590 ( 1.228 -4.460 -2.379) 5.202 5.034 ( 8.267 5.955 -2.405) 10.469 5.082 ( 9.434 1.549 -2.478) 9.876 5.531 ( 4.875 0.215 -1.774) 5.192 5.561 ( 4.547 -2.508 -2.901) 5.948 5.774 ( -1.375 2.305 5.480) 6.102 5.873 ( -2.848 -5.415 4.686) 7.706 5.997 ( -1.734 0.365 -0.436) 1.825 6.049 ( -4.255 -3.615 -2.380) 6.070 6.555 ( -1.019 2.949 -1.927) 3.667 6.600 ( 2.366 -0.192 -3.729) 4.420 6.911 ( -0.138 2.394 -0.329) 2.420 6.975 ( 0.837 -2.488 -1.342) 2.948 7.244 ( 3.253 3.983 3.449) 6.192 7.341 ( 2.568 -4.496 0.739) 5.230 7.541 ( 7.205 -0.814 -4.424) 8.493 7.599 ( 5.800 -5.518 -7.275) 10.817 8.356 ( -1.462 1.719 0.319) 2.279 8.372 ( -1.858 0.404 2.568) 3.195 8.765 ( 3.743 2.030 2.305) 4.842 8.807 ( 3.215 -1.528 -0.065) 3.560 10.034 ( 2.407 6.095 6.554) 9.268 10.107 ( 2.509 -0.134 7.856) 8.248 10.294 ( 3.117 7.957 -2.470) 8.895 10.431 ( 3.635 -3.959 -2.233) 5.821 10.590 ( -4.918 8.649 -2.504) 10.259 10.718 ( -1.568 -1.185 -4.562) 4.967 11.026 ( -3.426 1.228 1.367) 3.888 11.106 ( -1.879 -4.639 0.045) 5.006 12.268 ( -4.915 1.309 0.479) 5.109 12.335 ( -4.975 -5.008 -2.198) 7.393 12.712 ( 1.176 1.143 0.137) 1.646 12.764 ( 0.186 -2.982 0.964) 3.140 13.096 ( -5.676 1.566 -1.012) 5.974 13.161 ( -2.586 -4.353 0.142) 5.065 13.727 ( -5.480 5.295 1.214) 7.716 13.798 ( -4.483 -1.364 1.501) 4.920 14.158 ( 0.649 4.819 5.924) 7.664 14.294 ( 6.168 -7.161 6.025) 11.208 14.623 ( 4.251 1.622 -3.754) 5.898 14.704 ( 7.240 -5.493 -7.526) 11.799 19.379 ( -9.739 7.616 2.074) 12.536 19.467 ( -12.821 0.548 2.061) 12.997 19.982 ( -6.187 2.754 -2.087) 7.087 20.107 ( -9.150 -8.366 -1.841) 12.534 21.805 ( 11.870 8.480 -7.691) 16.491 21.945 ( 7.009 0.027 0.579) 7.033 22.133 ( 13.943 1.329 -2.546) 14.235 22.311 ( 7.692 -11.049 8.104) 15.714 23.866 ( -0.598 1.816 0.800) 2.072 23.896 ( -0.193 -0.559 -0.346) 0.686 24.375 ( 3.249 5.210 1.126) 6.242 24.480 ( 3.742 -4.327 -0.012) 5.720======================= Grid point 202 (112/116) =======================q-point: ( 0.38 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.293 ( 7.589 6.654 2.899) 10.501 2.416 ( 7.337 -2.939 0.055) 7.904 2.529 ( -3.842 8.520 7.928) 12.255 2.601 ( -6.311 -0.079 3.573) 7.252 2.815 ( 8.976 6.097 -1.623) 10.971 2.907 ( 3.375 -0.444 6.198) 7.071 2.973 ( 0.525 0.489 -4.965) 5.016 3.004 ( -4.283 -1.825 -0.832) 4.730 3.119 ( -1.111 -3.631 -2.509) 4.551 3.152 ( -3.994 -3.711 0.400) 5.467 3.430 ( 6.832 2.419 2.953) 7.826 3.521 ( 3.401 -4.370 8.731) 10.339 3.775 ( -0.913 5.773 3.584) 6.856 3.911 ( 1.530 -4.190 3.010) 5.381 4.029 ( 4.971 3.549 -1.666) 6.332 4.123 ( 0.298 -6.370 -2.053) 6.699 4.198 ( 1.839 1.087 -7.892) 8.176 4.235 ( -2.000 -2.176 -8.843) 9.324 4.602 ( 6.664 3.302 -0.291) 7.443 4.654 ( 4.541 -1.649 -0.336) 4.843 5.139 ( 3.247 7.000 -1.002) 7.781 5.185 ( 2.512 2.963 -2.849) 4.817 5.603 ( 2.765 -1.106 -1.232) 3.222 5.626 ( 3.173 -3.548 -2.873) 5.560 5.772 ( -0.547 2.430 2.888) 3.814 5.832 ( -1.836 -2.211 2.077) 3.546 6.016 ( 1.676 -3.028 1.671) 3.843 6.028 ( 2.284 -3.207 -1.935) 4.387 6.538 ( -0.097 4.582 0.956) 4.682 6.617 ( 0.602 -1.731 -0.854) 2.022 6.846 ( -4.850 3.206 -1.418) 5.984 6.931 ( -3.901 -3.539 -3.655) 6.411 7.316 ( 2.965 2.789 2.758) 4.917 7.390 ( 1.825 -3.629 -0.549) 4.099 7.624 ( 1.878 -0.597 -1.912) 2.746 7.667 ( 3.071 -4.270 -6.388) 8.275 8.338 ( -0.663 1.510 1.153) 2.012 8.351 ( -0.408 0.260 0.297) 0.568 8.831 ( 2.128 1.699 1.971) 3.361 8.857 ( 1.725 -0.500 0.331) 1.826 10.123 ( 4.240 6.107 7.555) 10.599 10.186 ( 2.474 0.965 9.704) 10.060 10.364 ( 4.563 5.184 -2.686) 7.410 10.445 ( -3.604 -0.063 1.178) 3.792 10.519 ( 1.099 4.335 -6.585) 7.960 10.645 ( -4.268 -4.089 -5.424) 8.022 10.993 ( -0.144 4.035 0.768) 4.110 11.073 ( -1.286 -2.481 -1.560) 3.201 12.195 ( -2.752 0.738 0.790) 2.957 12.251 ( -2.753 -4.547 -2.977) 6.093 12.711 ( -1.240 0.617 1.277) 1.884 12.751 ( -1.507 -2.792 -0.523) 3.215 13.044 ( 0.556 3.329 0.939) 3.503 13.131 ( -1.195 -4.870 1.039) 5.121 13.620 ( -4.414 4.348 0.121) 6.197 13.688 ( -6.284 -2.024 0.344) 6.611 14.232 ( 3.484 8.482 8.877) 12.762 14.413 ( 3.997 -6.036 3.658) 8.111 14.665 ( 1.331 1.158 -2.813) 3.320 14.787 ( 3.634 -7.938 -8.420) 12.129 19.232 ( -5.248 4.482 -0.284) 6.908 19.260 ( -8.250 2.323 1.011) 8.630 19.880 ( -3.602 -1.165 0.924) 3.897 19.944 ( -6.653 -6.754 0.451) 9.491 21.995 ( 6.678 10.327 -2.673) 12.585 22.016 ( 2.698 9.083 1.645) 9.617 22.423 ( 13.869 -9.819 -7.419) 18.542 22.442 ( 4.251 -11.064 5.196) 12.942 23.856 ( -0.733 2.356 1.230) 2.756 23.886 ( -0.565 0.047 -0.713) 0.911 24.446 ( 3.248 4.258 1.586) 5.585 24.532 ( 1.689 -3.528 -1.055) 4.051======================= Grid point 203 (113/116) =======================q-point: (-0.50 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.385 ( -2.253 7.663 7.358) 10.860 2.427 ( -6.619 3.911 5.691) 9.565 2.546 ( 2.886 3.572 -0.028) 4.592 2.576 ( 8.059 1.601 -2.706) 8.650 2.845 ( -3.518 1.179 6.142) 7.176 2.884 ( -4.782 -1.748 3.878) 6.401 2.976 ( 0.237 0.618 -1.968) 2.077 3.029 ( 3.617 -3.626 -3.908) 6.442 3.087 ( -2.736 -1.732 0.872) 3.354 3.104 ( -0.113 -3.304 -0.587) 3.358 3.534 ( -0.529 3.696 5.251) 6.443 3.620 ( 6.147 -3.121 -1.005) 6.966 3.790 ( 1.042 2.851 8.642) 9.160 3.899 ( -2.168 -5.227 6.057) 8.289 4.043 ( -0.918 1.990 -12.026) 12.224 4.094 ( -1.483 -1.948 -11.613) 11.868 4.204 ( -0.399 -0.786 1.588) 1.817 4.228 ( 0.936 -2.669 -1.595) 3.247 4.688 ( 1.362 1.686 -0.337) 2.193 4.708 ( 0.338 0.207 -1.825) 1.868 5.150 ( -2.120 6.949 1.888) 7.507 5.197 ( -0.085 3.438 -2.481) 4.240 5.615 ( -2.525 -0.956 2.234) 3.504 5.646 ( -1.638 -3.013 -0.540) 3.472 5.781 ( 1.630 2.070 1.147) 2.874 5.828 ( 2.404 -1.459 -2.753) 3.936 6.038 ( 0.105 -1.863 -0.068) 1.867 6.078 ( 2.742 -4.711 -3.554) 6.507 6.566 ( 1.172 4.863 3.963) 6.382 6.622 ( -0.898 1.142 -0.407) 1.509 6.782 ( 0.570 0.396 0.095) 0.700 6.840 ( -2.871 -3.519 -4.426) 6.342 7.364 ( 1.058 0.729 2.118) 2.477 7.402 ( -0.275 -2.369 -1.128) 2.638 7.613 ( -2.383 0.469 1.211) 2.714 7.676 ( -0.502 -4.876 -4.273) 6.503 8.337 ( 0.450 2.313 0.225) 2.367 8.367 ( 2.262 -0.441 -2.630) 3.497 8.857 ( 0.024 1.282 1.873) 2.269 8.871 ( -0.343 0.127 0.549) 0.660 10.202 ( -0.458 5.252 8.982) 10.415 10.236 ( -0.616 3.574 11.585) 12.139 10.366 ( -1.352 6.513 -3.262) 7.409 10.450 ( 3.456 0.626 -2.506) 4.314 10.521 ( -3.914 -1.375 -3.590) 5.486 10.567 ( 3.025 -3.952 -7.527) 9.024 11.017 ( 2.220 3.029 -0.480) 3.786 11.046 ( -0.620 0.425 -3.071) 3.161 12.164 ( -0.947 0.225 2.206) 2.411 12.210 ( -0.828 -4.004 -2.085) 4.590 12.692 ( -0.922 0.513 2.687) 2.887 12.721 ( -0.978 -2.236 -0.159) 2.446 13.092 ( 2.377 0.005 1.304) 2.711 13.101 ( -1.700 -0.922 0.441) 1.983 13.588 ( 0.805 0.553 1.118) 1.485 13.591 ( -2.582 0.168 0.769) 2.700 14.314 ( 1.968 8.399 8.965) 12.442 14.458 ( 0.220 -0.742 -1.601) 1.778 14.668 ( -0.617 -1.510 0.556) 1.723 14.799 ( 0.264 -9.474 -8.898) 13.000 19.166 ( -1.049 4.266 1.054) 4.518 19.197 ( 1.843 1.616 -1.881) 3.089 19.838 ( -1.869 -2.244 3.640) 4.666 19.883 ( 0.991 -6.130 -0.652) 6.244 21.972 ( -5.413 12.410 7.271) 15.368 22.116 ( 3.231 4.995 -4.676) 7.567 22.444 ( -3.755 -4.051 4.010) 6.826 22.628 ( 7.925 -15.255 -11.732) 20.813 23.848 ( -0.445 2.883 1.913) 3.489 23.875 ( -0.295 0.627 -0.639) 0.943 24.496 ( 1.003 1.921 1.691) 2.749 24.540 ( -0.150 -1.856 -2.377) 3.019======================= Grid point 204 (114/116) =======================q-point: (-0.38 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.296 ( -5.739 7.756 4.491) 10.643 2.353 ( -3.672 3.337 7.038) 8.611 2.610 ( 0.262 10.330 0.488) 10.345 2.654 ( -1.520 5.347 -4.146) 6.935 2.769 ( -6.935 -4.530 2.928) 8.785 2.821 ( -2.392 -6.041 6.597) 9.259 2.968 ( -3.046 -1.924 2.935) 4.647 3.003 ( -0.881 -5.240 -2.711) 5.966 3.092 ( 1.283 -1.244 0.817) 1.965 3.123 ( 3.445 -3.489 2.449) 5.481 3.497 ( -1.694 9.147 -2.148) 9.548 3.678 ( -0.489 -5.891 -3.103) 6.676 3.835 ( 0.708 4.736 7.009) 8.489 3.907 ( -0.014 1.177 7.561) 7.652 3.995 ( -0.561 0.187 -8.106) 8.127 4.012 ( -3.138 -3.259 -6.842) 8.203 4.169 ( -2.921 -0.298 -0.448) 2.970 4.220 ( -0.480 -5.234 -2.948) 6.026 4.624 ( -6.552 2.852 -2.050) 7.434 4.671 ( -3.511 -1.803 -2.058) 4.451 5.094 ( -4.102 6.601 2.826) 8.270 5.153 ( -4.369 1.960 0.574) 4.823 5.546 ( -4.186 0.082 3.237) 5.293 5.576 ( -4.470 -1.909 1.748) 5.165 5.836 ( 3.727 2.245 -2.513) 5.024 5.892 ( 4.079 -2.481 -3.407) 5.866 6.022 ( -0.887 0.253 -1.726) 1.957 6.097 ( 0.353 -6.131 -5.727) 8.397 6.540 ( -2.907 3.465 1.336) 4.716 6.591 ( -2.904 -0.205 1.269) 3.176 6.843 ( 4.537 0.453 -0.816) 4.632 6.868 ( 5.018 -1.202 1.718) 5.438 7.364 ( -1.799 -0.611 1.763) 2.592 7.375 ( -1.853 -0.804 -2.060) 2.885 7.551 ( -4.791 -0.025 3.614) 6.001 7.625 ( -3.776 -5.873 -1.888) 7.232 8.355 ( 1.473 3.647 -1.676) 4.276 8.410 ( 2.820 -1.194 -4.018) 5.052 8.844 ( -1.953 0.855 1.659) 2.701 8.850 ( -1.937 0.365 0.328) 1.998 10.150 ( -5.492 7.454 6.258) 11.175 10.224 ( -3.546 3.843 8.108) 9.647 10.344 ( -2.463 2.369 -1.772) 3.850 10.420 ( -2.531 -1.937 0.117) 3.189 10.533 ( 5.645 4.293 -7.473) 10.302 10.642 ( 4.834 -3.896 -4.021) 7.397 11.030 ( 0.501 2.276 -2.575) 3.473 11.068 ( 2.518 -0.685 -1.402) 2.962 12.175 ( 1.412 -0.243 3.621) 3.894 12.212 ( 1.802 -3.745 -0.307) 4.168 12.688 ( -0.901 0.056 3.841) 3.945 12.715 ( -0.026 -2.375 1.991) 3.099 13.060 ( -0.962 2.973 -0.447) 3.157 13.138 ( 1.101 -4.192 0.468) 4.360 13.598 ( 3.503 4.013 1.970) 5.679 13.665 ( 5.523 -2.110 2.250) 6.326 14.345 ( -1.446 6.743 5.369) 8.740 14.423 ( -2.297 2.879 -4.408) 5.744 14.643 ( -2.762 -3.217 3.518) 5.509 14.748 ( -2.763 -9.756 -8.584) 13.285 19.225 ( 6.931 6.463 0.055) 9.477 19.298 ( 9.003 0.251 -2.274) 9.289 19.846 ( 1.700 0.781 3.659) 4.109 19.950 ( 5.349 -8.386 0.237) 9.949 21.847 ( -9.225 11.779 6.439) 16.288 22.076 ( -7.350 -6.599 2.195) 10.118 22.345 ( -5.332 9.481 -4.251) 11.678 22.653 ( -1.680 -16.574 -11.852) 20.445 23.852 ( 0.229 2.620 2.092) 3.360 23.871 ( -0.095 0.772 0.133) 0.789 24.476 ( -2.860 2.240 -0.674) 3.695 24.530 ( -0.709 -2.794 -1.220) 3.130======================= Grid point 205 (115/116) =======================q-point: (-0.25 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 197Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.211 ( -4.434 9.622 0.216) 10.597 2.306 ( -3.817 6.746 4.910) 9.175 2.416 ( -16.389 3.647 0.566) 16.799 2.574 ( -9.451 -0.070 2.124) 9.687 2.651 ( -5.079 -2.853 3.258) 6.674 2.718 ( -7.152 -2.088 0.458) 7.465 2.904 ( -4.111 -1.644 9.676) 10.641 2.971 ( -4.353 -8.604 2.932) 10.079 3.195 ( 8.645 2.728 -1.207) 9.146 3.241 ( 6.786 -1.461 2.755) 7.469 3.487 ( 1.091 9.564 -5.331) 11.003 3.630 ( -1.693 -1.797 -3.215) 4.054 3.823 ( -4.162 2.866 -2.968) 5.860 3.883 ( -4.524 -1.623 -4.889) 6.856 3.916 ( 2.146 5.491 5.964) 8.386 4.048 ( 1.561 -2.535 2.890) 4.149 4.154 ( 3.439 -2.092 -0.877) 4.120 4.190 ( -2.327 -5.193 -5.292) 7.771 4.498 ( -3.914 2.581 -0.898) 4.774 4.584 ( -3.858 -5.231 -1.423) 6.653 4.994 ( -7.125 5.385 1.432) 9.045 5.041 ( -7.456 0.827 1.293) 7.613 5.480 ( -3.838 0.520 2.935) 4.859 5.502 ( -3.767 -0.988 2.017) 4.385 5.898 ( 3.198 2.635 -5.473) 6.865 5.953 ( 3.461 -1.262 -3.406) 5.017 6.033 ( 3.149 -0.926 -3.185) 4.574 6.069 ( -0.188 -4.479 -4.593) 6.418 6.508 ( -1.009 0.861 2.587) 2.907 6.532 ( -3.116 -0.645 2.757) 4.211 6.908 ( -0.075 2.615 0.146) 2.620 6.942 ( 0.965 -0.453 1.566) 1.895 7.312 ( -2.707 0.694 -0.211) 2.802 7.334 ( -1.915 -1.717 0.057) 2.573 7.447 ( -6.664 -1.805 4.146) 8.053 7.520 ( -6.313 -6.706 -1.281) 9.299 8.378 ( 1.417 4.306 -1.873) 4.905 8.445 ( 1.867 -1.433 -4.118) 4.743 8.793 ( -3.595 0.516 1.068) 3.785 8.800 ( -3.119 -0.064 -0.488) 3.157 10.062 ( -4.624 7.605 4.539) 9.991 10.161 ( -4.587 1.518 4.914) 6.892 10.283 ( -1.718 4.832 -2.485) 5.699 10.387 ( -1.922 -0.933 -0.572) 2.211 10.625 ( 5.231 4.559 -5.286) 8.723 10.711 ( 3.232 -1.519 -3.543) 5.031 11.053 ( 2.410 0.806 -1.310) 2.858 11.108 ( 1.911 -3.391 -0.240) 3.900 12.248 ( 5.071 0.034 3.158) 5.974 12.288 ( 5.807 -3.699 1.563) 7.060 12.666 ( -2.489 0.525 4.346) 5.036 12.719 ( -0.985 -4.071 4.589) 6.213 13.081 ( 3.270 2.797 0.485) 4.330 13.154 ( 0.968 -4.125 0.814) 4.315 13.715 ( 6.983 4.876 1.808) 8.707 13.788 ( 5.700 -1.811 2.055) 6.324 14.288 ( -3.573 5.256 -3.145) 7.091 14.360 ( -3.803 0.119 -0.698) 3.868 14.574 ( -5.466 -1.651 3.813) 6.866 14.646 ( -5.280 -7.777 -6.678) 11.530 19.423 ( 13.118 8.553 -1.915) 15.777 19.515 ( 13.303 0.934 -2.358) 13.542 19.915 ( 3.798 3.327 4.132) 6.524 20.068 ( 5.740 -9.874 1.571) 11.529 21.676 ( -9.152 8.556 4.434) 13.290 21.872 ( -13.082 -9.329 4.433) 16.668 22.227 ( -5.250 12.684 -8.107) 15.943 22.507 ( -9.528 -13.582 -10.280) 19.517 23.863 ( 0.129 1.413 1.243) 1.886 23.873 ( 0.113 0.724 1.613) 1.772 24.406 ( -3.566 3.487 -1.513) 5.211 24.490 ( -3.061 -4.289 -1.025) 5.368======================= Grid point 206 (116/116) =======================q-point: (-0.12 0.43 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 4.63e-04 4.63e-04 4.63e-04 4.63e-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 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 196Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.026 ( -15.616 12.133 3.263) 20.043 2.091 ( -11.376 7.838 -3.615) 14.280 2.295 ( 0.316 4.437 1.016) 4.562 2.413 ( -4.421 -9.042 4.334) 10.958 2.528 ( -7.699 -0.503 1.286) 7.822 2.591 ( -7.838 -4.434 -0.643) 9.028 2.846 ( -3.391 2.955 12.103) 12.912 2.938 ( -0.085 -5.234 7.709) 9.318 3.343 ( 5.983 4.321 -2.830) 7.904 3.359 ( 3.429 3.108 3.899) 6.051 3.457 ( -2.175 7.185 -0.840) 7.554 3.610 ( -2.235 -4.222 -5.603) 7.363 3.749 ( 1.417 4.239 -1.923) 4.866 3.842 ( -0.046 -2.350 -2.417) 3.372 4.006 ( 0.940 -2.150 -4.286) 4.886 4.011 ( -5.015 -0.006 3.689) 6.225 4.154 ( 6.920 5.090 -2.987) 9.095 4.301 ( 9.903 -6.641 2.036) 12.096 4.481 ( 1.145 -1.059 -0.393) 1.608 4.535 ( -1.573 -5.544 0.842) 5.824 4.819 ( -10.949 4.802 -1.930) 12.110 4.876 ( -8.315 -0.452 -2.950) 8.835 5.418 ( -2.577 0.482 1.347) 2.948 5.443 ( -2.736 -1.231 1.071) 3.186 5.916 ( 0.027 1.338 -2.690) 3.005 5.971 ( -1.871 -3.281 -3.022) 4.837 6.091 ( 7.541 4.838 -2.865) 9.406 6.170 ( 7.822 -1.606 -2.393) 8.336 6.487 ( -0.809 2.188 2.607) 3.498 6.546 ( 3.990 -3.358 1.886) 5.546 6.796 ( -10.636 5.048 0.411) 11.780 6.881 ( -7.542 -2.559 0.285) 7.969 7.272 ( -3.359 1.306 3.703) 5.167 7.311 ( 0.353 0.572 -2.733) 2.815 7.346 ( -4.946 -5.521 5.658) 9.325 7.416 ( -1.380 -7.586 -4.722) 9.041 8.399 ( 1.174 4.047 -0.851) 4.299 8.457 ( 0.332 -0.822 -3.001) 3.129 8.718 ( -4.083 0.605 1.314) 4.332 8.736 ( -2.673 -1.172 -1.789) 3.423 10.008 ( -2.447 6.484 5.610) 8.917 10.091 ( -3.531 0.240 3.343) 4.868 10.270 ( 0.771 6.033 -2.651) 6.635 10.338 ( -2.282 1.419 -2.957) 3.996 10.693 ( 3.067 4.407 -3.608) 6.469 10.740 ( 0.814 1.081 -3.443) 3.699 11.106 ( 2.740 -1.521 0.394) 3.159 11.143 ( 1.468 -4.273 0.650) 4.565 12.371 ( 6.056 1.389 1.464) 6.383 12.425 ( 6.653 -3.481 0.855) 7.557 12.630 ( -2.089 0.782 5.037) 5.509 12.698 ( -2.430 -5.086 5.009) 7.541 13.181 ( 5.183 -0.801 3.307) 6.200 13.193 ( 3.176 -2.098 3.088) 4.901 13.807 ( 0.278 3.857 -1.250) 4.064 13.880 ( 3.160 -2.214 -0.073) 3.860 14.250 ( 0.671 1.283 -2.363) 2.771 14.283 ( -1.562 -1.517 -0.787) 2.315 14.458 ( -6.974 1.484 1.633) 7.315 14.516 ( -6.147 -4.343 -4.010) 8.528 19.682 ( 12.191 9.549 -2.112) 15.629 19.744 ( 8.764 5.825 -0.710) 10.547 20.014 ( 6.009 0.998 2.373) 6.537 20.152 ( 2.304 -9.245 0.744) 9.556 21.556 ( -3.285 3.651 1.429) 5.115 21.658 ( -8.680 -5.694 1.809) 10.538 22.099 ( -5.192 7.457 -5.733) 10.744 22.256 ( -12.748 -7.281 -6.307) 15.979 23.866 ( -0.013 1.174 1.576) 1.965 23.882 ( 0.252 -0.074 1.341) 1.366 24.345 ( -1.846 2.738 -1.155) 3.498 24.414 ( -4.103 -3.527 -1.020) 5.506=================== 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 3/28224 10.0 852.834 1093.834 999.277 0.000 4.045 0.000 3/28224 20.0 202.939 172.148 189.773 0.000 -7.030 0.000 3/28224 30.0 77.255 62.272 71.894 0.000 -4.435 0.000 3/28224 40.0 41.447 33.039 38.957 0.000 -2.833 0.000 3/28224 50.0 26.795 21.254 25.311 0.000 -1.971 0.000 3/28224 60.0 19.314 15.298 18.289 0.000 -1.473 0.000 3/28224 70.0 14.922 11.831 14.151 0.000 -1.162 0.000 3/28224 80.0 12.087 9.608 11.474 0.000 -0.953 0.000 3/28224 90.0 10.127 8.079 9.624 0.000 -0.806 0.000 3/28224 100.0 8.704 6.972 8.279 0.000 -0.697 0.000 3/28224 110.0 7.628 6.136 7.261 0.000 -0.614 0.000 3/28224 120.0 6.791 5.485 6.468 0.000 -0.548 0.000 3/28224 130.0 6.123 4.963 5.834 0.000 -0.495 0.000 3/28224 140.0 5.579 4.537 5.315 0.000 -0.452 0.000 3/28224 150.0 5.128 4.183 4.885 0.000 -0.416 0.000 3/28224 160.0 4.749 3.883 4.521 0.000 -0.385 0.000 3/28224 170.0 4.426 3.626 4.210 0.000 -0.359 0.000 3/28224 180.0 4.148 3.404 3.941 0.000 -0.337 0.000 3/28224 190.0 3.905 3.209 3.707 0.000 -0.318 0.000 3/28224 200.0 3.692 3.037 3.500 0.000 -0.301 0.000 3/28224 210.0 3.503 2.884 3.316 0.000 -0.286 0.000 3/28224 220.0 3.335 2.747 3.152 0.000 -0.273 0.000 3/28224 230.0 3.183 2.623 3.004 0.000 -0.261 0.000 3/28224 240.0 3.047 2.511 2.870 0.000 -0.250 0.000 3/28224 250.0 2.922 2.409 2.749 0.000 -0.241 0.000 3/28224 260.0 2.809 2.315 2.637 0.000 -0.232 0.000 3/28224 270.0 2.704 2.229 2.535 0.000 -0.224 0.000 3/28224 280.0 2.608 2.149 2.441 0.000 -0.217 0.000 3/28224 290.0 2.519 2.075 2.354 0.000 -0.210 0.000 3/28224 300.0 2.436 2.007 2.274 0.000 -0.204 0.000 3/28224 310.0 2.359 1.943 2.199 0.000 -0.198 0.000 3/28224 320.0 2.287 1.883 2.128 0.000 -0.192 0.000 3/28224 330.0 2.220 1.827 2.063 0.000 -0.187 0.000 3/28224 340.0 2.157 1.774 2.001 0.000 -0.182 0.000 3/28224 350.0 2.097 1.724 1.944 0.000 -0.178 0.000 3/28224 360.0 2.041 1.677 1.889 0.000 -0.173 0.000 3/28224 370.0 1.988 1.633 1.838 0.000 -0.169 0.000 3/28224 380.0 1.937 1.591 1.789 0.000 -0.165 0.000 3/28224 390.0 1.890 1.551 1.743 0.000 -0.162 0.000 3/28224 400.0 1.844 1.513 1.700 0.000 -0.158 0.000 3/28224 410.0 1.801 1.477 1.658 0.000 -0.155 0.000 3/28224 420.0 1.760 1.443 1.619 0.000 -0.151 0.000 3/28224 430.0 1.721 1.410 1.581 0.000 -0.148 0.000 3/28224 440.0 1.683 1.379 1.546 0.000 -0.145 0.000 3/28224 450.0 1.647 1.349 1.511 0.000 -0.143 0.000 3/28224 460.0 1.613 1.321 1.479 0.000 -0.140 0.000 3/28224 470.0 1.580 1.293 1.447 0.000 -0.137 0.000 3/28224 480.0 1.548 1.267 1.417 0.000 -0.135 0.000 3/28224 490.0 1.518 1.242 1.389 0.000 -0.132 0.000 3/28224 500.0 1.489 1.218 1.361 0.000 -0.130 0.000 3/28224 510.0 1.461 1.194 1.335 0.000 -0.128 0.000 3/28224 520.0 1.434 1.172 1.309 0.000 -0.125 0.000 3/28224 530.0 1.408 1.150 1.285 0.000 -0.123 0.000 3/28224 540.0 1.383 1.130 1.261 0.000 -0.121 0.000 3/28224 550.0 1.358 1.109 1.238 0.000 -0.119 0.000 3/28224 560.0 1.335 1.090 1.216 0.000 -0.117 0.000 3/28224 570.0 1.312 1.071 1.195 0.000 -0.116 0.000 3/28224 580.0 1.291 1.053 1.175 0.000 -0.114 0.000 3/28224 590.0 1.269 1.036 1.155 0.000 -0.112 0.000 3/28224 600.0 1.249 1.019 1.136 0.000 -0.110 0.000 3/28224 610.0 1.229 1.003 1.117 0.000 -0.109 0.000 3/28224 620.0 1.210 0.987 1.100 0.000 -0.107 0.000 3/28224 630.0 1.191 0.971 1.082 0.000 -0.105 0.000 3/28224 640.0 1.173 0.957 1.066 0.000 -0.104 0.000 3/28224 650.0 1.156 0.942 1.049 0.000 -0.102 0.000 3/28224 660.0 1.139 0.928 1.034 0.000 -0.101 0.000 3/28224 670.0 1.122 0.915 1.018 0.000 -0.100 0.000 3/28224 680.0 1.106 0.901 1.003 0.000 -0.098 0.000 3/28224 690.0 1.091 0.889 0.989 0.000 -0.097 0.000 3/28224 700.0 1.076 0.876 0.975 0.000 -0.096 0.000 3/28224 710.0 1.061 0.864 0.961 0.000 -0.094 0.000 3/28224 720.0 1.047 0.852 0.948 0.000 -0.093 0.000 3/28224 730.0 1.033 0.841 0.935 0.000 -0.092 0.000 3/28224 740.0 1.019 0.830 0.923 0.000 -0.091 0.000 3/28224 750.0 1.006 0.819 0.910 0.000 -0.090 0.000 3/28224 760.0 0.993 0.808 0.899 0.000 -0.089 0.000 3/28224 770.0 0.980 0.798 0.887 0.000 -0.088 0.000 3/28224 780.0 0.968 0.788 0.876 0.000 -0.087 0.000 3/28224 790.0 0.956 0.778 0.865 0.000 -0.086 0.000 3/28224 800.0 0.945 0.768 0.854 0.000 -0.085 0.000 3/28224 810.0 0.933 0.759 0.844 0.000 -0.084 0.000 3/28224 820.0 0.922 0.750 0.833 0.000 -0.083 0.000 3/28224 830.0 0.911 0.741 0.823 0.000 -0.082 0.000 3/28224 840.0 0.901 0.732 0.814 0.000 -0.081 0.000 3/28224 850.0 0.890 0.724 0.804 0.000 -0.080 0.000 3/28224 860.0 0.880 0.715 0.795 0.000 -0.079 0.000 3/28224 870.0 0.870 0.707 0.786 0.000 -0.078 0.000 3/28224 880.0 0.860 0.699 0.777 0.000 -0.077 0.000 3/28224 890.0 0.851 0.692 0.768 0.000 -0.076 0.000 3/28224 900.0 0.842 0.684 0.760 0.000 -0.076 0.000 3/28224 910.0 0.833 0.677 0.751 0.000 -0.075 0.000 3/28224 920.0 0.824 0.669 0.743 0.000 -0.074 0.000 3/28224 930.0 0.815 0.662 0.735 0.000 -0.073 0.000 3/28224 940.0 0.807 0.655 0.728 0.000 -0.073 0.000 3/28224 950.0 0.798 0.648 0.720 0.000 -0.072 0.000 3/28224 960.0 0.790 0.642 0.713 0.000 -0.071 0.000 3/28224 970.0 0.782 0.635 0.705 0.000 -0.070 0.000 3/28224 980.0 0.774 0.629 0.698 0.000 -0.070 0.000 3/28224 990.0 0.767 0.623 0.691 0.000 -0.069 0.000 3/28224 1000.0 0.759 0.616 0.684 0.000 -0.068 0.000 3/28224Thermal conductivity related properties were written into "kappa-m877.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 11:41:23]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|