----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 23:46:03]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.542102890000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.527830790000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.230989570000000 Atomic positions (fractional): *1 Dy 0.07013782060792 0.75000000000000 0.01997138498777 162.500 2 Dy 0.57013782060792 0.75000000000000 0.48002861501223 162.500 3 Dy 0.42986217939208 0.25000000000000 0.51997138498776 162.500 4 Dy 0.92986217939208 0.25000000000000 0.98002861501224 162.500 *5 Ga 0.50000000000000 0.50000000000000 0.00000000000000 69.723 6 Ga 0.00000000000000 0.50000000000000 0.50000000000000 69.723 7 Ga 0.00000000000000 0.00000000000000 0.50000000000000 69.723 8 Ga 0.50000000000000 0.00000000000000 0.00000000000000 69.723 *9 O 0.53608712662893 0.25000000000000 0.10968940733554 15.999 *10 O 0.80436782061986 0.55593352318507 0.19372535047720 15.999 11 O 0.80436782061986 0.94406647681493 0.19372535047720 15.999 12 O 0.30436782061986 0.94406647681493 0.30627464952279 15.999 13 O 0.30436782061986 0.55593352318507 0.30627464952279 15.999 14 O 0.03608712662893 0.25000000000000 0.39031059266446 15.999 15 O 0.96391287337107 0.75000000000000 0.60968940733554 15.999 16 O 0.69563217938014 0.05593352318507 0.69372535047720 15.999 17 O 0.69563217938014 0.44406647681493 0.69372535047720 15.999 18 O 0.19563217938014 0.44406647681493 0.80627464952280 15.999 19 O 0.19563217938014 0.05593352318507 0.80627464952280 15.999 20 O 0.46391287337107 0.75000000000000 0.89031059266446 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.542102890000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.527830790000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.230989570000000 Atomic positions (fractional): *1 Dy 0.07013782060792 0.75000000000000 0.01997138498777 162.500 > 1 2 Dy 0.57013782060792 0.75000000000000 0.48002861501223 162.500 > 2 3 Dy 0.42986217939208 0.25000000000000 0.51997138498776 162.500 > 3 4 Dy 0.92986217939208 0.25000000000000 0.98002861501224 162.500 > 4 *5 Ga 0.50000000000000 0.50000000000000 0.00000000000000 69.723 > 5 6 Ga 0.00000000000000 0.50000000000000 0.50000000000000 69.723 > 6 7 Ga 0.00000000000000 0.00000000000000 0.50000000000000 69.723 > 7 8 Ga 0.50000000000000 0.00000000000000 0.00000000000000 69.723 > 8 *9 O 0.53608712662893 0.25000000000000 0.10968940733554 15.999 > 9 *10 O 0.80436782061986 0.55593352318507 0.19372535047720 15.999 > 10 11 O 0.80436782061986 0.94406647681493 0.19372535047720 15.999 > 11 12 O 0.30436782061986 0.94406647681493 0.30627464952279 15.999 > 12 13 O 0.30436782061986 0.55593352318507 0.30627464952279 15.999 > 13 14 O 0.03608712662893 0.25000000000000 0.39031059266446 15.999 > 14 15 O 0.96391287337107 0.75000000000000 0.60968940733554 15.999 > 15 16 O 0.69563217938014 0.05593352318507 0.69372535047720 15.999 > 16 17 O 0.69563217938014 0.44406647681493 0.69372535047720 15.999 > 17 18 O 0.19563217938014 0.44406647681493 0.80627464952280 15.999 > 18 19 O 0.19563217938014 0.05593352318507 0.80627464952280 15.999 > 19 20 O 0.46391287337107 0.75000000000000 0.89031059266446 15.999 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.084205780000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.527830790000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.461979140000000 Atomic positions (fractional): *1 Dy 0.03506891030396 0.75000000000000 0.00998569249388 162.500 > 1 2 Dy 0.53506891030396 0.75000000000000 0.00998569249388 162.500 > 1 3 Dy 0.03506891030396 0.75000000000000 0.50998569249388 162.500 > 1 4 Dy 0.53506891030396 0.75000000000000 0.50998569249388 162.500 > 1 5 Dy 0.28506891030396 0.75000000000000 0.24001430750612 162.500 > 2 6 Dy 0.78506891030396 0.75000000000000 0.24001430750612 162.500 > 2 7 Dy 0.28506891030396 0.75000000000000 0.74001430750612 162.500 > 2 8 Dy 0.78506891030396 0.75000000000000 0.74001430750612 162.500 > 2 9 Dy 0.21493108969604 0.25000000000000 0.25998569249388 162.500 > 3 10 Dy 0.71493108969604 0.25000000000000 0.25998569249388 162.500 > 3 11 Dy 0.21493108969604 0.25000000000000 0.75998569249388 162.500 > 3 12 Dy 0.71493108969604 0.25000000000000 0.75998569249388 162.500 > 3 13 Dy 0.46493108969604 0.25000000000000 0.49001430750612 162.500 > 4 14 Dy 0.96493108969604 0.25000000000000 0.49001430750612 162.500 > 4 15 Dy 0.46493108969604 0.25000000000000 0.99001430750612 162.500 > 4 16 Dy 0.96493108969604 0.25000000000000 0.99001430750612 162.500 > 4 *17 Ga 0.25000000000000 0.50000000000000 0.00000000000000 69.723 > 5 18 Ga 0.75000000000000 0.50000000000000 0.00000000000000 69.723 > 5 19 Ga 0.25000000000000 0.50000000000000 0.50000000000000 69.723 > 5 20 Ga 0.75000000000000 0.50000000000000 0.50000000000000 69.723 > 5 21 Ga 0.00000000000000 0.50000000000000 0.25000000000000 69.723 > 6 22 Ga 0.50000000000000 0.50000000000000 0.25000000000000 69.723 > 6 23 Ga 0.00000000000000 0.50000000000000 0.75000000000000 69.723 > 6 24 Ga 0.50000000000000 0.50000000000000 0.75000000000000 69.723 > 6 25 Ga 0.00000000000000 0.00000000000000 0.25000000000000 69.723 > 7 26 Ga 0.50000000000000 0.00000000000000 0.25000000000000 69.723 > 7 27 Ga 0.00000000000000 0.00000000000000 0.75000000000000 69.723 > 7 28 Ga 0.50000000000000 0.00000000000000 0.75000000000000 69.723 > 7 29 Ga 0.25000000000000 0.00000000000000 0.00000000000000 69.723 > 8 30 Ga 0.75000000000000 0.00000000000000 0.00000000000000 69.723 > 8 31 Ga 0.25000000000000 0.00000000000000 0.50000000000000 69.723 > 8 32 Ga 0.75000000000000 0.00000000000000 0.50000000000000 69.723 > 8 *33 O 0.26804356331447 0.25000000000000 0.05484470366777 15.999 > 9 34 O 0.76804356331447 0.25000000000000 0.05484470366777 15.999 > 9 35 O 0.26804356331447 0.25000000000000 0.55484470366777 15.999 > 9 36 O 0.76804356331447 0.25000000000000 0.55484470366777 15.999 > 9 *37 O 0.40218391030993 0.55593352318507 0.09686267523860 15.999 > 10 38 O 0.90218391030993 0.55593352318507 0.09686267523860 15.999 > 10 39 O 0.40218391030993 0.55593352318507 0.59686267523860 15.999 > 10 40 O 0.90218391030993 0.55593352318507 0.59686267523860 15.999 > 10 41 O 0.40218391030993 0.94406647681493 0.09686267523860 15.999 > 11 42 O 0.90218391030993 0.94406647681493 0.09686267523860 15.999 > 11 43 O 0.40218391030993 0.94406647681493 0.59686267523860 15.999 > 11 44 O 0.90218391030993 0.94406647681493 0.59686267523860 15.999 > 11 45 O 0.15218391030993 0.94406647681493 0.15313732476140 15.999 > 12 46 O 0.65218391030993 0.94406647681493 0.15313732476140 15.999 > 12 47 O 0.15218391030993 0.94406647681493 0.65313732476140 15.999 > 12 48 O 0.65218391030993 0.94406647681493 0.65313732476140 15.999 > 12 49 O 0.15218391030993 0.55593352318507 0.15313732476140 15.999 > 13 50 O 0.65218391030993 0.55593352318507 0.15313732476140 15.999 > 13 51 O 0.15218391030993 0.55593352318507 0.65313732476140 15.999 > 13 52 O 0.65218391030993 0.55593352318507 0.65313732476140 15.999 > 13 53 O 0.01804356331447 0.25000000000000 0.19515529633223 15.999 > 14 54 O 0.51804356331447 0.25000000000000 0.19515529633223 15.999 > 14 55 O 0.01804356331447 0.25000000000000 0.69515529633223 15.999 > 14 56 O 0.51804356331447 0.25000000000000 0.69515529633223 15.999 > 14 57 O 0.48195643668553 0.75000000000000 0.30484470366777 15.999 > 15 58 O 0.98195643668553 0.75000000000000 0.30484470366777 15.999 > 15 59 O 0.48195643668553 0.75000000000000 0.80484470366777 15.999 > 15 60 O 0.98195643668553 0.75000000000000 0.80484470366777 15.999 > 15 61 O 0.34781608969007 0.05593352318507 0.34686267523860 15.999 > 16 62 O 0.84781608969007 0.05593352318507 0.34686267523860 15.999 > 16 63 O 0.34781608969007 0.05593352318507 0.84686267523860 15.999 > 16 64 O 0.84781608969007 0.05593352318507 0.84686267523860 15.999 > 16 65 O 0.34781608969007 0.44406647681493 0.34686267523860 15.999 > 17 66 O 0.84781608969007 0.44406647681493 0.34686267523860 15.999 > 17 67 O 0.34781608969007 0.44406647681493 0.84686267523860 15.999 > 17 68 O 0.84781608969007 0.44406647681493 0.84686267523860 15.999 > 17 69 O 0.09781608969007 0.44406647681493 0.40313732476140 15.999 > 18 70 O 0.59781608969007 0.44406647681493 0.40313732476140 15.999 > 18 71 O 0.09781608969007 0.44406647681493 0.90313732476140 15.999 > 18 72 O 0.59781608969007 0.44406647681493 0.90313732476140 15.999 > 18 73 O 0.09781608969007 0.05593352318507 0.40313732476140 15.999 > 19 74 O 0.59781608969007 0.05593352318507 0.40313732476140 15.999 > 19 75 O 0.09781608969007 0.05593352318507 0.90313732476140 15.999 > 19 76 O 0.59781608969007 0.05593352318507 0.90313732476140 15.999 > 19 77 O 0.23195643668553 0.75000000000000 0.44515529633223 15.999 > 20 78 O 0.73195643668553 0.75000000000000 0.44515529633223 15.999 > 20 79 O 0.23195643668553 0.75000000000000 0.94515529633223 15.999 > 20 80 O 0.73195643668553 0.75000000000000 0.94515529633223 15.999 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.6164847 0.0000000 0.0000000 0.0000000 4.4672847 0.0000000 0.0000000 0.0000000 4.6222648 -------------------------- Born effective charges -------------------------- 1 Dy 3.9405222 0.0000000 -0.0757500 0.0000000 3.5968869 0.0000000 -0.2053255 0.0000000 3.9941520 2 Dy 3.9405222 0.0000000 0.0757500 0.0000000 3.5968869 0.0000000 0.2053255 0.0000000 3.9941520 3 Dy 3.9405222 0.0000000 0.0757500 0.0000000 3.5968869 0.0000000 0.2053255 0.0000000 3.9941520 4 Dy 3.9405222 0.0000000 -0.0757500 0.0000000 3.5968869 0.0000000 -0.2053255 0.0000000 3.9941520 5 Ga 3.3730429 -0.0826429 0.0928581 -0.0416106 3.2890813 -0.0027758 0.1548936 0.1229961 3.2497137 6 Ga 3.3730429 -0.0826429 -0.0928581 -0.0416106 3.2890813 0.0027758 -0.1548936 -0.1229961 3.2497137 7 Ga 3.3730429 0.0826429 -0.0928581 0.0416106 3.2890813 -0.0027758 -0.1548936 0.1229961 3.2497137 8 Ga 3.3730429 0.0826429 0.0928581 0.0416106 3.2890813 0.0027758 0.1548936 -0.1229961 3.2497137 9 O -2.1372390 0.0000000 0.3966970 0.0000000 -2.5050357 0.0000000 0.3851955 0.0000000 -2.5273762 10 O -2.5881630 -0.1273775 -0.1296850 -0.1569000 -2.1904663 -0.1090341 -0.1110559 -0.1404343 -2.3582448 11 O -2.5881630 0.1273775 -0.1296850 0.1569000 -2.1904663 0.1090341 -0.1110559 0.1404343 -2.3582448 12 O -2.5881630 0.1273775 0.1296850 0.1569000 -2.1904663 -0.1090341 0.1110559 -0.1404343 -2.3582448 13 O -2.5881630 -0.1273775 0.1296850 -0.1569000 -2.1904663 0.1090341 0.1110559 0.1404343 -2.3582448 14 O -2.1372390 0.0000000 -0.3966970 0.0000000 -2.5050357 0.0000000 -0.3851955 0.0000000 -2.5273762 15 O -2.1372390 0.0000000 -0.3966970 0.0000000 -2.5050357 0.0000000 -0.3851955 0.0000000 -2.5273762 16 O -2.5881630 0.1273775 0.1296850 0.1569000 -2.1904663 -0.1090341 0.1110559 -0.1404343 -2.3582448 17 O -2.5881630 -0.1273775 0.1296850 -0.1569000 -2.1904663 0.1090341 0.1110559 0.1404343 -2.3582448 18 O -2.5881630 -0.1273775 -0.1296850 -0.1569000 -2.1904663 -0.1090341 -0.1110559 -0.1404343 -2.3582448 19 O -2.5881630 0.1273775 -0.1296850 0.1569000 -2.1904663 0.1090341 -0.1110559 0.1404343 -2.3582448 20 O -2.1372390 0.0000000 0.3966970 0.0000000 -2.5050357 0.0000000 0.3851955 0.0000000 -2.5273762 ---------------------------------------------------------------------------- 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: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 994 Number of blocks in projector: 994 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 236 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (994, 966), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (172, 168), data: True |-- (172, 168), data: True |-- (236, 228), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 320 - Time: 0.733 Solver_block: 200 / 320 - Time: 0.729 Solver_block: 300 / 320 - Time: 0.730 Solver_block: 320 / 320 - Time: 0.182 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.391 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 994 Number of blocks in projector: 994 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 236 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (994, 966), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (172, 168), data: True |-- (172, 168), data: True |-- (236, 228), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 23:46:16]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:46:16]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.542102890000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.527830790000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.230989570000000 Atomic positions (fractional): 1 Dy 0.07013782060792 0.75000000000000 0.01997138498777 162.500 2 Dy 0.57013782060792 0.75000000000000 0.48002861501223 162.500 3 Dy 0.42986217939208 0.25000000000000 0.51997138498776 162.500 4 Dy 0.92986217939208 0.25000000000000 0.98002861501224 162.500 5 Ga 0.50000000000000 0.50000000000000 0.00000000000000 69.723 6 Ga 0.00000000000000 0.50000000000000 0.50000000000000 69.723 7 Ga 0.00000000000000 0.00000000000000 0.50000000000000 69.723 8 Ga 0.50000000000000 0.00000000000000 0.00000000000000 69.723 9 O 0.53608712662893 0.25000000000000 0.10968940733554 15.999 10 O 0.80436782061986 0.55593352318507 0.19372535047720 15.999 11 O 0.80436782061986 0.94406647681493 0.19372535047720 15.999 12 O 0.30436782061986 0.94406647681493 0.30627464952279 15.999 13 O 0.30436782061986 0.55593352318507 0.30627464952279 15.999 14 O 0.03608712662893 0.25000000000000 0.39031059266446 15.999 15 O 0.96391287337107 0.75000000000000 0.60968940733554 15.999 16 O 0.69563217938014 0.05593352318507 0.69372535047720 15.999 17 O 0.69563217938014 0.44406647681493 0.69372535047720 15.999 18 O 0.19563217938014 0.44406647681493 0.80627464952280 15.999 19 O 0.19563217938014 0.05593352318507 0.80627464952280 15.999 20 O 0.46391287337107 0.75000000000000 0.89031059266446 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.084205780000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.527830790000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.461979140000000 Atomic positions (fractional): 1 Dy 0.03506891030396 0.75000000000000 0.00998569249388 162.500 > 1 2 Dy 0.53506891030396 0.75000000000000 0.00998569249388 162.500 > 1 3 Dy 0.03506891030396 0.75000000000000 0.50998569249388 162.500 > 1 4 Dy 0.53506891030396 0.75000000000000 0.50998569249388 162.500 > 1 5 Dy 0.28506891030396 0.75000000000000 0.24001430750612 162.500 > 5 6 Dy 0.78506891030396 0.75000000000000 0.24001430750612 162.500 > 5 7 Dy 0.28506891030396 0.75000000000000 0.74001430750612 162.500 > 5 8 Dy 0.78506891030396 0.75000000000000 0.74001430750612 162.500 > 5 9 Dy 0.21493108969604 0.25000000000000 0.25998569249388 162.500 > 9 10 Dy 0.71493108969604 0.25000000000000 0.25998569249388 162.500 > 9 11 Dy 0.21493108969604 0.25000000000000 0.75998569249388 162.500 > 9 12 Dy 0.71493108969604 0.25000000000000 0.75998569249388 162.500 > 9 13 Dy 0.46493108969604 0.25000000000000 0.49001430750612 162.500 > 13 14 Dy 0.96493108969604 0.25000000000000 0.49001430750612 162.500 > 13 15 Dy 0.46493108969604 0.25000000000000 0.99001430750612 162.500 > 13 16 Dy 0.96493108969604 0.25000000000000 0.99001430750612 162.500 > 13 17 Ga 0.25000000000000 0.50000000000000 0.00000000000000 69.723 > 17 18 Ga 0.75000000000000 0.50000000000000 0.00000000000000 69.723 > 17 19 Ga 0.25000000000000 0.50000000000000 0.50000000000000 69.723 > 17 20 Ga 0.75000000000000 0.50000000000000 0.50000000000000 69.723 > 17 21 Ga 0.00000000000000 0.50000000000000 0.25000000000000 69.723 > 21 22 Ga 0.50000000000000 0.50000000000000 0.25000000000000 69.723 > 21 23 Ga 0.00000000000000 0.50000000000000 0.75000000000000 69.723 > 21 24 Ga 0.50000000000000 0.50000000000000 0.75000000000000 69.723 > 21 25 Ga 0.00000000000000 0.00000000000000 0.25000000000000 69.723 > 25 26 Ga 0.50000000000000 0.00000000000000 0.25000000000000 69.723 > 25 27 Ga 0.00000000000000 0.00000000000000 0.75000000000000 69.723 > 25 28 Ga 0.50000000000000 0.00000000000000 0.75000000000000 69.723 > 25 29 Ga 0.25000000000000 0.00000000000000 0.00000000000000 69.723 > 29 30 Ga 0.75000000000000 0.00000000000000 0.00000000000000 69.723 > 29 31 Ga 0.25000000000000 0.00000000000000 0.50000000000000 69.723 > 29 32 Ga 0.75000000000000 0.00000000000000 0.50000000000000 69.723 > 29 33 O 0.26804356331447 0.25000000000000 0.05484470366777 15.999 > 33 34 O 0.76804356331447 0.25000000000000 0.05484470366777 15.999 > 33 35 O 0.26804356331447 0.25000000000000 0.55484470366777 15.999 > 33 36 O 0.76804356331447 0.25000000000000 0.55484470366777 15.999 > 33 37 O 0.40218391030993 0.55593352318507 0.09686267523860 15.999 > 37 38 O 0.90218391030993 0.55593352318507 0.09686267523860 15.999 > 37 39 O 0.40218391030993 0.55593352318507 0.59686267523860 15.999 > 37 40 O 0.90218391030993 0.55593352318507 0.59686267523860 15.999 > 37 41 O 0.40218391030993 0.94406647681493 0.09686267523860 15.999 > 41 42 O 0.90218391030993 0.94406647681493 0.09686267523860 15.999 > 41 43 O 0.40218391030993 0.94406647681493 0.59686267523860 15.999 > 41 44 O 0.90218391030993 0.94406647681493 0.59686267523860 15.999 > 41 45 O 0.15218391030993 0.94406647681493 0.15313732476140 15.999 > 45 46 O 0.65218391030993 0.94406647681493 0.15313732476140 15.999 > 45 47 O 0.15218391030993 0.94406647681493 0.65313732476140 15.999 > 45 48 O 0.65218391030993 0.94406647681493 0.65313732476140 15.999 > 45 49 O 0.15218391030993 0.55593352318507 0.15313732476140 15.999 > 49 50 O 0.65218391030993 0.55593352318507 0.15313732476140 15.999 > 49 51 O 0.15218391030993 0.55593352318507 0.65313732476140 15.999 > 49 52 O 0.65218391030993 0.55593352318507 0.65313732476140 15.999 > 49 53 O 0.01804356331447 0.25000000000000 0.19515529633223 15.999 > 53 54 O 0.51804356331447 0.25000000000000 0.19515529633223 15.999 > 53 55 O 0.01804356331447 0.25000000000000 0.69515529633223 15.999 > 53 56 O 0.51804356331447 0.25000000000000 0.69515529633223 15.999 > 53 57 O 0.48195643668553 0.75000000000000 0.30484470366777 15.999 > 57 58 O 0.98195643668553 0.75000000000000 0.30484470366777 15.999 > 57 59 O 0.48195643668553 0.75000000000000 0.80484470366777 15.999 > 57 60 O 0.98195643668553 0.75000000000000 0.80484470366777 15.999 > 57 61 O 0.34781608969007 0.05593352318507 0.34686267523860 15.999 > 61 62 O 0.84781608969007 0.05593352318507 0.34686267523860 15.999 > 61 63 O 0.34781608969007 0.05593352318507 0.84686267523860 15.999 > 61 64 O 0.84781608969007 0.05593352318507 0.84686267523860 15.999 > 61 65 O 0.34781608969007 0.44406647681493 0.34686267523860 15.999 > 65 66 O 0.84781608969007 0.44406647681493 0.34686267523860 15.999 > 65 67 O 0.34781608969007 0.44406647681493 0.84686267523860 15.999 > 65 68 O 0.84781608969007 0.44406647681493 0.84686267523860 15.999 > 65 69 O 0.09781608969007 0.44406647681493 0.40313732476140 15.999 > 69 70 O 0.59781608969007 0.44406647681493 0.40313732476140 15.999 > 69 71 O 0.09781608969007 0.44406647681493 0.90313732476140 15.999 > 69 72 O 0.59781608969007 0.44406647681493 0.90313732476140 15.999 > 69 73 O 0.09781608969007 0.05593352318507 0.40313732476140 15.999 > 73 74 O 0.59781608969007 0.05593352318507 0.40313732476140 15.999 > 73 75 O 0.09781608969007 0.05593352318507 0.90313732476140 15.999 > 73 76 O 0.59781608969007 0.05593352318507 0.90313732476140 15.999 > 73 77 O 0.23195643668553 0.75000000000000 0.44515529633223 15.999 > 77 78 O 0.73195643668553 0.75000000000000 0.44515529633223 15.999 > 77 79 O 0.23195643668553 0.75000000000000 0.94515529633223 15.999 > 77 80 O 0.73195643668553 0.75000000000000 0.94515529633223 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.6164847 0.0000000 0.0000000 0.0000000 4.4672847 0.0000000 0.0000000 0.0000000 4.6222648 -------------------------- Born effective charges -------------------------- 1 Dy 3.9405222 0.0000000 -0.0757500 0.0000000 3.5968869 0.0000000 -0.2053255 0.0000000 3.9941520 2 Dy 3.9405222 0.0000000 0.0757500 0.0000000 3.5968869 0.0000000 0.2053255 0.0000000 3.9941520 3 Dy 3.9405222 0.0000000 0.0757500 0.0000000 3.5968869 0.0000000 0.2053255 0.0000000 3.9941520 4 Dy 3.9405222 0.0000000 -0.0757500 0.0000000 3.5968869 0.0000000 -0.2053255 0.0000000 3.9941520 5 Ga 3.3730429 -0.0826429 0.0928581 -0.0416106 3.2890813 -0.0027758 0.1548936 0.1229961 3.2497137 6 Ga 3.3730429 -0.0826429 -0.0928581 -0.0416106 3.2890813 0.0027758 -0.1548936 -0.1229961 3.2497137 7 Ga 3.3730429 0.0826429 -0.0928581 0.0416106 3.2890813 -0.0027758 -0.1548936 0.1229961 3.2497137 8 Ga 3.3730429 0.0826429 0.0928581 0.0416106 3.2890813 0.0027758 0.1548936 -0.1229961 3.2497137 9 O -2.1372390 0.0000000 0.3966970 0.0000000 -2.5050357 0.0000000 0.3851955 0.0000000 -2.5273762 10 O -2.5881630 -0.1273775 -0.1296850 -0.1569000 -2.1904663 -0.1090341 -0.1110559 -0.1404343 -2.3582448 11 O -2.5881630 0.1273775 -0.1296850 0.1569000 -2.1904663 0.1090341 -0.1110559 0.1404343 -2.3582448 12 O -2.5881630 0.1273775 0.1296850 0.1569000 -2.1904663 -0.1090341 0.1110559 -0.1404343 -2.3582448 13 O -2.5881630 -0.1273775 0.1296850 -0.1569000 -2.1904663 0.1090341 0.1110559 0.1404343 -2.3582448 14 O -2.1372390 0.0000000 -0.3966970 0.0000000 -2.5050357 0.0000000 -0.3851955 0.0000000 -2.5273762 15 O -2.1372390 0.0000000 -0.3966970 0.0000000 -2.5050357 0.0000000 -0.3851955 0.0000000 -2.5273762 16 O -2.5881630 0.1273775 0.1296850 0.1569000 -2.1904663 -0.1090341 0.1110559 -0.1404343 -2.3582448 17 O -2.5881630 -0.1273775 0.1296850 -0.1569000 -2.1904663 0.1090341 0.1110559 0.1404343 -2.3582448 18 O -2.5881630 -0.1273775 -0.1296850 -0.1569000 -2.1904663 -0.1090341 -0.1110559 -0.1404343 -2.3582448 19 O -2.5881630 0.1273775 -0.1296850 0.1569000 -2.1904663 0.1090341 -0.1110559 0.1404343 -2.3582448 20 O -2.1372390 0.0000000 0.3966970 0.0000000 -2.5050357 0.0000000 0.3851955 0.0000000 -2.5273762 ---------------------------------------------------------------------------- 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000003 (yzy) 0.00000003 (yzy) 0.00000003 (yyz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000006 (xz) 0.00000006 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:46:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:46:27]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.542102890000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.527830790000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.230989570000000 Atomic positions (fractional): 1 Dy 0.07013782060792 0.75000000000000 0.01997138498777 162.500 2 Dy 0.57013782060792 0.75000000000000 0.48002861501223 162.500 3 Dy 0.42986217939208 0.25000000000000 0.51997138498776 162.500 4 Dy 0.92986217939208 0.25000000000000 0.98002861501224 162.500 5 Ga 0.50000000000000 0.50000000000000 0.00000000000000 69.723 6 Ga 0.00000000000000 0.50000000000000 0.50000000000000 69.723 7 Ga 0.00000000000000 0.00000000000000 0.50000000000000 69.723 8 Ga 0.50000000000000 0.00000000000000 0.00000000000000 69.723 9 O 0.53608712662893 0.25000000000000 0.10968940733554 15.999 10 O 0.80436782061986 0.55593352318507 0.19372535047720 15.999 11 O 0.80436782061986 0.94406647681493 0.19372535047720 15.999 12 O 0.30436782061986 0.94406647681493 0.30627464952279 15.999 13 O 0.30436782061986 0.55593352318507 0.30627464952279 15.999 14 O 0.03608712662893 0.25000000000000 0.39031059266446 15.999 15 O 0.96391287337107 0.75000000000000 0.60968940733554 15.999 16 O 0.69563217938014 0.05593352318507 0.69372535047720 15.999 17 O 0.69563217938014 0.44406647681493 0.69372535047720 15.999 18 O 0.19563217938014 0.44406647681493 0.80627464952280 15.999 19 O 0.19563217938014 0.05593352318507 0.80627464952280 15.999 20 O 0.46391287337107 0.75000000000000 0.89031059266446 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.084205780000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.527830790000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.461979140000000 Atomic positions (fractional): 1 Dy 0.03506891030396 0.75000000000000 0.00998569249388 162.500 > 1 2 Dy 0.53506891030396 0.75000000000000 0.00998569249388 162.500 > 1 3 Dy 0.03506891030396 0.75000000000000 0.50998569249388 162.500 > 1 4 Dy 0.53506891030396 0.75000000000000 0.50998569249388 162.500 > 1 5 Dy 0.28506891030396 0.75000000000000 0.24001430750612 162.500 > 5 6 Dy 0.78506891030396 0.75000000000000 0.24001430750612 162.500 > 5 7 Dy 0.28506891030396 0.75000000000000 0.74001430750612 162.500 > 5 8 Dy 0.78506891030396 0.75000000000000 0.74001430750612 162.500 > 5 9 Dy 0.21493108969604 0.25000000000000 0.25998569249388 162.500 > 9 10 Dy 0.71493108969604 0.25000000000000 0.25998569249388 162.500 > 9 11 Dy 0.21493108969604 0.25000000000000 0.75998569249388 162.500 > 9 12 Dy 0.71493108969604 0.25000000000000 0.75998569249388 162.500 > 9 13 Dy 0.46493108969604 0.25000000000000 0.49001430750612 162.500 > 13 14 Dy 0.96493108969604 0.25000000000000 0.49001430750612 162.500 > 13 15 Dy 0.46493108969604 0.25000000000000 0.99001430750612 162.500 > 13 16 Dy 0.96493108969604 0.25000000000000 0.99001430750612 162.500 > 13 17 Ga 0.25000000000000 0.50000000000000 0.00000000000000 69.723 > 17 18 Ga 0.75000000000000 0.50000000000000 0.00000000000000 69.723 > 17 19 Ga 0.25000000000000 0.50000000000000 0.50000000000000 69.723 > 17 20 Ga 0.75000000000000 0.50000000000000 0.50000000000000 69.723 > 17 21 Ga 0.00000000000000 0.50000000000000 0.25000000000000 69.723 > 21 22 Ga 0.50000000000000 0.50000000000000 0.25000000000000 69.723 > 21 23 Ga 0.00000000000000 0.50000000000000 0.75000000000000 69.723 > 21 24 Ga 0.50000000000000 0.50000000000000 0.75000000000000 69.723 > 21 25 Ga 0.00000000000000 0.00000000000000 0.25000000000000 69.723 > 25 26 Ga 0.50000000000000 0.00000000000000 0.25000000000000 69.723 > 25 27 Ga 0.00000000000000 0.00000000000000 0.75000000000000 69.723 > 25 28 Ga 0.50000000000000 0.00000000000000 0.75000000000000 69.723 > 25 29 Ga 0.25000000000000 0.00000000000000 0.00000000000000 69.723 > 29 30 Ga 0.75000000000000 0.00000000000000 0.00000000000000 69.723 > 29 31 Ga 0.25000000000000 0.00000000000000 0.50000000000000 69.723 > 29 32 Ga 0.75000000000000 0.00000000000000 0.50000000000000 69.723 > 29 33 O 0.26804356331447 0.25000000000000 0.05484470366777 15.999 > 33 34 O 0.76804356331447 0.25000000000000 0.05484470366777 15.999 > 33 35 O 0.26804356331447 0.25000000000000 0.55484470366777 15.999 > 33 36 O 0.76804356331447 0.25000000000000 0.55484470366777 15.999 > 33 37 O 0.40218391030993 0.55593352318507 0.09686267523860 15.999 > 37 38 O 0.90218391030993 0.55593352318507 0.09686267523860 15.999 > 37 39 O 0.40218391030993 0.55593352318507 0.59686267523860 15.999 > 37 40 O 0.90218391030993 0.55593352318507 0.59686267523860 15.999 > 37 41 O 0.40218391030993 0.94406647681493 0.09686267523860 15.999 > 41 42 O 0.90218391030993 0.94406647681493 0.09686267523860 15.999 > 41 43 O 0.40218391030993 0.94406647681493 0.59686267523860 15.999 > 41 44 O 0.90218391030993 0.94406647681493 0.59686267523860 15.999 > 41 45 O 0.15218391030993 0.94406647681493 0.15313732476140 15.999 > 45 46 O 0.65218391030993 0.94406647681493 0.15313732476140 15.999 > 45 47 O 0.15218391030993 0.94406647681493 0.65313732476140 15.999 > 45 48 O 0.65218391030993 0.94406647681493 0.65313732476140 15.999 > 45 49 O 0.15218391030993 0.55593352318507 0.15313732476140 15.999 > 49 50 O 0.65218391030993 0.55593352318507 0.15313732476140 15.999 > 49 51 O 0.15218391030993 0.55593352318507 0.65313732476140 15.999 > 49 52 O 0.65218391030993 0.55593352318507 0.65313732476140 15.999 > 49 53 O 0.01804356331447 0.25000000000000 0.19515529633223 15.999 > 53 54 O 0.51804356331447 0.25000000000000 0.19515529633223 15.999 > 53 55 O 0.01804356331447 0.25000000000000 0.69515529633223 15.999 > 53 56 O 0.51804356331447 0.25000000000000 0.69515529633223 15.999 > 53 57 O 0.48195643668553 0.75000000000000 0.30484470366777 15.999 > 57 58 O 0.98195643668553 0.75000000000000 0.30484470366777 15.999 > 57 59 O 0.48195643668553 0.75000000000000 0.80484470366777 15.999 > 57 60 O 0.98195643668553 0.75000000000000 0.80484470366777 15.999 > 57 61 O 0.34781608969007 0.05593352318507 0.34686267523860 15.999 > 61 62 O 0.84781608969007 0.05593352318507 0.34686267523860 15.999 > 61 63 O 0.34781608969007 0.05593352318507 0.84686267523860 15.999 > 61 64 O 0.84781608969007 0.05593352318507 0.84686267523860 15.999 > 61 65 O 0.34781608969007 0.44406647681493 0.34686267523860 15.999 > 65 66 O 0.84781608969007 0.44406647681493 0.34686267523860 15.999 > 65 67 O 0.34781608969007 0.44406647681493 0.84686267523860 15.999 > 65 68 O 0.84781608969007 0.44406647681493 0.84686267523860 15.999 > 65 69 O 0.09781608969007 0.44406647681493 0.40313732476140 15.999 > 69 70 O 0.59781608969007 0.44406647681493 0.40313732476140 15.999 > 69 71 O 0.09781608969007 0.44406647681493 0.90313732476140 15.999 > 69 72 O 0.59781608969007 0.44406647681493 0.90313732476140 15.999 > 69 73 O 0.09781608969007 0.05593352318507 0.40313732476140 15.999 > 73 74 O 0.59781608969007 0.05593352318507 0.40313732476140 15.999 > 73 75 O 0.09781608969007 0.05593352318507 0.90313732476140 15.999 > 73 76 O 0.59781608969007 0.05593352318507 0.90313732476140 15.999 > 73 77 O 0.23195643668553 0.75000000000000 0.44515529633223 15.999 > 77 78 O 0.73195643668553 0.75000000000000 0.44515529633223 15.999 > 77 79 O 0.23195643668553 0.75000000000000 0.94515529633223 15.999 > 77 80 O 0.73195643668553 0.75000000000000 0.94515529633223 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.6164847 0.0000000 0.0000000 0.0000000 4.4672847 0.0000000 0.0000000 0.0000000 4.6222648 -------------------------- Born effective charges -------------------------- 1 Dy 3.9405222 0.0000000 -0.0757500 0.0000000 3.5968869 0.0000000 -0.2053255 0.0000000 3.9941520 2 Dy 3.9405222 0.0000000 0.0757500 0.0000000 3.5968869 0.0000000 0.2053255 0.0000000 3.9941520 3 Dy 3.9405222 0.0000000 0.0757500 0.0000000 3.5968869 0.0000000 0.2053255 0.0000000 3.9941520 4 Dy 3.9405222 0.0000000 -0.0757500 0.0000000 3.5968869 0.0000000 -0.2053255 0.0000000 3.9941520 5 Ga 3.3730429 -0.0826429 0.0928581 -0.0416106 3.2890813 -0.0027758 0.1548936 0.1229961 3.2497137 6 Ga 3.3730429 -0.0826429 -0.0928581 -0.0416106 3.2890813 0.0027758 -0.1548936 -0.1229961 3.2497137 7 Ga 3.3730429 0.0826429 -0.0928581 0.0416106 3.2890813 -0.0027758 -0.1548936 0.1229961 3.2497137 8 Ga 3.3730429 0.0826429 0.0928581 0.0416106 3.2890813 0.0027758 0.1548936 -0.1229961 3.2497137 9 O -2.1372390 0.0000000 0.3966970 0.0000000 -2.5050357 0.0000000 0.3851955 0.0000000 -2.5273762 10 O -2.5881630 -0.1273775 -0.1296850 -0.1569000 -2.1904663 -0.1090341 -0.1110559 -0.1404343 -2.3582448 11 O -2.5881630 0.1273775 -0.1296850 0.1569000 -2.1904663 0.1090341 -0.1110559 0.1404343 -2.3582448 12 O -2.5881630 0.1273775 0.1296850 0.1569000 -2.1904663 -0.1090341 0.1110559 -0.1404343 -2.3582448 13 O -2.5881630 -0.1273775 0.1296850 -0.1569000 -2.1904663 0.1090341 0.1110559 0.1404343 -2.3582448 14 O -2.1372390 0.0000000 -0.3966970 0.0000000 -2.5050357 0.0000000 -0.3851955 0.0000000 -2.5273762 15 O -2.1372390 0.0000000 -0.3966970 0.0000000 -2.5050357 0.0000000 -0.3851955 0.0000000 -2.5273762 16 O -2.5881630 0.1273775 0.1296850 0.1569000 -2.1904663 -0.1090341 0.1110559 -0.1404343 -2.3582448 17 O -2.5881630 -0.1273775 0.1296850 -0.1569000 -2.1904663 0.1090341 0.1110559 0.1404343 -2.3582448 18 O -2.5881630 -0.1273775 -0.1296850 -0.1569000 -2.1904663 -0.1090341 -0.1110559 -0.1404343 -2.3582448 19 O -2.5881630 0.1273775 -0.1296850 0.1569000 -2.1904663 0.1090341 -0.1110559 0.1404343 -2.3582448 20 O -2.1372390 0.0000000 0.3966970 0.0000000 -2.5050357 0.0000000 0.3851955 0.0000000 -2.5273762 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000003 (yzy) 0.00000003 (yzy) 0.00000003 (yyz) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 7 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.69, Number of G-points: 303, Lambda: 0.15 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/120) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.527 ( 0.000 0.000 0.000) 0.000 3.195 ( 0.000 0.000 0.000) 0.000 3.307 ( 0.000 0.000 0.000) 0.000 3.349 ( 0.000 0.000 0.000) 0.000 3.531 ( 0.000 0.000 0.000) 0.000 3.869 ( 0.000 0.000 0.000) 0.000 4.236 ( 0.000 0.000 0.000) 0.000 4.336 ( 0.000 0.000 0.000) 0.000 4.676 ( 0.000 0.000 0.000) 0.000 4.756 ( 0.000 0.000 0.000) 0.000 4.918 ( 0.000 0.000 0.000) 0.000 4.967 ( 0.000 0.000 0.000) 0.000 5.188 ( 0.000 0.000 0.000) 0.000 5.543 ( 0.000 0.000 0.000) 0.000 5.545 ( 0.000 0.000 0.000) 0.000 7.105 ( 0.000 0.000 0.000) 0.000 7.109 ( 0.000 0.000 0.000) 0.000 7.208 ( 0.000 0.000 0.000) 0.000 7.554 ( 0.000 0.000 0.000) 0.000 7.694 ( 0.000 0.000 0.000) 0.000 8.131 ( 0.000 0.000 0.000) 0.000 8.256 ( 0.000 0.000 0.000) 0.000 8.494 ( 0.000 0.000 0.000) 0.000 8.526 ( 0.000 0.000 0.000) 0.000 8.549 ( 0.000 0.000 0.000) 0.000 9.339 ( 0.000 0.000 0.000) 0.000 9.469 ( 0.000 0.000 0.000) 0.000 9.525 ( 0.000 0.000 0.000) 0.000 9.590 ( 0.000 0.000 0.000) 0.000 9.881 ( 0.000 0.000 0.000) 0.000 10.333 ( 0.000 0.000 0.000) 0.000 10.378 ( 0.000 0.000 0.000) 0.000 10.737 ( 0.000 0.000 0.000) 0.000 10.881 ( 0.000 0.000 0.000) 0.000 11.153 ( 0.000 0.000 0.000) 0.000 11.569 ( 0.000 0.000 0.000) 0.000 11.649 ( 0.000 0.000 0.000) 0.000 11.734 ( 0.000 0.000 0.000) 0.000 11.930 ( 0.000 0.000 0.000) 0.000 12.452 ( 0.000 0.000 0.000) 0.000 12.613 ( 0.000 0.000 0.000) 0.000 13.569 ( 0.000 0.000 0.000) 0.000 14.359 ( 0.000 0.000 0.000) 0.000 14.897 ( 0.000 0.000 0.000) 0.000 15.009 ( 0.000 0.000 0.000) 0.000 15.695 ( 0.000 0.000 0.000) 0.000 15.702 ( 0.000 0.000 0.000) 0.000 15.710 ( 0.000 0.000 0.000) 0.000 16.196 ( 0.000 0.000 0.000) 0.000 16.226 ( 0.000 0.000 0.000) 0.000 16.644 ( 0.000 0.000 0.000) 0.000 16.704 ( 0.000 0.000 0.000) 0.000 16.985 ( 0.000 0.000 0.000) 0.000 17.500 ( 0.000 0.000 0.000) 0.000 18.337 ( 0.000 0.000 0.000) 0.000 18.911 ( 0.000 0.000 0.000) 0.000 19.623 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/120) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.606 ( 29.723 0.000 0.000) 29.723 0.757 ( 37.135 0.000 0.000) 37.135 1.188 ( 57.200 0.000 0.000) 57.200 2.560 ( 3.072 0.000 0.000) 3.072 3.146 ( -5.732 0.000 0.000) 5.732 3.326 ( 1.902 0.000 0.000) 1.902 3.361 ( 1.010 0.000 0.000) 1.010 3.552 ( 1.928 0.000 0.000) 1.928 3.794 ( -7.041 0.000 0.000) 7.041 4.008 ( -22.119 0.000 0.000) 22.119 4.212 ( -2.355 0.000 0.000) 2.355 4.774 ( 1.225 0.000 0.000) 1.225 4.803 ( -11.038 0.000 0.000) 11.038 4.853 ( 3.804 0.000 0.000) 3.804 5.115 ( 18.129 0.000 0.000) 18.129 5.290 ( 9.995 0.000 0.000) 9.995 5.521 ( -3.788 0.000 0.000) 3.788 5.594 ( 5.368 0.000 0.000) 5.368 7.102 ( -0.582 0.000 0.000) 0.582 7.190 ( -2.131 0.000 0.000) 2.131 7.494 ( 2.898 0.000 0.000) 2.898 7.510 ( -2.759 0.000 0.000) 2.759 7.729 ( 0.567 0.000 0.000) 0.567 8.083 ( -4.371 0.000 0.000) 4.371 8.253 ( -0.441 0.000 0.000) 0.441 8.401 ( -13.445 0.000 0.000) 13.445 8.450 ( -6.590 0.000 0.000) 6.590 8.561 ( 4.184 0.000 0.000) 4.184 9.257 ( -13.345 0.000 0.000) 13.345 9.636 ( 3.321 0.000 0.000) 3.321 9.658 ( 5.599 0.000 0.000) 5.599 9.862 ( -1.395 0.000 0.000) 1.395 10.307 ( -2.129 0.000 0.000) 2.129 10.405 ( 2.621 0.000 0.000) 2.621 10.663 ( -6.384 0.000 0.000) 6.384 10.879 ( -0.549 0.000 0.000) 0.549 11.227 ( 7.554 0.000 0.000) 7.554 11.405 ( -9.957 0.000 0.000) 9.957 11.832 ( 14.390 0.000 0.000) 14.390 11.955 ( 15.459 0.000 0.000) 15.459 12.130 ( 19.407 0.000 0.000) 19.407 12.399 ( -10.512 0.000 0.000) 10.512 12.526 ( 6.969 0.000 0.000) 6.969 13.000 ( 11.869 0.000 0.000) 11.869 14.279 ( -7.501 0.000 0.000) 7.501 14.807 ( -8.927 0.000 0.000) 8.927 14.985 ( -1.671 0.000 0.000) 1.671 15.593 ( -11.200 0.000 0.000) 11.200 15.622 ( 4.888 0.000 0.000) 4.888 15.688 ( -0.041 0.000 0.000) 0.041 15.695 ( -0.698 0.000 0.000) 0.698 16.327 ( 8.462 0.000 0.000) 8.462 16.661 ( 2.578 0.000 0.000) 2.578 16.690 ( -1.223 0.000 0.000) 1.223 16.968 ( -1.534 0.000 0.000) 1.534 17.418 ( -8.100 0.000 0.000) 8.100 18.429 ( 8.550 0.000 0.000) 8.550 18.914 ( 0.278 0.000 0.000) 0.278 19.145 ( -1.518 0.000 0.000) 1.518 19.606 ( -1.689 0.000 0.000) 1.689 ======================= Grid point 2 (3/120) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.183 ( 27.628 0.000 0.000) 27.628 1.475 ( 34.037 0.000 0.000) 34.037 2.234 ( 44.942 0.000 0.000) 44.942 2.636 ( 3.910 0.000 0.000) 3.910 2.996 ( -8.892 0.000 0.000) 8.892 3.378 ( 3.025 0.000 0.000) 3.025 3.405 ( 4.561 0.000 0.000) 4.561 3.569 ( -20.693 0.000 0.000) 20.693 3.603 ( 3.145 0.000 0.000) 3.145 3.612 ( -10.418 0.000 0.000) 10.418 4.141 ( -4.699 0.000 0.000) 4.699 4.505 ( -17.728 0.000 0.000) 17.728 4.777 ( -1.388 0.000 0.000) 1.388 4.849 ( -2.532 0.000 0.000) 2.532 5.436 ( -3.559 0.000 0.000) 3.559 5.567 ( 24.697 0.000 0.000) 24.697 5.578 ( 18.323 0.000 0.000) 18.323 5.772 ( 12.437 0.000 0.000) 12.437 7.091 ( -0.441 0.000 0.000) 0.441 7.098 ( -7.834 0.000 0.000) 7.834 7.457 ( -3.188 0.000 0.000) 3.188 7.562 ( 2.816 0.000 0.000) 2.816 7.648 ( -8.612 0.000 0.000) 8.612 7.963 ( -7.817 0.000 0.000) 7.817 8.068 ( -18.659 0.000 0.000) 18.659 8.232 ( -1.863 0.000 0.000) 1.863 8.314 ( -4.809 0.000 0.000) 4.809 8.712 ( 10.631 0.000 0.000) 10.631 8.975 ( -14.149 0.000 0.000) 14.149 9.672 ( -0.486 0.000 0.000) 0.486 9.727 ( 1.435 0.000 0.000) 1.435 9.834 ( -1.486 0.000 0.000) 1.486 10.237 ( -4.219 0.000 0.000) 4.219 10.477 ( 4.479 0.000 0.000) 4.479 10.517 ( -7.585 0.000 0.000) 7.585 10.868 ( 0.049 0.000 0.000) 0.049 11.213 ( -9.222 0.000 0.000) 9.222 11.460 ( 15.513 0.000 0.000) 15.513 11.844 ( -13.545 0.000 0.000) 13.545 12.287 ( 16.563 0.000 0.000) 16.563 12.554 ( 23.924 0.000 0.000) 23.924 12.670 ( 33.210 0.000 0.000) 33.210 12.708 ( 10.504 0.000 0.000) 10.504 13.216 ( 9.662 0.000 0.000) 9.662 14.094 ( -9.798 0.000 0.000) 9.798 14.559 ( -14.985 0.000 0.000) 14.985 14.988 ( 3.377 0.000 0.000) 3.377 15.287 ( -18.583 0.000 0.000) 18.583 15.626 ( -7.312 0.000 0.000) 7.312 15.727 ( 3.725 0.000 0.000) 3.725 15.741 ( 6.416 0.000 0.000) 6.416 16.510 ( 8.913 0.000 0.000) 8.913 16.670 ( -0.304 0.000 0.000) 0.304 16.722 ( 3.196 0.000 0.000) 3.196 16.929 ( -2.251 0.000 0.000) 2.251 17.176 ( -16.017 0.000 0.000) 16.017 18.647 ( 12.468 0.000 0.000) 12.468 18.922 ( 0.494 0.000 0.000) 0.494 19.103 ( -2.510 0.000 0.000) 2.510 19.554 ( -3.544 0.000 0.000) 3.544 ======================= Grid point 3 (4/120) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( 24.334 0.000 0.000) 24.334 2.101 ( 27.658 0.000 0.000) 27.658 2.694 ( 1.410 0.000 0.000) 1.410 2.767 ( -8.053 0.000 0.000) 8.053 2.913 ( 16.160 0.000 0.000) 16.160 3.216 ( -13.583 0.000 0.000) 13.583 3.400 ( -10.355 0.000 0.000) 10.355 3.429 ( 1.233 0.000 0.000) 1.233 3.597 ( 13.689 0.000 0.000) 13.689 3.678 ( 4.275 0.000 0.000) 4.275 4.030 ( -6.149 0.000 0.000) 6.149 4.141 ( -17.027 0.000 0.000) 17.027 4.723 ( -3.395 0.000 0.000) 3.395 4.775 ( -4.356 0.000 0.000) 4.356 5.454 ( 7.683 0.000 0.000) 7.683 6.002 ( 23.061 0.000 0.000) 23.061 6.071 ( 25.055 0.000 0.000) 25.055 6.085 ( 18.336 0.000 0.000) 18.336 6.849 ( -17.181 0.000 0.000) 17.181 7.081 ( -1.180 0.000 0.000) 1.180 7.305 ( -14.342 0.000 0.000) 14.342 7.472 ( -5.791 0.000 0.000) 5.791 7.481 ( -14.274 0.000 0.000) 14.274 7.686 ( -18.512 0.000 0.000) 18.512 7.855 ( 0.736 0.000 0.000) 0.736 8.169 ( -4.509 0.000 0.000) 4.509 8.306 ( 3.526 0.000 0.000) 3.526 8.722 ( -10.454 0.000 0.000) 10.454 8.957 ( 13.065 0.000 0.000) 13.065 9.607 ( -5.901 0.000 0.000) 5.901 9.730 ( -0.620 0.000 0.000) 0.620 9.795 ( -2.437 0.000 0.000) 2.437 10.168 ( -2.053 0.000 0.000) 2.053 10.369 ( -7.083 0.000 0.000) 7.083 10.582 ( 5.938 0.000 0.000) 5.938 10.903 ( 3.832 0.000 0.000) 3.832 11.034 ( -8.650 0.000 0.000) 8.650 11.529 ( -15.834 0.000 0.000) 15.834 11.826 ( 20.110 0.000 0.000) 20.110 12.554 ( 7.829 0.000 0.000) 7.829 12.924 ( 10.577 0.000 0.000) 10.577 13.016 ( 17.859 0.000 0.000) 17.859 13.397 ( 9.180 0.000 0.000) 9.180 13.409 ( 39.204 0.000 0.000) 39.204 13.952 ( -2.131 0.000 0.000) 2.131 14.237 ( -16.511 0.000 0.000) 16.511 14.876 ( -21.790 0.000 0.000) 21.790 15.179 ( 16.684 0.000 0.000) 16.684 15.368 ( -18.727 0.000 0.000) 18.727 15.817 ( 4.624 0.000 0.000) 4.624 15.858 ( 4.735 0.000 0.000) 4.735 16.652 ( 2.246 0.000 0.000) 2.246 16.688 ( 2.134 0.000 0.000) 2.134 16.777 ( 2.045 0.000 0.000) 2.045 16.791 ( -19.446 0.000 0.000) 19.446 16.878 ( -2.820 0.000 0.000) 2.820 18.903 ( 12.509 0.000 0.000) 12.509 18.935 ( 0.872 0.000 0.000) 0.872 19.050 ( -2.742 0.000 0.000) 2.742 19.462 ( -5.680 0.000 0.000) 5.680 ======================= Grid point 4 (5/120) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 20.101 0.000 0.000) 20.101 2.509 ( -15.468 0.000 0.000) 15.468 2.538 ( 14.438 0.000 0.000) 14.438 2.684 ( -2.532 0.000 0.000) 2.532 3.068 ( 0.144 0.000 0.000) 0.144 3.177 ( 11.160 0.000 0.000) 11.160 3.197 ( -9.824 0.000 0.000) 9.824 3.377 ( -7.318 0.000 0.000) 7.318 3.769 ( 4.303 0.000 0.000) 4.303 3.794 ( 3.706 0.000 0.000) 3.706 3.902 ( -5.245 0.000 0.000) 5.245 3.913 ( -4.732 0.000 0.000) 4.732 4.672 ( -0.991 0.000 0.000) 0.991 4.695 ( -3.068 0.000 0.000) 3.068 5.790 ( 24.478 0.000 0.000) 24.478 6.283 ( -15.210 0.000 0.000) 15.210 6.481 ( 20.097 0.000 0.000) 20.097 6.546 ( 20.661 0.000 0.000) 20.661 6.613 ( 14.244 0.000 0.000) 14.244 6.949 ( -18.423 0.000 0.000) 18.423 6.972 ( -11.917 0.000 0.000) 11.917 7.071 ( -23.956 0.000 0.000) 23.956 7.392 ( -2.644 0.000 0.000) 2.644 7.407 ( -6.595 0.000 0.000) 6.595 7.939 ( 5.772 0.000 0.000) 5.772 8.060 ( -5.998 0.000 0.000) 5.998 8.415 ( 6.540 0.000 0.000) 6.540 8.552 ( -7.162 0.000 0.000) 7.162 9.216 ( 12.444 0.000 0.000) 12.444 9.444 ( -10.024 0.000 0.000) 10.024 9.722 ( 0.229 0.000 0.000) 0.229 9.746 ( -2.112 0.000 0.000) 2.112 10.167 ( 1.961 0.000 0.000) 1.961 10.242 ( -5.313 0.000 0.000) 5.313 10.714 ( 7.151 0.000 0.000) 7.151 10.867 ( -8.038 0.000 0.000) 8.038 11.027 ( 8.465 0.000 0.000) 8.465 11.240 ( -12.701 0.000 0.000) 12.701 12.229 ( 19.012 0.000 0.000) 19.012 12.534 ( -9.676 0.000 0.000) 9.676 13.111 ( 7.533 0.000 0.000) 7.533 13.193 ( 0.629 0.000 0.000) 0.629 13.623 ( 13.364 0.000 0.000) 13.364 13.914 ( -15.458 0.000 0.000) 15.458 14.069 ( 13.472 0.000 0.000) 13.472 14.184 ( 35.812 0.000 0.000) 35.812 14.444 ( -19.441 0.000 0.000) 19.441 14.878 ( -29.758 0.000 0.000) 29.758 15.641 ( 27.522 0.000 0.000) 27.522 15.892 ( 2.280 0.000 0.000) 2.280 15.920 ( 1.543 0.000 0.000) 1.543 16.236 ( -28.339 0.000 0.000) 28.339 16.747 ( 3.409 0.000 0.000) 3.409 16.770 ( 2.784 0.000 0.000) 2.784 16.798 ( -0.060 0.000 0.000) 0.060 16.816 ( -3.366 0.000 0.000) 3.366 18.959 ( 1.557 0.000 0.000) 1.557 18.998 ( -2.318 0.000 0.000) 2.318 19.136 ( 10.622 0.000 0.000) 10.622 19.324 ( -8.116 0.000 0.000) 8.116 ======================= Grid point 9 (6/120) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.614 ( 0.000 31.904 0.000) 31.904 0.703 ( 0.000 36.535 0.000) 36.535 1.090 ( 0.000 55.739 0.000) 55.739 2.540 ( 0.000 0.265 0.000) 0.265 3.183 ( 0.000 -1.121 0.000) 1.121 3.249 ( 0.000 -10.314 0.000) 10.314 3.264 ( 0.000 -3.449 0.000) 3.449 3.595 ( 0.000 6.583 0.000) 6.583 3.830 ( 0.000 -4.017 0.000) 4.017 4.127 ( 0.000 -10.089 0.000) 10.089 4.311 ( 0.000 -2.869 0.000) 2.869 4.738 ( 0.000 5.947 0.000) 5.947 4.796 ( 0.000 -1.436 0.000) 1.436 4.847 ( 0.000 -1.816 0.000) 1.816 5.180 ( 0.000 -0.857 0.000) 0.857 5.522 ( 0.000 -2.558 0.000) 2.558 5.634 ( 0.000 9.153 0.000) 9.153 5.753 ( 0.000 8.574 0.000) 8.574 6.987 ( 0.000 -11.691 0.000) 11.691 7.130 ( 0.000 -8.075 0.000) 8.075 7.175 ( 0.000 6.789 0.000) 6.789 7.720 ( 0.000 2.429 0.000) 2.429 8.065 ( 0.000 -4.272 0.000) 4.272 8.208 ( 0.000 -4.980 0.000) 4.980 8.228 ( 0.000 3.748 0.000) 3.748 8.480 ( 0.000 -1.410 0.000) 1.410 8.557 ( 0.000 1.105 0.000) 1.105 9.313 ( 0.000 -2.169 0.000) 2.169 9.375 ( 0.000 -1.141 0.000) 1.141 9.436 ( 0.000 -8.745 0.000) 8.745 9.486 ( 0.000 1.695 0.000) 1.695 9.596 ( 0.000 0.296 0.000) 0.296 9.882 ( 0.000 0.167 0.000) 0.167 10.153 ( 0.000 -7.926 0.000) 7.926 10.664 ( 0.000 18.270 0.000) 18.270 10.668 ( 0.000 -5.530 0.000) 5.530 10.836 ( 0.000 -4.400 0.000) 4.400 11.643 ( 0.000 -0.792 0.000) 0.792 11.658 ( 0.000 8.863 0.000) 8.863 11.947 ( 0.000 1.829 0.000) 1.829 11.979 ( 0.000 23.410 0.000) 23.410 12.454 ( 0.000 0.365 0.000) 0.365 12.560 ( 0.000 -5.383 0.000) 5.383 13.600 ( 0.000 3.335 0.000) 3.335 14.410 ( 0.000 5.055 0.000) 5.055 14.783 ( 0.000 -16.342 0.000) 16.342 14.881 ( 0.000 -1.767 0.000) 1.767 15.431 ( 0.000 13.154 0.000) 13.154 15.562 ( 0.000 -16.025 0.000) 16.025 15.704 ( 0.000 0.464 0.000) 0.464 16.116 ( 0.000 3.115 0.000) 3.115 16.177 ( 0.000 -2.049 0.000) 2.049 16.189 ( 0.000 -2.996 0.000) 2.996 16.611 ( 0.000 -6.813 0.000) 6.813 16.616 ( 0.000 -2.884 0.000) 2.884 17.427 ( 0.000 -7.393 0.000) 7.393 18.374 ( 0.000 3.746 0.000) 3.746 18.940 ( 0.000 -2.873 0.000) 2.873 19.042 ( 0.000 12.138 0.000) 12.138 19.638 ( 0.000 1.315 0.000) 1.315 ======================= Grid point 10 (7/120) ======================= q-point: ( 0.11 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.836 ( 22.427 18.190 0.000) 28.877 0.846 ( 19.639 21.481 0.000) 29.106 1.699 ( 43.080 39.230 0.000) 58.266 2.556 ( 1.636 -1.079 0.000) 1.960 3.124 ( -5.282 -1.694 0.000) 5.547 3.237 ( -1.574 -11.775 0.000) 11.880 3.278 ( 1.401 -4.157 0.000) 4.387 3.612 ( 1.243 6.009 0.000) 6.136 3.756 ( -6.826 -3.833 0.000) 7.828 4.040 ( -15.375 -0.395 0.000) 15.380 4.116 ( -5.026 -6.045 0.000) 7.861 4.709 ( -9.935 -7.647 0.000) 12.537 4.862 ( 2.563 6.752 0.000) 7.222 4.942 ( 9.872 2.961 0.000) 10.306 5.282 ( 9.977 -0.865 0.000) 10.015 5.408 ( -8.674 15.999 0.000) 18.199 5.518 ( -1.094 5.675 0.000) 5.780 5.678 ( 4.651 8.534 0.000) 9.719 7.072 ( -3.890 -5.944 0.000) 7.104 7.146 ( 8.066 -17.352 0.000) 19.135 7.215 ( 1.814 5.306 0.000) 5.608 7.728 ( -1.030 2.304 0.000) 2.524 7.879 ( -14.011 12.240 0.000) 18.604 8.015 ( -4.524 -4.352 0.000) 6.278 8.203 ( -0.842 -4.923 0.000) 4.995 8.423 ( -12.091 2.117 0.000) 12.275 8.430 ( -6.242 -1.510 0.000) 6.422 8.751 ( -2.447 15.040 0.000) 15.238 9.204 ( -14.471 -5.905 0.000) 15.630 9.587 ( 3.108 -2.561 0.000) 4.027 9.685 ( 6.275 0.844 0.000) 6.331 9.828 ( -0.759 -4.024 0.000) 4.095 10.149 ( 0.865 -7.531 0.000) 7.580 10.608 ( -5.401 -4.567 0.000) 7.073 10.650 ( 36.497 -32.725 0.000) 49.020 10.681 ( 1.579 18.921 0.000) 18.986 10.827 ( -0.868 -4.671 0.000) 4.751 11.534 ( -9.017 11.953 0.000) 14.973 11.849 ( 17.282 -0.776 0.000) 17.299 12.141 ( 19.174 1.377 0.000) 19.223 12.149 ( 13.467 19.271 0.000) 23.510 12.518 ( 6.046 -0.537 0.000) 6.069 12.521 ( -5.100 1.136 0.000) 5.225 13.219 ( -12.280 16.178 0.000) 20.311 14.317 ( -8.551 3.556 0.000) 9.261 14.794 ( -8.627 -1.374 0.000) 8.735 14.843 ( 0.178 -15.751 0.000) 15.752 15.473 ( -0.920 2.649 0.000) 2.804 15.596 ( 2.711 -12.315 0.000) 12.610 15.702 ( 0.594 1.243 0.000) 1.378 15.884 ( -6.300 12.956 0.000) 14.407 16.274 ( 7.200 -4.341 0.000) 8.407 16.577 ( -3.084 -8.600 0.000) 9.136 16.583 ( 12.543 -22.930 0.000) 26.136 16.640 ( 1.940 -3.915 0.000) 4.369 17.348 ( -7.866 -7.207 0.000) 10.668 18.462 ( 8.359 3.574 0.000) 9.091 19.045 ( 0.236 12.077 0.000) 12.080 19.064 ( 5.740 -5.519 0.000) 7.963 19.622 ( -1.576 1.436 0.000) 2.132 ======================= Grid point 11 (8/120) ======================= q-point: ( 0.22 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.291 ( 23.254 10.873 0.000) 25.670 1.412 ( 30.938 -0.657 0.000) 30.945 2.546 ( 37.265 25.920 0.000) 45.393 2.602 ( 2.773 -3.626 0.000) 4.565 2.981 ( -8.925 -1.128 0.000) 8.996 3.190 ( -2.734 -16.037 0.000) 16.268 3.319 ( 2.676 -5.499 0.000) 6.115 3.552 ( -9.631 -4.223 0.000) 10.517 3.660 ( -0.013 4.077 0.000) 4.077 3.731 ( -11.619 10.220 0.000) 15.475 4.030 ( -5.042 -9.857 0.000) 11.071 4.431 ( -16.864 -6.282 0.000) 17.996 4.914 ( 1.994 11.990 0.000) 12.154 4.929 ( -5.692 5.420 0.000) 7.860 5.495 ( 0.923 5.684 0.000) 5.759 5.568 ( 18.149 -1.035 0.000) 18.179 5.623 ( 20.468 6.614 0.000) 21.510 5.836 ( 11.364 6.677 0.000) 13.180 6.980 ( -5.885 -6.958 0.000) 9.113 7.224 ( -1.031 8.491 0.000) 8.553 7.254 ( 2.747 -14.310 0.000) 14.571 7.649 ( -7.364 1.773 0.000) 7.575 7.727 ( -3.827 7.392 0.000) 8.324 7.896 ( -7.757 -5.214 0.000) 9.347 8.070 ( -16.154 -0.350 0.000) 16.158 8.219 ( -3.737 -0.909 0.000) 3.846 8.286 ( -5.905 -2.404 0.000) 6.376 8.833 ( 8.292 10.953 0.000) 13.738 8.898 ( -15.290 -7.915 0.000) 17.217 9.617 ( -0.300 -2.860 0.000) 2.876 9.773 ( 2.208 2.103 0.000) 3.049 9.810 ( -0.933 -2.801 0.000) 2.953 10.147 ( -0.760 -4.599 0.000) 4.661 10.480 ( -6.809 -3.070 0.000) 7.469 10.721 ( 2.390 20.016 0.000) 20.158 10.813 ( -0.092 -4.847 0.000) 4.848 11.119 ( 14.766 -23.604 0.000) 27.842 11.350 ( -9.067 13.056 0.000) 15.895 12.055 ( -1.805 10.153 0.000) 10.313 12.445 ( 14.814 15.508 0.000) 21.446 12.588 ( 20.279 2.515 0.000) 20.434 12.675 ( 8.975 -2.963 0.000) 9.452 12.685 ( 31.131 2.000 0.000) 31.195 13.198 ( 5.857 -0.413 0.000) 5.872 14.110 ( -10.862 1.289 0.000) 10.938 14.557 ( -14.015 -0.081 0.000) 14.015 14.844 ( 1.553 -14.177 0.000) 14.262 15.321 ( -12.738 4.058 0.000) 13.369 15.612 ( -2.996 -3.405 0.000) 4.535 15.751 ( 4.208 2.573 0.000) 4.932 15.857 ( 2.441 9.942 0.000) 10.237 16.410 ( 3.917 -11.725 0.000) 12.362 16.528 ( 0.646 -9.382 0.000) 9.404 16.662 ( 0.151 -15.013 0.000) 15.013 16.723 ( 3.694 -8.581 0.000) 9.342 17.112 ( -15.708 -6.827 0.000) 17.127 18.678 ( 12.312 3.254 0.000) 12.735 19.051 ( 0.397 11.888 0.000) 11.895 19.118 ( 0.588 0.496 0.000) 0.769 19.573 ( -3.363 1.754 0.000) 3.793 ======================= Grid point 12 (9/120) ======================= q-point: ( 0.33 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.745 ( 21.571 4.220 0.000) 21.980 2.001 ( 26.756 -6.920 0.000) 27.636 2.654 ( 1.918 -4.426 0.000) 4.824 2.763 ( -12.196 -1.352 0.000) 12.271 3.030 ( 9.517 5.219 0.000) 10.854 3.136 ( -2.077 -3.152 0.000) 3.775 3.340 ( -9.697 -5.607 0.000) 11.202 3.379 ( 1.853 -5.429 0.000) 5.737 3.653 ( -1.025 -0.939 0.000) 1.390 3.680 ( 5.253 5.789 0.000) 7.817 3.914 ( -6.111 -8.439 0.000) 10.419 4.080 ( -16.633 -4.457 0.000) 17.220 4.871 ( 1.305 9.060 0.000) 9.153 4.937 ( 0.570 18.693 0.000) 18.701 5.552 ( 7.056 9.828 0.000) 12.099 5.988 ( 22.993 -1.422 0.000) 23.037 6.091 ( 24.348 1.985 0.000) 24.429 6.131 ( 17.559 4.586 0.000) 18.148 6.792 ( -13.899 -4.558 0.000) 14.627 7.175 ( -4.192 8.474 0.000) 9.454 7.217 ( -8.347 -8.263 0.000) 11.745 7.411 ( -14.697 -0.176 0.000) 14.698 7.633 ( -10.412 7.249 0.000) 12.687 7.713 ( -17.098 2.670 0.000) 17.305 7.780 ( 1.712 -6.488 0.000) 6.710 8.140 ( -5.378 -2.989 0.000) 6.152 8.255 ( 2.542 -4.652 0.000) 5.302 8.630 ( -10.690 -9.466 0.000) 14.279 9.035 ( 11.045 7.353 0.000) 13.269 9.570 ( -4.426 -2.001 0.000) 4.857 9.780 ( -1.031 3.016 0.000) 3.187 9.787 ( -1.426 -1.326 0.000) 1.947 10.135 ( -0.043 -1.598 0.000) 1.598 10.347 ( -6.308 -1.570 0.000) 6.501 10.782 ( 3.748 18.765 0.000) 19.135 10.841 ( 3.175 -5.142 0.000) 6.043 11.176 ( -8.157 13.450 0.000) 15.730 11.259 ( -1.549 -18.980 0.000) 19.043 12.067 ( 7.939 15.851 0.000) 17.728 12.674 ( 5.650 12.168 0.000) 13.415 12.861 ( 9.529 -6.599 0.000) 11.591 13.006 ( 15.336 -2.107 0.000) 15.480 13.245 ( 16.303 -9.463 0.000) 18.850 13.512 ( 32.348 5.738 0.000) 32.853 13.931 ( -6.173 -2.224 0.000) 6.561 14.277 ( -12.194 4.086 0.000) 12.860 14.829 ( -10.488 -5.561 0.000) 11.871 15.178 ( 8.302 0.604 0.000) 8.324 15.422 ( -16.646 5.110 0.000) 17.413 15.846 ( 4.650 2.876 0.000) 5.467 15.919 ( 2.854 5.593 0.000) 6.279 16.434 ( 1.283 -23.055 0.000) 23.091 16.605 ( 0.947 -4.940 0.000) 5.030 16.641 ( -2.132 -18.539 0.000) 18.662 16.736 ( -18.221 -6.559 0.000) 19.366 16.771 ( 1.277 -4.116 0.000) 4.309 18.929 ( 12.234 2.984 0.000) 12.593 19.060 ( 0.536 11.407 0.000) 11.419 19.113 ( -0.640 5.084 0.000) 5.124 19.485 ( -5.487 2.167 0.000) 5.899 ======================= Grid point 13 (10/120) ======================= q-point: ( 0.44 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 17.757 -0.862 0.000) 17.778 2.400 ( 3.038 -8.809 0.000) 9.318 2.543 ( -1.008 -0.317 0.000) 1.057 2.658 ( -2.402 -3.215 0.000) 4.013 3.041 ( -0.285 -2.778 0.000) 2.793 3.142 ( -9.199 -4.444 0.000) 10.216 3.227 ( 7.949 3.404 0.000) 8.647 3.373 ( -4.530 -2.083 0.000) 4.986 3.647 ( 1.669 -10.712 0.000) 10.841 3.715 ( -3.244 -13.977 0.000) 14.349 3.821 ( -2.360 0.414 0.000) 2.396 3.839 ( -5.845 -2.419 0.000) 6.326 4.932 ( 2.373 20.938 0.000) 21.072 4.946 ( 0.297 23.356 0.000) 23.358 5.852 ( 22.588 6.228 0.000) 23.431 6.324 ( -15.844 4.002 0.000) 16.342 6.470 ( 21.124 -2.389 0.000) 21.258 6.564 ( 21.630 1.830 0.000) 21.708 6.596 ( 15.140 0.172 0.000) 15.141 6.913 ( -19.325 -3.670 0.000) 19.670 6.995 ( -14.833 2.277 0.000) 15.006 7.048 ( -21.288 -0.914 0.000) 21.307 7.478 ( -4.734 6.674 0.000) 8.182 7.481 ( -3.755 6.808 0.000) 7.775 7.873 ( 6.161 -6.445 0.000) 8.916 8.009 ( -7.089 -5.432 0.000) 8.931 8.347 ( 5.688 -6.559 0.000) 8.682 8.466 ( -6.403 -8.448 0.000) 10.600 9.254 ( 10.465 3.684 0.000) 11.095 9.443 ( -8.112 0.339 0.000) 8.119 9.757 ( -0.749 2.427 0.000) 2.540 9.759 ( -0.971 0.709 0.000) 1.202 10.158 ( 2.483 -0.014 0.000) 2.483 10.233 ( -4.891 -0.206 0.000) 4.896 10.872 ( 5.141 15.572 0.000) 16.398 10.928 ( 3.554 -2.057 0.000) 4.106 11.039 ( -3.623 9.928 0.000) 10.568 11.132 ( -8.323 -9.702 0.000) 12.783 12.337 ( 16.072 10.136 0.000) 19.002 12.620 ( -10.202 8.592 0.000) 13.338 13.040 ( 7.466 -7.782 0.000) 10.784 13.131 ( -0.753 -7.672 0.000) 7.708 13.533 ( 13.900 -7.089 0.000) 15.604 13.790 ( -10.713 -8.123 0.000) 13.444 14.202 ( 6.896 9.355 0.000) 11.623 14.227 ( 30.765 3.734 0.000) 30.991 14.530 ( -11.116 8.587 0.000) 14.047 14.955 ( -28.930 7.983 0.000) 30.012 15.588 ( 27.426 -5.718 0.000) 28.016 15.921 ( 2.522 2.513 0.000) 3.560 15.952 ( 0.274 2.804 0.000) 2.817 16.171 ( -28.106 -6.697 0.000) 28.893 16.503 ( 3.715 -22.883 0.000) 23.183 16.581 ( -3.653 -20.730 0.000) 21.049 16.729 ( 3.379 -4.336 0.000) 5.497 16.774 ( -1.057 -3.649 0.000) 3.800 19.073 ( 0.706 10.233 0.000) 10.257 19.086 ( -0.135 7.630 0.000) 7.631 19.170 ( 9.697 3.395 0.000) 10.274 19.351 ( -7.921 2.595 0.000) 8.335 ======================= Grid point 18 (11/120) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.202 ( 0.000 29.837 0.000) 29.837 1.377 ( 0.000 34.226 0.000) 34.226 2.074 ( 0.000 46.395 0.000) 46.395 2.470 ( 0.000 -9.284 0.000) 9.284 2.976 ( 0.000 -17.746 0.000) 17.746 3.160 ( 0.000 -1.218 0.000) 1.218 3.242 ( 0.000 2.680 0.000) 2.680 3.709 ( 0.000 -5.915 0.000) 5.915 3.782 ( 0.000 10.184 0.000) 10.184 3.918 ( 0.000 -10.184 0.000) 10.184 4.209 ( 0.000 -8.428 0.000) 8.428 4.600 ( 0.000 -13.498 0.000) 13.498 4.885 ( 0.000 9.157 0.000) 9.157 4.945 ( 0.000 6.266 0.000) 6.266 5.156 ( 0.000 -1.708 0.000) 1.708 5.440 ( 0.000 -6.298 0.000) 6.298 5.875 ( 0.000 15.802 0.000) 15.802 5.946 ( 0.000 11.000 0.000) 11.000 6.705 ( 0.000 -16.652 0.000) 16.652 6.910 ( 0.000 -14.838 0.000) 14.838 7.357 ( 0.000 11.967 0.000) 11.967 7.774 ( 0.000 3.172 0.000) 3.172 7.984 ( 0.000 -4.178 0.000) 4.178 8.073 ( 0.000 -9.144 0.000) 9.144 8.295 ( 0.000 3.327 0.000) 3.327 8.446 ( 0.000 -2.077 0.000) 2.077 8.606 ( 0.000 4.460 0.000) 4.460 9.218 ( 0.000 -13.497 0.000) 13.497 9.280 ( 0.000 -0.943 0.000) 0.943 9.345 ( 0.000 -1.869 0.000) 1.869 9.525 ( 0.000 2.191 0.000) 2.191 9.598 ( 0.000 -0.087 0.000) 0.087 9.890 ( 0.000 0.719 0.000) 0.719 10.035 ( 0.000 -4.879 0.000) 4.879 10.580 ( 0.000 -3.084 0.000) 3.084 10.732 ( 0.000 -6.060 0.000) 6.060 11.021 ( 0.000 18.486 0.000) 18.486 11.614 ( 0.000 -2.537 0.000) 2.537 11.874 ( 0.000 12.950 0.000) 12.950 11.998 ( 0.000 3.520 0.000) 3.520 12.368 ( 0.000 2.607 0.000) 2.607 12.419 ( 0.000 -9.085 0.000) 9.085 12.637 ( 0.000 32.075 0.000) 32.075 13.701 ( 0.000 7.489 0.000) 7.489 14.462 ( 0.000 -17.066 0.000) 17.066 14.533 ( 0.000 7.297 0.000) 7.297 14.820 ( 0.000 -6.314 0.000) 6.314 15.064 ( 0.000 -33.264 0.000) 33.264 15.669 ( 0.000 11.561 0.000) 11.561 15.731 ( 0.000 2.763 0.000) 2.763 16.115 ( 0.000 -5.857 0.000) 5.857 16.118 ( 0.000 -4.215 0.000) 4.215 16.198 ( 0.000 5.303 0.000) 5.303 16.539 ( 0.000 -5.066 0.000) 5.066 16.564 ( 0.000 3.443 0.000) 3.443 17.234 ( 0.000 -12.397 0.000) 12.397 18.472 ( 0.000 6.362 0.000) 6.362 18.861 ( 0.000 -5.322 0.000) 5.322 19.298 ( 0.000 13.336 0.000) 13.336 19.657 ( 0.000 0.256 0.000) 0.256 ======================= Grid point 19 (12/120) ======================= q-point: ( 0.11 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( 9.950 25.665 0.000) 27.526 1.343 ( 2.701 30.923 0.000) 31.041 2.440 ( 28.615 34.840 0.000) 45.085 2.472 ( 0.278 -9.112 0.000) 9.116 2.933 ( -3.776 -18.013 0.000) 18.404 3.112 ( -4.719 -0.471 0.000) 4.743 3.228 ( -1.045 0.431 0.000) 1.130 3.630 ( -7.489 -7.133 0.000) 10.343 3.791 ( 0.448 10.441 0.000) 10.450 3.884 ( -2.617 -8.613 0.000) 9.002 4.120 ( -8.157 -0.019 0.000) 8.157 4.519 ( -8.007 -11.825 0.000) 14.281 4.987 ( 7.233 2.738 0.000) 7.734 5.009 ( 5.953 7.721 0.000) 9.749 5.257 ( 9.874 -1.800 0.000) 10.037 5.387 ( -3.092 -6.312 0.000) 7.028 5.862 ( -3.464 18.415 0.000) 18.738 5.905 ( 3.256 15.045 0.000) 15.393 6.807 ( 7.543 -18.238 0.000) 19.736 6.881 ( -2.579 -13.461 0.000) 13.706 7.385 ( 2.396 11.797 0.000) 12.038 7.762 ( -1.918 1.515 0.000) 2.444 7.890 ( -8.141 -4.317 0.000) 9.215 8.075 ( -0.035 -8.453 0.000) 8.454 8.098 ( -11.289 7.680 0.000) 13.654 8.390 ( -6.667 -2.792 0.000) 7.228 8.482 ( -11.442 4.365 0.000) 12.246 9.021 ( -2.540 12.855 0.000) 13.104 9.032 ( -15.028 -11.657 0.000) 19.019 9.567 ( 2.382 0.537 0.000) 2.442 9.682 ( 6.105 -1.070 0.000) 6.198 9.689 ( 4.167 -10.515 0.000) 11.311 10.052 ( 4.661 -2.681 0.000) 5.377 10.238 ( 27.252 -12.333 0.000) 29.913 10.536 ( -4.022 -2.283 0.000) 4.625 10.722 ( -0.982 -6.118 0.000) 6.196 11.064 ( 4.082 20.313 0.000) 20.719 11.804 ( -6.077 15.470 0.000) 16.620 11.805 ( 16.612 -4.078 0.000) 17.105 12.177 ( 17.516 2.322 0.000) 17.669 12.421 ( 4.782 -1.514 0.000) 5.016 12.456 ( 4.501 -6.229 0.000) 7.686 12.720 ( 7.567 31.178 0.000) 32.083 13.492 ( -15.057 13.435 0.000) 20.179 14.379 ( -12.326 1.178 0.000) 12.382 14.480 ( 0.327 -20.482 0.000) 20.484 14.757 ( -7.190 -2.379 0.000) 7.574 15.171 ( 9.152 -29.882 0.000) 31.252 15.613 ( -5.598 9.597 0.000) 11.110 15.750 ( 2.279 4.043 0.000) 4.641 16.074 ( -3.344 4.684 0.000) 5.755 16.188 ( 6.357 -6.129 0.000) 8.830 16.268 ( 4.440 -7.901 0.000) 9.063 16.495 ( -6.824 2.256 0.000) 7.187 16.565 ( 2.711 -4.830 0.000) 5.539 17.158 ( -7.636 -12.320 0.000) 14.495 18.558 ( 8.105 6.277 0.000) 10.251 18.957 ( 7.489 -6.041 0.000) 9.622 19.299 ( 0.019 13.172 0.000) 13.172 19.645 ( -1.266 0.463 0.000) 1.348 ======================= Grid point 20 (13/120) ======================= q-point: ( 0.22 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 16.959 15.308 0.000) 22.846 1.565 ( 14.706 17.130 0.000) 22.577 2.485 ( 1.115 -9.250 0.000) 9.317 2.837 ( -3.511 -21.013 0.000) 21.305 2.959 ( 1.730 4.623 0.000) 4.936 3.018 ( 10.727 13.373 0.000) 17.144 3.218 ( 0.275 -3.823 0.000) 3.833 3.440 ( -10.575 -7.203 0.000) 12.795 3.775 ( -2.607 7.827 0.000) 8.250 3.859 ( 1.144 -0.612 0.000) 1.298 3.922 ( -10.692 5.468 0.000) 12.009 4.292 ( -13.991 -8.129 0.000) 16.181 5.004 ( -2.578 3.706 0.000) 4.514 5.159 ( 8.311 12.458 0.000) 14.976 5.517 ( 14.293 -4.125 0.000) 14.876 5.537 ( 17.639 -2.303 0.000) 17.789 5.887 ( 6.310 18.953 0.000) 19.976 6.019 ( 8.431 12.368 0.000) 14.968 6.815 ( -4.056 -10.596 0.000) 11.346 6.949 ( 6.084 -17.565 0.000) 18.589 7.427 ( 1.076 12.860 0.000) 12.904 7.667 ( -7.959 0.199 0.000) 7.961 7.742 ( -6.893 -4.285 0.000) 8.117 7.915 ( -7.462 6.427 0.000) 9.848 8.031 ( -7.127 -3.967 0.000) 8.157 8.219 ( -11.356 1.214 0.000) 11.421 8.230 ( -7.532 -3.616 0.000) 8.355 8.690 ( -17.941 -13.273 0.000) 22.317 9.071 ( 5.563 13.231 0.000) 14.353 9.594 ( 0.016 0.590 0.000) 0.590 9.716 ( 0.419 -7.289 0.000) 7.301 9.777 ( 2.821 -1.778 0.000) 3.334 10.117 ( 2.509 1.582 0.000) 2.966 10.440 ( -5.025 -0.373 0.000) 5.039 10.698 ( 16.200 -19.038 0.000) 24.998 10.704 ( -0.351 -6.381 0.000) 6.391 11.158 ( 4.571 23.955 0.000) 24.388 11.663 ( -7.524 18.836 0.000) 20.283 12.121 ( 11.396 -2.863 0.000) 11.750 12.540 ( 6.680 -7.654 0.000) 10.159 12.608 ( 20.845 -0.077 0.000) 20.845 12.703 ( 22.040 -2.016 0.000) 22.132 12.893 ( 8.239 26.931 0.000) 28.164 13.294 ( -0.383 12.101 0.000) 12.108 14.111 ( -13.494 -2.401 0.000) 13.706 14.494 ( 2.853 -21.723 0.000) 21.910 14.565 ( -10.613 1.244 0.000) 10.686 15.362 ( 8.727 -23.943 0.000) 25.484 15.440 ( -11.076 8.189 0.000) 13.775 15.830 ( 5.438 5.920 0.000) 8.038 16.017 ( -2.401 2.147 0.000) 3.221 16.261 ( -9.871 0.912 0.000) 9.913 16.320 ( 0.960 -10.581 0.000) 10.625 16.363 ( 3.910 -9.091 0.000) 9.896 16.635 ( 3.480 -5.019 0.000) 6.107 16.926 ( -15.510 -12.192 0.000) 19.729 18.767 ( 11.936 5.902 0.000) 13.315 19.096 ( 5.781 -2.974 0.000) 6.501 19.298 ( -0.119 12.626 0.000) 12.627 19.605 ( -2.821 1.049 0.000) 3.010 ======================= Grid point 21 (14/120) ======================= q-point: ( 0.33 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( 14.688 8.453 0.000) 16.947 1.942 ( 19.764 1.997 0.000) 19.865 2.518 ( 2.066 -9.803 0.000) 10.019 2.697 ( -10.075 -8.811 0.000) 13.384 2.896 ( 0.679 -6.539 0.000) 6.574 3.202 ( 1.841 -1.598 0.000) 2.438 3.220 ( -4.858 -6.058 0.000) 7.766 3.255 ( -3.067 -6.566 0.000) 7.247 3.679 ( -6.549 3.633 0.000) 7.489 3.707 ( -10.081 1.816 0.000) 10.243 3.896 ( -0.722 3.716 0.000) 3.786 3.995 ( -14.284 -4.709 0.000) 15.040 5.105 ( 13.775 15.697 0.000) 20.884 5.318 ( 7.021 19.558 0.000) 20.780 5.754 ( 8.742 7.687 0.000) 11.642 5.942 ( 22.092 -3.646 0.000) 22.390 6.162 ( 20.425 7.184 0.000) 21.651 6.251 ( 14.571 7.920 0.000) 16.584 6.699 ( -8.198 -5.303 0.000) 9.764 7.020 ( -0.665 -12.713 0.000) 12.731 7.377 ( -8.368 12.758 0.000) 15.257 7.420 ( -16.191 0.547 0.000) 16.200 7.582 ( -8.513 -8.230 0.000) 11.841 7.778 ( -12.560 3.951 0.000) 13.167 7.808 ( -2.946 6.457 0.000) 7.097 8.059 ( -9.011 -5.368 0.000) 10.489 8.153 ( 0.106 -5.842 0.000) 5.843 8.383 ( -10.431 -15.819 0.000) 18.949 9.204 ( 7.197 9.898 0.000) 12.238 9.562 ( -3.182 1.345 0.000) 3.455 9.723 ( 0.351 -5.723 0.000) 5.734 9.793 ( -0.904 -2.019 0.000) 2.212 10.162 ( 2.182 5.017 0.000) 5.471 10.347 ( -4.164 2.252 0.000) 4.734 10.722 ( 2.285 -7.294 0.000) 7.643 10.892 ( 3.637 -17.754 0.000) 18.123 11.236 ( 3.289 26.221 0.000) 26.426 11.516 ( -6.905 21.518 0.000) 22.599 12.305 ( 9.777 6.744 0.000) 11.878 12.674 ( 6.300 -13.109 0.000) 14.545 12.887 ( 4.293 -8.775 0.000) 9.769 12.986 ( -0.367 19.714 0.000) 19.717 13.102 ( 17.692 -5.435 0.000) 18.508 13.660 ( 33.296 10.730 0.000) 34.982 13.862 ( -11.282 -5.547 0.000) 12.572 14.393 ( -4.816 8.511 0.000) 9.779 14.638 ( 10.120 -14.698 0.000) 17.845 15.236 ( -5.734 5.949 0.000) 8.262 15.472 ( -0.680 -7.212 0.000) 7.244 15.878 ( -7.545 -2.587 0.000) 7.976 15.963 ( -3.150 -7.348 0.000) 7.994 16.043 ( -0.130 -5.578 0.000) 5.580 16.316 ( -1.379 -6.728 0.000) 6.867 16.469 ( -3.284 -9.327 0.000) 9.888 16.560 ( -13.617 -11.205 0.000) 17.634 16.683 ( 1.069 -5.744 0.000) 5.843 19.010 ( 11.843 5.206 0.000) 12.937 19.188 ( 3.616 2.031 0.000) 4.147 19.292 ( -0.541 11.523 0.000) 11.535 19.529 ( -4.828 1.923 0.000) 5.197 ======================= Grid point 22 (15/120) ======================= q-point: ( 0.44 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( 11.657 0.670 0.000) 11.677 2.249 ( 6.026 -5.371 0.000) 8.072 2.521 ( -3.691 -3.048 0.000) 4.787 2.545 ( -0.450 -8.703 0.000) 8.715 2.952 ( 3.928 -5.422 0.000) 6.696 3.066 ( -7.430 -3.051 0.000) 8.032 3.214 ( 1.533 -6.939 0.000) 7.106 3.251 ( -0.924 -8.831 0.000) 8.879 3.545 ( -4.930 0.099 0.000) 4.931 3.551 ( -4.941 0.853 0.000) 5.014 3.793 ( -4.137 -3.112 0.000) 5.177 3.820 ( -4.807 -1.453 0.000) 5.022 5.383 ( 8.511 24.884 0.000) 26.299 5.422 ( 2.782 24.892 0.000) 25.047 5.994 ( 17.629 7.177 0.000) 19.034 6.331 ( -0.235 -7.119 0.000) 7.122 6.465 ( 8.221 6.063 0.000) 10.215 6.612 ( 22.714 3.305 0.000) 22.953 6.642 ( 16.480 3.353 0.000) 16.818 6.840 ( -16.583 -3.413 0.000) 16.931 7.046 ( -20.471 0.473 0.000) 20.476 7.064 ( -20.508 5.525 0.000) 21.240 7.514 ( 2.574 -7.591 0.000) 8.016 7.615 ( -5.862 5.733 0.000) 8.199 7.786 ( 0.669 1.523 0.000) 1.664 7.860 ( -7.740 -8.927 0.000) 11.815 8.197 ( 3.299 -8.592 0.000) 9.203 8.264 ( -3.539 -11.858 0.000) 12.375 9.346 ( 6.846 5.944 0.000) 9.067 9.473 ( -5.560 2.975 0.000) 6.306 9.734 ( 0.886 -4.018 0.000) 4.114 9.761 ( -1.798 -2.644 0.000) 3.198 10.211 ( 2.758 6.188 0.000) 6.775 10.272 ( -3.362 4.925 0.000) 5.963 10.793 ( 4.476 -9.457 0.000) 10.463 10.881 ( -3.526 -13.367 0.000) 13.824 11.303 ( 3.696 25.949 0.000) 26.210 11.392 ( -5.334 23.959 0.000) 24.546 12.545 ( 13.324 8.079 0.000) 15.582 12.749 ( -2.253 -9.425 0.000) 9.691 12.897 ( -4.304 6.694 0.000) 7.958 12.902 ( -1.224 -12.818 0.000) 12.876 13.402 ( 12.665 -7.500 0.000) 14.719 13.640 ( -11.330 -8.407 0.000) 14.108 14.338 ( 25.841 8.794 0.000) 27.296 14.406 ( 5.060 13.134 0.000) 14.075 14.728 ( 3.610 10.744 0.000) 11.334 15.165 ( -27.029 13.462 0.000) 30.196 15.428 ( 24.064 -10.638 0.000) 26.310 15.807 ( 2.310 -24.794 0.000) 24.902 15.889 ( -4.120 -16.575 0.000) 17.079 15.992 ( -27.748 -11.863 0.000) 30.178 16.156 ( 5.783 -1.262 0.000) 5.919 16.262 ( -4.099 -3.222 0.000) 5.214 16.613 ( 4.280 -7.657 0.000) 8.772 16.675 ( -1.819 -6.643 0.000) 6.888 19.220 ( 7.045 5.562 0.000) 8.976 19.256 ( 5.064 5.005 0.000) 7.120 19.274 ( -1.330 9.580 0.000) 9.672 19.408 ( -7.210 2.969 0.000) 7.798 ======================= Grid point 27 (16/120) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( 0.000 26.222 0.000) 26.222 1.992 ( 0.000 30.298 0.000) 30.298 2.182 ( 0.000 -20.133 0.000) 20.133 2.499 ( 0.000 -19.718 0.000) 19.718 2.864 ( 0.000 21.799 0.000) 21.799 3.118 ( 0.000 -4.858 0.000) 4.858 3.364 ( 0.000 9.026 0.000) 9.026 3.548 ( 0.000 -9.681 0.000) 9.681 3.815 ( 0.000 1.519 0.000) 1.519 3.989 ( 0.000 -13.571 0.000) 13.571 4.034 ( 0.000 14.747 0.000) 14.747 4.323 ( 0.000 -15.329 0.000) 15.329 5.047 ( 0.000 4.385 0.000) 4.385 5.077 ( 0.000 10.813 0.000) 10.813 5.114 ( 0.000 -2.754 0.000) 2.754 5.281 ( 0.000 -10.170 0.000) 10.170 6.159 ( 0.000 11.582 0.000) 11.582 6.215 ( 0.000 19.373 0.000) 19.373 6.402 ( 0.000 -14.461 0.000) 14.461 6.584 ( 0.000 -18.913 0.000) 18.913 7.609 ( 0.000 14.027 0.000) 14.027 7.838 ( 0.000 3.512 0.000) 3.512 7.866 ( 0.000 -12.516 0.000) 12.516 7.908 ( 0.000 -3.852 0.000) 3.852 8.354 ( 0.000 2.838 0.000) 2.838 8.403 ( 0.000 -2.408 0.000) 2.408 8.736 ( 0.000 9.333 0.000) 9.333 8.955 ( 0.000 -13.334 0.000) 13.334 9.280 ( 0.000 0.916 0.000) 0.916 9.308 ( 0.000 -1.870 0.000) 1.870 9.564 ( 0.000 1.788 0.000) 1.788 9.590 ( 0.000 -0.895 0.000) 0.895 9.913 ( 0.000 1.783 0.000) 1.783 9.959 ( 0.000 -3.176 0.000) 3.176 10.563 ( 0.000 1.308 0.000) 1.308 10.624 ( 0.000 -4.878 0.000) 4.878 11.334 ( 0.000 13.798 0.000) 13.798 11.530 ( 0.000 -6.883 0.000) 6.883 12.088 ( 0.000 6.206 0.000) 6.206 12.116 ( 0.000 11.807 0.000) 11.807 12.238 ( 0.000 -9.340 0.000) 9.340 12.299 ( 0.000 -7.137 0.000) 7.137 13.395 ( 0.000 43.906 0.000) 43.906 13.887 ( 0.000 11.986 0.000) 11.986 14.150 ( 0.000 -15.472 0.000) 15.472 14.243 ( 0.000 -43.996 0.000) 43.996 14.668 ( 0.000 6.594 0.000) 6.594 14.780 ( 0.000 -5.435 0.000) 5.435 15.819 ( 0.000 6.538 0.000) 6.538 15.866 ( 0.000 9.158 0.000) 9.158 15.969 ( 0.000 -8.616 0.000) 8.616 16.015 ( 0.000 -6.608 0.000) 6.608 16.310 ( 0.000 6.302 0.000) 6.302 16.430 ( 0.000 -6.219 0.000) 6.219 16.723 ( 0.000 11.946 0.000) 11.946 16.977 ( 0.000 -14.114 0.000) 14.114 18.605 ( 0.000 7.397 0.000) 7.397 18.743 ( 0.000 -6.949 0.000) 6.949 19.513 ( 0.000 8.874 0.000) 8.874 19.630 ( 0.000 -3.537 0.000) 3.537 ======================= Grid point 28 (17/120) ======================= q-point: ( 0.11 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( 4.697 24.084 0.000) 24.538 1.931 ( -3.293 30.139 0.000) 30.319 2.200 ( 1.694 -18.876 0.000) 18.952 2.462 ( -3.552 -24.948 0.000) 25.200 2.989 ( 8.911 14.356 0.000) 16.897 3.109 ( -1.437 -1.049 0.000) 1.779 3.307 ( -4.891 7.241 0.000) 8.738 3.470 ( -7.120 -9.123 0.000) 11.572 3.848 ( 4.099 6.466 0.000) 7.656 4.021 ( -1.750 13.171 0.000) 13.287 4.037 ( 2.571 -9.054 0.000) 9.412 4.276 ( -4.827 -13.418 0.000) 14.260 5.072 ( 0.621 6.622 0.000) 6.651 5.134 ( 8.247 5.249 0.000) 9.776 5.211 ( 9.435 -3.113 0.000) 9.935 5.232 ( -2.379 -9.360 0.000) 9.658 6.178 ( 2.322 15.469 0.000) 15.642 6.230 ( 1.651 18.480 0.000) 18.553 6.474 ( 6.009 -16.416 0.000) 17.482 6.580 ( -0.308 -17.734 0.000) 17.737 7.635 ( 2.406 13.805 0.000) 14.013 7.789 ( -4.475 1.438 0.000) 4.700 7.824 ( -6.913 -2.520 0.000) 7.358 7.883 ( 1.547 -11.790 0.000) 11.891 8.226 ( -9.404 5.877 0.000) 11.090 8.323 ( -7.678 -4.337 0.000) 8.818 8.600 ( -12.690 8.297 0.000) 15.162 8.797 ( -14.265 -12.141 0.000) 18.732 9.248 ( 2.202 11.454 0.000) 11.664 9.468 ( 6.072 -11.867 0.000) 13.331 9.598 ( 2.617 2.446 0.000) 3.583 9.647 ( 4.311 -2.449 0.000) 4.959 10.040 ( 8.433 1.161 0.000) 8.513 10.093 ( 14.526 -4.534 0.000) 15.217 10.534 ( -2.559 2.143 0.000) 3.338 10.609 ( -1.395 -5.350 0.000) 5.529 11.422 ( 7.964 16.735 0.000) 18.534 11.677 ( 12.948 -9.866 0.000) 16.279 12.089 ( -2.494 13.856 0.000) 14.079 12.232 ( 14.365 3.744 0.000) 14.845 12.310 ( 0.963 -9.019 0.000) 9.070 12.328 ( 9.744 -6.357 0.000) 11.634 13.426 ( 2.620 40.460 0.000) 40.545 13.766 ( -9.886 15.931 0.000) 18.749 14.100 ( -4.219 -19.116 0.000) 19.576 14.154 ( -8.117 -30.805 0.000) 31.856 14.709 ( -1.061 -1.926 0.000) 2.199 14.745 ( 1.864 -7.687 0.000) 7.909 15.799 ( -6.486 9.720 0.000) 11.686 15.862 ( 4.178 7.724 0.000) 8.782 15.978 ( -4.166 -9.153 0.000) 10.057 16.031 ( 5.606 -9.442 0.000) 10.981 16.323 ( 1.554 7.359 0.000) 7.522 16.457 ( 2.635 -6.498 0.000) 7.012 16.647 ( -7.649 11.938 0.000) 14.178 16.902 ( -7.596 -14.128 0.000) 16.040 18.691 ( 7.947 7.421 0.000) 10.873 18.831 ( 7.799 -7.152 0.000) 10.582 19.510 ( -0.372 8.644 0.000) 8.652 19.622 ( -0.834 -3.294 0.000) 3.398 ======================= Grid point 29 (18/120) ======================= q-point: ( 0.22 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( 7.312 18.628 0.000) 20.012 1.938 ( 4.448 23.473 0.000) 23.891 2.244 ( 2.565 -15.766 0.000) 15.973 2.401 ( -1.614 -24.413 0.000) 24.466 3.020 ( -5.056 4.525 0.000) 6.786 3.112 ( 0.343 -3.261 0.000) 3.279 3.205 ( -4.437 2.603 0.000) 5.144 3.301 ( -8.697 -6.833 0.000) 11.060 3.943 ( -6.276 9.555 0.000) 11.432 3.949 ( 2.222 7.331 0.000) 7.661 4.009 ( -5.138 1.519 0.000) 5.358 4.125 ( -10.087 -9.382 0.000) 13.776 5.126 ( 7.601 10.014 0.000) 12.572 5.355 ( 15.289 -12.038 0.000) 19.459 5.357 ( 13.390 8.192 0.000) 15.697 5.475 ( 16.305 -4.502 0.000) 16.915 6.256 ( 5.367 19.004 0.000) 19.748 6.289 ( 4.484 15.446 0.000) 16.084 6.577 ( 0.086 -14.277 0.000) 14.277 6.606 ( 6.691 -18.194 0.000) 19.385 7.664 ( -8.196 -0.042 0.000) 8.196 7.680 ( -7.984 -1.927 0.000) 8.213 7.692 ( 2.655 13.973 0.000) 14.223 7.914 ( 0.843 -8.790 0.000) 8.830 8.039 ( -8.313 6.266 0.000) 10.410 8.147 ( -8.393 -5.059 0.000) 9.799 8.275 ( -18.327 5.150 0.000) 19.037 8.437 ( -20.688 -11.962 0.000) 23.897 9.317 ( 3.937 12.557 0.000) 13.160 9.541 ( 2.226 -10.785 0.000) 11.013 9.636 ( 0.674 3.565 0.000) 3.628 9.715 ( 1.861 -4.266 0.000) 4.654 10.203 ( 7.286 7.353 0.000) 10.351 10.395 ( 12.818 -12.925 0.000) 18.204 10.477 ( -2.780 4.050 0.000) 4.912 10.580 ( -1.144 -6.396 0.000) 6.498 11.602 ( 8.838 21.887 0.000) 23.604 11.955 ( 13.232 -14.345 0.000) 19.516 12.025 ( -3.632 18.439 0.000) 18.793 12.335 ( 1.468 -13.734 0.000) 13.812 12.608 ( 19.811 0.562 0.000) 19.819 12.641 ( 19.381 -3.000 0.000) 19.612 13.462 ( -0.312 30.804 0.000) 30.806 13.623 ( 0.156 21.008 0.000) 21.009 13.947 ( -11.948 -17.201 0.000) 20.943 14.054 ( 2.440 -23.746 0.000) 23.871 14.627 ( -3.177 6.390 0.000) 7.136 14.877 ( 8.306 -21.516 0.000) 23.064 15.622 ( -10.518 10.909 0.000) 15.154 15.851 ( -8.024 -12.956 0.000) 15.239 15.975 ( 6.629 9.184 0.000) 11.326 16.166 ( 7.233 -10.451 0.000) 12.710 16.366 ( 2.208 8.246 0.000) 8.537 16.414 ( -15.565 12.004 0.000) 19.657 16.518 ( 2.820 -7.246 0.000) 7.775 16.670 ( -15.496 -14.187 0.000) 21.010 18.890 ( 11.113 6.740 0.000) 12.997 19.011 ( 9.286 -5.699 0.000) 10.895 19.497 ( -1.004 7.904 0.000) 7.967 19.594 ( -1.983 -2.553 0.000) 3.232 ======================= Grid point 30 (19/120) ======================= q-point: ( 0.33 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( 7.231 11.809 0.000) 13.847 2.089 ( 9.367 13.028 0.000) 16.046 2.298 ( 2.779 -12.705 0.000) 13.005 2.401 ( 0.767 -18.440 0.000) 18.456 2.916 ( -3.780 5.931 0.000) 7.033 3.069 ( -3.173 -9.282 0.000) 9.809 3.142 ( -3.191 -1.740 0.000) 3.635 3.157 ( -4.206 -3.260 0.000) 5.321 3.776 ( -9.627 6.084 0.000) 11.388 3.816 ( -10.151 7.017 0.000) 12.340 3.894 ( -11.932 -5.968 0.000) 13.341 3.913 ( -7.238 -2.480 0.000) 7.651 5.443 ( 21.495 18.391 0.000) 28.289 5.637 ( 13.504 13.676 0.000) 19.219 5.729 ( 18.899 -9.868 0.000) 21.321 5.838 ( 18.875 -7.705 0.000) 20.387 6.405 ( 10.443 16.798 0.000) 19.779 6.419 ( 8.717 9.240 0.000) 12.703 6.581 ( 0.269 -7.417 0.000) 7.422 6.734 ( 5.797 -16.946 0.000) 17.910 7.428 ( -15.605 0.661 0.000) 15.619 7.465 ( -13.117 -3.762 0.000) 13.646 7.653 ( -13.157 15.751 0.000) 20.523 7.852 ( -3.997 1.820 0.000) 4.392 7.926 ( -3.029 6.019 0.000) 6.738 7.946 ( -19.250 -5.029 0.000) 19.896 8.039 ( -2.022 -5.997 0.000) 6.328 8.070 ( -6.609 -15.064 0.000) 16.450 9.396 ( 3.900 10.092 0.000) 10.819 9.579 ( 1.820 -8.954 0.000) 9.137 9.619 ( -2.279 4.443 0.000) 4.993 9.717 ( -1.508 -5.305 0.000) 5.515 10.320 ( 4.328 11.194 0.000) 12.002 10.434 ( -1.473 6.450 0.000) 6.616 10.574 ( 5.166 -15.319 0.000) 16.167 10.574 ( 0.656 -7.954 0.000) 7.981 11.751 ( 5.716 26.655 0.000) 27.261 11.952 ( -3.490 23.334 0.000) 23.593 12.195 ( 10.456 -17.961 0.000) 20.783 12.364 ( 1.357 -19.396 0.000) 19.443 12.851 ( 4.703 5.508 0.000) 7.243 12.988 ( 13.672 -7.164 0.000) 15.435 13.377 ( -8.215 20.052 0.000) 21.670 13.695 ( -12.851 -12.676 0.000) 18.050 13.930 ( 29.094 17.487 0.000) 33.945 14.297 ( 22.166 -20.007 0.000) 29.860 14.629 ( 3.492 17.186 0.000) 17.537 15.057 ( 9.426 -26.932 0.000) 28.534 15.405 ( -10.355 11.693 0.000) 15.619 15.676 ( -9.132 -16.647 0.000) 18.988 15.984 ( -21.441 12.034 0.000) 24.588 16.131 ( 1.733 6.706 0.000) 6.926 16.259 ( -13.529 -10.991 0.000) 17.431 16.344 ( -0.598 -10.829 0.000) 10.846 16.391 ( -0.012 8.438 0.000) 8.438 16.552 ( 0.324 -7.934 0.000) 7.941 19.111 ( 10.504 4.967 0.000) 11.619 19.184 ( 7.739 -2.319 0.000) 8.079 19.466 ( -2.092 6.538 0.000) 6.865 19.539 ( -3.644 -1.305 0.000) 3.870 ======================= Grid point 31 (20/120) ======================= q-point: ( 0.44 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( 5.549 5.785 0.000) 8.016 2.237 ( 3.044 4.384 0.000) 5.337 2.352 ( 2.300 -10.458 0.000) 10.708 2.389 ( -1.800 -9.835 0.000) 9.998 2.924 ( 4.648 3.307 0.000) 5.704 3.046 ( -5.779 1.290 0.000) 5.922 3.046 ( 1.912 -8.633 0.000) 8.842 3.112 ( -2.916 -5.481 0.000) 6.209 3.616 ( -4.482 5.007 0.000) 6.720 3.638 ( -6.226 6.831 0.000) 9.243 3.715 ( -3.875 -4.967 0.000) 6.299 3.756 ( -6.636 -5.106 0.000) 8.373 5.815 ( 10.841 18.886 0.000) 21.776 5.845 ( 5.851 19.043 0.000) 19.921 6.042 ( 12.636 -4.161 0.000) 13.303 6.141 ( 6.950 -12.532 0.000) 14.330 6.596 ( 6.705 6.309 0.000) 9.206 6.672 ( 13.046 -1.147 0.000) 13.096 6.695 ( 14.919 5.327 0.000) 15.841 6.783 ( -2.679 -3.322 0.000) 4.268 7.086 ( -15.577 5.176 0.000) 16.414 7.233 ( -22.910 12.621 0.000) 26.156 7.273 ( -0.123 -13.675 0.000) 13.676 7.511 ( -19.910 -14.670 0.000) 24.731 7.861 ( 1.622 7.994 0.000) 8.157 7.890 ( -1.269 7.148 0.000) 7.260 8.036 ( 0.689 -8.194 0.000) 8.223 8.045 ( -0.103 -10.879 0.000) 10.879 9.475 ( 4.013 7.446 0.000) 8.459 9.555 ( -3.817 5.536 0.000) 6.725 9.619 ( 2.272 -7.358 0.000) 7.701 9.670 ( -2.705 -6.120 0.000) 6.691 10.382 ( 2.096 11.266 0.000) 11.459 10.411 ( -1.023 9.123 0.000) 9.180 10.600 ( 1.597 -10.414 0.000) 10.536 10.620 ( 0.090 -13.495 0.000) 13.495 11.835 ( 3.041 28.746 0.000) 28.906 11.890 ( -2.769 27.186 0.000) 27.327 12.348 ( 4.338 -23.865 0.000) 24.256 12.382 ( 0.136 -23.863 0.000) 23.864 12.954 ( 7.846 13.479 0.000) 15.596 13.164 ( -11.844 15.771 0.000) 19.723 13.214 ( 10.534 -12.439 0.000) 16.301 13.441 ( -12.197 -12.805 0.000) 17.685 14.573 ( 27.732 15.401 0.000) 31.722 14.732 ( 4.783 21.732 0.000) 22.252 14.826 ( 26.185 -5.568 0.000) 26.771 15.231 ( 4.850 -30.158 0.000) 30.546 15.283 ( 2.588 1.316 0.000) 2.904 15.444 ( -27.181 15.416 0.000) 31.248 15.501 ( -7.040 -18.370 0.000) 19.673 15.735 ( -26.854 -14.809 0.000) 30.666 16.270 ( 5.566 8.900 0.000) 10.497 16.360 ( -3.130 8.596 0.000) 9.148 16.448 ( 5.152 -9.383 0.000) 10.705 16.528 ( -2.679 -8.620 0.000) 9.027 19.300 ( 8.090 2.877 0.000) 8.587 19.319 ( 5.890 1.141 0.000) 5.999 19.409 ( -3.721 4.444 0.000) 5.796 19.445 ( -5.800 0.402 0.000) 5.813 ======================= Grid point 63 (21/120) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.558 ( 0.000 0.000 28.874) 28.874 0.619 ( 0.000 0.000 31.870) 31.870 1.125 ( 0.000 0.000 57.558) 57.558 2.585 ( 0.000 0.000 5.596) 5.596 3.148 ( 0.000 0.000 -9.075) 9.075 3.235 ( 0.000 0.000 -2.529) 2.529 3.347 ( 0.000 0.000 -0.769) 0.769 3.537 ( 0.000 0.000 -0.072) 0.072 3.802 ( 0.000 0.000 -6.444) 6.444 4.090 ( 0.000 0.000 -20.648) 20.648 4.139 ( 0.000 0.000 -9.612) 9.612 4.725 ( 0.000 0.000 3.869) 3.869 4.876 ( 0.000 0.000 8.666) 8.666 4.880 ( 0.000 0.000 -3.594) 3.594 5.005 ( 0.000 0.000 4.679) 4.679 5.529 ( 0.000 0.000 -1.596) 1.596 5.644 ( 0.000 0.000 9.682) 9.682 5.650 ( 0.000 0.000 9.974) 9.974 7.065 ( 0.000 0.000 -4.200) 4.200 7.142 ( 0.000 0.000 3.499) 3.499 7.552 ( 0.000 0.000 -0.288) 0.288 7.564 ( 0.000 0.000 0.311) 0.311 7.791 ( 0.000 0.000 9.545) 9.545 8.008 ( 0.000 0.000 -12.256) 12.256 8.420 ( 0.000 0.000 -7.934) 7.934 8.484 ( 0.000 0.000 -4.284) 4.284 8.512 ( 0.000 0.000 -3.622) 3.622 9.250 ( 0.000 0.000 -6.045) 6.045 9.338 ( 0.000 0.000 -5.581) 5.581 9.559 ( 0.000 0.000 5.526) 5.526 9.565 ( 0.000 0.000 -2.541) 2.541 9.702 ( 0.000 0.000 -9.573) 9.573 10.191 ( 0.000 0.000 -11.373) 11.373 10.382 ( 0.000 0.000 21.102) 21.102 10.450 ( 0.000 0.000 7.480) 7.480 10.992 ( 0.000 0.000 9.076) 9.076 11.161 ( 0.000 0.000 0.838) 0.838 11.215 ( 0.000 0.000 -6.019) 6.019 11.604 ( 0.000 0.000 2.338) 2.338 11.763 ( 0.000 0.000 9.285) 9.285 11.789 ( 0.000 0.000 5.663) 5.663 12.032 ( 0.000 0.000 11.888) 11.888 12.601 ( 0.000 0.000 -0.419) 0.419 13.461 ( 0.000 0.000 -10.950) 10.950 14.254 ( 0.000 0.000 -10.599) 10.599 14.672 ( 0.000 0.000 -20.220) 20.220 14.844 ( 0.000 0.000 -12.147) 12.147 15.586 ( 0.000 0.000 -11.959) 11.959 15.653 ( 0.000 0.000 16.227) 16.227 15.694 ( 0.000 0.000 -2.100) 2.100 16.182 ( 0.000 0.000 3.521) 3.521 16.474 ( 0.000 0.000 16.532) 16.532 16.580 ( 0.000 0.000 -5.801) 5.801 16.618 ( 0.000 0.000 -6.704) 6.704 16.957 ( 0.000 0.000 -2.745) 2.745 17.127 ( 0.000 0.000 1.110) 1.110 18.484 ( 0.000 0.000 13.614) 13.614 18.910 ( 0.000 0.000 -0.097) 0.097 19.022 ( 0.000 0.000 -0.484) 0.484 19.621 ( 0.000 0.000 -0.209) 0.209 ======================= Grid point 64 (22/120) ======================= q-point: ( 0.11 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( 21.510 0.000 19.467) 29.011 0.968 ( 28.050 0.000 19.396) 34.103 1.604 ( 40.025 0.000 37.750) 55.019 2.614 ( 2.656 0.000 5.189) 5.829 3.105 ( -4.672 0.000 -4.688) 6.618 3.232 ( 0.693 0.000 -7.899) 7.929 3.349 ( -0.051 0.000 -0.149) 0.157 3.541 ( 1.845 0.000 -1.115) 2.156 3.719 ( -7.863 0.000 -7.193) 10.657 3.915 ( -15.230 0.000 -10.415) 18.451 4.110 ( -2.591 0.000 -9.458) 9.806 4.749 ( 2.827 0.000 -1.184) 3.065 4.776 ( -10.097 0.000 -2.792) 10.476 4.881 ( -0.681 0.000 2.963) 3.040 5.124 ( 10.042 0.000 2.151) 10.270 5.345 ( -5.293 0.000 2.096) 5.693 5.708 ( 2.232 0.000 13.642) 13.823 5.748 ( 9.958 0.000 13.408) 16.702 7.069 ( 0.274 0.000 -3.390) 3.401 7.254 ( 5.640 0.000 3.808) 6.805 7.498 ( -3.996 0.000 0.391) 4.015 7.518 ( -2.749 0.000 0.238) 2.759 7.775 ( -3.476 0.000 4.535) 5.714 7.941 ( -5.353 0.000 -11.158) 12.376 8.321 ( -7.914 0.000 -4.423) 9.066 8.375 ( -11.222 0.000 -2.028) 11.403 8.546 ( 5.603 0.000 -1.620) 5.833 8.616 ( -15.782 0.000 15.278) 21.966 9.211 ( -12.785 0.000 -3.906) 13.368 9.610 ( 3.319 0.000 -2.654) 4.250 9.641 ( 2.606 0.000 -2.321) 3.490 9.900 ( 2.018 0.000 -1.617) 2.586 10.213 ( 2.585 0.000 -6.042) 6.572 10.477 ( 2.521 0.000 7.349) 7.769 10.626 ( 3.356 0.000 -1.554) 3.698 10.896 ( -6.903 0.000 5.960) 9.120 11.232 ( 7.178 0.000 0.783) 7.220 11.501 ( -8.843 0.000 9.305) 12.837 11.607 ( 18.861 0.000 -25.999) 32.120 11.879 ( 11.537 0.000 -4.989) 12.570 12.019 ( 22.975 0.000 7.464) 24.157 12.300 ( 21.828 0.000 14.874) 26.414 12.602 ( 1.511 0.000 -1.348) 2.025 13.342 ( -4.277 0.000 6.497) 7.778 14.181 ( -6.849 0.000 -9.960) 12.088 14.640 ( -4.390 0.000 -14.536) 15.185 14.789 ( -3.899 0.000 -15.522) 16.004 15.392 ( -14.446 0.000 -15.772) 21.387 15.587 ( -1.350 0.000 9.667) 9.760 15.772 ( 2.794 0.000 2.212) 3.564 16.189 ( -4.547 0.000 24.556) 24.973 16.380 ( 5.006 0.000 7.920) 9.370 16.615 ( 3.300 0.000 -4.995) 5.987 16.626 ( 0.637 0.000 -5.210) 5.249 16.944 ( -1.231 0.000 -2.412) 2.708 17.296 ( 2.247 0.000 -7.648) 7.971 18.546 ( 5.975 0.000 11.152) 12.651 18.907 ( -0.155 0.000 -0.581) 0.601 19.035 ( -0.047 0.000 -5.988) 5.988 19.603 ( -1.839 0.000 -0.367) 1.875 ======================= Grid point 65 (23/120) ======================= q-point: ( 0.22 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 23.864 0.000 11.539) 26.507 1.575 ( 30.563 0.000 10.002) 32.158 2.440 ( 38.207 0.000 20.072) 43.159 2.677 ( 3.125 0.000 4.005) 5.080 2.977 ( -7.679 0.000 -2.253) 8.003 3.233 ( -0.376 0.000 -9.373) 9.381 3.404 ( 6.353 0.000 -3.471) 7.240 3.493 ( -14.847 0.000 -6.366) 16.154 3.594 ( -14.055 0.000 -3.461) 14.475 3.604 ( 4.151 0.000 0.139) 4.154 4.041 ( -4.251 0.000 -9.275) 10.203 4.500 ( -16.441 0.000 -0.803) 16.460 4.798 ( 0.851 0.000 0.108) 0.858 4.841 ( -3.112 0.000 0.905) 3.241 5.317 ( 0.558 0.000 -5.477) 5.505 5.372 ( 15.104 0.000 -9.872) 18.044 5.812 ( 9.831 0.000 15.616) 18.453 6.035 ( 17.791 0.000 17.644) 25.056 7.072 ( -0.143 0.000 -2.392) 2.396 7.205 ( -10.269 0.000 8.665) 13.436 7.459 ( -3.105 0.000 -1.444) 3.425 7.519 ( 4.487 0.000 -4.511) 6.362 7.597 ( -14.215 0.000 -2.631) 14.456 7.813 ( -7.494 0.000 -10.708) 13.069 8.114 ( -13.765 0.000 3.946) 14.319 8.213 ( -1.859 0.000 -4.404) 4.780 8.423 ( -7.240 0.000 9.082) 11.614 8.724 ( 11.518 0.000 1.276) 11.588 8.933 ( -13.980 0.000 -3.640) 14.446 9.651 ( 0.060 0.000 -2.059) 2.060 9.653 ( -0.670 0.000 -6.642) 6.676 9.910 ( -0.237 0.000 4.173) 4.180 10.250 ( 0.426 0.000 2.038) 2.082 10.547 ( 4.442 0.000 7.193) 8.454 10.554 ( -8.057 0.000 2.793) 8.527 10.810 ( -0.557 0.000 -2.354) 2.419 11.300 ( -8.567 0.000 8.703) 12.212 11.470 ( 14.194 0.000 1.221) 14.246 11.691 ( -7.083 0.000 -13.316) 15.083 12.188 ( 17.360 0.000 -7.790) 19.027 12.544 ( 26.390 0.000 6.253) 27.121 12.737 ( 12.264 0.000 -3.530) 12.762 12.839 ( 31.161 0.000 15.185) 34.664 13.362 ( 4.528 0.000 9.465) 10.492 14.012 ( -8.817 0.000 -8.525) 12.264 14.449 ( -13.721 0.000 -7.869) 15.818 14.778 ( 3.529 0.000 -18.984) 19.310 15.050 ( -19.188 0.000 -18.946) 26.965 15.631 ( 4.679 0.000 1.800) 5.014 15.751 ( -5.701 0.000 7.075) 9.086 16.120 ( -1.705 0.000 22.590) 22.655 16.528 ( 7.414 0.000 1.622) 7.590 16.642 ( 1.177 0.000 -2.382) 2.657 16.695 ( 4.147 0.000 -1.778) 4.512 16.913 ( -1.720 0.000 -1.546) 2.312 17.189 ( -11.029 0.000 0.709) 11.052 18.709 ( 9.753 0.000 6.038) 11.471 18.905 ( -0.099 0.000 -1.739) 1.742 19.013 ( -1.787 0.000 -7.621) 7.828 19.547 ( -3.784 0.000 -0.781) 3.864 ======================= Grid point 66 (24/120) ======================= q-point: ( 0.33 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.774 ( 22.432 0.000 6.634) 23.393 2.147 ( 25.560 0.000 4.789) 26.005 2.716 ( 0.384 0.000 2.118) 2.153 2.781 ( -9.908 0.000 0.843) 9.944 2.985 ( 12.913 0.000 6.944) 14.661 3.196 ( -12.456 0.000 -2.019) 12.619 3.269 ( 4.376 0.000 -13.632) 14.317 3.361 ( -10.049 0.000 -3.978) 10.808 3.533 ( 2.974 0.000 -4.304) 5.231 3.762 ( 13.015 0.000 5.947) 14.309 3.939 ( -6.595 0.000 -8.677) 10.899 4.179 ( -13.210 0.000 3.270) 13.609 4.762 ( -3.797 0.000 3.210) 4.972 4.778 ( -2.880 0.000 0.479) 2.920 5.389 ( 9.068 0.000 -5.548) 10.631 5.735 ( 20.821 0.000 -16.425) 26.520 6.106 ( 18.136 0.000 9.183) 20.329 6.420 ( 19.582 0.000 16.990) 25.925 6.896 ( -19.835 0.000 3.082) 20.073 7.035 ( -6.356 0.000 -7.400) 9.755 7.246 ( -16.307 0.000 -6.003) 17.377 7.411 ( -2.256 0.000 2.034) 3.038 7.452 ( -14.135 0.000 -2.981) 14.446 7.767 ( 5.460 0.000 -5.824) 7.983 7.836 ( -13.849 0.000 9.516) 16.803 8.250 ( 4.884 0.000 -3.589) 6.060 8.274 ( -8.094 0.000 6.186) 10.187 8.684 ( -10.254 0.000 -3.326) 10.780 8.977 ( 13.158 0.000 2.177) 13.336 9.600 ( -5.141 0.000 -0.655) 5.183 9.647 ( 0.683 0.000 -6.078) 6.116 9.883 ( -2.856 0.000 5.762) 6.431 10.228 ( -1.896 0.000 5.300) 5.629 10.385 ( -7.681 0.000 1.321) 7.794 10.653 ( 6.045 0.000 7.270) 9.454 10.863 ( 5.329 0.000 -2.287) 5.799 11.120 ( -8.915 0.000 8.752) 12.493 11.469 ( -12.941 0.000 -4.913) 13.842 11.822 ( 19.576 0.000 -0.368) 19.579 12.488 ( 9.980 0.000 -6.209) 11.754 12.940 ( 14.274 0.000 3.918) 14.802 13.084 ( 18.257 0.000 -0.591) 18.267 13.461 ( 4.346 0.000 7.827) 8.953 13.474 ( 27.507 0.000 4.997) 27.957 13.931 ( 6.591 0.000 -1.179) 6.696 14.140 ( -16.278 0.000 -7.942) 18.112 14.639 ( -21.447 0.000 -19.294) 28.849 14.961 ( 15.375 0.000 -17.895) 23.593 15.518 ( -17.686 0.000 10.120) 20.377 15.727 ( 3.348 0.000 -4.262) 5.420 16.112 ( 1.072 0.000 17.227) 17.260 16.634 ( 1.243 0.000 -0.746) 1.450 16.682 ( 2.855 0.000 -0.430) 2.888 16.764 ( 2.383 0.000 2.080) 3.163 16.874 ( -2.319 0.000 -0.434) 2.360 16.915 ( -13.526 0.000 7.657) 15.543 18.905 ( 0.149 0.000 -3.122) 3.125 18.919 ( 10.827 0.000 1.683) 10.957 18.973 ( -2.055 0.000 -7.257) 7.542 19.450 ( -5.880 0.000 -1.258) 6.013 ======================= Grid point 67 (25/120) ======================= q-point: ( 0.44 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 19.093 0.000 3.956) 19.498 2.532 ( -14.663 0.000 2.221) 14.830 2.551 ( 13.266 0.000 1.214) 13.321 2.690 ( -2.957 0.000 0.498) 2.998 3.058 ( 0.035 0.000 -0.956) 0.956 3.159 ( 7.506 0.000 -2.384) 7.876 3.173 ( -8.825 0.000 -2.200) 9.095 3.297 ( -4.239 0.000 -8.520) 9.517 3.584 ( 5.344 0.000 -9.119) 10.569 3.751 ( -10.386 0.000 -8.782) 13.601 3.972 ( 5.864 0.000 8.943) 10.694 4.041 ( -2.592 0.000 7.855) 8.271 4.705 ( -1.252 0.000 2.826) 3.091 4.719 ( -2.402 0.000 2.386) 3.386 5.744 ( 25.277 0.000 -4.756) 25.721 6.189 ( 23.941 0.000 -17.720) 29.786 6.263 ( -18.897 0.000 -2.477) 19.058 6.659 ( -18.606 0.000 -11.210) 21.722 6.665 ( 13.443 0.000 4.835) 14.286 6.816 ( 11.326 0.000 5.254) 12.485 7.051 ( -8.441 0.000 3.829) 9.269 7.076 ( -21.556 0.000 0.702) 21.568 7.417 ( 3.807 0.000 5.553) 6.733 7.575 ( -11.385 0.000 10.475) 15.471 7.920 ( 8.618 0.000 -1.432) 8.736 8.099 ( -9.093 0.000 2.386) 9.401 8.376 ( 6.980 0.000 -3.134) 7.651 8.517 ( -7.160 0.000 -2.987) 7.758 9.234 ( 12.108 0.000 1.861) 12.250 9.452 ( -9.394 0.000 0.822) 9.430 9.693 ( 3.941 0.000 -1.736) 4.306 9.794 ( -5.500 0.000 3.482) 6.509 10.212 ( 0.795 0.000 3.765) 3.848 10.264 ( -4.336 0.000 1.668) 4.646 10.788 ( 7.386 0.000 7.620) 10.612 10.946 ( -8.335 0.000 8.167) 11.669 11.008 ( 8.969 0.000 -0.687) 8.995 11.217 ( -11.720 0.000 -1.362) 11.799 12.214 ( 18.486 0.000 -1.453) 18.543 12.504 ( -8.490 0.000 -3.014) 9.009 13.190 ( 10.296 0.000 7.195) 12.561 13.303 ( 1.335 0.000 6.675) 6.808 13.568 ( 9.059 0.000 -3.224) 9.615 13.821 ( -14.940 0.000 -8.530) 17.204 13.831 ( 15.595 0.000 -15.118) 21.720 14.204 ( -20.302 0.000 -17.341) 26.700 14.420 ( 32.485 0.000 12.764) 34.903 15.051 ( -28.372 0.000 12.300) 30.923 15.354 ( 21.129 0.000 -18.200) 27.887 15.683 ( -9.442 0.000 -14.215) 17.066 16.197 ( 8.193 0.000 17.807) 19.601 16.445 ( -15.526 0.000 13.843) 20.801 16.749 ( 3.609 0.000 0.377) 3.629 16.795 ( 1.593 0.000 3.039) 3.431 16.815 ( -0.346 0.000 1.600) 1.637 16.819 ( -3.170 0.000 0.317) 3.186 18.913 ( 0.754 0.000 -4.642) 4.703 18.936 ( -1.532 0.000 -6.127) 6.316 19.129 ( 9.931 0.000 -0.689) 9.955 19.311 ( -8.043 0.000 -1.426) 8.169 ======================= Grid point 72 (26/120) ======================= q-point: ( 0.00 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.778 ( 0.000 19.370 19.800) 27.699 0.891 ( 0.000 28.187 17.453) 33.153 1.588 ( 0.000 38.065 40.553) 55.619 2.592 ( 0.000 -0.479 4.802) 4.826 3.142 ( 0.000 -0.246 -9.790) 9.793 3.177 ( 0.000 -4.850 -2.452) 5.434 3.247 ( 0.000 -10.298 -0.004) 10.298 3.568 ( 0.000 4.965 -3.147) 5.879 3.794 ( 0.000 -2.510 -5.072) 5.659 4.037 ( 0.000 -9.236 -7.075) 11.635 4.101 ( 0.000 0.508 -18.453) 18.460 4.774 ( 0.000 -8.528 -3.543) 9.234 4.790 ( 0.000 5.132 4.830) 7.048 4.958 ( 0.000 5.572 10.328) 11.735 5.194 ( 0.000 9.442 1.127) 9.509 5.490 ( 0.000 3.550 -11.009) 11.567 5.618 ( 0.000 -2.573 9.483) 9.825 5.715 ( 0.000 6.635 7.567) 10.064 7.023 ( 0.000 -10.536 2.888) 10.925 7.122 ( 0.000 4.426 -4.306) 6.174 7.347 ( 0.000 -11.759 11.502) 16.449 7.725 ( 0.000 2.531 -16.226) 16.422 7.828 ( 0.000 3.563 10.213) 10.817 7.998 ( 0.000 2.125 -8.201) 8.472 8.407 ( 0.000 -1.258 -7.782) 7.883 8.524 ( 0.000 1.387 -3.377) 3.651 8.555 ( 0.000 1.890 1.899) 2.679 9.235 ( 0.000 -6.348 -7.517) 9.839 9.237 ( 0.000 -1.148 -5.611) 5.727 9.471 ( 0.000 -8.567 -1.652) 8.724 9.563 ( 0.000 0.715 4.992) 5.043 9.739 ( 0.000 1.964 -6.848) 7.124 10.059 ( 0.000 -17.342 28.483) 33.347 10.098 ( 0.000 -6.339 -6.084) 8.786 10.598 ( 0.000 10.240 0.769) 10.269 10.749 ( 0.000 -8.655 6.881) 11.057 10.997 ( 0.000 1.884 10.524) 10.691 11.678 ( 0.000 7.167 0.793) 7.211 11.735 ( 0.000 -1.466 7.472) 7.615 11.946 ( 0.000 24.763 -10.687) 26.971 12.058 ( 0.000 2.742 12.551) 12.847 12.117 ( 0.000 27.330 -8.103) 28.506 12.556 ( 0.000 -4.257 0.191) 4.262 13.488 ( 0.000 2.956 -11.294) 11.674 14.217 ( 0.000 -2.692 -12.006) 12.304 14.656 ( 0.000 -1.711 -20.121) 20.194 14.755 ( 0.000 -9.307 -9.355) 13.196 15.468 ( 0.000 -4.813 12.044) 12.970 15.514 ( 0.000 -10.278 -6.308) 12.059 15.851 ( 0.000 7.248 0.053) 7.248 16.116 ( 0.000 -6.106 0.045) 6.107 16.401 ( 0.000 -6.753 5.140) 8.486 16.529 ( 0.000 -15.379 25.722) 29.969 16.550 ( 0.000 -3.959 4.859) 6.268 16.567 ( 0.000 -1.855 -6.457) 6.718 17.267 ( 0.000 -2.140 -11.516) 11.714 18.511 ( 0.000 2.888 12.744) 13.067 18.993 ( 0.000 -2.749 2.641) 3.812 19.042 ( 0.000 12.119 -0.044) 12.119 19.636 ( 0.000 1.259 -0.273) 1.288 ======================= Grid point 73 (27/120) ======================= q-point: ( 0.11 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.998 ( 21.180 9.305 16.972) 28.692 1.058 ( 14.902 20.041 17.017) 30.221 1.985 ( 33.308 31.826 27.502) 53.653 2.604 ( 1.146 -1.764 4.378) 4.857 3.100 ( -4.664 -0.547 -2.933) 5.536 3.161 ( -1.171 -6.957 -7.833) 10.542 3.244 ( 0.338 -9.067 -1.720) 9.235 3.585 ( 1.344 4.650 -2.957) 5.672 3.714 ( -6.983 -1.574 -4.516) 8.463 3.924 ( -11.217 -1.773 -11.505) 16.165 4.045 ( -3.946 -3.642 -6.816) 8.677 4.674 ( -9.656 -8.242 -3.398) 13.142 4.807 ( 3.156 4.690 -1.791) 5.930 5.020 ( 1.410 9.269 5.140) 10.692 5.211 ( 2.851 4.312 -0.364) 5.182 5.396 ( -2.238 9.076 -3.748) 10.071 5.658 ( 3.837 -2.412 12.431) 13.231 5.807 ( 8.881 4.997 11.323) 15.234 7.074 ( 1.422 -4.066 -1.293) 4.497 7.179 ( 6.471 -3.412 -0.129) 7.316 7.293 ( -4.873 -10.545 9.089) 14.750 7.687 ( -3.159 4.346 -11.560) 12.748 7.812 ( -2.907 3.330 6.397) 7.776 7.914 ( -6.987 0.407 -8.509) 11.017 8.295 ( -8.923 -2.732 -3.099) 9.833 8.400 ( -11.139 1.521 -1.302) 11.317 8.535 ( -6.008 -3.767 9.252) 11.657 8.729 ( -4.288 12.657 -1.314) 13.428 9.172 ( -13.420 -4.455 -2.973) 14.449 9.543 ( 2.287 -3.582 -3.919) 5.781 9.684 ( 5.273 1.462 -0.614) 5.507 9.885 ( 1.253 -1.383 -0.504) 1.933 10.116 ( 4.136 -7.203 -2.336) 8.629 10.483 ( 15.759 -13.795 0.279) 20.945 10.611 ( 3.466 5.128 -0.348) 6.199 10.813 ( 9.957 -14.872 5.396) 18.693 10.915 ( -6.071 3.597 7.992) 10.661 11.615 ( -7.134 11.223 7.616) 15.325 11.939 ( 14.586 1.614 4.831) 15.450 12.022 ( 8.887 14.683 -7.557) 18.753 12.106 ( 10.379 14.878 -13.621) 22.685 12.365 ( 17.905 7.454 11.780) 22.692 12.578 ( 3.998 -1.208 0.497) 4.206 13.363 ( -6.230 2.548 2.990) 7.365 14.177 ( -5.404 -0.352 -12.145) 13.297 14.622 ( -3.843 -2.210 -15.535) 16.155 14.702 ( -4.578 -9.513 -12.795) 16.588 15.352 ( -9.250 -1.850 -7.408) 11.995 15.560 ( 2.944 -3.784 2.230) 5.288 15.832 ( -0.835 3.938 3.869) 5.583 16.192 ( 0.927 -1.670 13.598) 13.731 16.282 ( 0.232 -6.801 9.267) 11.498 16.517 ( 0.081 -9.265 -2.709) 9.653 16.579 ( 1.363 -4.923 -6.420) 8.204 16.705 ( 5.529 -13.193 9.328) 17.078 17.263 ( -2.484 -5.557 -7.210) 9.436 18.571 ( 5.811 2.789 10.290) 12.142 19.024 ( 1.600 1.195 -2.229) 2.993 19.044 ( 0.380 9.599 -0.754) 9.637 19.618 ( -1.725 1.381 -0.430) 2.251 ======================= Grid point 74 (28/120) ======================= q-point: ( 0.22 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( 19.977 11.503 11.709) 25.855 1.517 ( 28.005 -1.967 10.712) 30.049 2.634 ( 1.723 -4.176 2.949) 5.394 2.685 ( 31.220 20.036 13.164) 39.363 2.977 ( -7.710 -0.288 -0.338) 7.723 3.097 ( -3.832 -11.928 -7.528) 14.617 3.300 ( 4.384 -6.844 -2.746) 8.579 3.507 ( -9.443 -2.647 -4.032) 10.603 3.640 ( -1.533 3.089 -2.883) 4.495 3.681 ( -7.906 8.633 -4.917) 12.697 3.955 ( -5.007 -7.507 -6.325) 11.020 4.413 ( -15.552 -7.005 -1.835) 17.155 4.869 ( 0.615 5.358 -3.254) 6.299 4.988 ( -1.300 12.883 4.610) 13.745 5.309 ( 5.600 -0.319 -8.638) 10.299 5.478 ( 9.891 10.319 -7.864) 16.314 5.805 ( 11.554 0.764 14.293) 18.395 6.068 ( 16.651 2.761 16.401) 23.534 7.056 ( -4.403 -3.628 4.080) 7.014 7.177 ( -5.510 -3.545 -1.053) 6.636 7.309 ( 4.734 -6.948 2.938) 8.906 7.606 ( -10.447 4.954 -9.326) 14.854 7.662 ( -5.714 2.837 -2.237) 6.760 7.781 ( -6.885 -1.273 -6.272) 9.400 8.114 ( -10.643 -1.404 2.437) 11.008 8.194 ( -5.804 -0.655 -2.445) 6.332 8.388 ( -7.192 -3.063 7.500) 10.833 8.802 ( 0.223 2.344 -2.455) 3.401 8.908 ( -5.647 1.758 0.875) 5.979 9.563 ( -0.119 -2.830 -4.721) 5.505 9.754 ( 1.498 3.814 -2.246) 4.673 9.886 ( -0.486 -2.141 4.621) 5.116 10.185 ( 2.089 -4.502 3.486) 6.065 10.478 ( -5.969 -3.954 1.787) 7.379 10.715 ( 4.216 2.760 -3.249) 5.996 10.819 ( -2.260 9.948 5.113) 11.411 11.108 ( 12.963 -21.670 -0.877) 25.267 11.442 ( -9.033 12.881 9.237) 18.244 12.000 ( -3.364 17.083 -7.053) 18.786 12.297 ( 17.433 9.325 -9.360) 21.874 12.527 ( 23.365 -1.172 3.027) 23.589 12.707 ( 15.006 -2.649 -3.726) 15.687 12.881 ( 26.927 4.476 15.852) 31.566 13.337 ( 3.053 -1.602 9.327) 9.943 14.017 ( -9.099 0.351 -9.314) 13.025 14.444 ( -12.621 -0.373 -8.503) 15.223 14.669 ( 1.408 -11.172 -16.866) 20.279 15.108 ( -13.909 5.412 -16.205) 22.031 15.633 ( 3.286 0.926 1.117) 3.592 15.811 ( -2.142 3.655 7.325) 8.462 16.143 ( -2.001 2.193 20.097) 20.315 16.376 ( 3.472 -16.472 -3.151) 17.126 16.532 ( 2.705 -7.282 1.199) 7.860 16.603 ( 0.434 -12.259 -5.674) 13.515 16.771 ( 1.905 -8.148 4.764) 9.629 17.127 ( -10.885 -6.616 0.746) 12.760 18.730 ( 9.590 2.628 5.095) 11.173 19.035 ( 0.096 10.603 -2.106) 10.811 19.053 ( 0.103 3.959 -5.073) 6.436 19.565 ( -3.599 1.701 -0.838) 4.068 ======================= Grid point 75 (29/120) ======================= q-point: ( 0.33 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( 19.619 5.123 7.356) 21.570 2.056 ( 24.687 -6.866 5.689) 26.248 2.651 ( -1.059 -5.410 -0.187) 5.516 2.788 ( -10.061 -1.694 1.943) 10.386 3.021 ( 1.397 -4.266 -2.506) 5.141 3.105 ( 4.591 -0.292 -3.422) 5.734 3.311 ( -2.215 -1.755 -5.239) 5.953 3.322 ( -7.981 -0.577 -0.956) 8.058 3.588 ( -1.355 3.432 -5.183) 6.362 3.729 ( 6.142 -1.197 3.678) 7.259 3.855 ( -4.096 -6.788 -5.054) 9.402 4.098 ( -14.128 -5.447 1.433) 15.209 4.869 ( 2.337 8.867 -0.055) 9.170 4.988 ( -0.026 19.673 4.617) 20.207 5.447 ( 10.047 5.308 -8.735) 14.332 5.775 ( 19.003 4.539 -15.318) 24.826 6.118 ( 18.792 1.496 9.711) 21.205 6.434 ( 18.426 1.101 15.993) 24.424 6.831 ( -16.690 -5.485 2.089) 17.692 7.099 ( -6.359 5.037 -7.591) 11.110 7.230 ( -17.155 -2.532 -2.751) 17.558 7.333 ( -7.235 -0.962 -2.356) 7.670 7.596 ( -7.913 8.507 1.299) 11.691 7.686 ( 1.803 -6.749 -5.278) 8.755 7.886 ( -9.856 3.100 8.845) 13.601 8.182 ( 2.459 -6.160 -1.592) 6.821 8.240 ( -7.300 -3.221 2.851) 8.473 8.593 ( -10.568 -8.920 -3.075) 14.167 9.067 ( 11.183 8.098 3.144) 14.161 9.545 ( -1.880 -1.549 -2.128) 3.234 9.748 ( -1.464 5.855 -2.657) 6.594 9.862 ( -2.189 -2.231 5.633) 6.442 10.195 ( -0.568 -2.249 5.442) 5.916 10.347 ( -6.138 -2.644 0.174) 6.685 10.803 ( 4.838 -5.168 -2.437) 7.487 10.837 ( 3.708 16.787 5.783) 18.138 11.216 ( -3.313 -9.275 0.105) 9.849 11.277 ( -6.830 5.783 6.517) 11.071 12.037 ( 9.227 15.357 -2.674) 18.114 12.591 ( 9.164 9.924 -7.527) 15.464 12.863 ( 12.653 -7.768 3.248) 15.198 13.080 ( 18.217 -0.805 -2.870) 18.460 13.315 ( 6.881 -10.361 10.472) 16.258 13.564 ( 22.035 5.471 4.450) 23.136 13.893 ( -0.081 -3.212 -3.712) 4.910 14.197 ( -8.610 5.189 -5.997) 11.705 14.633 ( -11.475 -2.067 -17.170) 20.755 14.980 ( 9.115 2.852 -15.543) 18.242 15.541 ( -14.854 3.037 7.657) 16.985 15.801 ( 1.325 6.380 -2.420) 6.951 16.120 ( -0.189 0.738 15.506) 15.525 16.426 ( 3.024 -23.565 -0.753) 23.770 16.560 ( -4.030 -13.156 -2.922) 14.066 16.628 ( 3.539 -10.337 0.546) 10.940 16.790 ( -0.811 -5.113 4.154) 6.638 16.867 ( -12.188 -5.217 7.223) 15.098 18.933 ( 9.861 2.788 -0.002) 10.247 19.037 ( 0.167 11.483 -2.193) 11.692 19.051 ( 0.269 6.080 -5.646) 8.302 19.473 ( -5.686 2.115 -1.309) 6.206 ======================= Grid point 76 (30/120) ======================= q-point: ( 0.44 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( 16.514 -0.310 4.412) 17.096 2.440 ( 3.770 -8.226 3.984) 9.887 2.526 ( -1.107 -2.234 -1.335) 2.829 2.667 ( -4.146 -3.076 0.664) 5.205 3.025 ( 0.013 -3.187 -2.388) 3.982 3.079 ( -4.402 -5.460 -5.727) 9.055 3.236 ( 1.045 3.946 0.149) 4.085 3.302 ( -2.116 -0.778 -6.531) 6.909 3.566 ( 1.859 -2.940 -5.897) 6.847 3.676 ( -7.473 -8.611 -3.982) 12.077 3.857 ( 1.381 -6.866 4.112) 8.121 3.912 ( -4.760 -6.973 5.753) 10.216 4.946 ( 3.159 19.773 1.409) 20.073 4.979 ( -0.750 23.134 3.025) 23.343 5.790 ( 24.089 4.665 -6.099) 25.283 6.209 ( 23.426 1.925 -17.182) 29.116 6.300 ( -20.193 3.596 -3.330) 20.779 6.589 ( 14.291 -4.897 3.549) 15.518 6.712 ( -22.407 3.032 -13.859) 26.521 6.815 ( 12.852 -0.217 9.035) 15.712 7.003 ( -12.464 -1.878 3.028) 12.964 7.121 ( -11.742 2.966 4.669) 12.979 7.513 ( 0.600 8.245 5.372) 9.859 7.606 ( -7.694 2.157 7.736) 11.122 7.879 ( 7.012 -3.959 1.104) 8.128 8.049 ( -9.263 -5.400 3.186) 11.185 8.297 ( 6.245 -7.285 -4.363) 10.540 8.427 ( -6.787 -8.679 -3.392) 11.528 9.287 ( 10.312 4.888 3.211) 11.855 9.463 ( -6.716 1.450 2.047) 7.169 9.739 ( 1.365 3.803 -1.391) 4.273 9.797 ( -3.792 0.043 2.946) 4.802 10.196 ( 1.193 -0.980 3.190) 3.544 10.247 ( -3.814 -1.066 1.039) 4.094 10.914 ( 5.912 -1.336 1.538) 6.254 10.939 ( 5.307 8.358 4.389) 10.830 11.092 ( -5.840 6.253 4.356) 9.601 11.132 ( -7.637 -0.452 2.481) 8.042 12.315 ( 15.894 9.491 -2.139) 18.635 12.586 ( -8.963 8.124 -3.579) 12.616 13.108 ( 11.161 -9.271 6.827) 16.035 13.264 ( -2.821 -6.287 10.087) 12.216 13.439 ( 11.335 -9.283 -8.553) 16.965 13.666 ( -8.930 -7.156 -10.523) 15.546 14.010 ( 9.460 10.284 -11.863) 18.330 14.273 ( -11.302 5.402 -11.227) 16.822 14.505 ( 25.336 8.824 8.106) 28.027 15.098 ( -27.374 5.026 10.590) 29.778 15.351 ( 22.054 -0.687 -15.789) 27.132 15.721 ( -11.754 3.349 -13.570) 18.263 16.174 ( 6.289 -3.134 16.124) 17.588 16.370 ( -12.443 -9.788 11.373) 19.493 16.509 ( 4.595 -22.054 0.881) 22.545 16.605 ( -4.919 -16.474 2.561) 17.382 16.752 ( 2.093 -4.519 2.909) 5.768 16.793 ( -1.477 -3.539 1.844) 4.255 19.027 ( 0.615 9.316 -5.012) 10.597 19.035 ( -0.340 9.499 -4.778) 10.638 19.162 ( 9.292 3.230 -0.788) 9.869 19.337 ( -7.851 2.533 -1.480) 8.381 ======================= Grid point 81 (31/120) ======================= q-point: ( 0.00 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( 0.000 26.815 6.085) 27.496 1.471 ( 0.000 31.228 9.450) 32.627 2.332 ( 0.000 36.586 23.279) 43.364 2.497 ( 0.000 -10.737 1.930) 10.909 2.981 ( 0.000 -17.203 0.412) 17.208 3.083 ( 0.000 -3.524 -7.263) 8.073 3.196 ( 0.000 5.982 -3.931) 7.158 3.661 ( 0.000 -1.352 -6.788) 6.922 3.765 ( 0.000 5.277 -1.562) 5.503 3.846 ( 0.000 -8.613 -4.698) 9.811 4.080 ( 0.000 -3.528 -12.861) 13.337 4.562 ( 0.000 -13.363 -3.803) 13.893 4.906 ( 0.000 6.866 2.360) 7.260 5.058 ( 0.000 3.987 11.434) 12.109 5.236 ( 0.000 -0.188 6.826) 6.829 5.537 ( 0.000 -6.116 9.519) 11.315 5.725 ( 0.000 15.846 -14.901) 21.752 5.903 ( 0.000 12.835 2.718) 13.119 6.761 ( 0.000 -15.290 5.062) 16.106 7.081 ( 0.000 -16.294 11.754) 20.091 7.246 ( 0.000 7.993 -8.827) 11.908 7.677 ( 0.000 -5.440 -17.148) 17.990 7.918 ( 0.000 5.891 12.103) 13.460 8.083 ( 0.000 4.936 -4.940) 6.984 8.378 ( 0.000 -1.736 -7.220) 7.426 8.486 ( 0.000 -7.417 9.373) 11.953 8.578 ( 0.000 4.777 -2.890) 5.583 9.166 ( 0.000 -4.443 -7.094) 8.370 9.218 ( 0.000 -0.613 -5.190) 5.226 9.276 ( 0.000 -9.078 -3.291) 9.656 9.593 ( 0.000 2.388 4.684) 5.258 9.754 ( 0.000 -0.558 -2.278) 2.346 9.860 ( 0.000 -5.059 13.126) 14.068 9.988 ( 0.000 -5.266 -4.453) 6.897 10.645 ( 0.000 -3.168 7.297) 7.955 10.697 ( 0.000 -0.275 1.304) 1.333 11.139 ( 0.000 12.846 8.475) 15.390 11.690 ( 0.000 -3.456 6.492) 7.355 11.842 ( 0.000 9.204 -2.869) 9.641 12.139 ( 0.000 5.907 13.896) 15.099 12.298 ( 0.000 8.128 -7.930) 11.355 12.375 ( 0.000 -4.804 -2.134) 5.257 12.710 ( 0.000 31.651 6.296) 32.272 13.579 ( 0.000 6.754 -12.237) 13.978 14.146 ( 0.000 -6.256 -18.932) 19.939 14.584 ( 0.000 -5.812 -3.926) 7.013 14.599 ( 0.000 -4.992 -19.526) 20.154 15.102 ( 0.000 -31.452 3.418) 31.637 15.496 ( 0.000 5.785 1.568) 5.994 15.984 ( 0.000 7.108 -0.735) 7.146 16.002 ( 0.000 -6.543 -3.836) 7.585 16.305 ( 0.000 -2.606 -5.284) 5.892 16.395 ( 0.000 -1.737 22.752) 22.818 16.485 ( 0.000 -2.563 10.844) 11.143 16.542 ( 0.000 0.082 -3.722) 3.723 17.121 ( 0.000 -11.467 -10.234) 15.369 18.590 ( 0.000 5.256 11.021) 12.210 18.922 ( 0.000 -4.646 4.978) 6.809 19.296 ( 0.000 13.250 -0.171) 13.252 19.654 ( 0.000 0.212 -0.375) 0.431 ======================= Grid point 82 (32/120) ======================= q-point: ( 0.11 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( 8.575 22.395 6.411) 24.822 1.520 ( 6.150 26.895 12.639) 30.346 2.491 ( 0.963 -8.810 1.940) 9.073 2.602 ( 20.796 26.314 14.927) 36.712 2.937 ( -4.082 -16.212 0.262) 16.720 3.049 ( -3.115 -3.839 -6.052) 7.815 3.181 ( -1.009 3.524 -4.124) 5.517 3.608 ( -5.766 -3.498 -3.309) 7.512 3.765 ( 0.451 8.155 -2.405) 8.514 3.793 ( -3.955 -7.087 -7.421) 10.997 4.047 ( -4.420 0.594 -8.045) 9.198 4.483 ( -7.703 -11.651 -3.471) 14.392 4.904 ( 2.129 5.489 -1.957) 6.204 5.155 ( 7.321 3.368 6.554) 10.388 5.236 ( -2.224 1.530 3.804) 4.665 5.526 ( 2.823 -2.461 6.859) 7.815 5.762 ( 4.234 15.680 -2.376) 16.414 5.953 ( 5.284 10.666 4.017) 12.562 6.843 ( 6.680 -15.433 3.814) 17.244 7.030 ( -4.521 -14.419 10.709) 18.521 7.279 ( 2.774 7.115 -8.246) 11.239 7.660 ( -1.636 -4.700 -14.779) 15.594 7.885 ( -3.188 4.400 9.485) 10.930 8.000 ( -8.385 6.397 -6.368) 12.320 8.222 ( -10.681 -4.530 0.177) 11.604 8.392 ( -9.308 -3.654 1.132) 10.064 8.497 ( -6.892 2.057 2.005) 7.466 8.951 ( -7.610 4.122 -4.666) 9.832 9.056 ( -7.249 -2.026 -0.023) 7.527 9.501 ( 4.655 -1.568 -4.900) 6.938 9.674 ( 4.681 -2.256 1.140) 5.319 9.852 ( 0.444 -2.503 8.231) 8.615 9.982 ( 10.636 -5.470 -6.481) 13.603 10.204 ( 21.806 -11.366 0.774) 24.602 10.588 ( -3.765 -2.835 5.337) 7.120 10.693 ( -1.026 -4.138 0.691) 4.319 11.143 ( 1.338 17.253 6.334) 18.428 11.854 ( 0.445 10.608 3.434) 11.159 11.898 ( 14.849 -2.325 7.983) 17.018 12.203 ( 10.602 6.059 3.588) 12.727 12.341 ( 1.078 6.398 -6.521) 9.199 12.402 ( 6.409 -5.043 -4.670) 9.398 12.818 ( 9.820 28.321 8.960) 31.285 13.457 ( -8.485 7.733 -4.340) 12.273 14.143 ( -2.423 -5.154 -17.226) 18.143 14.444 ( -7.739 -13.109 -9.421) 17.902 14.594 ( -4.533 -2.419 -12.376) 13.400 15.163 ( 4.221 -25.043 -1.204) 25.425 15.510 ( 1.758 4.789 1.817) 5.415 15.903 ( -5.451 4.566 -2.303) 7.474 16.087 ( 5.979 -7.207 -1.343) 9.461 16.256 ( -4.383 -0.417 3.628) 5.705 16.369 ( -1.353 -2.874 9.251) 9.781 16.470 ( -2.736 -2.575 2.938) 4.769 16.592 ( 4.317 -2.738 5.483) 7.497 17.090 ( -3.789 -11.876 -6.492) 14.055 18.650 ( 5.754 5.283 8.698) 11.691 18.975 ( 4.420 -4.080 1.621) 6.230 19.294 ( -0.228 13.118 -0.430) 13.127 19.640 ( -1.415 0.418 -0.532) 1.568 ======================= Grid point 83 (33/120) ======================= q-point: ( 0.22 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 17.370 10.138 6.593) 21.165 1.714 ( 12.226 18.474 11.370) 24.900 2.499 ( 0.533 -10.450 1.074) 10.519 2.824 ( -6.144 -15.087 -1.648) 16.373 2.967 ( -2.806 -1.686 0.943) 3.407 2.996 ( 10.363 7.613 -2.084) 13.027 3.180 ( 0.964 -4.389 -4.167) 6.128 3.463 ( -7.290 -2.199 2.890) 8.145 3.727 ( -2.310 6.015 -6.897) 9.438 3.789 ( 2.145 2.682 -3.765) 5.095 3.897 ( -9.414 4.763 -2.908) 10.944 4.270 ( -12.802 -7.924 -2.235) 15.221 4.965 ( 1.844 5.066 -2.940) 6.140 5.223 ( 6.274 7.579 1.638) 9.974 5.316 ( 8.312 3.690 -3.965) 9.921 5.693 ( 11.369 7.947 -1.774) 13.984 5.892 ( 9.061 9.831 10.078) 16.742 6.136 ( 13.183 5.177 8.822) 16.686 6.910 ( -7.380 -10.979 7.308) 15.114 6.979 ( 6.039 -14.082 2.488) 15.523 7.338 ( 2.544 6.225 -6.155) 9.116 7.612 ( -3.347 -4.316 -10.226) 11.593 7.732 ( -16.251 7.231 -2.834) 18.012 7.825 ( -4.370 3.932 -0.215) 5.882 8.052 ( -6.557 -4.117 -0.825) 7.786 8.184 ( -9.815 -1.827 -1.228) 10.058 8.337 ( -8.414 -1.538 6.360) 10.659 8.673 ( -16.802 -11.007 -1.458) 20.139 9.091 ( 6.468 12.305 2.034) 14.050 9.554 ( 1.315 1.331 -3.189) 3.697 9.741 ( 2.226 -4.702 1.329) 5.369 9.868 ( 0.224 -0.292 7.594) 7.602 10.129 ( 5.067 -0.590 0.245) 5.107 10.412 ( -3.583 -2.715 -0.591) 4.534 10.636 ( 3.334 -6.738 -3.892) 8.466 10.723 ( 9.597 -15.915 1.618) 18.656 11.195 ( 3.362 22.490 3.618) 23.026 11.752 ( -7.075 18.364 8.528) 21.448 12.193 ( 6.950 -0.238 5.782) 9.044 12.375 ( 9.718 -0.015 -9.536) 13.615 12.580 ( 19.378 4.122 -5.904) 20.673 12.652 ( 17.793 -2.878 -4.670) 18.619 13.057 ( 12.098 16.522 13.759) 24.671 13.369 ( 3.089 6.778 5.850) 9.471 14.008 ( -10.041 -1.978 -9.976) 14.292 14.362 ( 0.073 -18.343 -12.539) 22.219 14.457 ( -7.037 0.178 -9.063) 11.476 15.183 ( -3.330 -3.230 -10.792) 11.746 15.569 ( 3.867 -8.961 7.540) 12.333 15.839 ( -0.159 3.747 -2.437) 4.472 16.126 ( -3.788 -8.731 6.639) 11.605 16.188 ( -3.456 -0.533 -5.198) 6.264 16.332 ( -2.797 -4.718 3.344) 6.424 16.418 ( 0.208 -6.242 4.430) 7.657 16.669 ( 2.805 -4.513 5.253) 7.472 16.950 ( -10.082 -11.432 1.017) 15.276 18.807 ( 9.492 5.201 3.922) 11.512 19.067 ( 4.382 -1.041 -2.544) 5.173 19.287 ( -0.549 12.656 -1.135) 12.718 19.596 ( -3.065 0.993 -0.947) 3.358 ======================= Grid point 84 (34/120) ======================= q-point: ( 0.33 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( 14.797 4.237 7.303) 17.036 1.995 ( 16.811 4.990 5.479) 18.372 2.518 ( 0.988 -9.177 0.105) 9.231 2.670 ( -8.802 -9.909 -2.561) 13.499 2.922 ( 0.206 -3.144 1.768) 3.613 3.059 ( -3.021 -5.493 -8.265) 10.374 3.191 ( 0.985 -7.551 -5.290) 9.272 3.338 ( -5.476 -3.092 4.556) 7.765 3.650 ( -5.662 4.094 -3.108) 7.647 3.693 ( -9.241 0.253 -1.686) 9.396 3.835 ( -2.091 2.767 -2.991) 4.580 4.016 ( -10.916 -3.498 0.497) 11.474 5.089 ( 12.701 13.644 -1.090) 18.672 5.396 ( 5.858 21.707 6.491) 23.402 5.530 ( 15.091 1.959 -14.394) 20.947 5.930 ( 12.821 11.709 -12.848) 21.600 6.154 ( 16.978 0.981 13.238) 21.551 6.455 ( 16.877 1.456 11.045) 20.222 6.713 ( -12.222 -6.626 -0.077) 13.903 7.066 ( 1.207 -8.270 3.315) 8.991 7.305 ( -17.710 10.281 -7.819) 21.920 7.351 ( -10.250 1.555 -3.855) 11.061 7.537 ( -2.306 -7.304 -3.964) 8.624 7.751 ( -3.660 7.357 2.880) 8.707 7.923 ( -6.687 0.448 4.966) 8.341 8.055 ( -3.802 -6.954 -1.893) 8.148 8.164 ( -8.130 -4.313 2.234) 9.470 8.374 ( -11.002 -13.159 -0.419) 17.157 9.241 ( 7.874 9.508 3.626) 12.866 9.561 ( -0.687 2.849 -0.055) 2.931 9.769 ( 0.543 -4.893 3.000) 5.765 9.841 ( -2.767 0.491 5.072) 5.799 10.191 ( 1.494 2.845 2.697) 4.195 10.324 ( -3.716 1.003 -1.743) 4.225 10.677 ( 3.064 -7.568 -3.190) 8.766 10.880 ( 3.055 -16.646 -0.908) 16.948 11.268 ( 3.901 24.663 3.636) 25.233 11.607 ( -7.096 21.552 8.798) 24.336 12.299 ( 7.727 10.457 -1.510) 13.089 12.618 ( 12.091 -13.694 -1.954) 18.372 12.826 ( 4.251 5.431 -6.710) 9.623 13.027 ( 16.423 -4.591 -8.504) 19.055 13.149 ( -2.270 -1.783 13.816) 14.115 13.697 ( 16.592 7.948 2.464) 18.561 13.822 ( 0.660 -3.829 -4.247) 5.756 14.330 ( 0.064 9.368 -4.506) 10.396 14.509 ( 9.368 -11.033 -11.901) 18.738 15.089 ( -1.935 7.725 -10.716) 13.351 15.608 ( -4.559 -2.568 9.480) 10.828 15.812 ( -3.580 -12.400 -4.098) 13.541 16.033 ( -7.685 -1.583 -1.443) 7.978 16.089 ( 0.083 -13.493 3.667) 13.983 16.228 ( -7.050 -6.707 0.968) 9.779 16.489 ( 3.965 -7.064 2.377) 8.442 16.668 ( -5.829 -7.922 7.852) 12.586 16.746 ( -5.375 -6.674 4.888) 9.865 19.011 ( 10.304 4.914 -0.091) 11.417 19.146 ( 3.574 3.135 -3.915) 6.158 19.271 ( -1.052 11.656 -2.103) 11.890 19.515 ( -5.051 1.834 -1.448) 5.566 ======================= Grid point 85 (35/120) ======================= q-point: ( 0.44 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( 10.294 0.389 4.960) 11.434 2.292 ( 7.039 -5.524 4.153) 9.865 2.475 ( -2.391 -3.437 -3.208) 5.274 2.553 ( -3.346 -8.794 0.084) 9.409 2.955 ( 1.721 -3.081 -2.132) 4.123 2.984 ( -2.606 -4.183 -6.076) 7.823 3.216 ( 1.105 -8.044 -2.614) 8.530 3.248 ( -2.962 -5.130 2.202) 6.320 3.532 ( -4.255 2.323 -1.434) 5.056 3.544 ( -5.139 -1.306 -0.487) 5.324 3.766 ( -0.584 -3.416 -1.009) 3.609 3.843 ( -6.990 -2.740 0.918) 7.564 5.355 ( 9.789 21.545 -1.663) 23.723 5.448 ( -0.419 24.211 0.944) 24.233 5.895 ( 21.032 5.355 -8.590) 23.341 6.230 ( 8.729 -1.520 -11.943) 14.871 6.380 ( -6.570 4.463 -8.591) 11.700 6.546 ( 17.889 2.434 5.714) 18.936 6.708 ( -9.314 -2.806 -6.882) 11.916 6.882 ( -12.032 6.828 -2.344) 14.032 6.993 ( -1.333 0.411 10.376) 10.469 7.184 ( -10.084 3.761 6.294) 12.468 7.562 ( 4.337 -8.999 3.566) 10.607 7.669 ( -4.779 6.377 5.302) 9.571 7.831 ( -1.565 1.024 4.409) 4.789 7.891 ( -8.153 -10.182 2.988) 13.382 8.146 ( 3.470 -7.887 -4.874) 9.900 8.231 ( -4.896 -10.797 -2.805) 12.183 9.395 ( 7.236 6.196 4.758) 10.648 9.515 ( -4.265 4.032 4.034) 7.121 9.769 ( -0.133 -3.499 2.837) 4.507 9.785 ( -2.021 -0.361 2.139) 2.965 10.218 ( 1.755 4.349 0.563) 4.723 10.264 ( -2.637 3.744 -0.784) 4.646 10.762 ( 5.071 -9.851 -1.999) 11.258 10.859 ( -3.930 -12.995 -1.432) 13.651 11.357 ( 5.073 24.894 5.675) 26.032 11.472 ( -6.326 23.790 7.784) 25.819 12.520 ( 13.192 9.938 -2.682) 16.733 12.756 ( -7.273 1.114 -1.366) 7.483 12.859 ( 8.357 -9.906 0.250) 12.962 13.025 ( -7.516 -13.503 8.253) 17.519 13.310 ( 11.907 -6.631 -8.824) 16.236 13.546 ( -11.807 -6.810 -8.284) 15.950 14.229 ( 15.480 13.272 -9.511) 22.500 14.417 ( -0.932 11.030 -4.351) 11.894 14.704 ( 19.773 10.306 1.830) 22.373 15.233 ( -20.102 7.725 3.652) 21.843 15.316 ( 15.480 -2.071 -6.340) 16.856 15.767 ( -17.484 -0.089 -10.423) 20.355 15.861 ( 2.314 -30.506 3.551) 30.799 15.976 ( -7.741 -27.056 1.994) 28.212 16.258 ( 7.636 -0.403 9.835) 12.457 16.424 ( -8.482 -3.025 10.822) 14.079 16.634 ( 3.441 -7.581 2.559) 8.710 16.698 ( -2.459 -6.242 2.032) 7.010 19.184 ( 4.851 6.832 -3.839) 9.217 19.226 ( 3.693 6.593 -3.101) 8.169 19.250 ( 1.526 7.570 -2.010) 7.980 19.392 ( -7.185 2.804 -1.694) 7.896 ======================= Grid point 90 (36/120) ======================= q-point: ( 0.00 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( 0.000 24.997 1.000) 25.017 2.026 ( 0.000 21.717 3.074) 21.934 2.214 ( 0.000 -13.156 3.233) 13.547 2.559 ( 0.000 -22.141 5.499) 22.813 2.891 ( 0.000 14.930 1.761) 15.033 3.032 ( 0.000 -2.819 -7.584) 8.091 3.363 ( 0.000 10.751 -0.584) 10.767 3.567 ( 0.000 -9.187 1.518) 9.312 3.739 ( 0.000 5.399 -5.989) 8.063 3.942 ( 0.000 -11.034 -5.609) 12.378 4.004 ( 0.000 14.141 -3.456) 14.557 4.286 ( 0.000 -15.170 -3.687) 15.611 5.031 ( 0.000 5.504 0.065) 5.505 5.090 ( 0.000 -0.645 6.043) 6.078 5.265 ( 0.000 4.042 10.490) 11.241 5.393 ( 0.000 -8.388 10.258) 13.251 6.006 ( 0.000 12.936 -9.357) 15.966 6.125 ( 0.000 5.202 -4.193) 6.682 6.546 ( 0.000 -2.021 9.512) 9.724 6.750 ( 0.000 -17.422 11.178) 20.700 7.405 ( 0.000 8.355 -13.419) 15.807 7.554 ( 0.000 -7.239 -16.154) 17.702 8.044 ( 0.000 6.928 12.895) 14.638 8.135 ( 0.000 -0.858 4.089) 4.178 8.344 ( 0.000 -1.548 -5.893) 6.093 8.356 ( 0.000 -4.280 2.678) 5.048 8.718 ( 0.000 10.075 -1.810) 10.236 8.951 ( 0.000 -13.801 -0.501) 13.811 9.217 ( 0.000 0.387 -5.684) 5.697 9.225 ( 0.000 -0.355 -7.398) 7.406 9.648 ( 0.000 3.331 5.701) 6.603 9.713 ( 0.000 -3.248 6.355) 7.137 9.838 ( 0.000 1.730 -2.332) 2.904 9.898 ( 0.000 -4.204 -4.511) 6.166 10.620 ( 0.000 0.484 7.117) 7.133 10.655 ( 0.000 -2.755 5.214) 5.898 11.399 ( 0.000 12.808 5.536) 13.953 11.592 ( 0.000 -7.326 5.395) 9.098 12.010 ( 0.000 8.716 -4.656) 9.882 12.187 ( 0.000 -9.909 -4.375) 10.832 12.270 ( 0.000 7.028 11.908) 13.827 12.367 ( 0.000 -2.230 5.441) 5.881 13.443 ( 0.000 42.395 4.528) 42.636 13.743 ( 0.000 10.358 -13.861) 17.304 13.965 ( 0.000 -11.528 -17.246) 20.745 14.248 ( 0.000 -37.961 -2.393) 38.036 14.560 ( 0.000 2.077 -8.542) 8.791 14.643 ( 0.000 -8.494 -8.474) 11.998 15.646 ( 0.000 9.563 -2.122) 9.796 15.839 ( 0.000 -10.105 -2.651) 10.447 16.121 ( 0.000 7.125 -1.262) 7.236 16.242 ( 0.000 -5.147 -3.152) 6.036 16.402 ( 0.000 1.748 18.013) 18.097 16.443 ( 0.000 -2.289 13.836) 14.024 16.635 ( 0.000 10.062 -7.953) 12.825 16.873 ( 0.000 -13.754 -9.693) 16.827 18.702 ( 0.000 6.271 9.003) 10.972 18.820 ( 0.000 -5.972 6.950) 9.163 19.510 ( 0.000 8.817 -0.332) 8.823 19.626 ( 0.000 -3.531 -0.406) 3.554 ======================= Grid point 91 (37/120) ======================= q-point: ( 0.11 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.770 ( 2.862 23.447 0.428) 23.625 2.022 ( 0.678 21.581 6.196) 22.463 2.217 ( 0.651 -14.188 2.806) 14.477 2.535 ( -2.042 -22.923 6.674) 23.962 2.962 ( 4.358 7.018 -2.994) 8.787 3.013 ( -1.856 -0.676 -8.271) 8.503 3.305 ( -5.050 9.069 -1.043) 10.432 3.495 ( -6.473 -9.546 1.852) 11.681 3.789 ( 5.184 9.728 -4.812) 12.028 3.957 ( -0.691 2.273 -6.207) 6.646 4.019 ( 1.371 3.199 -2.967) 4.574 4.243 ( -4.335 -13.243 -3.167) 14.290 5.021 ( 0.026 6.833 -0.601) 6.860 5.135 ( 2.162 -4.149 -0.029) 4.678 5.304 ( 3.968 4.693 11.811) 13.315 5.417 ( 6.938 -7.066 12.198) 15.712 6.063 ( 4.816 13.725 -6.070) 15.761 6.160 ( 3.319 6.933 -3.545) 8.465 6.601 ( 4.850 -5.941 8.812) 11.682 6.734 ( -1.371 -15.230 10.727) 18.679 7.425 ( 1.735 7.594 -12.984) 15.141 7.555 ( -0.076 -6.116 -14.775) 15.991 7.977 ( -5.224 5.194 9.365) 11.915 8.065 ( -6.309 -2.441 3.893) 7.805 8.187 ( -10.540 3.764 -2.970) 11.580 8.295 ( -7.687 -5.933 -1.368) 9.806 8.596 ( -10.610 7.956 -0.369) 13.266 8.787 ( -13.595 -11.557 -0.988) 17.871 9.220 ( 4.447 10.713 -2.761) 11.923 9.410 ( 7.657 -8.568 -4.318) 12.275 9.672 ( 2.137 3.152 4.970) 6.261 9.764 ( 3.400 -5.750 9.999) 12.025 9.967 ( 11.401 2.788 -7.437) 13.895 10.050 ( 13.912 -5.841 -2.604) 15.312 10.569 ( -4.255 0.831 4.965) 6.591 10.614 ( -3.448 -3.667 2.915) 5.817 11.476 ( 6.753 16.579 4.721) 18.513 11.741 ( 12.601 -10.911 5.555) 17.570 12.090 ( 4.813 10.185 -1.635) 11.383 12.257 ( 6.491 -7.939 -4.164) 11.068 12.304 ( 6.570 5.189 8.329) 11.809 12.385 ( 3.086 -2.294 4.051) 5.586 13.476 ( 2.669 38.060 4.624) 38.432 13.659 ( -6.693 13.217 -10.292) 18.039 13.935 ( -2.315 -14.751 -14.841) 21.053 14.144 ( -9.180 -25.802 -3.444) 27.602 14.566 ( -1.647 0.356 -11.123) 11.250 14.681 ( 5.557 -15.961 -3.638) 17.288 15.671 ( 1.376 10.613 -1.938) 10.876 15.881 ( 2.821 -10.557 -3.089) 11.356 16.039 ( -5.990 6.495 -0.778) 8.870 16.176 ( -4.762 -6.956 -2.583) 8.817 16.405 ( -0.223 4.057 14.594) 15.149 16.470 ( 0.913 -1.699 9.033) 9.236 16.616 ( -1.669 8.129 -3.152) 8.877 16.841 ( -3.638 -13.576 -6.058) 15.305 18.762 ( 5.735 6.278 6.773) 10.871 18.879 ( 5.434 -5.813 4.500) 9.142 19.505 ( -0.566 8.610 -0.536) 8.645 19.616 ( -0.995 -3.300 -0.576) 3.494 ======================= Grid point 92 (38/120) ======================= q-point: ( 0.22 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( 6.949 17.332 0.468) 18.679 2.074 ( 4.148 14.707 6.694) 16.682 2.247 ( 2.541 -11.217 3.330) 11.974 2.500 ( -1.293 -19.028 8.190) 20.756 2.941 ( -3.594 0.902 -7.135) 8.040 3.001 ( -1.822 -4.309 -8.873) 10.031 3.198 ( -4.865 5.978 -1.367) 7.827 3.347 ( -7.411 -8.650 2.469) 11.655 3.872 ( -3.085 6.883 -6.956) 10.260 3.896 ( -3.090 5.252 -4.811) 7.763 3.998 ( -3.552 4.741 -1.468) 6.103 4.117 ( -7.924 -7.850 -0.868) 11.188 5.083 ( 6.992 7.256 -3.116) 10.548 5.207 ( 9.373 -4.911 -7.237) 12.820 5.492 ( 13.626 10.725 10.750) 20.402 5.680 ( 17.397 -7.552 14.115) 23.641 6.152 ( 3.408 14.132 -3.685) 14.997 6.265 ( 7.241 4.941 -2.545) 9.128 6.686 ( -0.447 -8.804 8.276) 12.091 6.732 ( 5.126 -10.841 8.492) 14.694 7.455 ( 0.410 5.245 -10.579) 11.815 7.535 ( -2.627 -3.734 -10.422) 11.378 7.885 ( -7.516 6.443 7.874) 12.649 7.896 ( -9.019 4.143 -7.246) 12.289 7.988 ( -6.526 -1.035 -2.482) 7.058 8.098 ( -10.474 -7.243 -2.605) 12.999 8.349 ( -13.036 3.008 5.289) 14.386 8.465 ( -17.556 -9.391 2.455) 20.061 9.319 ( 4.948 11.417 0.147) 12.444 9.512 ( 3.443 -7.926 -2.102) 8.893 9.714 ( 1.483 4.125 6.747) 8.046 9.817 ( 1.214 -5.005 9.929) 11.186 10.184 ( 9.224 6.170 -3.578) 11.660 10.333 ( 9.609 -7.678 -5.032) 13.289 10.501 ( -0.189 -2.016 2.540) 3.249 10.548 ( -2.489 -5.173 -0.704) 5.784 11.626 ( 7.464 21.931 2.453) 23.296 11.995 ( 11.244 -15.201 3.796) 19.284 12.100 ( -1.812 15.334 6.084) 16.596 12.339 ( 2.026 -7.413 0.250) 7.689 12.587 ( 16.580 0.138 -4.149) 17.091 12.614 ( 17.864 -1.849 -0.798) 17.978 13.490 ( -3.295 25.688 1.828) 25.963 13.603 ( 5.438 16.437 -1.382) 17.369 13.897 ( -8.560 -11.355 -5.942) 15.412 13.960 ( 0.998 -22.303 -8.277) 23.810 14.532 ( -0.033 8.534 -7.326) 11.247 14.838 ( 9.263 -23.350 -2.115) 25.209 15.615 ( -7.898 10.608 -1.207) 13.280 15.860 ( -6.825 -14.517 -0.371) 16.046 15.979 ( 1.816 9.221 -5.062) 10.675 16.154 ( 2.554 -7.845 -6.091) 10.255 16.353 ( -6.872 5.950 7.262) 11.635 16.416 ( -5.250 2.095 6.412) 8.548 16.601 ( -0.082 -0.613 5.418) 5.453 16.724 ( -7.326 -11.284 2.117) 13.619 18.915 ( 8.987 5.774 2.442) 10.958 19.014 ( 7.443 -4.323 0.346) 8.614 19.486 ( -1.345 7.935 -1.097) 8.122 19.584 ( -2.259 -2.596 -1.037) 3.594 ======================= Grid point 93 (39/120) ======================= q-point: ( 0.33 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( 9.640 8.382 0.844) 12.802 2.169 ( 5.065 5.533 2.929) 8.053 2.319 ( 3.927 -6.218 5.178) 8.994 2.467 ( -2.581 -11.513 4.710) 12.704 2.891 ( -0.516 0.132 -2.317) 2.377 2.943 ( -2.492 -5.326 -8.491) 10.329 3.125 ( -2.435 1.345 -2.392) 3.668 3.215 ( -5.706 -7.127 2.685) 9.516 3.717 ( -8.823 4.197 -4.854) 10.910 3.769 ( -8.417 1.314 -5.528) 10.155 3.867 ( -9.842 2.806 0.244) 10.238 3.949 ( -8.785 -4.045 0.959) 9.719 5.343 ( 17.942 11.728 -7.174) 22.604 5.502 ( 17.618 -4.804 -13.888) 22.942 5.783 ( 13.599 18.432 11.164) 25.482 6.059 ( 18.458 -8.658 12.208) 23.763 6.204 ( 2.652 12.727 -8.147) 15.342 6.430 ( 8.012 -8.261 -3.947) 12.166 6.670 ( 1.344 6.181 6.752) 9.252 6.865 ( 6.666 -11.821 7.970) 15.738 7.377 ( -10.904 1.259 -3.231) 11.443 7.410 ( -10.132 -2.269 -3.814) 11.061 7.574 ( -14.158 13.692 -7.875) 21.212 7.833 ( -7.308 -9.386 -4.023) 12.557 7.884 ( -2.817 3.388 -0.677) 4.458 7.950 ( -3.913 -2.516 0.261) 4.660 8.101 ( -10.748 -1.414 5.094) 11.978 8.157 ( -10.236 -7.931 6.711) 14.585 9.417 ( 4.965 9.061 2.128) 10.549 9.571 ( 2.646 -5.490 0.065) 6.095 9.712 ( -1.773 2.728 8.139) 8.765 9.800 ( -2.769 -4.433 8.179) 9.707 10.314 ( 3.648 9.424 -1.121) 10.168 10.388 ( 0.497 4.846 -4.196) 6.430 10.528 ( 0.562 -7.576 -2.597) 8.028 10.584 ( 3.989 -13.270 0.161) 13.857 11.762 ( 6.039 26.079 1.916) 26.838 12.036 ( -2.959 22.112 7.580) 23.562 12.219 ( 9.728 -19.934 2.557) 22.328 12.392 ( 3.505 -11.959 2.117) 12.641 12.804 ( 4.872 2.388 -5.470) 7.705 12.926 ( 12.024 -7.237 -5.833) 15.198 13.355 ( -10.145 17.076 -1.977) 19.961 13.640 ( -13.610 -11.527 -5.724) 18.731 13.945 ( 27.310 13.571 0.379) 30.498 14.233 ( 23.073 -15.918 -5.822) 28.629 14.600 ( 6.642 19.001 -1.306) 20.171 15.037 ( 10.364 -22.686 -0.612) 24.949 15.415 ( -10.381 6.850 -1.289) 12.504 15.673 ( -10.623 -15.963 -1.709) 19.251 15.933 ( -14.238 8.366 -4.093) 17.014 16.087 ( -12.467 -3.264 -9.114) 15.784 16.230 ( -0.289 4.690 9.266) 10.389 16.365 ( 3.448 -6.853 5.403) 9.383 16.555 ( -4.612 -1.025 8.411) 9.647 16.623 ( -2.313 -6.061 4.908) 8.135 19.103 ( 9.387 4.376 -0.798) 10.387 19.161 ( 7.053 -1.410 -2.130) 7.501 19.448 ( -2.491 6.672 -1.869) 7.363 19.523 ( -3.937 -1.419 -1.640) 4.495 ======================= Grid point 94 (40/120) ======================= q-point: ( 0.44 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( 6.857 3.119 2.109) 7.823 2.268 ( 3.387 1.518 1.933) 4.184 2.362 ( -0.156 -7.157 1.775) 7.376 2.396 ( -3.431 -6.249 0.358) 7.138 2.937 ( 3.676 0.641 -3.771) 5.305 2.941 ( 2.707 0.065 -0.623) 2.778 3.078 ( -2.644 -4.425 -3.428) 6.191 3.109 ( -5.071 -6.683 2.180) 8.668 3.589 ( -2.352 4.712 -2.152) 5.689 3.638 ( -5.066 5.458 -0.785) 7.488 3.696 ( -3.326 -3.150 -1.002) 4.690 3.770 ( -8.022 -5.187 0.422) 9.562 5.704 ( 15.229 13.975 -7.665) 22.045 5.806 ( 8.504 8.378 -9.472) 15.239 5.973 ( 6.218 5.326 -2.637) 8.601 6.132 ( -6.492 -7.779 -4.679) 11.160 6.483 ( 18.225 6.218 -7.566) 20.690 6.586 ( 11.634 -3.248 0.649) 12.097 6.735 ( -2.582 8.609 0.203) 8.990 6.898 ( -10.491 -5.861 -0.690) 12.037 7.106 ( -2.261 10.288 7.915) 13.176 7.268 ( -4.421 1.504 5.576) 7.273 7.351 ( -4.793 -5.257 4.632) 8.489 7.553 ( -16.293 -15.241 3.578) 22.595 7.877 ( 0.547 6.976 1.796) 7.225 7.897 ( -1.594 4.705 0.628) 5.007 8.010 ( 0.120 -6.263 -2.192) 6.636 8.043 ( -2.886 -8.881 0.344) 9.345 9.520 ( 5.174 6.934 4.409) 9.710 9.604 ( -1.365 3.776 4.268) 5.859 9.671 ( 0.058 -4.925 5.335) 7.261 9.727 ( -3.911 -4.997 5.350) 8.300 10.361 ( 1.910 9.943 -2.077) 10.335 10.391 ( -0.730 9.245 -1.823) 9.451 10.564 ( 2.577 -10.661 -2.714) 11.299 10.608 ( -1.161 -12.841 -1.311) 12.960 11.872 ( 5.035 28.076 4.276) 28.842 11.965 ( -4.176 26.968 7.026) 28.180 12.382 ( 6.085 -24.534 3.886) 25.574 12.445 ( 0.251 -21.711 5.248) 22.338 12.902 ( 7.447 11.012 -5.752) 14.484 13.114 ( -11.813 13.099 -4.519) 18.209 13.137 ( 9.651 -10.628 -8.060) 16.464 13.371 ( -12.907 -11.831 -7.004) 18.858 14.519 ( 23.863 16.547 -6.169) 29.687 14.702 ( 8.471 13.652 -5.464) 16.971 14.807 ( 22.526 2.222 0.817) 22.650 15.229 ( -2.309 -27.944 -1.071) 28.060 15.263 ( 4.264 4.040 -2.468) 6.371 15.444 ( -9.710 -3.167 2.214) 10.451 15.551 ( -16.037 -7.143 3.410) 17.884 15.688 ( -22.885 -8.228 -1.289) 24.353 16.327 ( 6.511 6.471 5.905) 10.914 16.443 ( -2.949 3.028 5.843) 7.211 16.481 ( 2.842 -6.944 4.048) 8.525 16.567 ( -3.711 -7.110 3.305) 8.674 19.276 ( 7.349 2.925 -2.508) 8.298 19.293 ( 6.319 1.335 -2.503) 6.927 19.383 ( -4.026 4.721 -2.608) 6.730 19.424 ( -5.927 0.149 -2.099) 6.290 ======================= Grid point 126 (41/120) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( 0.000 0.000 27.523) 27.523 1.208 ( 0.000 0.000 29.519) 29.519 2.162 ( 0.000 0.000 49.162) 49.162 2.717 ( 0.000 0.000 7.562) 7.562 2.870 ( 0.000 0.000 -17.012) 17.012 3.241 ( 0.000 0.000 1.945) 1.945 3.296 ( 0.000 0.000 -4.638) 4.638 3.550 ( 0.000 0.000 0.860) 0.860 3.648 ( 0.000 0.000 -9.107) 9.107 3.657 ( 0.000 0.000 -23.246) 23.246 3.907 ( 0.000 0.000 -12.849) 12.849 4.776 ( 0.000 0.000 1.158) 1.158 4.794 ( 0.000 0.000 -5.288) 5.288 5.016 ( 0.000 0.000 5.013) 5.013 5.172 ( 0.000 0.000 12.561) 12.561 5.493 ( 0.000 0.000 -1.519) 1.519 5.887 ( 0.000 0.000 15.114) 15.114 5.889 ( 0.000 0.000 14.770) 14.770 6.961 ( 0.000 0.000 -6.499) 6.499 7.214 ( 0.000 0.000 3.250) 3.250 7.539 ( 0.000 0.000 -1.278) 1.278 7.544 ( 0.000 0.000 -4.292) 4.292 7.718 ( 0.000 0.000 -15.237) 15.237 8.016 ( 0.000 0.000 12.140) 12.140 8.179 ( 0.000 0.000 -17.635) 17.635 8.368 ( 0.000 0.000 -7.615) 7.615 8.435 ( 0.000 0.000 -3.150) 3.150 9.144 ( 0.000 0.000 -4.869) 4.869 9.201 ( 0.000 0.000 -7.825) 7.825 9.493 ( 0.000 0.000 -5.012) 5.012 9.564 ( 0.000 0.000 -5.584) 5.584 9.583 ( 0.000 0.000 -4.786) 4.786 10.045 ( 0.000 0.000 -0.770) 0.770 10.656 ( 0.000 0.000 13.718) 13.718 10.810 ( 0.000 0.000 22.438) 22.438 11.089 ( 0.000 0.000 -6.738) 6.738 11.168 ( 0.000 0.000 8.783) 8.783 11.185 ( 0.000 0.000 1.549) 1.549 11.623 ( 0.000 0.000 -0.179) 0.179 11.912 ( 0.000 0.000 4.820) 4.820 11.944 ( 0.000 0.000 10.231) 10.231 12.403 ( 0.000 0.000 26.091) 26.091 12.646 ( 0.000 0.000 6.126) 6.126 13.179 ( 0.000 0.000 -17.478) 17.478 13.979 ( 0.000 0.000 -17.304) 17.304 14.242 ( 0.000 0.000 -22.867) 22.867 14.645 ( 0.000 0.000 -7.463) 7.463 15.235 ( 0.000 0.000 -23.818) 23.818 15.606 ( 0.000 0.000 -7.724) 7.724 15.976 ( 0.000 0.000 16.564) 16.564 16.290 ( 0.000 0.000 5.685) 5.685 16.376 ( 0.000 0.000 -12.176) 12.176 16.528 ( 0.000 0.000 -1.992) 1.992 16.819 ( 0.000 0.000 16.136) 16.136 16.888 ( 0.000 0.000 -4.235) 4.235 17.156 ( 0.000 0.000 1.907) 1.907 18.784 ( 0.000 0.000 16.315) 16.315 18.907 ( 0.000 0.000 -0.230) 0.230 19.007 ( 0.000 0.000 -1.076) 1.076 19.613 ( 0.000 0.000 -0.693) 0.693 ======================= Grid point 127 (42/120) ======================= q-point: ( 0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.252 ( 13.425 0.000 22.574) 26.265 1.402 ( 17.549 0.000 24.258) 29.940 2.397 ( 21.020 0.000 39.382) 44.640 2.737 ( 1.745 0.000 7.093) 7.305 2.906 ( 3.641 0.000 -13.253) 13.744 3.133 ( -5.970 0.000 -2.695) 6.550 3.369 ( 0.165 0.000 2.023) 2.030 3.511 ( 0.145 0.000 -2.362) 2.367 3.529 ( -8.156 0.000 -13.548) 15.814 3.646 ( -4.868 0.000 -14.680) 15.466 3.887 ( -1.997 0.000 -12.221) 12.383 4.704 ( -8.707 0.000 -4.616) 9.855 4.751 ( -1.451 0.000 0.713) 1.617 4.965 ( -3.174 0.000 5.225) 6.113 5.203 ( 2.146 0.000 6.154) 6.517 5.372 ( -7.978 0.000 1.290) 8.081 5.968 ( 5.677 0.000 14.073) 15.175 6.040 ( 13.546 0.000 16.461) 21.318 6.974 ( 0.912 0.000 -6.558) 6.621 7.293 ( 6.760 0.000 0.189) 6.762 7.490 ( -6.041 0.000 -2.871) 6.689 7.504 ( -3.579 0.000 -1.789) 4.001 7.686 ( -2.535 0.000 -13.800) 14.031 7.867 ( -12.029 0.000 3.754) 12.601 8.136 ( -3.724 0.000 -14.406) 14.880 8.353 ( -7.121 0.000 -0.499) 7.138 8.512 ( 11.480 0.000 -0.351) 11.485 8.814 ( -15.809 0.000 5.702) 16.806 9.133 ( -11.826 0.000 -4.095) 12.515 9.537 ( 3.581 0.000 -4.869) 6.044 9.539 ( -2.261 0.000 -8.156) 8.464 9.741 ( 9.370 0.000 -11.022) 14.466 10.158 ( 8.978 0.000 0.790) 9.013 10.678 ( 2.241 0.000 13.476) 13.661 10.780 ( -5.590 0.000 14.816) 15.836 11.056 ( -9.130 0.000 8.903) 12.752 11.260 ( 7.412 0.000 2.084) 7.699 11.266 ( 14.673 0.000 -11.641) 18.730 11.700 ( 2.945 0.000 6.396) 7.041 11.826 ( -3.130 0.000 3.834) 4.950 12.157 ( 20.877 0.000 3.426) 21.156 12.630 ( 0.099 0.000 5.975) 5.976 12.672 ( 22.281 0.000 23.932) 32.698 13.243 ( 5.832 0.000 -12.424) 13.724 13.917 ( -5.875 0.000 -16.924) 17.915 14.271 ( 2.903 0.000 -22.577) 22.763 14.579 ( -6.785 0.000 -5.376) 8.657 15.023 ( -16.561 0.000 -22.409) 27.864 15.726 ( 7.196 0.000 -7.324) 10.267 15.843 ( -7.367 0.000 14.617) 16.368 16.378 ( 2.120 0.000 -1.818) 2.793 16.488 ( 11.233 0.000 -3.254) 11.695 16.552 ( 2.222 0.000 -1.681) 2.786 16.723 ( -6.400 0.000 19.553) 20.574 16.883 ( -0.405 0.000 -3.691) 3.713 17.207 ( 2.350 0.000 -1.813) 2.968 18.801 ( 1.738 0.000 14.260) 14.365 18.895 ( -1.226 0.000 -0.766) 1.446 18.959 ( -4.079 0.000 -2.648) 4.863 19.591 ( -2.243 0.000 -0.961) 2.440 ======================= Grid point 128 (43/120) ======================= q-point: ( 0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( 17.304 0.000 14.960) 22.874 1.828 ( 23.219 0.000 15.639) 27.995 2.771 ( 1.117 0.000 5.371) 5.486 2.790 ( 11.170 0.000 -1.377) 11.255 2.951 ( -2.394 0.000 7.080) 7.474 3.129 ( 6.163 0.000 5.835) 8.488 3.329 ( 4.049 0.000 -3.216) 5.171 3.344 ( -9.913 0.000 -9.233) 13.546 3.466 ( -11.627 0.000 -9.319) 14.900 3.611 ( 8.241 0.000 0.200) 8.243 3.831 ( -3.275 0.000 -10.671) 11.162 4.471 ( -13.373 0.000 -2.197) 13.552 4.752 ( 1.176 0.000 -2.849) 3.082 4.907 ( -2.942 0.000 4.080) 5.030 5.255 ( -3.175 0.000 -1.126) 3.369 5.273 ( 6.048 0.000 -0.758) 6.095 6.098 ( 8.004 0.000 14.293) 16.382 6.368 ( 17.907 0.000 16.685) 24.476 6.966 ( -3.109 0.000 -9.368) 9.871 7.269 ( -15.523 0.000 -5.780) 16.564 7.385 ( -8.562 0.000 -3.738) 9.342 7.434 ( 4.619 0.000 -3.692) 5.913 7.617 ( -10.642 0.000 3.286) 11.138 7.637 ( -1.525 0.000 -6.045) 6.234 8.078 ( -0.750 0.000 -9.426) 9.456 8.184 ( -9.381 0.000 2.454) 9.697 8.584 ( -8.507 0.000 7.462) 11.316 8.771 ( 13.681 0.000 4.070) 14.274 8.862 ( -13.718 0.000 -3.324) 14.115 9.499 ( -0.802 0.000 -8.541) 8.579 9.597 ( 1.568 0.000 -3.586) 3.914 9.878 ( 4.540 0.000 -7.215) 8.524 10.319 ( 5.135 0.000 4.123) 6.586 10.631 ( -8.958 0.000 6.375) 10.995 10.745 ( 4.363 0.000 13.225) 13.926 10.875 ( -5.969 0.000 7.723) 9.761 11.465 ( 2.796 0.000 -8.544) 8.990 11.468 ( 10.976 0.000 4.300) 11.788 11.568 ( -6.833 0.000 12.953) 14.645 12.036 ( 16.079 0.000 -7.792) 17.868 12.581 ( 16.970 0.000 -7.472) 18.542 12.764 ( 16.043 0.000 10.479) 19.162 13.197 ( 27.802 0.000 21.566) 35.186 13.387 ( 7.812 0.000 -6.929) 10.443 13.777 ( -5.975 0.000 -15.328) 16.451 14.330 ( -5.861 0.000 -21.287) 22.079 14.416 ( 0.571 0.000 0.422) 0.710 14.652 ( -19.780 0.000 -21.917) 29.523 15.754 ( -2.015 0.000 10.184) 10.382 15.797 ( -1.333 0.000 -3.168) 3.438 16.379 ( -2.123 0.000 -1.402) 2.544 16.609 ( 3.363 0.000 -0.422) 3.389 16.655 ( 0.372 0.000 15.496) 15.501 16.691 ( 8.171 0.000 1.230) 8.263 16.875 ( -0.336 0.000 -2.271) 2.296 17.192 ( -4.172 0.000 -0.071) 4.173 18.855 ( -2.834 0.000 -3.648) 4.620 18.858 ( 4.067 0.000 8.993) 9.870 18.880 ( -3.077 0.000 -5.244) 6.081 19.524 ( -4.426 0.000 -1.656) 4.725 ======================= Grid point 129 (44/120) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( 18.030 0.000 8.363) 19.875 2.273 ( 19.814 0.000 7.863) 21.318 2.761 ( -2.250 0.000 2.136) 3.103 2.771 ( -7.703 0.000 -3.261) 8.365 2.993 ( 4.375 0.000 -12.611) 13.348 3.116 ( -2.225 0.000 4.194) 4.748 3.140 ( -9.610 0.000 -3.882) 10.364 3.263 ( -7.465 0.000 -5.419) 9.224 3.469 ( 1.132 0.000 -1.460) 1.848 3.733 ( -5.119 0.000 -11.719) 12.789 3.933 ( 18.675 0.000 12.878) 22.685 4.242 ( -7.245 0.000 3.057) 7.863 4.760 ( -0.672 0.000 -1.714) 1.841 4.842 ( -3.439 0.000 3.572) 4.958 5.278 ( 7.402 0.000 -5.448) 9.191 5.486 ( 15.345 0.000 -8.867) 17.723 6.297 ( 10.320 0.000 9.901) 14.302 6.704 ( 7.861 0.000 2.397) 8.218 6.781 ( -9.164 0.000 -5.714) 10.799 6.877 ( -21.402 0.000 -6.160) 22.271 7.230 ( -4.894 0.000 2.803) 5.639 7.373 ( -10.054 0.000 -5.182) 11.311 7.491 ( -2.130 0.000 4.820) 5.269 7.709 ( 7.854 0.000 -0.095) 7.855 7.978 ( -11.169 0.000 4.838) 12.172 8.111 ( 2.610 0.000 -8.977) 9.349 8.424 ( -7.572 0.000 7.626) 10.747 8.624 ( -9.413 0.000 -2.400) 9.714 9.043 ( 13.173 0.000 4.782) 14.014 9.531 ( 4.257 0.000 -5.406) 6.881 9.583 ( -3.033 0.000 -1.078) 3.219 9.926 ( -0.165 0.000 -2.353) 2.359 10.333 ( -2.733 0.000 4.836) 5.554 10.422 ( -10.239 0.000 2.866) 10.633 10.851 ( 6.261 0.000 13.213) 14.621 10.890 ( 6.088 0.000 5.668) 8.318 11.353 ( -9.591 0.000 15.026) 17.826 11.404 ( -7.089 0.000 -0.704) 7.123 11.815 ( 18.031 0.000 -0.161) 18.031 12.345 ( 12.266 0.000 -8.220) 14.765 12.885 ( 15.502 0.000 -10.329) 18.628 13.123 ( 15.355 0.000 5.677) 16.371 13.476 ( -1.227 0.000 -7.155) 7.260 13.519 ( 4.384 0.000 -5.451) 6.995 14.000 ( 30.435 0.000 10.338) 32.143 14.041 ( -16.942 0.000 -4.484) 17.525 14.245 ( -20.549 0.000 -20.856) 29.278 14.659 ( 18.657 0.000 -8.074) 20.329 15.646 ( -13.853 0.000 2.225) 14.031 15.702 ( -5.179 0.000 2.920) 5.945 16.350 ( 1.108 0.000 4.082) 4.230 16.685 ( 4.110 0.000 0.989) 4.228 16.695 ( 1.793 0.000 8.379) 8.568 16.811 ( 3.936 0.000 2.168) 4.494 16.865 ( -0.960 0.000 -0.452) 1.061 17.053 ( -8.690 0.000 6.625) 10.927 18.801 ( -2.014 0.000 -8.372) 8.611 18.831 ( -2.118 0.000 -5.778) 6.154 18.965 ( 6.530 0.000 3.043) 7.204 19.415 ( -6.383 0.000 -2.421) 6.827 ======================= Grid point 130 (45/120) ======================= q-point: ( 0.44 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.278 ( 16.526 0.000 3.817) 16.961 2.571 ( -12.370 0.000 0.659) 12.388 2.571 ( 9.280 0.000 0.343) 9.286 2.693 ( -4.338 0.000 -0.650) 4.386 3.041 ( 1.230 0.000 -0.444) 1.308 3.054 ( 2.395 0.000 -10.272) 10.547 3.097 ( -1.106 0.000 -8.036) 8.112 3.137 ( -6.062 0.000 -0.710) 6.103 3.467 ( 1.894 0.000 -3.459) 3.944 3.580 ( -8.298 0.000 -8.301) 11.738 4.169 ( 4.422 0.000 11.466) 12.289 4.203 ( 0.790 0.000 9.597) 9.629 4.747 ( 0.115 0.000 1.264) 1.269 4.777 ( -2.719 0.000 2.813) 3.913 5.614 ( 25.209 0.000 -8.571) 26.627 5.866 ( 21.803 0.000 -15.120) 26.532 6.169 ( -25.823 0.000 -7.785) 26.971 6.328 ( -23.384 0.000 -18.704) 29.944 6.769 ( 13.645 0.000 5.633) 14.762 6.998 ( 10.247 0.000 10.558) 14.713 7.099 ( -16.382 0.000 1.384) 16.440 7.146 ( -5.030 0.000 6.161) 7.953 7.539 ( 7.116 0.000 5.966) 9.286 7.743 ( -11.855 0.000 6.421) 13.482 7.890 ( 9.587 0.000 -1.953) 9.783 8.073 ( -7.497 0.000 -5.761) 9.454 8.367 ( 3.140 0.000 3.183) 4.471 8.473 ( -6.341 0.000 -0.769) 6.388 9.288 ( 11.009 0.000 3.787) 11.643 9.476 ( -7.544 0.000 1.671) 7.727 9.665 ( 8.634 0.000 -1.178) 8.714 9.844 ( -7.878 0.000 1.069) 7.950 10.269 ( -1.558 0.000 1.286) 2.020 10.291 ( -3.282 0.000 1.641) 3.670 10.994 ( 7.912 0.000 13.514) 15.660 11.049 ( 8.915 0.000 5.443) 10.445 11.165 ( -9.056 0.000 14.174) 16.820 11.233 ( -9.222 0.000 3.754) 9.956 12.176 ( 16.806 0.000 -2.384) 16.974 12.423 ( -5.620 0.000 -5.228) 7.676 13.196 ( 14.340 0.000 -10.494) 17.770 13.329 ( 3.864 0.000 -0.971) 3.984 13.535 ( 10.020 0.000 -15.824) 18.730 13.558 ( 1.237 0.000 -3.528) 3.739 13.710 ( -14.400 0.000 -0.352) 14.404 13.844 ( -18.899 0.000 -19.047) 26.832 14.661 ( 32.560 0.000 11.930) 34.677 15.095 ( 22.669 0.000 -6.111) 23.478 15.250 ( -25.241 0.000 7.657) 26.377 15.493 ( -15.797 0.000 -3.696) 16.224 16.455 ( 8.798 0.000 7.101) 11.306 16.645 ( -7.869 0.000 6.118) 9.968 16.766 ( 3.812 0.000 1.486) 4.092 16.830 ( -2.495 0.000 0.976) 2.679 16.865 ( 2.125 0.000 4.866) 5.309 16.915 ( -3.769 0.000 9.280) 10.016 18.781 ( -0.075 0.000 -9.157) 9.157 18.795 ( -1.372 0.000 -7.765) 7.885 19.112 ( 7.926 0.000 -1.023) 7.992 19.272 ( -7.743 0.000 -2.559) 8.155 ======================= Grid point 135 (46/120) ======================= q-point: ( 0.00 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( 0.000 5.952 26.305) 26.970 1.289 ( 0.000 18.312 22.713) 29.175 2.403 ( 0.000 21.565 41.127) 46.437 2.668 ( 0.000 -5.744 -0.067) 5.744 2.913 ( 0.000 4.520 -9.148) 10.204 3.151 ( 0.000 -7.284 -1.219) 7.385 3.229 ( 0.000 -10.072 -2.543) 10.388 3.460 ( 0.000 0.401 -8.764) 8.773 3.681 ( 0.000 -2.539 -4.461) 5.133 3.707 ( 0.000 3.912 -20.865) 21.228 3.884 ( 0.000 -1.998 -8.638) 8.866 4.682 ( 0.000 -9.493 -5.831) 11.141 4.864 ( 0.000 6.525 1.567) 6.710 5.155 ( 0.000 11.385 8.597) 14.266 5.266 ( 0.000 10.000 8.328) 13.014 5.414 ( 0.000 -4.512 1.114) 4.648 5.857 ( 0.000 -2.568 14.827) 15.048 5.903 ( 0.000 1.081 12.332) 12.380 6.979 ( 0.000 1.242 -6.685) 6.800 7.125 ( 0.000 -8.313 3.386) 8.976 7.472 ( 0.000 -4.560 -11.183) 12.077 7.487 ( 0.000 -8.420 2.320) 8.733 7.800 ( 0.000 7.441 -11.272) 13.507 8.062 ( 0.000 4.397 12.616) 13.360 8.172 ( 0.000 -0.459 -16.862) 16.868 8.444 ( 0.000 1.216 -4.080) 4.257 8.471 ( 0.000 8.282 -7.897) 11.443 9.084 ( 0.000 -9.346 -7.812) 12.181 9.135 ( 0.000 -0.962 -4.824) 4.919 9.419 ( 0.000 -7.318 -3.697) 8.199 9.571 ( 0.000 -0.744 -5.929) 5.975 9.588 ( 0.000 0.870 -7.757) 7.806 10.024 ( 0.000 -1.781 2.046) 2.712 10.541 ( 0.000 -18.739 19.366) 26.948 10.742 ( 0.000 7.324 12.861) 14.800 10.913 ( 0.000 -4.249 11.265) 12.040 11.179 ( 0.000 1.937 8.473) 8.691 11.666 ( 0.000 26.348 -11.431) 28.721 11.667 ( 0.000 4.348 -1.541) 4.613 11.880 ( 0.000 -1.883 4.381) 4.769 12.165 ( 0.000 18.912 6.129) 19.880 12.427 ( 0.000 2.474 24.965) 25.087 12.624 ( 0.000 -0.741 7.889) 7.923 13.199 ( 0.000 2.230 -17.829) 17.968 13.941 ( 0.000 -4.363 -16.940) 17.493 14.234 ( 0.000 -0.829 -21.938) 21.954 14.594 ( 0.000 -4.600 -5.378) 7.077 15.265 ( 0.000 1.663 -19.918) 19.987 15.628 ( 0.000 1.497 -2.032) 2.524 15.876 ( 0.000 -7.191 7.943) 10.714 16.145 ( 0.000 -16.893 2.801) 17.124 16.339 ( 0.000 -4.724 -9.239) 10.377 16.408 ( 0.000 -5.786 -4.066) 7.072 16.833 ( 0.000 -3.868 5.621) 6.823 16.836 ( 0.000 0.561 16.380) 16.390 17.107 ( 0.000 -5.834 -2.634) 6.401 18.787 ( 0.000 1.210 14.436) 14.486 19.017 ( 0.000 0.462 0.252) 0.526 19.044 ( 0.000 12.084 0.657) 12.101 19.626 ( 0.000 1.114 -0.798) 1.370 ======================= Grid point 136 (47/120) ======================= q-point: ( 0.11 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( 12.983 7.682 21.806) 26.516 1.427 ( 12.916 10.339 21.077) 26.794 2.583 ( 13.495 12.903 24.131) 30.511 2.696 ( 3.920 -1.079 8.700) 9.603 2.936 ( 3.427 2.168 -8.069) 9.031 3.085 ( -4.855 -4.225 -1.913) 6.714 3.213 ( -2.635 -11.792 -2.556) 12.350 3.487 ( 2.098 0.981 -7.466) 7.817 3.616 ( -5.068 -2.191 -5.773) 7.988 3.647 ( -5.711 5.256 -14.291) 16.263 3.875 ( -1.461 -1.472 -9.884) 10.099 4.590 ( -8.663 -9.114 -5.224) 13.616 4.818 ( -2.792 5.447 1.812) 6.384 5.117 ( -2.317 12.464 5.731) 13.912 5.280 ( -1.360 2.811 6.078) 6.833 5.357 ( -2.104 5.102 0.374) 5.532 5.919 ( 5.689 -2.708 14.745) 16.035 6.058 ( 13.480 0.541 14.572) 19.859 6.993 ( 1.129 1.270 -6.484) 6.703 7.199 ( 6.203 -8.301 1.108) 10.422 7.415 ( -6.725 -8.301 0.690) 10.705 7.483 ( 0.371 -3.580 -8.206) 8.960 7.714 ( -8.078 5.063 -10.942) 14.513 7.944 ( -9.469 6.140 5.344) 12.487 8.122 ( -3.947 -1.471 -13.671) 14.305 8.366 ( -7.095 1.105 -2.119) 7.487 8.604 ( 9.159 5.437 -0.199) 10.653 8.753 ( -13.760 -2.793 2.641) 14.287 9.105 ( -10.615 -2.898 -3.777) 11.633 9.446 ( 0.710 -3.991 -6.189) 7.398 9.619 ( 3.545 2.562 -6.621) 7.935 9.731 ( 9.598 -0.772 -11.020) 14.634 10.119 ( 7.873 -3.527 2.993) 9.132 10.667 ( 5.931 -12.120 14.865) 20.075 10.750 ( -1.643 3.264 13.766) 14.243 10.884 ( 4.247 -10.262 3.072) 11.523 11.079 ( -7.710 3.783 8.620) 12.167 11.724 ( 4.753 17.031 -3.922) 18.112 11.772 ( 7.275 11.815 -5.622) 14.971 11.986 ( -4.702 13.789 6.160) 15.817 12.145 ( 18.474 -0.201 2.805) 18.687 12.553 ( 2.724 -5.767 9.059) 11.079 12.769 ( 18.967 8.587 19.763) 28.707 13.248 ( 4.634 0.798 -12.530) 13.384 13.896 ( -4.536 -2.438 -16.964) 17.729 14.242 ( 1.032 -3.274 -21.861) 22.129 14.535 ( -6.011 -3.942 -3.457) 7.976 15.076 ( -14.820 4.681 -19.816) 25.184 15.708 ( 3.364 -2.665 5.290) 6.812 15.847 ( 0.275 1.182 0.907) 1.515 16.222 ( 5.327 -19.723 0.552) 20.437 16.393 ( 3.523 -5.954 -12.126) 13.961 16.418 ( 1.609 -8.369 1.181) 8.603 16.744 ( -6.224 0.658 18.668) 19.689 16.846 ( 0.940 -2.817 3.685) 4.732 17.147 ( 1.752 -6.503 -2.879) 7.325 18.800 ( 1.283 1.138 12.058) 12.179 18.988 ( -2.383 2.130 -1.420) 3.497 19.035 ( -0.858 12.147 0.247) 12.180 19.605 ( -2.124 1.237 -1.062) 2.677 ======================= Grid point 137 (48/120) ======================= q-point: ( 0.22 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 15.028 10.275 13.931) 22.923 1.791 ( 21.286 -2.138 16.612) 27.086 2.679 ( 0.170 -7.089 0.411) 7.103 2.839 ( 4.272 1.579 -5.173) 6.893 2.971 ( -6.303 -0.595 -0.682) 6.368 3.037 ( -0.844 -7.691 4.714) 9.060 3.264 ( 9.708 -2.338 1.166) 10.053 3.436 ( -3.580 3.014 -1.798) 5.013 3.493 ( -7.245 4.204 -9.409) 12.597 3.630 ( 5.831 3.416 -1.074) 6.843 3.812 ( -4.344 -1.890 -8.245) 9.509 4.363 ( -13.067 -8.387 -3.279) 15.869 4.806 ( 1.433 5.027 -2.269) 5.699 5.089 ( -0.171 15.109 5.602) 16.115 5.225 ( -1.693 -1.687 -0.562) 2.455 5.377 ( 3.651 10.213 -2.422) 11.113 6.077 ( 10.144 -0.300 14.103) 17.375 6.378 ( 17.211 0.034 15.328) 23.047 7.000 ( -1.907 2.695 -8.331) 8.962 7.177 ( -14.231 -8.935 -4.194) 17.319 7.340 ( 3.361 -5.729 -0.624) 6.672 7.450 ( -9.474 4.138 -4.536) 11.290 7.532 ( -2.906 -4.619 -6.968) 8.851 7.770 ( -6.728 7.600 1.407) 10.247 8.047 ( -2.335 -2.713 -7.853) 8.630 8.201 ( -8.581 0.720 1.486) 8.738 8.517 ( -8.246 -5.721 5.881) 11.633 8.755 ( -6.051 -3.790 -2.371) 7.524 8.943 ( 4.304 9.316 3.286) 10.775 9.456 ( 1.055 -1.277 -6.059) 6.281 9.681 ( 1.993 5.196 -5.250) 7.651 9.866 ( 4.241 -0.544 -6.479) 7.763 10.273 ( 5.688 -4.344 5.009) 8.736 10.581 ( -9.813 -3.923 8.171) 13.359 10.745 ( 1.171 -3.448 7.384) 8.233 10.964 ( -1.826 10.809 9.593) 14.567 11.105 ( 11.182 -17.347 1.344) 20.682 11.678 ( -8.840 11.930 14.537) 20.780 11.849 ( 3.672 18.806 -7.024) 20.408 12.127 ( 15.229 8.814 -8.446) 19.518 12.557 ( 16.375 -2.546 -8.065) 18.430 12.697 ( 15.630 -6.611 10.195) 19.798 13.241 ( 25.254 4.582 20.648) 32.941 13.372 ( 7.399 -0.946 -6.006) 9.577 13.777 ( -5.710 -0.159 -15.280) 16.312 14.263 ( -2.067 -6.926 -21.814) 22.980 14.381 ( -5.910 -2.334 1.247) 6.475 14.766 ( -14.063 9.989 -18.632) 25.391 15.729 ( -0.178 -0.295 7.851) 7.859 15.870 ( -0.914 4.792 -2.329) 5.406 16.318 ( 4.079 -19.692 -0.938) 20.132 16.391 ( -1.720 -4.871 -2.030) 5.550 16.499 ( 3.766 -16.570 -1.322) 17.044 16.659 ( -1.288 -1.500 13.646) 13.789 16.867 ( 0.863 -1.710 4.248) 4.660 17.128 ( -3.907 -6.758 0.128) 7.807 18.839 ( 2.423 1.594 4.421) 5.288 18.946 ( -1.211 5.160 -3.597) 6.406 19.013 ( -1.146 11.976 -0.510) 12.041 19.541 ( -4.231 1.565 -1.748) 4.838 ======================= Grid point 138 (49/120) ======================= q-point: ( 0.33 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( 15.511 5.778 8.267) 18.502 2.210 ( 19.236 -5.678 9.814) 22.329 2.647 ( -3.485 -6.670 -0.462) 7.540 2.806 ( -8.590 -5.469 -0.837) 10.218 2.888 ( 0.935 -2.234 -10.422) 10.699 3.018 ( -0.678 -7.326 -4.478) 8.612 3.210 ( -5.445 -0.626 -4.633) 7.177 3.325 ( -6.426 6.206 -0.688) 8.960 3.502 ( -1.214 2.996 -2.587) 4.140 3.718 ( -5.280 -2.494 -7.818) 9.758 3.862 ( 11.743 -4.625 9.194) 15.615 4.126 ( -8.443 -8.345 1.559) 11.973 4.861 ( 4.834 9.423 -0.820) 10.622 5.086 ( -1.342 20.859 4.919) 21.474 5.287 ( 9.541 0.967 -7.045) 11.899 5.538 ( 13.240 5.926 -8.633) 16.880 6.317 ( 12.441 2.784 10.117) 16.275 6.688 ( 8.941 -2.099 6.199) 11.080 6.758 ( -20.835 -4.645 -11.082) 24.052 6.898 ( -11.283 4.305 -5.860) 13.423 7.232 ( -7.092 0.238 2.681) 7.586 7.323 ( -4.360 -0.843 -0.041) 4.441 7.588 ( 2.978 -1.487 -2.608) 4.229 7.685 ( -0.291 4.895 4.672) 6.773 8.017 ( -6.769 1.102 3.566) 7.729 8.071 ( 1.317 -2.994 -6.538) 7.311 8.350 ( -8.828 -6.647 6.309) 12.725 8.540 ( -10.150 -7.819 -2.043) 12.975 9.149 ( 11.562 9.504 5.393) 15.909 9.501 ( 3.195 0.099 -2.251) 3.910 9.687 ( -1.179 7.225 -3.495) 8.112 9.913 ( 0.097 -1.181 -1.668) 2.046 10.302 ( -2.633 -2.934 4.727) 6.155 10.376 ( -8.883 -3.444 3.205) 10.051 10.815 ( 6.206 -6.353 4.451) 9.934 11.005 ( 4.632 12.745 11.823) 17.991 11.219 ( -0.253 -13.334 2.067) 13.496 11.491 ( -9.375 13.100 14.130) 21.428 11.984 ( 11.066 13.370 -2.585) 17.547 12.421 ( 11.410 7.367 -9.686) 16.681 12.848 ( 15.081 -4.130 -9.658) 18.379 13.024 ( 12.972 -9.342 2.973) 16.260 13.462 ( -2.019 -2.601 -0.483) 3.328 13.564 ( 6.989 5.214 -6.670) 10.978 13.825 ( 1.482 -10.361 -2.110) 10.677 14.183 ( 8.661 7.491 5.038) 12.510 14.266 ( -10.272 1.521 -19.368) 21.976 14.724 ( 13.273 6.756 -7.188) 16.537 15.648 ( -10.755 1.809 4.324) 11.732 15.774 ( -7.827 5.469 -1.168) 9.620 16.342 ( 0.508 -2.325 4.061) 4.707 16.430 ( 4.926 -22.577 1.174) 23.138 16.544 ( 0.834 -19.813 1.691) 19.902 16.675 ( 1.457 -4.429 5.499) 7.210 16.870 ( -0.799 -2.366 3.708) 4.471 17.000 ( -7.985 -5.953 6.695) 12.001 18.874 ( 0.847 6.206 -6.576) 9.082 18.946 ( -0.303 9.263 -4.913) 10.490 19.020 ( 3.517 6.565 1.247) 7.551 19.436 ( -6.186 1.979 -2.504) 6.961 ======================= Grid point 139 (50/120) ======================= q-point: ( 0.44 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( 13.384 0.098 3.643) 13.871 2.502 ( -3.148 -4.460 -1.527) 5.668 2.536 ( 4.829 -6.165 5.483) 9.559 2.675 ( -4.730 -2.176 0.025) 5.206 2.908 ( 1.070 -6.620 -9.126) 11.325 2.954 ( -4.081 -7.327 -6.899) 10.860 3.189 ( 1.207 4.614 -3.931) 6.181 3.223 ( -3.337 4.733 -1.221) 5.918 3.476 ( 1.226 0.451 -3.250) 3.503 3.577 ( -7.623 -1.083 -5.893) 9.696 3.973 ( 2.713 -13.756 7.423) 15.865 4.037 ( -3.162 -12.252 7.411) 14.664 4.975 ( 4.711 18.139 1.288) 18.785 5.042 ( -2.604 21.647 2.977) 22.006 5.635 ( 24.488 2.269 -9.828) 26.484 5.899 ( 21.708 3.518 -14.146) 26.148 6.174 ( -26.115 0.462 -10.196) 28.038 6.372 ( -23.870 4.407 -16.960) 29.611 6.715 ( 14.256 -3.615 6.930) 16.259 6.950 ( -1.834 -4.299 5.045) 6.877 7.124 ( -0.249 4.672 8.631) 9.818 7.223 ( -5.414 4.614 5.799) 9.178 7.618 ( 3.492 6.087 4.043) 8.099 7.716 ( -2.780 -1.336 3.627) 4.761 7.925 ( 2.346 2.148 3.187) 4.503 8.057 ( -6.806 -1.737 -3.966) 8.066 8.259 ( 3.089 -10.546 2.489) 11.268 8.375 ( -6.976 -9.302 -1.216) 11.690 9.366 ( 9.708 7.263 4.855) 13.061 9.516 ( -4.107 3.663 3.309) 6.422 9.703 ( 5.079 4.032 -2.224) 6.856 9.844 ( -6.829 -0.156 1.159) 6.928 10.236 ( -0.949 -2.651 0.309) 2.833 10.268 ( -3.315 -1.891 1.335) 4.043 10.963 ( 7.789 -8.167 5.140) 12.401 11.087 ( -1.117 -2.446 8.799) 9.201 11.174 ( 1.658 6.515 8.339) 10.711 11.309 ( -8.570 14.036 13.196) 21.085 12.259 ( 14.471 7.884 -3.629) 16.874 12.484 ( -5.744 6.079 -6.825) 10.795 13.168 ( 15.553 -4.024 -12.064) 20.090 13.243 ( 11.034 -11.314 1.896) 15.917 13.370 ( -5.864 -6.978 -8.269) 12.307 13.548 ( -15.164 -9.601 1.733) 18.031 13.756 ( 6.952 10.212 -13.982) 18.658 13.972 ( -13.495 10.077 -17.352) 24.181 14.717 ( 30.518 5.280 11.494) 33.035 15.119 ( 21.440 2.134 -5.360) 22.202 15.286 ( -23.158 3.881 7.704) 24.712 15.535 ( -16.757 3.757 -4.543) 17.764 16.415 ( 5.973 -7.886 7.587) 12.467 16.509 ( -0.736 -19.612 2.978) 19.851 16.552 ( 3.136 -17.793 4.048) 18.515 16.655 ( -4.598 -6.106 1.527) 7.795 16.844 ( -0.569 -4.252 5.026) 6.608 16.874 ( -3.408 -4.798 8.716) 10.517 18.892 ( 1.172 9.858 -8.303) 12.942 18.920 ( -1.604 11.261 -7.051) 13.383 19.142 ( 7.492 2.933 -1.170) 8.131 19.297 ( -7.562 2.368 -2.648) 8.355 ======================= Grid point 144 (51/120) ======================= q-point: ( 0.00 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 0.000 16.012 15.962) 22.609 1.714 ( 0.000 24.606 15.141) 28.891 2.496 ( 0.000 -12.011 -2.664) 12.302 2.797 ( 0.000 13.818 20.121) 24.408 2.935 ( 0.000 -4.539 -6.958) 8.307 2.990 ( 0.000 -12.482 1.844) 12.618 3.130 ( 0.000 8.223 -2.384) 8.562 3.484 ( 0.000 -0.208 -10.058) 10.060 3.680 ( 0.000 7.449 -6.355) 9.792 3.765 ( 0.000 1.581 -18.385) 18.453 3.797 ( 0.000 -7.766 -2.132) 8.054 4.464 ( 0.000 -13.274 -6.331) 14.707 4.967 ( 0.000 5.614 4.427) 7.150 5.345 ( 0.000 5.878 16.895) 17.889 5.383 ( 0.000 3.629 8.780) 9.501 5.569 ( 0.000 17.909 -0.318) 17.912 5.777 ( 0.000 -6.127 15.027) 16.228 5.968 ( 0.000 6.818 4.122) 7.967 6.860 ( 0.000 -13.019 4.315) 13.715 7.076 ( 0.000 3.662 -8.455) 9.214 7.242 ( 0.000 -16.063 4.284) 16.624 7.385 ( 0.000 -5.297 -13.661) 14.652 7.937 ( 0.000 6.424 -9.773) 11.696 8.125 ( 0.000 0.156 -5.146) 5.148 8.203 ( 0.000 5.066 2.352) 5.585 8.502 ( 0.000 5.711 -4.741) 7.423 8.551 ( 0.000 -2.199 -1.176) 2.494 8.972 ( 0.000 -0.553 -11.470) 11.483 9.111 ( 0.000 -1.357 -5.603) 5.765 9.228 ( 0.000 -12.321 -2.717) 12.616 9.566 ( 0.000 0.036 -8.881) 8.881 9.578 ( 0.000 -1.403 -10.022) 10.120 9.996 ( 0.000 -0.708 8.010) 8.042 10.261 ( 0.000 -10.942 20.981) 23.663 10.847 ( 0.000 2.408 13.399) 13.614 10.855 ( 0.000 -1.968 14.161) 14.297 11.289 ( 0.000 10.114 7.249) 12.444 11.772 ( 0.000 6.391 -4.207) 7.651 11.808 ( 0.000 -4.122 5.183) 6.622 12.082 ( 0.000 13.035 -13.449) 18.729 12.375 ( 0.000 0.700 2.016) 2.135 12.486 ( 0.000 3.158 20.757) 20.996 12.864 ( 0.000 29.454 9.885) 31.068 13.271 ( 0.000 5.456 -18.747) 19.524 13.806 ( 0.000 -9.552 -17.118) 19.603 14.210 ( 0.000 -2.044 -18.718) 18.830 14.506 ( 0.000 -4.040 -1.444) 4.290 15.145 ( 0.000 -19.724 -1.326) 19.769 15.625 ( 0.000 -0.658 8.903) 8.927 15.827 ( 0.000 -9.235 -13.089) 16.019 15.840 ( 0.000 3.514 -11.825) 12.336 16.207 ( 0.000 -7.992 -1.308) 8.099 16.365 ( 0.000 0.059 -10.650) 10.650 16.770 ( 0.000 -3.428 7.401) 8.157 16.832 ( 0.000 -0.676 17.613) 17.626 16.944 ( 0.000 -10.004 -0.599) 10.021 18.831 ( 0.000 3.110 12.741) 13.115 19.008 ( 0.000 -1.492 3.634) 3.928 19.294 ( 0.000 12.877 0.014) 12.877 19.642 ( 0.000 0.132 -0.932) 0.941 ======================= Grid point 145 (52/120) ======================= q-point: ( 0.11 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( 8.490 12.413 15.804) 21.816 1.781 ( 6.287 21.686 14.226) 26.687 2.500 ( 0.541 -11.330 -1.509) 11.442 2.876 ( 0.786 2.121 1.237) 2.578 2.889 ( -1.970 -7.109 -2.481) 7.783 3.007 ( 3.652 -4.388 9.170) 10.801 3.102 ( -2.097 4.030 -3.919) 6.000 3.499 ( 1.715 3.533 -6.995) 8.022 3.643 ( -4.456 2.954 -8.271) 9.848 3.710 ( -1.771 1.472 -4.674) 5.211 3.835 ( 0.996 -0.765 -11.419) 11.487 4.393 ( -6.750 -11.416 -5.825) 14.485 4.934 ( -2.673 7.343 5.238) 9.408 5.241 ( -3.184 -0.527 5.909) 6.733 5.382 ( -4.756 11.230 7.462) 14.297 5.604 ( 4.619 14.261 6.168) 16.210 5.911 ( 9.994 2.240 13.205) 16.711 6.060 ( 9.700 0.906 7.779) 12.467 6.911 ( 4.184 -11.392 2.053) 12.308 7.116 ( 3.083 1.429 -6.403) 7.248 7.189 ( -4.621 -14.041 2.614) 15.012 7.398 ( 1.283 -4.945 -12.309) 13.327 7.834 ( -9.492 6.339 -9.228) 14.678 8.066 ( -10.241 5.184 0.793) 11.505 8.084 ( -3.910 -1.211 -6.008) 7.270 8.381 ( -10.832 -0.671 -2.618) 11.164 8.545 ( -3.664 -4.325 2.012) 6.015 8.856 ( -5.008 4.797 -5.100) 8.608 9.034 ( -1.550 -1.565 -1.726) 2.799 9.401 ( 5.907 -1.472 -5.534) 8.227 9.621 ( 4.544 -1.330 -7.803) 9.127 9.728 ( 12.821 0.261 -11.697) 17.357 10.050 ( 4.560 -2.935 8.208) 9.837 10.388 ( 11.382 -13.713 15.984) 23.939 10.749 ( -8.131 -1.770 11.177) 13.935 10.806 ( -4.179 -2.373 10.443) 11.496 11.268 ( -0.523 15.065 6.796) 16.535 11.864 ( 8.605 5.711 -2.282) 10.577 12.038 ( 16.086 -2.329 5.036) 17.015 12.137 ( 5.982 12.652 -12.134) 18.523 12.295 ( -4.500 7.980 1.813) 9.339 12.455 ( -0.555 -0.968 12.767) 12.815 13.044 ( 14.841 21.912 14.173) 30.021 13.290 ( 2.286 4.043 -13.063) 13.864 13.805 ( -0.463 -7.733 -17.777) 19.391 14.150 ( -5.089 -5.749 -17.016) 18.668 14.462 ( -4.227 -3.069 -0.690) 5.269 15.100 ( -4.970 -8.321 -7.374) 12.178 15.624 ( 1.697 -5.940 7.024) 9.354 15.775 ( -0.522 -8.057 -5.406) 9.717 15.967 ( 5.686 0.070 -13.492) 14.642 16.190 ( -1.283 -11.253 -1.115) 11.381 16.370 ( 0.402 0.369 -8.136) 8.155 16.750 ( -5.979 0.208 17.363) 18.365 16.790 ( 1.522 -3.374 7.139) 8.042 16.974 ( 0.868 -10.742 -0.375) 10.784 18.845 ( 1.500 3.296 10.511) 11.118 19.008 ( 0.145 -0.320 1.777) 1.812 19.285 ( -0.889 12.819 -0.412) 12.857 19.624 ( -1.820 0.327 -1.203) 2.207 ======================= Grid point 146 (53/120) ======================= q-point: ( 0.22 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( 15.002 4.137 13.414) 20.545 1.943 ( 9.304 15.678 11.519) 21.565 2.515 ( 0.838 -10.357 0.556) 10.405 2.760 ( -7.257 -6.882 -5.033) 11.196 2.889 ( -0.803 -7.860 -6.512) 10.238 3.014 ( -3.495 5.628 -2.424) 7.055 3.107 ( 0.320 -12.953 1.077) 13.001 3.505 ( -7.807 -3.011 -3.885) 9.225 3.588 ( 5.159 8.699 -2.400) 10.394 3.727 ( 1.305 2.275 -4.543) 5.246 3.804 ( -2.382 5.343 -5.585) 8.087 4.210 ( -10.844 -7.340 -4.088) 13.718 4.925 ( 2.855 7.142 0.497) 7.707 5.185 ( -1.229 -1.984 -0.159) 2.339 5.390 ( 6.066 15.704 6.072) 17.896 5.668 ( 1.875 19.089 1.169) 19.216 6.133 ( 12.163 5.678 12.730) 18.499 6.334 ( 16.043 -5.237 11.834) 20.612 6.971 ( -8.761 -11.650 -1.917) 14.702 7.004 ( -1.378 -5.225 -2.878) 6.122 7.243 ( 5.840 -1.678 -3.537) 7.030 7.428 ( 1.365 -4.136 -7.867) 8.992 7.578 ( -15.596 6.907 -7.020) 18.445 7.881 ( -6.749 3.311 -2.405) 7.893 7.994 ( -4.079 -2.228 -0.941) 4.742 8.171 ( -8.739 -3.998 -0.508) 9.623 8.427 ( -7.813 -2.725 2.911) 8.771 8.643 ( -13.827 -7.017 -1.594) 15.587 9.146 ( 8.968 10.316 3.639) 14.145 9.487 ( 3.685 3.410 -3.798) 6.296 9.719 ( 4.740 -0.110 -4.603) 6.608 9.917 ( 4.386 6.359 -4.418) 8.899 10.166 ( 6.520 -6.867 5.469) 10.935 10.498 ( -7.224 -5.470 9.838) 13.375 10.645 ( -0.011 -5.822 5.025) 7.691 10.776 ( 5.132 -13.809 4.608) 15.436 11.295 ( 3.149 20.235 7.107) 21.676 11.936 ( -3.632 13.600 8.743) 16.571 12.177 ( 1.413 14.950 -6.970) 16.555 12.286 ( 10.587 2.499 -2.252) 11.109 12.489 ( 16.368 -4.229 -8.950) 19.129 12.566 ( 12.606 -3.292 5.456) 14.125 13.359 ( 10.553 6.392 14.424) 18.981 13.391 ( 11.802 5.121 -3.744) 13.399 13.764 ( -4.089 -1.499 -15.221) 15.832 14.076 ( 0.361 -12.392 -15.209) 19.621 14.360 ( -4.642 1.071 1.654) 5.042 14.966 ( -6.912 8.619 -12.426) 16.628 15.714 ( 6.290 -17.843 6.909) 20.141 15.784 ( 0.672 -4.496 -0.638) 4.591 15.980 ( -4.715 -5.450 -14.004) 15.750 16.190 ( 0.784 -11.793 0.542) 11.831 16.370 ( -0.626 0.566 -2.308) 2.457 16.637 ( -4.610 -0.116 15.434) 16.108 16.810 ( 0.135 -4.102 6.439) 7.636 16.948 ( -3.551 -11.522 0.959) 12.095 18.897 ( 3.770 3.980 4.606) 7.161 19.022 ( 1.434 2.267 -1.454) 3.052 19.259 ( -1.681 12.527 -1.573) 12.737 19.568 ( -3.718 0.863 -1.909) 4.267 ======================= Grid point 147 (54/120) ======================= q-point: ( 0.33 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( 15.491 -2.343 8.288) 17.725 2.129 ( 8.738 6.799 8.179) 13.765 2.533 ( -0.328 -5.202 1.464) 5.414 2.616 ( -5.443 -9.721 -2.529) 11.424 2.841 ( -4.129 -7.972 -8.789) 12.563 2.954 ( -2.153 4.256 -6.442) 8.015 3.114 ( 2.252 -9.539 0.487) 9.813 3.358 ( -6.473 -3.034 -2.705) 7.644 3.594 ( -3.783 4.708 -2.189) 6.424 3.641 ( -6.097 -3.210 -3.810) 7.874 3.821 ( -2.039 0.029 0.775) 2.182 4.006 ( -8.292 -4.058 -1.229) 9.313 5.063 ( 11.424 10.125 -1.708) 15.361 5.279 ( 9.628 0.202 -9.411) 13.465 5.544 ( 6.864 23.886 6.990) 25.817 5.732 ( 7.273 14.602 -7.051) 17.772 6.399 ( 14.100 3.348 12.276) 18.993 6.619 ( -5.895 -3.056 0.238) 6.644 6.637 ( -4.717 -7.742 -3.961) 9.893 6.990 ( -6.864 2.535 -10.135) 12.500 7.262 ( -7.560 3.928 4.662) 9.712 7.336 ( -1.639 1.405 1.211) 2.475 7.472 ( 4.379 -6.703 -2.003) 8.254 7.817 ( -0.454 4.194 0.787) 4.291 7.950 ( -0.070 -4.945 -0.336) 4.956 8.032 ( -5.315 -3.972 0.875) 6.692 8.220 ( -12.900 -5.915 2.792) 14.463 8.383 ( -11.053 -6.982 1.315) 13.140 9.332 ( 9.345 8.301 5.559) 13.679 9.559 ( 3.445 5.011 -0.201) 6.084 9.792 ( 2.002 2.793 -0.716) 3.510 9.925 ( -2.736 4.191 1.423) 5.203 10.245 ( -0.265 -2.457 2.515) 3.526 10.323 ( -6.576 -1.606 2.522) 7.224 10.665 ( 3.416 -8.615 2.947) 9.725 10.888 ( 2.629 -16.411 2.854) 16.864 11.386 ( 5.709 22.200 8.936) 24.602 11.815 ( -7.089 19.710 11.911) 24.096 12.244 ( 6.885 13.258 -3.675) 15.384 12.545 ( 12.610 -0.666 -8.253) 15.085 12.742 ( 8.353 -3.293 -5.008) 10.281 12.816 ( 10.980 -10.988 -6.832) 16.970 13.385 ( -6.430 -5.190 7.763) 11.338 13.633 ( -9.688 -8.357 -9.861) 16.154 13.702 ( 16.105 7.892 -8.543) 19.866 14.255 ( 11.058 -3.723 -11.897) 16.664 14.349 ( 9.314 11.443 6.549) 16.143 14.906 ( 3.838 11.952 -6.522) 14.146 15.718 ( -10.810 2.177 1.106) 11.083 15.810 ( -1.442 -13.711 -0.607) 13.800 15.873 ( -0.289 -19.680 -4.357) 20.159 16.159 ( -4.115 -14.730 3.341) 15.655 16.357 ( 0.579 0.713 4.756) 4.843 16.591 ( 0.030 -3.943 8.659) 9.515 16.791 ( -2.042 -5.362 3.204) 6.571 16.840 ( -6.493 -10.014 6.485) 13.582 18.991 ( 5.208 5.707 -2.631) 8.162 19.072 ( 3.707 4.434 -2.719) 6.387 19.219 ( -2.186 11.529 -2.976) 12.106 19.475 ( -5.615 1.611 -2.715) 6.442 ======================= Grid point 148 (55/120) ======================= q-point: ( 0.44 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.278 ( 6.708 -0.356 2.830) 7.289 2.388 ( 10.502 -7.554 5.662) 14.121 2.422 ( -5.786 -3.620 -2.189) 7.168 2.575 ( -4.835 -8.083 3.068) 9.906 2.803 ( 2.896 -2.843 -8.747) 9.642 2.898 ( -4.199 1.306 -6.331) 7.708 3.194 ( 4.399 -5.695 0.125) 7.197 3.259 ( -3.133 -2.342 -1.570) 4.215 3.508 ( -3.147 4.350 -1.138) 5.488 3.525 ( -4.799 -2.627 -1.317) 5.628 3.769 ( 0.496 -7.329 1.321) 7.464 3.857 ( -6.956 -6.206 1.092) 9.386 5.316 ( 10.544 15.818 -3.157) 19.271 5.426 ( 0.594 15.415 -3.413) 15.799 5.712 ( 15.414 6.416 -10.546) 19.747 5.993 ( 10.636 4.650 -9.972) 15.303 6.195 ( -14.124 3.979 -11.432) 18.601 6.491 ( -20.687 8.130 -11.755) 25.144 6.691 ( 13.482 1.462 8.244) 15.870 6.888 ( -4.303 -2.333 2.890) 5.684 7.218 ( 2.831 4.579 10.703) 11.981 7.300 ( -3.117 3.512 5.394) 7.152 7.609 ( 9.083 -6.447 1.296) 11.214 7.789 ( -5.361 5.644 5.713) 9.656 7.921 ( -2.031 -2.790 3.872) 5.186 7.973 ( -7.169 -11.048 5.965) 14.458 8.044 ( 5.102 -6.258 -4.465) 9.227 8.192 ( -8.533 -7.873 -0.668) 11.630 9.513 ( 8.191 6.898 7.101) 12.849 9.606 ( 0.005 5.887 5.027) 7.742 9.796 ( -0.687 3.902 0.059) 3.962 9.834 ( -4.867 -0.481 2.117) 5.330 10.212 ( 0.224 1.250 -1.529) 1.988 10.252 ( -2.797 1.391 -0.478) 3.160 10.767 ( 5.778 -11.855 3.228) 13.577 10.869 ( -3.778 -14.224 3.342) 15.092 11.518 ( 7.211 23.252 10.994) 26.712 11.667 ( -7.553 22.681 12.086) 26.787 12.441 ( 11.392 10.475 -5.592) 16.455 12.631 ( -5.342 8.163 -10.069) 14.020 12.926 ( 11.537 -19.723 4.115) 23.217 13.022 ( 7.621 -11.491 -11.788) 18.141 13.221 ( -5.818 -9.911 1.738) 11.623 13.372 ( -14.350 -8.766 -9.153) 19.145 14.005 ( 13.056 16.076 -12.833) 24.363 14.217 ( -7.779 15.943 -13.856) 22.509 14.823 ( 27.546 4.314 7.561) 28.888 15.156 ( 15.692 1.398 -3.321) 16.100 15.379 ( -18.625 4.061 5.234) 19.768 15.593 ( -17.334 0.829 -5.592) 18.233 15.951 ( 4.898 -29.209 6.110) 30.241 16.056 ( -5.466 -23.633 5.543) 24.882 16.437 ( 6.882 -0.999 6.449) 9.484 16.574 ( -4.458 -3.352 4.507) 7.171 16.725 ( -1.346 -7.868 5.556) 9.725 16.754 ( -2.674 -6.926 5.427) 9.196 19.082 ( 3.738 8.933 -6.344) 11.577 19.139 ( -0.764 9.902 -5.726) 11.464 19.212 ( 4.781 4.251 -1.963) 6.691 19.346 ( -7.024 2.386 -2.982) 7.995 ======================= Grid point 153 (56/120) ======================= q-point: ( 0.00 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( 0.000 18.889 6.257) 19.898 2.085 ( 0.000 0.290 2.848) 2.863 2.316 ( 0.000 6.819 7.759) 10.329 2.661 ( 0.000 -18.361 3.343) 18.663 2.870 ( 0.000 -0.923 -8.476) 8.526 2.904 ( 0.000 -3.273 0.757) 3.359 3.344 ( 0.000 12.737 -1.577) 12.835 3.562 ( 0.000 -2.559 -5.071) 5.680 3.632 ( 0.000 0.147 -4.329) 4.331 3.747 ( 0.000 -3.963 -14.374) 14.911 3.905 ( 0.000 14.289 -6.405) 15.658 4.190 ( 0.000 -15.193 -6.268) 16.435 5.125 ( 0.000 10.903 11.255) 15.670 5.323 ( 0.000 -7.639 18.218) 19.755 5.489 ( 0.000 6.931 12.948) 14.687 5.634 ( 0.000 -8.189 14.540) 16.687 5.909 ( 0.000 16.315 -0.863) 16.338 6.093 ( 0.000 0.535 0.022) 0.535 6.690 ( 0.000 0.500 5.099) 5.123 6.908 ( 0.000 -17.673 4.658) 18.276 7.167 ( 0.000 5.528 -11.289) 12.570 7.277 ( 0.000 -5.881 -12.808) 14.094 8.038 ( 0.000 4.233 -10.962) 11.751 8.100 ( 0.000 -2.296 -11.744) 11.966 8.314 ( 0.000 6.131 6.631) 9.031 8.440 ( 0.000 -7.152 3.487) 7.957 8.676 ( 0.000 12.233 -2.237) 12.436 8.928 ( 0.000 -11.970 -2.358) 12.200 9.054 ( 0.000 0.397 -9.735) 9.743 9.086 ( 0.000 -1.508 -7.753) 7.898 9.558 ( 0.000 -0.355 -11.942) 11.947 9.563 ( 0.000 -0.459 -11.901) 11.910 10.013 ( 0.000 2.766 14.801) 15.058 10.101 ( 0.000 -6.409 19.338) 20.372 10.838 ( 0.000 0.087 14.675) 14.676 10.851 ( 0.000 -0.909 14.354) 14.383 11.516 ( 0.000 12.012 6.710) 13.760 11.702 ( 0.000 -7.377 5.751) 9.354 11.908 ( 0.000 8.184 -5.847) 10.058 12.079 ( 0.000 -8.656 -6.555) 10.858 12.460 ( 0.000 6.276 3.257) 7.071 12.522 ( 0.000 -0.118 12.521) 12.522 13.407 ( 0.000 8.794 -19.730) 21.601 13.516 ( 0.000 28.887 -3.173) 29.061 13.619 ( 0.000 -2.739 -11.044) 11.378 14.094 ( 0.000 -15.189 -9.973) 18.171 14.460 ( 0.000 0.211 0.204) 0.294 14.639 ( 0.000 -23.407 6.527) 24.300 15.662 ( 0.000 4.416 0.551) 4.451 15.751 ( 0.000 -3.536 -11.352) 11.890 15.942 ( 0.000 6.198 -12.644) 14.081 16.063 ( 0.000 -6.795 -6.980) 9.741 16.430 ( 0.000 7.544 -11.412) 13.680 16.628 ( 0.000 -11.475 -10.635) 15.646 16.819 ( 0.000 -0.505 18.726) 18.732 16.825 ( 0.000 -1.809 17.741) 17.833 18.897 ( 0.000 3.686 10.311) 10.950 18.963 ( 0.000 -3.109 7.215) 7.856 19.501 ( 0.000 8.563 -0.565) 8.582 19.614 ( 0.000 -3.450 -0.875) 3.559 ======================= Grid point 154 (57/120) ======================= q-point: ( 0.11 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 3.227 17.035 6.770) 18.613 2.100 ( 1.420 -1.255 2.705) 3.303 2.336 ( 2.146 7.008 8.718) 11.389 2.656 ( -0.325 -16.925 3.774) 17.344 2.837 ( -3.120 -0.286 -8.851) 9.389 2.898 ( -1.128 -6.528 -2.126) 6.958 3.275 ( -5.534 11.989 -1.679) 13.311 3.507 ( -6.367 -11.422 -1.147) 13.127 3.665 ( 4.158 8.857 -9.707) 13.783 3.770 ( 1.027 -1.367 -13.341) 13.451 3.927 ( 1.687 11.069 -5.666) 12.548 4.163 ( -2.692 -12.700 -5.374) 14.050 5.101 ( -3.609 9.063 9.827) 13.847 5.218 ( -5.817 -2.845 9.140) 11.202 5.552 ( 2.017 7.447 13.242) 15.326 5.692 ( 11.780 -5.535 17.225) 21.589 6.041 ( 9.088 10.339 3.503) 14.204 6.132 ( 3.512 3.149 -0.089) 4.718 6.732 ( 3.710 -2.728 4.282) 6.288 6.883 ( -2.608 -15.190 3.835) 15.882 7.200 ( 3.155 5.056 -10.568) 12.133 7.300 ( 2.213 -5.336 -11.833) 13.168 7.938 ( -8.800 4.722 -9.636) 13.878 8.018 ( -7.471 -3.730 -10.919) 13.746 8.193 ( -9.287 6.059 4.375) 11.920 8.304 ( -11.500 -5.823 0.381) 12.896 8.585 ( -6.439 7.291 -0.792) 9.759 8.760 ( -11.581 -9.812 -1.807) 15.286 9.153 ( 9.584 9.591 -3.829) 14.089 9.322 ( 10.135 -7.365 -4.715) 13.387 9.637 ( 7.729 3.403 -9.420) 12.651 9.709 ( 13.864 -2.878 -12.280) 18.743 10.047 ( 2.616 3.341 13.781) 14.419 10.171 ( 6.770 -9.224 15.766) 19.480 10.734 ( -8.482 0.290 11.399) 14.212 10.759 ( -7.647 -2.181 11.282) 13.803 11.582 ( 5.314 16.565 6.414) 18.541 11.848 ( 11.430 -9.922 4.706) 15.850 12.031 ( 10.761 4.864 -3.330) 12.270 12.148 ( 7.296 -6.667 -6.829) 12.013 12.443 ( -1.031 7.783 1.340) 7.965 12.509 ( -0.171 1.077 10.400) 10.457 13.411 ( 1.042 8.753 -14.882) 17.296 13.567 ( 4.224 26.359 1.142) 26.719 13.616 ( -0.006 -7.636 -13.533) 15.538 14.006 ( -8.027 -12.448 -8.487) 17.071 14.448 ( -0.639 3.196 1.001) 3.409 14.700 ( 5.820 -24.288 5.577) 25.591 15.644 ( -4.295 6.491 -7.117) 10.546 15.732 ( 0.369 -1.086 -11.145) 11.204 15.970 ( 1.666 -0.919 -9.753) 9.937 16.006 ( -3.689 -6.719 -1.365) 7.785 16.457 ( 1.927 8.859 -9.271) 12.967 16.661 ( 2.456 -10.591 -8.708) 13.930 16.768 ( -4.115 1.273 18.707) 19.196 16.814 ( -2.074 -4.397 15.191) 15.950 18.914 ( 1.798 3.757 8.290) 9.277 18.978 ( 1.523 -2.710 5.324) 6.165 19.490 ( -1.102 8.416 -0.924) 8.538 19.600 ( -1.442 -3.252 -1.176) 3.747 ======================= Grid point 155 (58/120) ======================= q-point: ( 0.22 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( 6.802 10.900 6.949) 14.607 2.136 ( 2.074 -4.273 2.046) 5.172 2.406 ( 4.653 7.810 10.385) 13.802 2.634 ( -3.257 -9.166 3.514) 10.342 2.773 ( -2.091 -2.135 -10.130) 10.562 2.854 ( -2.133 -10.746 -4.185) 11.728 3.162 ( -5.230 9.639 -1.650) 11.090 3.362 ( -7.276 -10.510 -0.951) 12.818 3.703 ( -2.063 4.379 -10.424) 11.493 3.752 ( -3.263 -0.212 -10.643) 11.134 3.951 ( -0.098 7.729 -3.524) 8.495 4.082 ( -5.545 -6.448 -3.427) 9.169 5.054 ( 1.744 5.838 1.798) 6.352 5.138 ( -0.273 -3.169 0.641) 3.245 5.715 ( 13.211 18.383 11.925) 25.587 5.968 ( 12.294 2.777 15.411) 19.908 6.168 ( 5.049 -0.198 3.659) 6.238 6.259 ( 8.051 -0.465 3.239) 8.691 6.783 ( -3.802 -5.270 0.505) 6.517 6.837 ( 3.222 -8.956 1.353) 9.614 7.284 ( 4.800 3.947 -7.718) 9.908 7.357 ( 2.927 -3.577 -7.851) 9.110 7.715 ( -13.648 7.280 -8.683) 17.739 7.846 ( -8.699 -5.910 -9.531) 14.193 8.008 ( -7.715 2.958 3.508) 8.977 8.081 ( -9.427 -4.654 -0.870) 10.550 8.426 ( -9.672 2.686 2.540) 10.355 8.515 ( -12.455 -6.116 2.396) 14.081 9.321 ( 7.310 8.532 0.045) 11.235 9.467 ( 5.581 -6.005 -2.633) 8.610 9.812 ( 7.705 9.764 0.101) 12.438 10.003 ( 11.299 -8.696 -1.905) 14.384 10.088 ( 2.468 9.885 5.372) 11.518 10.318 ( 4.810 -12.788 7.076) 15.387 10.576 ( -4.997 -0.623 5.537) 7.485 10.611 ( -5.678 -4.361 6.046) 9.370 11.700 ( 6.426 21.403 5.465) 23.006 12.064 ( 9.913 -13.655 2.137) 17.008 12.188 ( 2.950 6.667 2.450) 7.691 12.332 ( 5.970 -5.006 -1.946) 8.031 12.489 ( 8.360 8.726 -5.051) 13.097 12.595 ( 9.115 -0.193 -0.522) 9.132 13.487 ( 5.880 8.420 -5.856) 11.822 13.553 ( -3.891 7.183 -3.103) 8.738 13.713 ( 5.212 -2.587 -10.458) 11.968 13.831 ( -3.623 -11.942 -3.840) 13.057 14.482 ( 5.194 13.515 4.514) 15.166 14.859 ( 9.705 -21.504 4.601) 24.037 15.494 ( -9.332 6.172 -12.270) 16.605 15.715 ( -5.226 -12.805 -13.911) 19.616 15.919 ( -0.482 5.689 0.179) 5.713 16.054 ( 3.074 -6.877 -1.019) 7.601 16.466 ( -1.826 9.523 -0.955) 9.744 16.655 ( -6.743 -1.500 14.679) 16.223 16.696 ( 0.339 -6.625 -3.381) 7.446 16.751 ( -3.496 -6.108 11.122) 13.162 18.974 ( 4.246 3.807 3.434) 6.657 19.028 ( 3.499 -1.539 1.245) 4.020 19.456 ( -2.272 7.911 -1.901) 8.447 19.555 ( -3.010 -2.654 -1.979) 4.475 ======================= Grid point 156 (59/120) ======================= q-point: ( 0.33 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( 8.936 2.972 5.431) 10.871 2.189 ( 3.361 -3.651 0.976) 5.058 2.485 ( 1.300 1.795 9.505) 9.760 2.518 ( -7.066 -1.717 0.021) 7.272 2.747 ( 0.758 0.495 -9.082) 9.127 2.890 ( 5.227 -12.067 -0.826) 13.176 3.071 ( -4.102 7.487 -1.857) 8.737 3.232 ( -5.499 -8.894 -0.763) 10.485 3.609 ( -5.642 1.877 -6.052) 8.485 3.652 ( -5.259 -1.182 -6.669) 8.574 3.864 ( -8.620 4.209 -1.080) 9.653 3.942 ( -8.264 -3.499 -1.883) 9.169 5.207 ( 13.147 4.989 -6.419) 15.457 5.266 ( 12.398 -1.626 -9.587) 15.756 5.989 ( 6.510 21.696 8.569) 24.219 6.054 ( 3.228 18.063 -3.992) 18.778 6.303 ( -0.591 -11.448 6.333) 13.096 6.414 ( 11.519 -16.365 5.359) 20.718 6.716 ( 0.959 10.530 -1.254) 10.648 6.917 ( 1.794 -9.158 -3.451) 9.950 7.360 ( 0.443 1.353 -0.458) 1.496 7.387 ( -0.190 -1.911 0.438) 1.969 7.431 ( -10.465 12.823 -2.884) 16.800 7.711 ( -3.991 -14.104 -5.714) 15.732 7.909 ( -2.532 0.395 1.034) 2.764 7.945 ( -4.130 -3.432 -0.675) 5.412 8.196 ( -12.412 3.303 4.777) 13.704 8.281 ( -10.812 -4.754 5.662) 13.098 9.465 ( 7.396 6.434 2.473) 10.110 9.574 ( 5.422 -4.104 0.027) 6.800 9.890 ( -0.659 7.847 9.097) 12.032 9.993 ( -6.079 -0.757 10.654) 12.290 10.250 ( 6.494 4.507 -5.594) 9.684 10.317 ( -0.136 -0.084 -1.384) 1.393 10.524 ( -1.536 -4.650 2.627) 5.557 10.597 ( 1.968 -12.454 1.783) 12.734 11.842 ( 7.681 24.662 6.538) 26.646 12.184 ( -0.754 17.445 5.979) 18.457 12.285 ( 10.288 -20.342 3.695) 23.093 12.418 ( 5.598 -1.504 0.487) 5.817 12.654 ( 4.867 0.692 -8.961) 10.221 12.767 ( 7.132 -3.093 -10.219) 12.839 13.333 ( -13.802 2.529 -0.354) 14.037 13.465 ( -12.816 -8.951 -12.333) 19.912 13.897 ( 21.757 11.747 -5.412) 25.311 14.117 ( 22.685 -10.373 -5.555) 25.555 14.654 ( 10.578 21.069 7.339) 24.692 15.076 ( 11.530 -9.434 4.424) 15.540 15.300 ( -9.282 -5.646 -8.805) 13.984 15.547 ( -9.366 -18.081 -11.045) 23.165 15.898 ( -5.321 8.237 2.013) 10.011 16.034 ( -7.155 -5.016 1.529) 8.870 16.412 ( -1.318 5.761 7.271) 9.369 16.533 ( -3.411 -4.078 11.356) 12.538 16.667 ( -3.290 -4.738 1.251) 5.903 16.693 ( -2.567 -4.901 4.806) 7.328 19.081 ( 6.228 3.563 -1.484) 7.327 19.116 ( 5.228 0.137 -2.098) 5.636 19.398 ( -3.526 6.911 -3.188) 8.388 19.478 ( -4.693 -1.676 -2.974) 5.803 ======================= Grid point 157 (60/120) ======================= q-point: ( 0.44 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 5.652 -0.575 2.206) 6.095 2.286 ( 7.204 -3.168 1.368) 7.988 2.381 ( -6.107 -0.286 -0.715) 6.156 2.430 ( -5.624 -5.668 2.906) 8.497 2.838 ( 6.950 6.370 -3.198) 9.955 2.975 ( -5.945 6.449 -1.921) 8.979 3.014 ( 6.416 -10.869 0.351) 12.626 3.132 ( -5.134 -9.170 0.062) 10.510 3.544 ( 0.610 3.954 -2.388) 4.659 3.603 ( -0.212 1.639 -2.693) 3.160 3.681 ( -6.240 -0.194 -0.771) 6.290 3.760 ( -8.893 -4.996 -1.397) 10.295 5.530 ( 16.699 6.547 -10.664) 20.867 5.574 ( 16.674 1.760 -12.594) 20.970 5.862 ( -10.507 7.638 -9.754) 16.244 5.980 ( -16.254 -4.690 -10.340) 19.827 6.421 ( 14.503 16.499 0.490) 21.973 6.622 ( 3.914 0.271 1.998) 4.403 6.747 ( -1.302 4.463 2.520) 5.288 6.832 ( -6.504 -3.793 -2.063) 7.806 7.308 ( 1.828 5.368 9.542) 11.100 7.377 ( -2.659 6.413 3.315) 7.693 7.437 ( 6.880 -9.194 5.015) 12.530 7.615 ( -7.988 -17.078 2.617) 19.034 7.902 ( 1.377 0.803 0.272) 1.617 7.924 ( 2.096 1.229 1.925) 3.100 7.996 ( -5.339 1.550 2.479) 6.087 8.080 ( -8.921 -5.071 3.543) 10.856 9.622 ( 8.069 5.025 5.477) 10.971 9.687 ( 5.315 -0.004 3.958) 6.627 9.803 ( -6.306 1.230 7.659) 9.997 9.845 ( -7.493 -1.155 6.261) 9.833 10.312 ( 2.730 9.044 -2.762) 9.843 10.353 ( -0.251 8.888 -1.873) 9.086 10.536 ( 2.730 -11.743 0.578) 12.070 10.595 ( -2.160 -13.876 0.851) 14.068 11.998 ( 7.525 26.367 8.628) 28.746 12.126 ( -4.825 24.466 8.862) 26.466 12.473 ( 7.235 -20.303 3.959) 21.914 12.540 ( 2.524 -17.213 4.131) 17.881 12.737 ( 7.985 8.607 -10.523) 15.766 12.910 ( 5.102 -1.497 -14.250) 15.210 13.041 ( -11.184 -3.205 -2.745) 11.954 13.187 ( -13.680 -10.764 -11.882) 21.075 14.353 ( 20.251 19.301 -10.120) 29.750 14.535 ( 10.195 11.347 -10.573) 18.560 14.820 ( 8.167 -0.644 -2.235) 8.492 15.100 ( -12.509 -15.887 -8.984) 22.127 15.320 ( 12.807 -0.498 6.241) 14.256 15.484 ( 7.251 -14.258 4.081) 16.508 15.657 ( -16.196 4.438 8.617) 18.874 15.777 ( -16.106 -7.316 8.193) 19.495 16.455 ( 4.835 3.200 6.036) 8.370 16.536 ( 0.919 -2.054 5.107) 5.581 16.585 ( -3.111 -4.122 4.499) 6.849 16.631 ( -3.667 -5.599 3.445) 7.528 19.207 ( 5.837 4.036 -4.433) 8.367 19.235 ( 6.399 1.073 -3.421) 7.335 19.316 ( -4.575 5.150 -4.200) 8.068 19.369 ( -6.152 -0.483 -3.600) 7.144 ======================= Grid point 189 (61/120) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( 0.000 0.000 25.296) 25.296 1.738 ( 0.000 0.000 25.606) 25.606 2.570 ( 0.000 0.000 -12.790) 12.790 2.826 ( 0.000 0.000 12.135) 12.135 2.853 ( 0.000 0.000 6.067) 6.067 3.183 ( 0.000 0.000 -8.672) 8.672 3.241 ( 0.000 0.000 -19.321) 19.321 3.306 ( 0.000 0.000 4.946) 4.946 3.468 ( 0.000 0.000 -9.477) 9.477 3.567 ( 0.000 0.000 6.245) 6.245 3.780 ( 0.000 0.000 2.427) 2.427 4.678 ( 0.000 0.000 -6.864) 6.864 4.786 ( 0.000 0.000 0.445) 0.445 5.047 ( 0.000 0.000 -1.711) 1.711 5.460 ( 0.000 0.000 16.928) 16.928 5.519 ( 0.000 0.000 6.157) 6.157 6.195 ( 0.000 0.000 15.831) 15.831 6.200 ( 0.000 0.000 17.063) 17.063 6.828 ( 0.000 0.000 -6.584) 6.584 7.249 ( 0.000 0.000 0.425) 0.425 7.306 ( 0.000 0.000 -16.268) 16.268 7.491 ( 0.000 0.000 -4.212) 4.212 7.553 ( 0.000 0.000 -5.474) 5.474 7.741 ( 0.000 0.000 -28.008) 28.008 8.138 ( 0.000 0.000 -0.903) 0.903 8.209 ( 0.000 0.000 -8.369) 8.369 8.495 ( 0.000 0.000 10.814) 10.814 9.062 ( 0.000 0.000 -3.764) 3.764 9.067 ( 0.000 0.000 -5.724) 5.724 9.374 ( 0.000 0.000 -7.406) 7.406 9.436 ( 0.000 0.000 -7.726) 7.726 9.468 ( 0.000 0.000 -4.739) 4.739 10.139 ( 0.000 0.000 8.417) 8.417 10.911 ( 0.000 0.000 -8.718) 8.718 10.957 ( 0.000 0.000 16.872) 16.872 11.219 ( 0.000 0.000 1.990) 1.990 11.243 ( 0.000 0.000 18.299) 18.299 11.321 ( 0.000 0.000 7.118) 7.118 11.622 ( 0.000 0.000 1.106) 1.106 11.964 ( 0.000 0.000 2.446) 2.446 12.156 ( 0.000 0.000 10.735) 10.735 12.814 ( 0.000 0.000 9.939) 9.939 12.835 ( 0.000 0.000 -17.582) 17.582 12.980 ( 0.000 0.000 32.770) 32.770 13.633 ( 0.000 0.000 -17.364) 17.364 13.830 ( 0.000 0.000 -20.071) 20.071 14.600 ( 0.000 0.000 3.651) 3.651 14.729 ( 0.000 0.000 -27.523) 27.523 15.380 ( 0.000 0.000 -16.216) 16.216 16.046 ( 0.000 0.000 -19.563) 19.563 16.264 ( 0.000 0.000 13.147) 13.147 16.438 ( 0.000 0.000 6.690) 6.690 16.533 ( 0.000 0.000 1.988) 1.988 16.805 ( 0.000 0.000 -4.265) 4.265 17.075 ( 0.000 0.000 10.341) 10.341 17.197 ( 0.000 0.000 2.232) 2.232 18.903 ( 0.000 0.000 -0.158) 0.158 18.981 ( 0.000 0.000 -1.615) 1.615 19.075 ( 0.000 0.000 13.688) 13.688 19.591 ( 0.000 0.000 -1.714) 1.714 ======================= Grid point 190 (62/120) ======================= q-point: ( 0.11 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 6.713 0.000 21.486) 22.510 1.857 ( 11.144 0.000 22.702) 25.290 2.567 ( 0.246 0.000 -11.365) 11.368 2.868 ( 1.103 0.000 6.335) 6.430 2.955 ( 8.794 0.000 -0.018) 8.794 3.150 ( 0.060 0.000 4.558) 4.558 3.206 ( -3.231 0.000 -17.822) 18.113 3.374 ( 5.469 0.000 -5.401) 7.686 3.421 ( -4.683 0.000 -9.880) 10.934 3.507 ( -5.351 0.000 9.613) 11.002 3.779 ( 0.692 0.000 5.065) 5.112 4.602 ( -7.298 0.000 -6.094) 9.508 4.764 ( -2.082 0.000 0.807) 2.233 5.018 ( -2.625 0.000 -0.690) 2.714 5.389 ( -4.759 0.000 13.635) 14.442 5.436 ( -6.929 0.000 7.337) 10.091 6.254 ( 4.597 0.000 15.581) 16.245 6.345 ( 12.479 0.000 13.295) 18.234 6.832 ( -0.170 0.000 -6.673) 6.675 7.249 ( -0.420 0.000 -6.652) 6.665 7.311 ( -3.735 0.000 -12.604) 13.146 7.447 ( -4.306 0.000 -4.299) 6.085 7.486 ( -0.535 0.000 -9.953) 9.967 7.808 ( 4.350 0.000 -17.391) 17.927 7.902 ( -12.840 0.000 0.689) 12.858 8.285 ( -2.190 0.000 -6.689) 7.039 8.617 ( 12.075 0.000 10.589) 16.060 8.875 ( -9.745 0.000 1.486) 9.858 9.053 ( -8.871 0.000 -4.258) 9.840 9.383 ( -2.726 0.000 -6.689) 7.223 9.425 ( 4.375 0.000 -6.925) 8.191 9.554 ( 7.427 0.000 -8.296) 11.135 10.236 ( 8.261 0.000 6.658) 10.610 10.976 ( 2.113 0.000 16.905) 17.036 10.979 ( -3.868 0.000 -5.422) 6.660 11.098 ( -3.245 0.000 7.868) 8.511 11.287 ( -1.885 0.000 9.399) 9.586 11.312 ( 8.559 0.000 3.419) 9.217 11.687 ( 6.697 0.000 -2.076) 7.011 12.053 ( -8.575 0.000 13.361) 15.876 12.183 ( 16.985 0.000 1.892) 17.091 12.771 ( 1.114 0.000 4.669) 4.800 12.992 ( 10.233 0.000 -10.289) 14.512 13.193 ( 19.172 0.000 29.253) 34.976 13.575 ( -5.624 0.000 -17.212) 18.107 13.841 ( 1.080 0.000 -21.585) 21.612 14.563 ( -14.080 0.000 -24.620) 28.362 14.587 ( -1.002 0.000 6.655) 6.729 15.493 ( 8.459 0.000 -16.856) 18.860 16.019 ( -2.265 0.000 -6.015) 6.427 16.235 ( -1.074 0.000 1.389) 1.756 16.545 ( 7.919 0.000 3.956) 8.852 16.560 ( 2.593 0.000 2.045) 3.302 16.811 ( 0.627 0.000 -3.716) 3.768 17.029 ( -3.711 0.000 12.300) 12.848 17.207 ( 0.551 0.000 1.268) 1.383 18.877 ( -2.481 0.000 -1.009) 2.679 18.918 ( -5.773 0.000 -1.759) 6.035 19.061 ( -1.272 0.000 12.511) 12.575 19.563 ( -2.772 0.000 -2.005) 3.421 ======================= Grid point 191 (63/120) ======================= q-point: ( 0.22 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( 9.559 0.000 13.249) 16.338 2.139 ( 15.592 0.000 16.020) 22.355 2.587 ( 1.577 0.000 -11.930) 12.033 2.866 ( -2.213 0.000 4.127) 4.683 2.950 ( -5.216 0.000 -3.176) 6.107 3.137 ( -3.059 0.000 -11.885) 12.272 3.264 ( -1.097 0.000 -5.395) 5.505 3.286 ( -7.913 0.000 -8.435) 11.565 3.414 ( 4.039 0.000 9.348) 10.184 3.511 ( 4.176 0.000 -7.679) 8.741 3.875 ( 11.914 0.000 16.219) 20.125 4.419 ( -9.471 0.000 -3.093) 9.964 4.722 ( -1.381 0.000 -0.106) 1.385 4.954 ( -3.562 0.000 0.037) 3.562 5.290 ( -6.788 0.000 6.086) 9.117 5.336 ( 0.130 0.000 7.522) 7.523 6.365 ( 6.340 0.000 13.676) 15.074 6.562 ( 3.028 0.000 -6.065) 6.779 6.826 ( 3.305 0.000 5.135) 6.106 7.044 ( -17.332 0.000 -16.515) 23.940 7.285 ( 0.513 0.000 -10.561) 10.573 7.348 ( -4.211 0.000 -0.823) 4.291 7.578 ( 6.665 0.000 -2.828) 7.240 7.688 ( -8.280 0.000 4.000) 9.196 7.884 ( 3.268 0.000 -9.887) 10.413 8.179 ( -7.174 0.000 -3.220) 7.864 8.701 ( -7.616 0.000 4.497) 8.845 8.814 ( -12.714 0.000 -1.625) 12.817 8.891 ( 14.066 0.000 8.402) 16.385 9.367 ( 1.731 0.000 -4.415) 4.742 9.515 ( 3.846 0.000 -5.007) 6.314 9.710 ( 7.214 0.000 -8.999) 11.534 10.392 ( 5.145 0.000 3.798) 6.395 10.746 ( -13.672 0.000 3.234) 14.049 11.022 ( -3.996 0.000 6.967) 8.031 11.042 ( 4.285 0.000 17.466) 17.984 11.393 ( 7.171 0.000 0.447) 7.185 11.534 ( 13.129 0.000 3.895) 13.694 11.849 ( -6.131 0.000 8.857) 10.772 11.907 ( 9.792 0.000 -0.610) 9.811 12.475 ( 10.965 0.000 -1.605) 11.081 12.915 ( 12.978 0.000 3.991) 13.578 13.199 ( 9.585 0.000 -10.025) 13.870 13.420 ( -8.879 0.000 -14.353) 16.877 13.679 ( 27.441 0.000 20.820) 34.445 13.854 ( -0.883 0.000 -25.037) 25.053 14.238 ( -17.333 0.000 -19.910) 26.398 14.595 ( 3.539 0.000 15.036) 15.447 15.626 ( 3.409 0.000 -14.183) 14.587 15.971 ( -2.869 0.000 9.690) 10.106 16.228 ( 0.411 0.000 -10.153) 10.161 16.630 ( 4.227 0.000 2.316) 4.819 16.692 ( 5.846 0.000 -1.397) 6.010 16.831 ( 1.351 0.000 -2.302) 2.669 16.962 ( -2.170 0.000 13.895) 14.064 17.206 ( -0.810 0.000 1.739) 1.918 18.779 ( -7.285 0.000 -3.428) 8.052 18.809 ( -4.157 0.000 -3.036) 5.148 19.034 ( -1.090 0.000 9.049) 9.114 19.482 ( -5.236 0.000 -2.734) 5.907 ======================= Grid point 192 (64/120) ======================= q-point: ( 0.33 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( 11.246 0.000 4.320) 12.047 2.419 ( 10.701 0.000 6.588) 12.566 2.601 ( -1.492 0.000 -12.366) 12.456 2.778 ( -5.877 0.000 -1.104) 5.980 2.866 ( -1.734 0.000 -1.517) 2.304 3.052 ( -4.368 0.000 -3.898) 5.854 3.143 ( -7.061 0.000 -0.789) 7.105 3.192 ( -1.143 0.000 -1.844) 2.170 3.457 ( -1.616 0.000 -1.615) 2.285 3.534 ( -2.237 0.000 -7.338) 7.671 4.243 ( 18.948 0.000 17.121) 25.538 4.299 ( -0.363 0.000 3.378) 3.397 4.718 ( 0.762 0.000 -1.991) 2.132 4.878 ( -3.925 0.000 -0.142) 3.927 5.205 ( 0.368 0.000 -0.962) 1.030 5.409 ( 7.505 0.000 0.647) 7.533 6.370 ( -17.039 0.000 -19.834) 26.148 6.425 ( -9.588 0.000 -1.147) 9.657 6.722 ( -4.958 0.000 -4.625) 6.780 7.026 ( 11.823 0.000 14.431) 18.656 7.260 ( -3.762 0.000 -6.320) 7.355 7.302 ( -0.855 0.000 4.045) 4.134 7.575 ( -2.471 0.000 3.970) 4.676 7.710 ( 6.401 0.000 -1.276) 6.526 7.939 ( 1.866 0.000 -8.249) 8.457 8.013 ( -9.347 0.000 -1.261) 9.431 8.552 ( -7.530 0.000 5.430) 9.284 8.604 ( -7.283 0.000 0.288) 7.288 9.159 ( 12.301 0.000 7.083) 14.195 9.462 ( 7.619 0.000 -1.350) 7.738 9.557 ( 0.083 0.000 -1.748) 1.750 9.827 ( 4.035 0.000 -6.578) 7.717 10.393 ( -4.604 0.000 1.485) 4.837 10.475 ( -12.198 0.000 1.783) 12.328 11.049 ( 5.974 0.000 9.836) 11.508 11.144 ( 5.941 0.000 17.015) 18.023 11.449 ( -1.684 0.000 4.438) 4.747 11.651 ( -9.835 0.000 13.971) 17.085 11.831 ( 15.525 0.000 3.013) 15.814 12.188 ( 13.120 0.000 -7.909) 15.319 12.695 ( 12.412 0.000 -7.296) 14.398 13.169 ( 9.289 0.000 -1.373) 9.390 13.246 ( -6.916 0.000 -14.369) 15.946 13.352 ( 5.668 0.000 -9.099) 10.720 13.767 ( -7.627 0.000 -22.019) 23.302 13.852 ( -17.804 0.000 -20.222) 26.942 14.291 ( 29.597 0.000 18.411) 34.856 14.793 ( 16.254 0.000 18.242) 24.433 15.593 ( -7.237 0.000 -7.582) 10.482 15.853 ( -9.954 0.000 12.147) 15.704 16.288 ( 6.263 0.000 -8.727) 10.742 16.721 ( 4.639 0.000 2.637) 5.336 16.748 ( -0.906 0.000 -4.173) 4.270 16.857 ( 0.912 0.000 -0.372) 0.985 16.961 ( 2.043 0.000 12.110) 12.281 17.169 ( -2.827 0.000 5.422) 6.115 18.654 ( -4.658 0.000 -6.372) 7.893 18.720 ( -4.535 0.000 -5.842) 7.396 19.033 ( 1.337 0.000 3.992) 4.210 19.359 ( -6.893 0.000 -3.412) 7.692 ======================= Grid point 193 (65/120) ======================= q-point: ( 0.44 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( 11.612 0.000 -3.385) 12.095 2.497 ( -8.485 0.000 -8.847) 12.258 2.548 ( 3.920 0.000 -2.546) 4.674 2.647 ( -6.401 0.000 -4.267) 7.693 2.900 ( 4.306 0.000 -2.818) 5.146 3.009 ( -6.233 0.000 -1.729) 6.469 3.067 ( 4.901 0.000 3.566) 6.061 3.160 ( -3.141 0.000 2.721) 4.156 3.418 ( -0.807 0.000 -2.519) 2.645 3.452 ( -4.051 0.000 -4.741) 6.236 4.365 ( 6.230 0.000 10.039) 11.815 4.457 ( 0.129 0.000 15.752) 15.752 4.746 ( 2.026 0.000 -1.359) 2.440 4.802 ( -3.502 0.000 -0.437) 3.529 5.426 ( 22.016 0.000 -10.783) 24.515 5.640 ( 15.196 0.000 -8.145) 17.242 5.962 ( -28.372 0.000 -13.723) 31.517 5.993 ( -19.217 0.000 -15.732) 24.835 6.879 ( 12.614 0.000 5.951) 13.947 7.119 ( -10.164 0.000 0.685) 10.187 7.206 ( 5.735 0.000 11.023) 12.426 7.279 ( -2.083 0.000 7.539) 7.822 7.621 ( 7.094 0.000 2.315) 7.462 7.810 ( -10.507 0.000 0.673) 10.529 7.835 ( 5.943 0.000 -3.833) 7.072 7.932 ( -2.988 0.000 -7.669) 8.230 8.456 ( -1.030 0.000 4.985) 5.090 8.495 ( -4.040 0.000 2.669) 4.843 9.374 ( 8.987 0.000 4.997) 10.283 9.512 ( -4.632 0.000 1.906) 5.009 9.653 ( 10.559 0.000 0.132) 10.560 9.830 ( -5.082 0.000 -2.114) 5.504 10.275 ( -2.858 0.000 -0.147) 2.862 10.313 ( -5.103 0.000 0.187) 5.106 11.201 ( 8.222 0.000 9.717) 12.728 11.282 ( 7.835 0.000 15.881) 17.709 11.356 ( -6.764 0.000 8.307) 10.713 11.456 ( -9.368 0.000 15.043) 17.721 12.138 ( 13.857 0.000 -0.965) 13.890 12.320 ( -2.044 0.000 -4.986) 5.389 12.968 ( 13.912 0.000 -11.209) 17.866 13.197 ( -6.838 0.000 -9.730) 11.892 13.230 ( 7.029 0.000 -15.748) 17.246 13.468 ( 6.330 0.000 -6.776) 9.273 13.492 ( -16.991 0.000 -17.691) 24.529 13.602 ( -7.505 0.000 -12.351) 14.452 14.872 ( 26.901 0.000 10.137) 28.748 15.185 ( 20.899 0.000 14.464) 25.416 15.333 ( -18.431 0.000 1.151) 18.466 15.575 ( -17.202 0.000 11.620) 20.759 16.463 ( 10.214 0.000 -5.025) 11.383 16.655 ( -7.926 0.000 -4.528) 9.128 16.806 ( 3.547 0.000 2.524) 4.353 16.855 ( -1.272 0.000 1.522) 1.984 17.024 ( 3.738 0.000 10.104) 10.773 17.101 ( -3.777 0.000 8.969) 9.732 18.605 ( -0.171 0.000 -8.555) 8.557 18.639 ( -3.218 0.000 -8.142) 8.754 19.095 ( 4.819 0.000 -0.679) 4.867 19.216 ( -6.962 0.000 -3.110) 7.625 ======================= Grid point 198 (66/120) ======================= q-point: ( 0.00 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 0.000 0.156 23.106) 23.106 1.726 ( 0.000 12.101 22.457) 25.510 2.519 ( 0.000 -4.515 -10.281) 11.229 2.900 ( 0.000 3.293 3.231) 4.614 2.941 ( 0.000 9.982 4.542) 10.967 3.098 ( 0.000 -8.785 -5.885) 10.573 3.209 ( 0.000 -13.583 6.212) 14.936 3.238 ( 0.000 2.184 -13.488) 13.664 3.390 ( 0.000 4.205 -9.221) 10.135 3.647 ( 0.000 -3.270 -0.777) 3.361 3.768 ( 0.000 1.128 0.465) 1.220 4.553 ( 0.000 -10.474 -7.652) 12.972 4.888 ( 0.000 9.977 2.858) 10.378 5.242 ( 0.000 17.097 0.433) 17.102 5.487 ( 0.000 0.817 11.565) 11.594 5.529 ( 0.000 5.157 13.830) 14.760 6.160 ( 0.000 -2.973 16.335) 16.603 6.190 ( 0.000 -1.963 16.605) 16.721 6.838 ( 0.000 1.086 -7.371) 7.451 7.171 ( 0.000 -8.085 1.137) 8.165 7.227 ( 0.000 -5.251 -13.220) 14.225 7.473 ( 0.000 -8.106 -4.792) 9.417 7.606 ( 0.000 7.715 -8.929) 11.800 7.744 ( 0.000 0.414 -27.243) 27.246 8.211 ( 0.000 7.392 -0.205) 7.395 8.308 ( 0.000 9.420 -8.300) 12.554 8.466 ( 0.000 -2.618 9.031) 9.403 8.954 ( 0.000 -10.035 -5.572) 11.478 9.054 ( 0.000 -1.153 -3.599) 3.779 9.329 ( 0.000 -5.803 -5.848) 8.238 9.408 ( 0.000 -2.343 -8.373) 8.694 9.449 ( 0.000 -1.572 -6.582) 6.768 10.159 ( 0.000 2.125 10.032) 10.255 10.744 ( 0.000 -10.639 2.966) 11.045 11.043 ( 0.000 7.687 17.371) 18.996 11.200 ( 0.000 -2.136 16.058) 16.200 11.324 ( 0.000 1.121 6.679) 6.773 11.493 ( 0.000 18.897 -6.486) 19.979 11.642 ( 0.000 1.992 -0.168) 1.999 11.938 ( 0.000 -2.127 3.104) 3.763 12.296 ( 0.000 11.643 6.597) 13.382 12.827 ( 0.000 3.149 11.404) 11.831 12.848 ( 0.000 1.308 -17.136) 17.186 12.948 ( 0.000 -3.071 25.964) 26.145 13.608 ( 0.000 -2.985 -15.916) 16.193 13.871 ( 0.000 4.132 -14.271) 14.857 14.583 ( 0.000 -1.369 4.742) 4.935 14.805 ( 0.000 7.262 -26.414) 27.394 15.426 ( 0.000 4.613 -16.435) 17.070 16.033 ( 0.000 -1.410 -19.253) 19.305 16.092 ( 0.000 -15.200 11.636) 19.142 16.229 ( 0.000 -22.943 4.945) 23.470 16.436 ( 0.000 -5.921 3.210) 6.735 16.783 ( 0.000 -3.770 -6.625) 7.623 17.102 ( 0.000 1.660 11.146) 11.269 17.176 ( 0.000 -1.723 6.163) 6.400 18.972 ( 0.000 4.943 2.849) 5.705 19.012 ( 0.000 2.693 -0.665) 2.774 19.127 ( 0.000 6.448 9.604) 11.568 19.602 ( 0.000 0.948 -1.809) 2.042 ======================= Grid point 199 (67/120) ======================= q-point: ( 0.11 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.785 ( 5.463 10.491 19.219) 22.567 1.837 ( 10.422 -0.695 20.674) 23.163 2.530 ( 1.205 -3.592 -9.774) 10.482 2.862 ( -3.086 -1.065 1.762) 3.709 3.002 ( 0.204 1.025 -4.283) 4.409 3.096 ( 1.357 -4.303 -6.508) 7.919 3.179 ( 0.768 -8.289 9.031) 12.282 3.295 ( 3.404 4.849 -10.961) 12.460 3.418 ( 3.165 1.052 -6.002) 6.866 3.575 ( -6.217 -0.269 -2.130) 6.577 3.767 ( 0.286 -0.640 3.289) 3.363 4.475 ( -7.350 -10.260 -6.829) 14.350 4.866 ( -2.191 10.094 4.139) 11.128 5.216 ( -2.202 16.833 2.031) 17.098 5.415 ( -6.776 -0.963 9.282) 11.532 5.456 ( -4.232 7.423 11.635) 14.435 6.216 ( 4.814 -2.845 16.054) 16.999 6.343 ( 12.712 -0.908 13.495) 18.561 6.847 ( 0.380 1.336 -7.682) 7.807 7.182 ( 0.425 -6.455 -4.298) 7.767 7.253 ( -1.218 -4.601 -10.206) 11.261 7.395 ( -2.580 -8.683 -7.873) 12.001 7.536 ( -6.510 6.544 -8.252) 12.381 7.782 ( 1.796 -1.452 -17.871) 18.020 8.017 ( -10.050 9.309 0.944) 13.731 8.302 ( -3.971 1.097 -5.077) 6.538 8.647 ( 12.317 2.829 5.354) 13.725 8.785 ( -9.921 -8.316 0.857) 12.974 9.038 ( -5.690 -0.902 -2.846) 6.425 9.324 ( 0.145 -3.246 -5.744) 6.599 9.467 ( 4.413 1.109 -8.226) 9.401 9.542 ( 8.904 -1.008 -8.515) 12.362 10.235 ( 6.628 0.177 8.447) 10.739 10.845 ( 6.689 -10.918 0.236) 12.806 11.020 ( -10.705 -1.748 13.444) 17.275 11.062 ( 0.598 4.215 16.424) 16.967 11.243 ( -6.330 0.816 8.265) 10.442 11.576 ( 7.444 17.508 -5.956) 19.936 11.731 ( 8.322 3.845 -1.888) 9.360 12.146 ( 8.289 2.254 4.966) 9.922 12.190 ( -0.946 6.810 6.677) 9.584 12.752 ( -0.497 -1.867 8.124) 8.351 12.985 ( 9.277 -0.053 -10.905) 14.317 13.194 ( 19.193 0.558 19.574) 27.420 13.564 ( -4.170 -1.481 -15.474) 16.094 13.871 ( 0.275 2.974 -13.828) 14.147 14.552 ( -5.262 -1.167 -0.167) 5.393 14.666 ( -8.773 8.132 -16.409) 20.307 15.539 ( 8.315 4.454 -17.045) 19.481 15.992 ( -2.515 -4.056 1.372) 4.965 16.131 ( 2.800 -9.071 -7.529) 12.116 16.273 ( 3.765 -24.429 4.022) 25.042 16.462 ( 2.217 -8.383 2.333) 8.980 16.797 ( 1.190 -3.134 -5.861) 6.752 17.057 ( -3.581 1.572 12.640) 13.231 17.183 ( 0.164 -2.333 4.838) 5.374 18.944 ( -3.474 3.680 1.752) 5.355 18.964 ( -3.324 5.533 -1.101) 6.548 19.114 ( -1.302 6.241 8.847) 10.905 19.575 ( -2.646 1.074 -2.095) 3.542 ======================= Grid point 200 (68/120) ======================= q-point: ( 0.22 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.924 ( 8.113 7.811 11.436) 16.050 2.106 ( 15.123 -2.588 15.411) 21.746 2.567 ( 2.232 -2.149 -9.757) 10.237 2.788 ( -4.250 -6.367 1.035) 7.724 2.923 ( -6.268 -2.260 -3.991) 7.767 3.031 ( -4.257 -11.218 -3.580) 12.521 3.235 ( -3.863 -0.205 -5.077) 6.382 3.345 ( 0.739 3.692 -4.796) 6.097 3.463 ( 0.438 2.261 -0.646) 2.391 3.540 ( 4.079 2.920 -9.897) 11.095 3.830 ( 8.693 -3.924 11.730) 15.118 4.291 ( -9.815 -9.949 -4.227) 14.601 4.822 ( -1.001 9.720 4.434) 10.730 5.175 ( -1.723 18.219 1.773) 18.386 5.281 ( -6.051 -0.018 7.700) 9.793 5.398 ( -0.543 7.281 5.495) 9.138 6.346 ( 7.831 -0.595 13.875) 15.944 6.569 ( 5.024 0.283 -2.798) 5.758 6.839 ( -0.211 0.653 -1.171) 1.357 6.995 ( -15.311 -5.353 -13.427) 21.056 7.264 ( 2.617 -1.824 -6.369) 7.124 7.389 ( -6.207 4.205 -2.214) 7.818 7.472 ( 6.014 -8.321 -1.659) 10.400 7.753 ( -3.586 1.743 -4.266) 5.839 7.920 ( -0.215 5.382 -3.164) 6.246 8.194 ( -6.171 0.367 -2.478) 6.660 8.612 ( -7.576 -7.915 3.844) 11.612 8.715 ( -8.226 -6.673 -1.672) 10.723 9.041 ( 9.909 11.286 6.732) 16.459 9.355 ( 3.404 0.057 -3.792) 5.096 9.565 ( 4.539 3.049 -6.618) 8.585 9.714 ( 7.252 1.264 -8.218) 11.032 10.367 ( 4.642 -2.493 5.144) 7.364 10.710 ( -14.112 -2.878 3.371) 14.792 10.927 ( -2.203 -6.490 9.876) 12.021 11.180 ( 7.385 3.854 10.137) 13.121 11.199 ( 4.067 -5.556 11.088) 13.052 11.745 ( 8.611 14.355 -3.779) 17.161 11.935 ( 4.056 3.368 4.132) 6.698 11.997 ( -0.059 13.241 1.673) 13.346 12.447 ( 10.365 -2.924 -1.835) 10.925 12.864 ( 10.995 -5.186 5.976) 13.546 13.181 ( 9.612 -0.826 -10.502) 14.261 13.452 ( -6.100 1.494 -15.384) 16.616 13.591 ( 14.656 -5.651 1.455) 15.775 13.930 ( 9.714 4.967 -0.357) 10.916 14.290 ( -16.967 5.065 -18.242) 25.422 14.636 ( 4.066 4.862 11.558) 13.182 15.664 ( 2.807 3.398 -14.701) 15.348 15.949 ( -2.287 -2.703 10.088) 10.691 16.192 ( 3.318 -3.919 -12.788) 13.780 16.363 ( 5.142 -24.658 3.359) 25.411 16.510 ( 2.532 -13.727 0.367) 13.963 16.809 ( -0.602 -2.904 -2.436) 3.838 16.995 ( -2.022 0.498 11.445) 11.633 17.172 ( -1.402 -3.863 4.278) 5.932 18.838 ( -5.613 5.347 -2.051) 8.019 18.907 ( -2.947 8.249 -2.384) 9.078 19.081 ( -1.590 5.376 6.880) 8.875 19.498 ( -5.029 1.410 -2.812) 5.932 ======================= Grid point 201 (69/120) ======================= q-point: ( 0.33 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( 9.347 4.540 3.436) 10.945 2.383 ( 10.561 -3.329 6.192) 12.687 2.593 ( -0.599 -1.495 -7.331) 7.506 2.722 ( -0.613 -8.137 -0.696) 8.189 2.774 ( -7.747 -1.837 -3.098) 8.544 2.965 ( -3.054 -11.400 -0.507) 11.812 3.138 ( -3.077 3.878 -3.374) 5.991 3.290 ( -3.999 3.393 -2.415) 5.773 3.461 ( -2.127 1.131 -2.962) 3.819 3.556 ( -2.390 1.759 -7.717) 8.268 4.050 ( 6.054 -14.444 7.653) 17.432 4.170 ( 1.266 -10.266 3.505) 10.921 4.866 ( 5.762 11.646 2.490) 13.230 5.151 ( -2.029 22.863 0.636) 22.961 5.197 ( 0.836 -0.763 -0.861) 1.422 5.467 ( 7.632 6.817 1.331) 10.320 6.367 ( -16.837 0.443 -15.235) 22.711 6.476 ( -10.495 4.402 -8.108) 13.973 6.672 ( -1.465 -4.199 0.151) 4.450 6.991 ( 7.443 -3.268 8.022) 11.421 7.281 ( -0.468 3.459 1.977) 4.011 7.340 ( 0.045 2.199 2.327) 3.202 7.561 ( 2.994 -4.398 -0.431) 5.338 7.736 ( 2.165 4.488 -0.424) 5.001 7.934 ( 0.814 0.416 -4.633) 4.722 8.070 ( -5.836 3.347 -0.051) 6.728 8.461 ( -7.784 -8.721 5.001) 12.715 8.522 ( -8.382 -7.338 0.091) 11.140 9.270 ( 11.144 10.432 7.011) 16.798 9.467 ( 7.685 1.272 -0.851) 7.836 9.624 ( 0.979 5.935 -3.023) 6.732 9.828 ( 3.987 0.519 -5.841) 7.090 10.362 ( -5.320 -3.036 1.783) 6.380 10.434 ( -11.922 -3.306 1.897) 12.516 10.957 ( 5.613 -7.876 9.519) 13.570 11.283 ( 5.437 7.877 16.407) 18.994 11.306 ( 1.947 -7.839 6.443) 10.332 11.767 ( -9.030 10.956 12.608) 18.987 11.949 ( 10.982 10.131 -0.227) 14.943 12.238 ( 11.720 5.073 -9.041) 15.647 12.654 ( 11.794 -4.304 -7.836) 14.800 13.049 ( 5.695 -8.347 -2.048) 10.310 13.329 ( -5.738 1.694 -10.088) 11.728 13.367 ( 8.486 3.572 -10.918) 14.282 13.655 ( -3.770 -8.326 -17.398) 19.653 13.931 ( -17.803 6.483 -16.616) 25.200 14.358 ( 27.312 5.926 14.130) 31.316 14.832 ( 15.403 4.044 16.416) 22.871 15.620 ( -7.493 2.098 -8.544) 11.556 15.850 ( -8.680 -0.426 10.492) 13.624 16.284 ( 6.423 -0.865 -8.743) 10.883 16.472 ( 5.352 -23.371 3.592) 24.243 16.563 ( 2.528 -17.735 -0.606) 17.924 16.765 ( -3.781 -3.769 0.049) 5.339 16.974 ( -0.375 -2.491 8.659) 9.018 17.124 ( -3.357 -5.272 6.006) 8.668 18.750 ( -2.715 8.756 -5.406) 10.643 18.844 ( -3.342 10.947 -5.554) 12.722 19.068 ( 0.743 3.699 3.337) 5.038 19.378 ( -6.692 1.826 -3.480) 7.761 ======================= Grid point 202 (70/120) ======================= q-point: ( 0.44 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 8.563 -0.246 -3.016) 9.083 2.431 ( -5.144 -4.321 -6.354) 9.247 2.601 ( 2.239 2.229 -1.619) 3.551 2.654 ( -3.721 0.928 -2.540) 4.600 2.777 ( 4.916 -8.914 -0.290) 10.184 2.883 ( -5.073 -9.478 0.553) 10.764 3.143 ( 2.568 4.207 -1.356) 5.112 3.207 ( -3.845 2.171 -0.343) 4.429 3.427 ( -0.107 1.162 -2.369) 2.641 3.474 ( -4.337 1.825 -4.342) 6.403 4.115 ( 4.073 -18.053 7.196) 19.857 4.196 ( -2.429 -17.350 8.614) 19.522 4.993 ( 5.013 15.980 1.125) 16.786 5.077 ( -3.915 19.366 0.506) 19.764 5.427 ( 20.720 0.607 -11.350) 23.633 5.703 ( 15.491 7.271 -6.032) 18.144 5.917 ( -24.973 -2.156 -15.593) 29.520 6.085 ( -21.174 7.681 -13.193) 26.104 6.858 ( 11.703 -1.238 7.674) 14.049 7.037 ( -4.351 -4.548 4.132) 7.529 7.288 ( 1.751 5.156 7.796) 9.509 7.330 ( -1.531 3.510 5.134) 6.405 7.647 ( 6.035 0.174 -0.399) 6.051 7.756 ( -2.639 2.295 0.408) 3.520 7.941 ( 0.815 2.604 -3.852) 4.720 7.984 ( -2.748 6.397 -0.229) 6.967 8.349 ( -1.768 -10.756 5.365) 12.149 8.391 ( -4.911 -10.006 2.557) 11.436 9.464 ( 8.008 8.893 5.180) 13.040 9.581 ( -2.826 6.579 3.106) 7.805 9.666 ( 9.198 1.881 -1.017) 9.443 9.835 ( -4.805 0.592 -1.640) 5.112 10.231 ( -2.720 -3.854 -0.505) 4.744 10.277 ( -5.494 -3.244 -0.569) 6.406 11.104 ( 7.980 -9.115 8.982) 15.081 11.248 ( -5.718 -10.564 8.401) 14.658 11.424 ( 7.494 13.612 15.727) 22.109 11.586 ( -8.653 12.840 14.558) 21.253 12.189 ( 11.574 5.049 -3.005) 12.980 12.347 ( -2.199 2.908 -6.605) 7.544 12.914 ( 13.315 -5.508 -12.333) 18.966 13.158 ( -7.374 -6.135 -11.346) 14.857 13.198 ( 7.697 -2.920 -8.500) 11.833 13.463 ( -9.410 -5.305 -11.969) 16.123 13.546 ( 1.328 5.988 -7.478) 9.671 13.649 ( -7.589 10.740 -15.666) 20.454 14.904 ( 25.591 2.480 7.913) 26.901 15.194 ( 16.335 0.754 11.626) 20.064 15.375 ( -14.176 3.683 1.909) 14.770 15.595 ( -16.236 2.046 11.013) 19.725 16.445 ( 8.861 -2.924 -4.577) 10.393 16.552 ( 1.240 -20.669 2.291) 20.833 16.598 ( 0.977 -17.251 -0.540) 17.287 16.659 ( -6.011 -6.334 0.371) 8.740 16.985 ( 1.786 -5.329 8.724) 10.378 17.046 ( -3.977 -5.974 8.198) 10.895 18.735 ( 0.975 11.562 -7.554) 13.846 18.778 ( -3.024 12.402 -7.437) 14.774 19.122 ( 4.545 2.581 -0.836) 5.293 19.239 ( -6.804 2.174 -3.188) 7.822 ======================= Grid point 207 (71/120) ======================= q-point: ( 0.00 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.788 ( 0.000 6.723 16.257) 17.592 2.012 ( 0.000 15.823 14.547) 21.494 2.433 ( 0.000 -3.538 -1.730) 3.938 2.824 ( 0.000 -8.915 -5.364) 10.404 2.892 ( 0.000 -14.185 -1.860) 14.307 3.099 ( 0.000 7.429 -1.067) 7.505 3.144 ( 0.000 5.250 3.913) 6.548 3.285 ( 0.000 -2.166 -10.957) 11.169 3.449 ( 0.000 2.151 -13.007) 13.184 3.582 ( 0.000 2.794 -2.340) 3.645 3.733 ( 0.000 -5.793 -3.874) 6.969 4.322 ( 0.000 -13.635 -8.451) 16.042 5.139 ( 0.000 16.163 14.077) 21.434 5.573 ( 0.000 8.361 10.993) 13.811 5.599 ( 0.000 17.766 6.709) 18.991 5.691 ( 0.000 11.384 12.548) 16.943 6.091 ( 0.000 -4.333 15.831) 16.413 6.114 ( 0.000 -5.585 14.404) 15.449 6.863 ( 0.000 -0.098 -6.004) 6.005 6.971 ( 0.000 -10.167 -0.474) 10.178 7.127 ( 0.000 -5.965 -11.949) 13.355 7.261 ( 0.000 -13.416 -3.257) 13.806 7.718 ( 0.000 3.977 -13.146) 13.734 7.756 ( 0.000 0.762 -25.006) 25.018 8.400 ( 0.000 11.402 3.682) 11.981 8.419 ( 0.000 -1.122 2.573) 2.807 8.491 ( 0.000 6.680 -4.223) 7.903 8.775 ( 0.000 -5.817 -8.327) 10.158 9.011 ( 0.000 -3.360 -4.739) 5.809 9.161 ( 0.000 -11.162 -4.200) 11.927 9.369 ( 0.000 -1.638 -9.348) 9.490 9.405 ( 0.000 -2.890 -7.973) 8.481 10.221 ( 0.000 4.470 13.592) 14.309 10.578 ( 0.000 -7.125 11.577) 13.594 11.149 ( 0.000 1.602 16.065) 16.145 11.155 ( 0.000 -2.108 15.915) 16.054 11.435 ( 0.000 11.630 8.869) 14.626 11.695 ( 0.000 3.660 -3.102) 4.798 11.807 ( 0.000 8.414 -11.156) 13.973 11.915 ( 0.000 3.349 3.500) 4.844 12.428 ( 0.000 0.853 2.611) 2.747 12.819 ( 0.000 -6.250 3.529) 7.178 12.937 ( 0.000 4.103 -7.629) 8.662 13.052 ( 0.000 20.170 6.150) 21.087 13.520 ( 0.000 -4.946 -8.985) 10.256 13.969 ( 0.000 5.347 -3.783) 6.550 14.565 ( 0.000 -0.255 7.596) 7.601 14.947 ( 0.000 4.665 -19.268) 19.824 15.532 ( 0.000 5.133 -18.222) 18.931 15.696 ( 0.000 -27.449 0.621) 27.456 15.807 ( 0.000 -11.707 7.559) 13.935 16.013 ( 0.000 -1.907 -17.718) 17.820 16.310 ( 0.000 -6.653 2.713) 7.185 16.639 ( 0.000 -10.824 -10.045) 14.767 17.120 ( 0.000 0.334 12.178) 12.183 17.147 ( 0.000 -1.208 11.318) 11.382 19.036 ( 0.000 2.287 7.867) 8.192 19.061 ( 0.000 2.024 1.988) 2.837 19.309 ( 0.000 10.902 2.181) 11.118 19.616 ( 0.000 0.155 -1.842) 1.848 ======================= Grid point 208 (72/120) ======================= q-point: ( 0.11 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 7.615 4.693 15.977) 18.310 2.039 ( 2.588 13.990 11.588) 18.350 2.456 ( 2.283 -3.143 -1.450) 4.146 2.773 ( -4.450 -7.265 -4.761) 9.760 2.869 ( -2.441 -13.401 -1.472) 13.701 3.017 ( -5.861 2.446 -4.248) 7.641 3.205 ( 3.266 0.377 4.932) 5.928 3.347 ( 3.799 0.584 -8.365) 9.206 3.436 ( 0.145 0.352 -12.626) 12.632 3.591 ( 0.293 4.918 -6.321) 8.014 3.717 ( -0.298 -4.429 -1.587) 4.714 4.261 ( -5.782 -11.886 -7.928) 15.414 5.125 ( -2.564 16.197 14.557) 21.927 5.427 ( -8.768 2.577 13.482) 16.287 5.525 ( -4.810 13.315 7.921) 16.222 5.714 ( 0.000 19.680 3.898) 20.063 6.179 ( 7.930 -0.574 14.670) 16.686 6.286 ( 13.551 -5.791 15.019) 21.041 6.866 ( 0.202 -0.716 -7.206) 7.244 7.021 ( 2.669 -8.535 -2.865) 9.391 7.139 ( -3.047 -9.557 -7.406) 12.469 7.205 ( 0.476 -8.392 -8.290) 11.806 7.646 ( -6.569 4.608 -11.634) 14.132 7.759 ( -0.281 -1.010 -17.938) 17.968 8.185 ( -10.778 6.427 3.626) 13.062 8.314 ( -8.284 0.716 -3.814) 9.148 8.571 ( -3.166 -7.592 0.957) 8.281 8.762 ( -2.307 3.004 -4.670) 6.013 9.015 ( 6.712 -0.337 0.333) 6.729 9.294 ( 6.146 -0.478 -5.417) 8.206 9.444 ( 5.549 -2.577 -8.934) 10.828 9.520 ( 13.125 -1.511 -9.748) 16.419 10.257 ( 2.992 2.590 12.550) 13.159 10.655 ( 6.997 -8.917 9.802) 14.985 10.979 ( -13.638 -1.923 12.229) 18.418 11.056 ( -8.612 -3.594 13.579) 16.476 11.420 ( 0.473 15.360 9.497) 18.065 11.801 ( 8.838 4.227 -3.875) 10.535 11.899 ( 7.199 13.629 -9.957) 18.350 12.113 ( 15.870 -2.305 3.477) 16.409 12.349 ( -6.292 3.830 2.938) 7.930 12.718 ( -4.749 -1.855 10.078) 11.295 13.016 ( 7.555 3.689 -12.619) 15.163 13.266 ( 14.440 8.352 1.260) 16.729 13.506 ( -0.981 -3.472 -8.263) 9.016 13.944 ( -1.666 4.014 0.074) 4.346 14.539 ( -3.212 0.217 6.190) 6.977 14.850 ( -6.763 9.274 -15.893) 19.605 15.615 ( 5.759 -0.764 -16.679) 17.661 15.721 ( 2.375 -28.351 0.922) 28.465 15.831 ( 2.179 -8.003 6.410) 10.483 16.037 ( 2.554 -2.042 -15.175) 15.524 16.312 ( 0.291 -6.535 1.593) 6.733 16.671 ( 2.686 -9.778 -9.626) 13.981 17.071 ( -4.361 0.107 13.026) 13.737 17.133 ( -1.721 -2.542 10.145) 10.599 19.006 ( -2.765 2.978 4.796) 6.286 19.049 ( -1.009 2.738 3.085) 4.247 19.292 ( -1.721 10.807 1.733) 11.079 19.592 ( -2.360 0.325 -2.140) 3.203 ======================= Grid point 209 (73/120) ======================= q-point: ( 0.22 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( 10.365 1.199 13.984) 17.448 2.117 ( 5.966 8.599 5.667) 11.902 2.518 ( 3.534 -1.925 -0.588) 4.067 2.666 ( -5.842 -6.006 -2.930) 8.876 2.805 ( -3.369 -11.282 -1.384) 11.855 2.896 ( -6.138 -0.386 -5.918) 8.535 3.188 ( -3.281 -4.999 3.694) 7.029 3.364 ( -2.909 -0.801 -7.599) 8.176 3.496 ( 3.812 0.619 -10.730) 11.404 3.588 ( -0.665 -0.532 -7.661) 7.709 3.771 ( 5.588 0.219 0.704) 5.636 4.110 ( -8.576 -8.390 -6.281) 13.542 5.039 ( -3.592 10.823 10.930) 15.796 5.259 ( -7.708 -0.499 8.404) 11.414 5.536 ( 6.013 17.898 9.529) 21.149 5.683 ( -2.884 22.140 -0.628) 22.335 6.378 ( 11.426 3.726 13.127) 17.798 6.545 ( 9.588 -3.913 6.271) 12.107 6.811 ( -15.511 -6.024 -12.858) 21.029 6.878 ( -2.524 -4.430 -7.174) 8.801 7.194 ( 6.578 -5.691 -2.215) 8.975 7.317 ( 7.721 -6.248 -3.919) 10.677 7.491 ( -7.528 5.528 -3.881) 10.114 7.735 ( -1.574 -2.237 -8.441) 8.873 8.041 ( -3.717 4.294 2.871) 6.364 8.150 ( -7.003 -4.881 -1.813) 8.726 8.461 ( -7.289 -5.841 1.179) 9.415 8.610 ( -10.206 -3.895 -1.980) 11.102 9.228 ( 11.030 6.536 4.895) 13.724 9.416 ( 6.743 5.603 -3.247) 9.349 9.586 ( 8.436 1.360 -7.899) 11.637 9.783 ( 10.363 4.995 -8.110) 14.075 10.312 ( 1.651 -2.466 9.190) 9.657 10.668 ( -14.382 -1.128 4.433) 15.092 10.794 ( -0.185 -7.759 10.402) 12.978 10.922 ( 0.741 -13.913 9.947) 17.119 11.478 ( 5.102 18.140 12.103) 22.396 11.971 ( 6.479 6.205 -5.432) 10.488 12.067 ( 7.923 13.064 -4.982) 16.070 12.250 ( -1.145 9.013 0.833) 9.124 12.378 ( 8.710 -3.401 -1.571) 9.481 12.734 ( 6.408 -7.588 9.065) 13.447 13.197 ( 10.065 2.582 -11.794) 15.719 13.442 ( -0.188 -1.365 -17.618) 17.672 13.524 ( 2.864 -1.239 -3.769) 4.893 13.984 ( 7.742 -0.364 11.029) 13.480 14.421 ( -6.817 9.264 -2.833) 11.845 14.793 ( 2.355 11.159 0.911) 11.441 15.670 ( -1.045 -7.869 -17.005) 18.767 15.793 ( 3.768 -30.961 3.461) 31.381 15.883 ( 3.333 -2.000 6.954) 7.967 16.118 ( 4.933 -2.868 -9.273) 10.888 16.324 ( 0.939 -4.485 -0.869) 4.664 16.718 ( 1.158 -6.881 -6.950) 9.849 16.965 ( -5.566 -2.622 12.227) 13.688 17.075 ( -4.014 -5.527 8.755) 11.104 18.947 ( -2.468 5.470 0.776) 6.051 19.030 ( -0.599 3.925 1.410) 4.213 19.243 ( -3.031 10.376 0.557) 10.824 19.523 ( -4.551 0.787 -2.889) 5.447 ======================= Grid point 210 (74/120) ======================= q-point: ( 0.33 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.194 ( 4.761 3.791 1.808) 6.349 2.313 ( 9.644 -3.568 7.480) 12.715 2.523 ( -4.801 -4.373 0.077) 6.494 2.612 ( 2.874 -1.978 0.060) 3.490 2.749 ( -3.370 -10.403 1.625) 11.055 2.787 ( -3.010 2.643 -8.564) 9.454 3.147 ( 0.019 -3.141 0.291) 3.155 3.279 ( -4.781 -3.401 -4.541) 7.420 3.509 ( -1.699 2.207 -6.948) 7.485 3.562 ( -2.385 -2.021 -4.561) 5.530 3.839 ( -1.556 -6.083 0.796) 6.329 3.977 ( -3.231 -8.478 -1.916) 9.273 5.059 ( 6.146 7.174 2.517) 9.777 5.182 ( 1.609 -0.673 -0.448) 1.801 5.595 ( -5.463 21.133 -3.854) 22.166 5.715 ( 10.498 20.214 6.569) 23.706 6.359 ( -22.852 -2.853 -17.567) 28.965 6.582 ( -8.301 6.379 -9.448) 14.102 6.632 ( 10.790 1.852 11.031) 15.542 6.917 ( 4.921 -5.082 3.397) 7.848 7.313 ( 4.637 -1.622 -0.205) 4.917 7.394 ( -1.794 3.421 3.469) 5.192 7.467 ( 6.411 -4.027 1.587) 7.736 7.758 ( 5.442 -2.433 -3.766) 7.051 7.992 ( -3.086 2.919 2.014) 4.701 8.048 ( -2.602 -6.412 0.960) 6.986 8.275 ( -10.655 -7.988 3.193) 13.694 8.407 ( -9.816 -3.150 0.804) 10.341 9.436 ( 10.143 4.367 4.713) 12.007 9.555 ( 6.923 6.235 0.007) 9.317 9.752 ( 6.868 9.118 -2.710) 11.732 9.897 ( 1.243 8.295 -3.049) 8.925 10.287 ( -4.755 -4.800 2.202) 7.106 10.383 ( -12.164 -1.515 2.301) 12.472 10.781 ( 2.477 -9.960 8.363) 13.239 11.004 ( 2.546 -17.469 8.376) 19.540 11.608 ( 7.443 19.852 14.013) 25.414 12.000 ( -3.323 11.971 4.907) 13.357 12.176 ( 5.817 13.587 -3.082) 15.097 12.362 ( 8.247 6.200 -8.501) 13.369 12.544 ( 9.687 -6.261 -8.474) 14.312 12.853 ( 4.343 -12.428 3.633) 13.657 13.293 ( -7.068 -4.606 -15.598) 17.733 13.423 ( -0.168 -3.346 -11.093) 11.588 13.569 ( 6.795 5.276 -4.671) 9.789 14.064 ( -4.045 5.304 -9.395) 11.523 14.496 ( 17.126 9.450 7.770) 21.047 14.944 ( 12.189 7.693 11.189) 18.247 15.583 ( -7.340 -9.923 -11.885) 17.134 15.805 ( -3.145 -10.365 5.416) 12.111 15.979 ( 5.417 -17.704 6.801) 19.724 16.188 ( 1.048 -9.532 -1.111) 9.653 16.362 ( 3.508 0.244 -2.668) 4.415 16.695 ( -3.291 -3.476 -1.921) 5.158 16.873 ( -3.374 -7.349 8.522) 11.749 16.981 ( -5.019 -8.836 7.189) 12.448 18.925 ( 0.475 8.514 -3.215) 9.113 19.031 ( 0.605 6.583 -2.673) 7.131 19.180 ( -2.702 8.252 -0.447) 8.694 19.413 ( -6.208 1.395 -3.627) 7.324 ======================= Grid point 211 (75/120) ======================= q-point: ( 0.44 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( 3.937 -0.353 -1.584) 4.258 2.363 ( -4.121 -2.310 -3.874) 6.110 2.526 ( 5.452 -8.783 8.288) 13.250 2.636 ( -4.869 -7.971 -0.035) 9.341 2.707 ( 4.051 2.822 1.017) 5.041 2.770 ( -1.189 2.552 -5.705) 6.362 3.174 ( 1.409 -2.263 -3.240) 4.196 3.200 ( -2.386 -3.052 -3.875) 5.479 3.471 ( -1.012 3.274 -2.295) 4.124 3.499 ( -2.982 0.890 -1.830) 3.610 3.814 ( 1.605 -12.458 3.263) 12.978 3.898 ( -5.360 -12.881 3.015) 14.273 5.233 ( 9.102 8.322 -4.436) 13.107 5.331 ( 7.335 5.102 -6.061) 10.797 5.497 ( 1.531 7.832 -11.106) 13.676 5.814 ( -16.234 -1.843 -12.472) 20.554 6.026 ( 6.644 19.524 -2.768) 20.809 6.304 ( -15.845 15.949 -7.511) 23.703 6.858 ( 9.484 1.108 8.838) 13.011 6.971 ( -1.119 -3.194 5.302) 6.290 7.363 ( 0.866 2.313 3.313) 4.132 7.377 ( -0.581 1.790 3.112) 3.636 7.624 ( 10.114 -2.625 0.880) 10.486 7.838 ( -8.546 1.741 -0.266) 8.725 7.957 ( 8.844 -1.287 0.551) 8.954 8.045 ( 1.409 -3.844 4.040) 5.752 8.101 ( -5.058 -10.527 6.603) 13.416 8.204 ( -10.545 -5.624 1.464) 12.040 9.641 ( 9.772 5.624 5.318) 12.466 9.693 ( 6.639 5.959 3.496) 9.582 9.795 ( -2.868 11.537 1.056) 11.935 9.858 ( -5.549 2.336 0.963) 6.097 10.173 ( -1.801 -1.020 -2.220) 3.035 10.227 ( -5.151 -0.376 -2.203) 5.615 10.880 ( 6.095 -13.948 7.932) 17.164 10.987 ( -3.807 -16.200 8.104) 18.510 11.761 ( 7.424 20.800 13.575) 25.924 11.898 ( -6.170 18.645 10.432) 22.238 12.320 ( 7.616 8.657 -6.146) 13.066 12.434 ( -2.147 6.074 -8.450) 10.626 12.771 ( 12.399 -9.004 -12.587) 19.830 12.953 ( 2.192 -14.507 -3.257) 15.029 13.106 ( -4.613 -7.066 -10.846) 13.742 13.272 ( -11.860 -12.657 -3.557) 17.706 13.782 ( 10.486 17.496 -9.715) 22.593 13.950 ( -6.549 19.397 -13.235) 24.378 14.907 ( 20.520 -4.124 1.750) 21.003 15.177 ( 2.055 -5.107 1.434) 5.689 15.437 ( 0.059 2.479 5.618) 6.140 15.650 ( -12.084 3.407 9.935) 16.011 16.079 ( 4.574 -23.691 6.477) 24.983 16.160 ( -3.228 -18.482 4.540) 19.303 16.468 ( 6.607 0.317 -2.140) 6.952 16.601 ( -5.967 -1.976 -1.717) 6.516 16.840 ( 0.447 -9.169 7.022) 11.558 16.888 ( -3.933 -9.903 6.554) 12.510 18.962 ( 2.878 10.980 -5.726) 12.714 19.021 ( -2.303 11.624 -6.181) 13.366 19.177 ( 3.217 2.883 -1.475) 4.565 19.283 ( -6.440 1.903 -3.489) 7.568 ======================= Grid point 216 (76/120) ======================= q-point: ( 0.00 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( 0.000 11.021 9.104) 14.295 2.146 ( 0.000 -5.011 3.639) 6.193 2.486 ( 0.000 9.520 8.160) 12.538 2.660 ( 0.000 -9.936 -1.145) 10.002 2.750 ( 0.000 4.610 -2.321) 5.161 2.987 ( 0.000 -15.714 7.116) 17.250 3.257 ( 0.000 7.770 -8.864) 11.787 3.318 ( 0.000 2.057 -17.292) 17.414 3.480 ( 0.000 1.808 -10.443) 10.599 3.572 ( 0.000 -8.039 -4.163) 9.053 3.773 ( 0.000 13.147 -7.267) 15.022 4.047 ( 0.000 -14.977 -8.630) 17.285 5.478 ( 0.000 18.183 24.316) 30.363 5.741 ( 0.000 -5.985 23.194) 23.954 5.753 ( 0.000 9.666 13.626) 16.707 5.936 ( 0.000 -9.931 16.642) 19.380 5.945 ( 0.000 13.810 4.787) 14.617 6.097 ( 0.000 0.323 0.873) 0.931 6.747 ( 0.000 -1.977 1.350) 2.394 6.918 ( 0.000 -15.281 -3.446) 15.665 6.969 ( 0.000 4.442 -9.840) 10.796 7.068 ( 0.000 -6.141 -8.987) 10.885 7.764 ( 0.000 1.100 -17.385) 17.420 7.769 ( 0.000 0.401 -21.561) 21.565 8.414 ( 0.000 1.606 2.890) 3.307 8.479 ( 0.000 -4.605 1.135) 4.742 8.651 ( 0.000 13.746 -0.060) 13.746 8.808 ( 0.000 5.108 -9.569) 10.847 8.928 ( 0.000 -12.284 -3.331) 12.728 8.933 ( 0.000 -4.821 -7.747) 9.124 9.347 ( 0.000 -0.475 -9.357) 9.369 9.358 ( 0.000 -1.664 -8.654) 8.812 10.326 ( 0.000 6.330 16.356) 17.538 10.451 ( 0.000 -6.630 15.998) 17.317 11.132 ( 0.000 -0.243 14.671) 14.673 11.142 ( 0.000 -1.042 14.274) 14.312 11.674 ( 0.000 9.932 10.143) 14.196 11.790 ( 0.000 -4.029 1.667) 4.360 11.801 ( 0.000 8.959 -4.412) 9.987 11.977 ( 0.000 -4.796 -1.569) 5.046 12.475 ( 0.000 7.373 -1.391) 7.503 12.659 ( 0.000 -10.004 -0.424) 10.013 13.060 ( 0.000 8.223 -14.804) 16.934 13.220 ( 0.000 -6.523 -17.282) 18.472 13.693 ( 0.000 23.889 9.249) 25.617 14.006 ( 0.000 -4.794 2.638) 5.472 14.585 ( 0.000 3.530 11.954) 12.464 14.798 ( 0.000 -18.136 7.985) 19.816 15.425 ( 0.000 0.028 -18.358) 18.358 15.505 ( 0.000 -6.056 -17.263) 18.295 15.789 ( 0.000 7.480 -3.651) 8.323 15.941 ( 0.000 -6.723 -10.816) 12.735 16.256 ( 0.000 3.048 -4.367) 5.325 16.412 ( 0.000 -11.707 -9.857) 15.304 17.123 ( 0.000 0.167 12.774) 12.775 17.130 ( 0.000 -0.597 12.841) 12.855 19.070 ( 0.000 1.261 7.394) 7.500 19.081 ( 0.000 0.163 5.064) 5.066 19.491 ( 0.000 7.664 -0.348) 7.672 19.592 ( 0.000 -3.046 -1.431) 3.366 ======================= Grid point 217 (77/120) ======================= q-point: ( 0.11 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( 3.975 9.271 9.590) 13.919 2.161 ( 1.403 -4.057 3.703) 5.669 2.499 ( 1.482 8.004 6.814) 10.616 2.649 ( -1.063 -8.731 -1.603) 8.940 2.716 ( -3.145 3.935 -2.464) 5.608 2.925 ( -5.145 -13.062 2.479) 14.256 3.239 ( -2.429 7.495 -1.969) 8.121 3.377 ( 2.972 -3.472 -14.679) 15.374 3.440 ( -2.210 3.022 -11.238) 11.845 3.537 ( -2.010 -7.019 -7.655) 10.578 3.810 ( 2.807 11.041 -6.785) 13.260 4.033 ( -1.621 -12.066 -8.134) 14.642 5.397 ( -9.911 9.601 19.728) 24.075 5.468 ( -12.919 0.648 16.171) 20.708 5.789 ( 2.229 15.893 11.083) 19.503 6.063 ( 11.852 5.295 17.662) 21.920 6.113 ( 4.755 -4.307 2.716) 6.966 6.196 ( 11.549 0.715 10.634) 15.716 6.764 ( 0.991 -4.072 -0.662) 4.242 6.873 ( -5.667 -12.780 -4.758) 14.768 7.013 ( 4.606 2.930 -8.860) 10.407 7.095 ( 3.792 -4.927 -10.053) 11.820 7.710 ( -4.927 2.263 -14.596) 15.570 7.740 ( -2.753 -1.136 -16.424) 16.692 8.238 ( -11.563 1.502 0.390) 11.666 8.291 ( -13.903 -3.728 -1.289) 14.451 8.571 ( -3.837 7.022 -0.466) 8.016 8.719 ( -8.811 -6.751 -2.509) 11.380 9.091 ( 15.577 7.384 -2.233) 17.382 9.234 ( 12.667 -6.440 -4.367) 14.866 9.434 ( 9.349 1.896 -10.013) 13.830 9.482 ( 13.779 -2.538 -10.665) 17.608 10.344 ( 1.308 6.552 15.927) 17.271 10.492 ( 3.786 -8.461 15.415) 17.987 10.961 ( -13.691 0.321 11.348) 17.786 10.991 ( -12.290 -2.724 11.552) 17.085 11.727 ( 3.735 14.996 8.212) 17.501 11.863 ( 8.273 1.283 -2.816) 8.832 12.003 ( 12.946 -0.509 -3.096) 13.321 12.066 ( 9.716 -5.660 3.769) 11.859 12.427 ( -3.718 8.968 -2.295) 9.975 12.621 ( -2.787 -8.851 -0.157) 9.281 13.124 ( 5.967 7.419 -14.089) 17.004 13.279 ( 4.896 -7.784 -16.672) 19.040 13.685 ( -1.214 19.952 6.602) 21.051 13.956 ( -4.398 -5.521 5.318) 8.838 14.594 ( 1.485 7.324 12.415) 14.490 14.843 ( 4.576 -14.121 7.459) 16.613 15.357 ( -4.990 -1.078 -15.069) 15.910 15.485 ( -2.335 -9.980 -17.435) 20.225 15.856 ( 4.984 5.812 -3.063) 8.246 15.973 ( 3.107 -5.596 -6.745) 9.299 16.283 ( 2.760 4.907 -6.313) 8.458 16.457 ( 4.019 -11.621 -10.417) 16.116 17.074 ( -4.760 0.488 12.937) 13.794 17.094 ( -3.704 -1.573 12.340) 12.980 19.054 ( -1.342 1.929 5.704) 6.169 19.073 ( -0.677 -0.004 4.773) 4.821 19.473 ( -1.851 7.590 -0.777) 7.851 19.571 ( -2.061 -2.906 -1.781) 3.983 ======================= Grid point 218 (78/120) ======================= q-point: ( 0.22 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( 6.049 4.356 10.159) 12.601 2.196 ( 2.006 -2.309 3.896) 4.953 2.550 ( 3.069 3.344 2.328) 5.100 2.611 ( -3.259 -0.757 -4.607) 5.694 2.647 ( -2.455 0.029 1.956) 3.139 2.824 ( -3.821 -9.376 -1.915) 10.304 3.158 ( -4.607 4.868 1.181) 6.806 3.303 ( -6.286 -7.095 -5.843) 11.135 3.490 ( 2.964 0.027 -12.086) 12.444 3.521 ( -0.464 -3.164 -10.245) 10.732 3.857 ( 1.280 6.359 -6.234) 8.996 3.976 ( -4.145 -6.229 -7.311) 10.461 5.185 ( -7.973 4.799 11.253) 14.603 5.242 ( -8.912 -1.633 10.103) 13.571 5.934 ( 9.776 22.591 10.237) 26.659 6.095 ( -3.308 17.702 -2.481) 18.179 6.363 ( 12.759 -12.518 15.548) 23.691 6.415 ( 8.716 -6.499 12.722) 16.735 6.691 ( -9.345 -1.117 -9.461) 13.344 6.779 ( 0.489 -6.937 -7.154) 9.977 7.145 ( 7.705 2.015 -6.092) 10.027 7.221 ( 7.905 -4.729 -6.499) 11.274 7.589 ( -6.299 4.940 -5.617) 9.779 7.678 ( -2.788 -4.024 -7.365) 8.844 8.038 ( -8.098 -1.922 -0.275) 8.328 8.056 ( -8.893 -3.895 -1.026) 9.763 8.457 ( -7.536 4.219 1.063) 8.702 8.544 ( -8.811 -3.960 0.453) 9.670 9.324 ( 9.010 4.804 0.390) 10.219 9.416 ( 7.436 -4.267 -2.485) 8.926 9.717 ( 16.221 9.238 -7.310) 20.047 9.833 ( 17.825 -1.636 -9.690) 20.354 10.339 ( -3.219 7.155 14.691) 16.654 10.566 ( -0.330 -14.396 15.070) 20.844 10.681 ( -10.135 1.753 4.941) 11.411 10.746 ( -10.376 -5.112 7.171) 13.610 11.833 ( 7.006 17.664 7.890) 20.576 12.037 ( 9.090 -0.820 -4.187) 10.041 12.214 ( 6.716 -0.793 -1.019) 6.839 12.293 ( 9.088 -7.675 1.600) 12.002 12.387 ( 1.274 12.974 -5.691) 14.224 12.602 ( 1.804 -8.065 -0.642) 8.289 13.268 ( 6.456 4.849 -13.501) 15.732 13.374 ( 2.852 -5.665 -14.427) 15.759 13.636 ( -1.839 12.815 1.489) 13.031 13.884 ( -0.403 -10.382 8.418) 13.372 14.672 ( 6.226 17.535 11.578) 21.915 14.976 ( 8.181 -0.692 5.614) 9.946 15.266 ( -3.673 -13.248 -6.914) 15.389 15.415 ( -4.071 -15.274 -15.345) 22.030 15.941 ( 3.167 5.073 0.583) 6.009 16.046 ( 3.172 -5.399 -2.319) 6.678 16.361 ( 4.586 7.658 -7.555) 11.694 16.548 ( 4.308 -10.486 -9.533) 14.812 16.939 ( -8.376 0.509 12.730) 15.247 16.983 ( -7.104 -3.849 11.223) 13.829 19.032 ( -0.385 3.263 2.447) 4.097 19.065 ( 0.157 -0.062 2.512) 2.518 19.418 ( -3.525 7.306 -1.911) 8.334 19.510 ( -4.004 -2.482 -2.681) 5.420 ======================= Grid point 219 (79/120) ======================= q-point: ( 0.33 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( 3.803 0.425 5.138) 6.407 2.252 ( 4.476 -2.784 6.856) 8.648 2.489 ( -6.043 1.184 -1.233) 6.280 2.568 ( -4.155 -6.628 -1.854) 8.039 2.685 ( 6.191 7.302 4.023) 10.384 2.817 ( 3.113 -2.962 -6.442) 7.744 3.082 ( -2.808 0.694 1.353) 3.193 3.186 ( -5.133 -6.798 -4.224) 9.508 3.502 ( -1.021 -1.468 -4.962) 5.274 3.511 ( 0.023 -1.754 -7.341) 7.547 3.819 ( -6.032 2.086 -3.526) 7.292 3.871 ( -5.948 -3.408 -5.311) 8.672 5.142 ( 4.291 2.366 0.650) 4.943 5.169 ( 2.761 -0.828 -0.114) 2.885 5.928 ( -11.773 14.073 -8.723) 20.316 6.072 ( -5.306 5.812 -4.351) 8.992 6.335 ( -2.199 9.584 1.891) 10.013 6.621 ( 9.132 -8.232 12.326) 17.410 6.726 ( 8.072 5.390 3.915) 10.466 6.794 ( 1.128 -4.396 -6.556) 7.974 7.289 ( 6.349 1.450 -3.553) 7.418 7.362 ( 4.716 -4.552 -2.589) 7.048 7.500 ( -1.795 5.879 4.012) 7.340 7.661 ( 1.639 -8.915 -0.200) 9.067 7.909 ( -4.654 -3.324 -0.741) 5.767 7.943 ( -2.232 -5.042 0.961) 5.597 8.278 ( -9.800 5.109 3.679) 11.648 8.362 ( -9.540 -3.047 2.697) 10.372 9.502 ( 9.277 3.528 1.344) 10.015 9.568 ( 8.005 -2.845 -0.655) 8.521 9.983 ( 7.974 11.620 0.152) 14.094 10.126 ( 9.802 8.117 -5.773) 13.975 10.189 ( -10.183 0.724 9.325) 13.826 10.367 ( -9.265 -2.545 4.864) 10.769 10.613 ( -3.260 -6.193 6.225) 9.366 10.679 ( 1.212 -14.145 6.975) 15.817 12.001 ( 9.213 20.045 9.277) 23.932 12.205 ( 5.542 9.286 -3.385) 11.331 12.315 ( 7.222 -9.012 -1.268) 11.618 12.425 ( 5.693 1.806 0.368) 5.984 12.464 ( 5.358 1.601 -11.218) 12.534 12.639 ( 0.050 -7.877 -2.073) 8.145 13.219 ( -10.961 -0.396 -11.104) 15.607 13.299 ( -10.357 -7.004 -3.997) 13.127 13.794 ( 17.109 14.861 -3.872) 22.990 14.039 ( 15.162 -8.541 -2.444) 17.573 14.766 ( 0.339 19.254 -0.381) 19.261 15.108 ( -1.667 4.731 -3.634) 6.194 15.235 ( 5.950 -18.235 3.551) 19.507 15.415 ( 6.968 -18.388 3.812) 20.030 15.965 ( -1.697 4.801 3.575) 6.222 16.063 ( -2.327 -5.122 0.525) 5.650 16.446 ( 3.644 7.574 -3.288) 9.025 16.608 ( 1.446 -7.518 -5.630) 9.504 16.764 ( -8.098 -1.111 11.049) 13.744 16.828 ( -7.594 -6.501 8.189) 12.923 19.051 ( 2.365 4.463 -1.360) 5.231 19.091 ( 2.577 0.306 -0.761) 2.705 19.334 ( -4.771 6.604 -3.277) 8.781 19.413 ( -5.573 -1.812 -3.688) 6.924 ======================= Grid point 220 (80/120) ======================= q-point: ( 0.44 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.286 ( 3.408 1.701 1.919) 4.265 2.348 ( 2.067 -1.879 1.772) 3.308 2.384 ( -1.714 -2.105 4.103) 4.919 2.469 ( -5.232 -7.721 2.044) 9.548 2.818 ( 6.223 8.343 -0.032) 10.408 2.885 ( 1.155 6.621 -5.792) 8.872 3.043 ( -0.202 -8.123 -0.074) 8.125 3.097 ( -4.000 -8.174 -4.087) 9.975 3.508 ( 2.619 2.224 -1.169) 3.630 3.544 ( 2.867 0.911 -3.133) 4.343 3.668 ( -6.239 -1.957 -0.377) 6.550 3.725 ( -8.029 -6.013 -1.847) 10.200 5.329 ( 13.011 2.797 -8.868) 15.992 5.359 ( 15.180 -0.412 -9.533) 17.929 5.640 ( -15.545 6.219 -12.553) 20.926 5.741 ( -20.224 -4.705 -14.047) 25.069 6.474 ( 9.873 23.987 4.461) 26.321 6.649 ( -6.292 17.309 0.972) 18.443 6.832 ( 5.077 -9.353 5.815) 12.127 6.873 ( 2.142 -5.997 5.583) 8.469 7.392 ( 3.079 1.890 -0.050) 3.613 7.421 ( 1.287 2.818 1.126) 3.296 7.513 ( 4.336 -5.966 2.700) 7.854 7.647 ( -5.694 -15.499 0.254) 16.514 7.928 ( 7.051 0.869 3.015) 7.717 7.971 ( 5.371 -2.466 3.501) 6.869 8.087 ( -8.741 4.011 5.421) 11.040 8.157 ( -10.763 -2.502 3.821) 11.692 9.703 ( 10.787 2.669 2.722) 11.440 9.744 ( 9.657 -0.926 1.853) 9.877 9.925 ( -10.509 3.505 4.059) 11.798 9.956 ( -11.392 1.826 5.709) 12.873 10.268 ( 5.565 12.702 -1.326) 13.930 10.332 ( 0.160 10.856 -0.148) 10.859 10.596 ( 1.906 -14.869 5.496) 15.966 10.659 ( -2.932 -17.295 5.586) 18.410 12.169 ( 6.689 20.562 6.941) 22.709 12.249 ( -0.881 17.818 2.498) 18.014 12.448 ( 4.672 -4.671 -6.017) 8.936 12.520 ( 0.088 1.020 -8.533) 8.594 12.649 ( 6.556 -6.788 -4.663) 10.527 12.656 ( 11.860 -5.292 -1.683) 13.096 12.956 ( -12.479 -6.185 -9.811) 17.036 13.027 ( -14.924 -11.719 0.839) 18.993 14.167 ( 17.161 21.483 -8.657) 28.827 14.328 ( 6.661 15.702 -10.626) 20.095 14.719 ( 0.751 -11.063 -6.493) 12.850 14.913 ( -13.179 -20.673 -10.072) 26.505 15.507 ( 16.227 5.503 12.804) 21.390 15.638 ( 11.797 -7.241 10.465) 17.352 15.838 ( -9.908 0.988 9.414) 13.703 15.930 ( -10.619 -7.123 6.775) 14.471 16.517 ( 3.839 4.973 0.427) 6.297 16.596 ( -3.218 1.531 -0.812) 3.655 16.665 ( -0.567 -8.077 5.755) 9.934 16.708 ( -4.151 -8.033 4.046) 9.906 19.122 ( 4.493 5.608 -4.034) 8.241 19.165 ( 4.113 1.934 -3.752) 5.894 19.236 ( -4.266 4.119 -3.807) 7.047 19.294 ( -6.086 -1.171 -4.029) 7.392 ======================= Grid point 252 (81/120) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 0.000 0.000 21.986) 21.986 2.181 ( 0.000 0.000 20.670) 20.670 2.435 ( 0.000 0.000 -0.245) 0.245 2.730 ( 0.000 0.000 -13.802) 13.802 2.827 ( 0.000 0.000 -12.984) 12.984 2.902 ( 0.000 0.000 -17.795) 17.795 3.043 ( 0.000 0.000 2.564) 2.564 3.294 ( 0.000 0.000 -8.476) 8.476 3.428 ( 0.000 0.000 7.576) 7.576 3.663 ( 0.000 0.000 -1.079) 1.079 4.039 ( 0.000 0.000 18.655) 18.655 4.529 ( 0.000 0.000 -8.900) 8.900 4.808 ( 0.000 0.000 2.136) 2.136 4.973 ( 0.000 0.000 -5.256) 5.256 5.799 ( 0.000 0.000 18.084) 18.084 5.801 ( 0.000 0.000 24.117) 24.117 6.351 ( 0.000 0.000 -3.915) 3.915 6.511 ( 0.000 0.000 14.236) 14.236 6.825 ( 0.000 0.000 9.942) 9.942 7.030 ( 0.000 0.000 -12.200) 12.200 7.131 ( 0.000 0.000 -33.316) 33.316 7.250 ( 0.000 0.000 -0.449) 0.449 7.357 ( 0.000 0.000 -10.237) 10.237 7.427 ( 0.000 0.000 -7.580) 7.580 8.076 ( 0.000 0.000 -3.595) 3.595 8.076 ( 0.000 0.000 -4.833) 4.833 8.750 ( 0.000 0.000 13.945) 13.945 8.989 ( 0.000 0.000 -2.447) 2.447 9.001 ( 0.000 0.000 -2.509) 2.509 9.210 ( 0.000 0.000 -9.762) 9.762 9.336 ( 0.000 0.000 -2.611) 2.611 9.384 ( 0.000 0.000 -3.860) 3.860 10.322 ( 0.000 0.000 10.266) 10.266 10.725 ( 0.000 0.000 -10.350) 10.350 11.224 ( 0.000 0.000 8.480) 8.480 11.258 ( 0.000 0.000 1.942) 1.942 11.439 ( 0.000 0.000 5.141) 5.141 11.484 ( 0.000 0.000 6.022) 6.022 11.732 ( 0.000 0.000 12.371) 12.371 12.072 ( 0.000 0.000 9.440) 9.440 12.268 ( 0.000 0.000 -2.066) 2.066 12.531 ( 0.000 0.000 -14.063) 14.063 12.995 ( 0.000 0.000 9.288) 9.288 13.412 ( 0.000 0.000 -2.614) 2.614 13.478 ( 0.000 0.000 -16.674) 16.674 13.563 ( 0.000 0.000 22.501) 22.501 14.275 ( 0.000 0.000 -14.332) 14.332 14.795 ( 0.000 0.000 16.237) 16.237 14.988 ( 0.000 0.000 -24.456) 24.456 15.631 ( 0.000 0.000 -23.280) 23.280 16.466 ( 0.000 0.000 7.774) 7.774 16.539 ( 0.000 0.000 3.432) 3.432 16.587 ( 0.000 0.000 3.382) 3.382 16.727 ( 0.000 0.000 -3.874) 3.874 17.214 ( 0.000 0.000 4.428) 4.428 17.237 ( 0.000 0.000 1.791) 1.791 18.904 ( 0.000 0.000 0.386) 0.386 18.948 ( 0.000 0.000 -1.725) 1.725 19.300 ( 0.000 0.000 9.791) 9.791 19.543 ( 0.000 0.000 -3.505) 3.505 ======================= Grid point 253 (82/120) ======================= q-point: ( 0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.053 ( -0.296 0.000 17.162) 17.164 2.254 ( 6.891 0.000 18.743) 19.970 2.416 ( -1.274 0.000 -3.832) 4.038 2.812 ( 6.414 0.000 -9.756) 11.676 2.861 ( 2.862 0.000 -13.895) 14.187 2.979 ( 6.386 0.000 -14.299) 15.660 3.007 ( -3.170 0.000 4.035) 5.132 3.250 ( -4.210 0.000 -8.063) 9.096 3.421 ( 0.045 0.000 6.300) 6.300 3.606 ( -5.172 0.000 -0.293) 5.181 4.061 ( 2.553 0.000 16.637) 16.832 4.471 ( -5.288 0.000 -7.605) 9.263 4.792 ( -1.628 0.000 2.389) 2.891 4.956 ( -1.670 0.000 -4.921) 5.196 5.700 ( -7.869 0.000 18.167) 19.798 5.726 ( -6.922 0.000 23.811) 24.797 6.365 ( -0.829 0.000 -11.710) 11.740 6.540 ( 2.646 0.000 12.979) 13.246 6.885 ( 6.046 0.000 12.376) 13.774 6.957 ( -13.540 0.000 -27.335) 30.505 7.035 ( 1.188 0.000 -11.801) 11.860 7.333 ( -1.591 0.000 -7.774) 7.936 7.349 ( 8.376 0.000 -1.480) 8.506 7.554 ( 8.602 0.000 -10.127) 13.287 7.926 ( -7.865 0.000 2.289) 8.191 8.136 ( -0.616 0.000 -8.056) 8.079 8.849 ( 9.165 0.000 12.628) 15.603 8.894 ( -6.290 0.000 0.990) 6.367 8.977 ( -6.036 0.000 -3.519) 6.986 9.272 ( 5.626 0.000 -9.042) 10.650 9.309 ( -0.919 0.000 -1.064) 1.406 9.420 ( 4.404 0.000 -5.850) 7.322 10.392 ( 5.745 0.000 9.331) 10.957 10.791 ( 3.384 0.000 -10.885) 11.399 11.254 ( 4.397 0.000 9.913) 10.845 11.275 ( -9.975 0.000 7.949) 12.755 11.383 ( 10.536 0.000 2.705) 10.878 11.412 ( -5.509 0.000 2.534) 6.064 11.724 ( -0.327 0.000 8.942) 8.948 12.206 ( -5.717 0.000 -0.504) 5.739 12.285 ( 16.109 0.000 8.632) 18.276 12.666 ( 11.336 0.000 -10.425) 15.401 12.996 ( 0.747 0.000 6.403) 6.447 13.343 ( -5.681 0.000 -2.635) 6.262 13.460 ( -1.742 0.000 -17.941) 18.025 13.680 ( 8.427 0.000 10.592) 13.535 14.204 ( -4.266 0.000 -2.857) 5.134 14.831 ( 3.775 0.000 18.095) 18.485 15.093 ( 8.877 0.000 -24.613) 26.165 15.683 ( 5.073 0.000 -22.310) 22.880 16.400 ( -4.760 0.000 9.378) 10.517 16.587 ( 2.838 0.000 0.017) 2.838 16.613 ( 2.535 0.000 3.240) 4.114 16.743 ( 1.518 0.000 -3.452) 3.771 17.198 ( -1.483 0.000 5.561) 5.756 17.239 ( 0.220 0.000 1.684) 1.698 18.862 ( -4.113 0.000 -0.384) 4.131 18.888 ( -5.682 0.000 -1.441) 5.862 19.270 ( -2.848 0.000 9.293) 9.719 19.510 ( -3.234 0.000 -3.702) 4.915 ======================= Grid point 254 (83/120) ======================= q-point: ( 0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 1.079 0.000 9.252) 9.315 2.397 ( -0.734 0.000 -8.488) 8.520 2.420 ( 8.168 0.000 13.148) 15.479 2.847 ( -5.777 0.000 -9.086) 10.767 2.897 ( 1.092 0.000 -1.160) 1.593 2.999 ( 3.197 0.000 1.063) 3.369 3.097 ( 3.659 0.000 -9.814) 10.474 3.152 ( -3.881 0.000 -5.700) 6.896 3.450 ( 1.462 0.000 0.961) 1.750 3.496 ( -4.082 0.000 0.741) 4.148 4.176 ( 10.053 0.000 11.027) 14.922 4.359 ( -4.227 0.000 -3.098) 5.240 4.747 ( -2.568 0.000 2.595) 3.651 4.907 ( -3.068 0.000 -4.264) 5.253 5.547 ( -10.514 0.000 21.357) 23.805 5.555 ( -5.577 0.000 14.874) 15.885 6.257 ( -9.882 0.000 -19.535) 21.892 6.548 ( -10.089 0.000 -9.814) 14.075 6.708 ( -2.965 0.000 -3.264) 4.410 7.057 ( 10.384 0.000 12.668) 16.380 7.083 ( 3.207 0.000 -10.193) 10.686 7.325 ( 1.069 0.000 -2.130) 2.383 7.527 ( 8.435 0.000 -1.110) 8.507 7.708 ( 6.343 0.000 -8.704) 10.770 7.776 ( -6.931 0.000 5.610) 8.917 8.069 ( -5.435 0.000 -7.735) 9.454 8.756 ( -7.034 0.000 1.695) 7.236 8.797 ( -10.096 0.000 -0.560) 10.111 9.072 ( 12.027 0.000 9.951) 15.610 9.344 ( 4.670 0.000 1.873) 5.032 9.403 ( 6.594 0.000 -6.781) 9.459 9.551 ( 7.734 0.000 -7.617) 10.856 10.477 ( 0.859 0.000 5.293) 5.362 10.718 ( -10.390 0.000 -5.169) 11.605 11.167 ( -0.373 0.000 8.267) 8.276 11.378 ( 6.621 0.000 15.956) 17.275 11.400 ( 4.846 0.000 -1.622) 5.110 11.636 ( 12.545 0.000 6.481) 14.120 11.766 ( 6.901 0.000 -4.099) 8.027 12.066 ( -7.426 0.000 2.048) 7.703 12.556 ( 8.674 0.000 9.704) 13.015 12.910 ( 12.345 0.000 -3.934) 12.957 13.068 ( 6.612 0.000 -3.035) 7.276 13.201 ( -8.187 0.000 -3.434) 8.879 13.405 ( -3.920 0.000 -21.174) 21.534 13.712 ( -7.589 0.000 -19.312) 20.750 14.288 ( 14.579 0.000 25.379) 29.268 14.959 ( 9.442 0.000 22.173) 24.100 15.276 ( 8.023 0.000 -21.987) 23.405 15.829 ( 9.270 0.000 -19.501) 21.592 16.288 ( -6.688 0.000 11.311) 13.141 16.628 ( 0.995 0.000 -5.346) 5.438 16.683 ( 4.258 0.000 2.968) 5.190 16.787 ( 2.796 0.000 -2.389) 3.678 17.166 ( -1.301 0.000 7.400) 7.513 17.245 ( 0.353 0.000 1.745) 1.780 18.732 ( -8.478 0.000 -1.407) 8.594 18.758 ( -6.720 0.000 -2.287) 7.098 19.194 ( -4.338 0.000 7.631) 8.778 19.417 ( -5.841 0.000 -4.113) 7.144 ======================= Grid point 255 (84/120) ======================= q-point: ( 0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( 3.325 0.000 2.074) 3.919 2.372 ( -2.226 0.000 -11.262) 11.480 2.514 ( 0.467 0.000 3.736) 3.765 2.699 ( -8.132 0.000 -6.191) 10.221 2.892 ( -0.191 0.000 3.923) 3.927 3.050 ( 3.656 0.000 3.228) 4.877 3.092 ( -3.431 0.000 -4.445) 5.616 3.169 ( 3.778 0.000 -1.337) 4.008 3.406 ( -2.814 0.000 -1.108) 3.025 3.467 ( -2.770 0.000 -2.203) 3.539 4.370 ( 6.082 0.000 4.457) 7.540 4.476 ( 18.606 0.000 4.684) 19.187 4.707 ( -1.041 0.000 1.091) 1.508 4.838 ( -3.729 0.000 -3.715) 5.264 5.321 ( -11.233 0.000 14.568) 18.396 5.496 ( -0.124 0.000 8.057) 8.058 6.007 ( -13.843 0.000 -17.733) 22.496 6.160 ( -23.575 0.000 -21.529) 31.925 6.815 ( 8.583 0.000 9.635) 12.904 7.139 ( 1.739 0.000 -6.461) 6.691 7.268 ( 9.745 0.000 9.914) 13.901 7.368 ( 2.887 0.000 2.482) 3.807 7.655 ( -4.682 0.000 5.109) 6.930 7.668 ( 5.589 0.000 -1.670) 5.833 7.797 ( 2.316 0.000 -6.935) 7.311 7.936 ( -7.593 0.000 -6.428) 9.949 8.619 ( -6.707 0.000 1.873) 6.963 8.631 ( -5.402 0.000 1.884) 5.721 9.301 ( 10.209 0.000 7.352) 12.581 9.486 ( 9.009 0.000 3.640) 9.717 9.511 ( 3.713 0.000 -3.297) 4.966 9.702 ( 6.712 0.000 -6.416) 9.285 10.408 ( -6.776 0.000 0.770) 6.819 10.476 ( -11.787 0.000 -1.481) 11.880 11.244 ( 6.856 0.000 10.261) 12.340 11.481 ( 3.859 0.000 17.380) 17.804 11.506 ( 3.504 0.000 -0.222) 3.511 11.786 ( -0.327 0.000 2.147) 2.172 11.963 ( 6.006 0.000 6.000) 8.489 12.052 ( 13.646 0.000 -6.066) 14.934 12.670 ( 5.189 0.000 5.669) 7.685 13.034 ( -7.626 0.000 -4.627) 8.920 13.118 ( 4.809 0.000 -2.220) 5.297 13.199 ( 5.485 0.000 -7.516) 9.305 13.322 ( -2.281 0.000 -22.331) 22.447 13.470 ( -14.630 0.000 -19.591) 24.451 14.668 ( 20.578 0.000 20.319) 28.919 15.214 ( 15.536 0.000 23.894) 28.501 15.374 ( 1.096 0.000 -14.744) 14.785 16.042 ( 10.834 0.000 -16.732) 19.933 16.123 ( -9.172 0.000 15.014) 17.594 16.613 ( -2.900 0.000 -9.439) 9.875 16.775 ( 4.601 0.000 2.723) 5.346 16.846 ( 2.778 0.000 -0.895) 2.919 17.159 ( 0.761 0.000 7.922) 7.958 17.250 ( -0.080 0.000 2.596) 2.597 18.567 ( -7.148 0.000 -2.557) 7.591 18.618 ( -6.886 0.000 -4.543) 8.250 19.115 ( -3.077 0.000 4.509) 5.459 19.286 ( -6.916 0.000 -4.156) 8.068 ======================= Grid point 256 (85/120) ======================= q-point: ( 0.44 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 5.265 0.000 -4.697) 7.056 2.298 ( -4.974 0.000 -9.908) 11.087 2.497 ( -0.086 0.000 -2.114) 2.116 2.552 ( -5.625 0.000 -4.834) 7.416 2.920 ( 2.998 0.000 3.187) 4.375 3.002 ( -4.793 0.000 -0.126) 4.794 3.157 ( 5.286 0.000 4.906) 7.212 3.215 ( -0.061 0.000 2.290) 2.291 3.367 ( -0.658 0.000 -1.871) 1.984 3.393 ( -3.203 0.000 -2.266) 3.923 4.571 ( 12.338 0.000 11.393) 16.794 4.712 ( 1.604 0.000 -1.411) 2.136 4.751 ( 0.680 0.000 12.560) 12.579 4.765 ( -3.368 0.000 -2.989) 4.503 5.236 ( 10.310 0.000 -6.699) 12.295 5.557 ( 6.248 0.000 -0.838) 6.303 5.657 ( -25.505 0.000 -17.574) 30.973 5.742 ( -11.838 0.000 -10.379) 15.744 6.997 ( 8.628 0.000 6.114) 10.575 7.126 ( -3.607 0.000 -0.200) 3.613 7.398 ( 3.257 0.000 8.005) 8.642 7.428 ( 1.209 0.000 7.948) 8.039 7.633 ( 3.943 0.000 -0.495) 3.974 7.755 ( 3.278 0.000 -3.658) 4.911 7.774 ( -8.308 0.000 -4.241) 9.328 7.803 ( -1.373 0.000 -5.622) 5.787 8.536 ( -1.484 0.000 3.157) 3.488 8.550 ( -2.590 0.000 2.423) 3.547 9.467 ( 6.116 0.000 4.338) 7.498 9.539 ( -1.044 0.000 0.663) 1.236 9.677 ( 8.967 0.000 2.361) 9.272 9.783 ( -0.117 0.000 -2.566) 2.569 10.267 ( -4.214 0.000 -0.480) 4.241 10.297 ( -6.028 0.000 -1.599) 6.236 11.394 ( 7.233 0.000 9.671) 12.077 11.506 ( -3.326 0.000 5.928) 6.797 11.563 ( 4.815 0.000 12.181) 13.098 11.679 ( -6.619 0.000 6.845) 9.522 12.165 ( 10.344 0.000 3.773) 11.010 12.262 ( 3.216 0.000 -0.464) 3.249 12.816 ( 9.393 0.000 -3.703) 10.097 12.965 ( 3.267 0.000 -10.287) 10.793 13.020 ( -9.899 0.000 -8.956) 13.349 13.168 ( -14.443 0.000 -15.969) 21.532 13.308 ( 3.827 0.000 -8.532) 9.351 13.336 ( 0.843 0.000 -11.846) 11.876 15.051 ( 16.583 0.000 8.579) 18.671 15.304 ( -8.238 0.000 -3.865) 9.099 15.550 ( 17.080 0.000 21.395) 27.377 15.870 ( -14.339 0.000 16.913) 22.173 16.292 ( 11.898 0.000 -12.087) 16.960 16.501 ( -8.308 0.000 -11.214) 13.956 16.854 ( 2.942 0.000 2.255) 3.707 16.881 ( 0.335 0.000 0.939) 0.997 17.193 ( 2.306 0.000 6.828) 7.207 17.235 ( -1.518 0.000 4.704) 4.943 18.474 ( -1.697 0.000 -4.728) 5.024 18.502 ( -4.118 0.000 -5.744) 7.067 19.091 ( 1.063 0.000 0.407) 1.138 19.158 ( -5.323 0.000 -2.857) 6.041 ======================= Grid point 261 (86/120) ======================= q-point: ( 0.00 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 0.000 -6.206 15.204) 16.422 2.114 ( 0.000 4.385 16.100) 16.686 2.412 ( 0.000 0.166 1.470) 1.479 2.791 ( 0.000 5.094 -11.022) 12.142 2.839 ( 0.000 -0.782 -9.575) 9.607 2.955 ( 0.000 5.611 -15.783) 16.751 3.060 ( 0.000 1.942 4.383) 4.794 3.252 ( 0.000 -6.357 -3.521) 7.267 3.356 ( 0.000 -6.046 2.956) 6.730 3.580 ( 0.000 -6.180 -5.658) 8.379 3.956 ( 0.000 -8.108 13.571) 15.808 4.390 ( 0.000 -11.445 -9.465) 14.852 4.986 ( 0.000 17.161 6.275) 18.272 5.196 ( 0.000 19.408 -4.394) 19.900 5.808 ( 0.000 2.061 22.560) 22.654 5.862 ( 0.000 5.634 20.502) 21.262 6.368 ( 0.000 1.386 -1.251) 1.867 6.487 ( 0.000 -2.492 14.180) 14.397 6.800 ( 0.000 -2.436 8.012) 8.374 6.993 ( 0.000 -3.250 -10.870) 11.345 7.148 ( 0.000 0.983 -28.348) 28.365 7.189 ( 0.000 -5.648 -3.750) 6.779 7.321 ( 0.000 -5.817 -10.535) 12.035 7.427 ( 0.000 1.061 -10.305) 10.359 8.159 ( 0.000 8.182 -2.936) 8.693 8.179 ( 0.000 10.014 -4.766) 11.091 8.680 ( 0.000 -6.092 10.725) 12.334 8.875 ( 0.000 -10.121 -2.849) 10.514 9.005 ( 0.000 -0.762 -1.039) 1.289 9.194 ( 0.000 -3.241 -7.939) 8.575 9.297 ( 0.000 -3.277 -3.030) 4.463 9.343 ( 0.000 -3.425 -4.382) 5.562 10.364 ( 0.000 4.274 10.913) 11.720 10.712 ( 0.000 -0.841 -5.448) 5.513 11.316 ( 0.000 8.296 8.120) 11.608 11.371 ( 0.000 9.739 0.427) 9.749 11.431 ( 0.000 0.020 4.436) 4.436 11.467 ( 0.000 -0.920 3.942) 4.048 11.737 ( 0.000 0.775 12.594) 12.617 12.049 ( 0.000 -1.453 8.235) 8.362 12.352 ( 0.000 6.600 -2.761) 7.155 12.546 ( 0.000 1.503 -13.759) 13.841 12.972 ( 0.000 -1.744 2.810) 3.307 13.214 ( 0.000 -14.869 -3.005) 15.170 13.470 ( 0.000 5.929 5.191) 7.880 13.854 ( 0.000 17.235 12.411) 21.238 14.334 ( 0.000 6.150 -18.105) 19.121 14.775 ( 0.000 -1.435 13.477) 13.553 15.042 ( 0.000 5.160 -21.690) 22.295 15.623 ( 0.000 -0.714 -23.024) 23.035 16.281 ( 0.000 -17.324 7.717) 18.965 16.328 ( 0.000 -23.705 4.779) 24.182 16.490 ( 0.000 -5.295 2.260) 5.757 16.653 ( 0.000 -7.216 -6.546) 9.742 17.259 ( 0.000 2.913 5.324) 6.069 17.275 ( 0.000 2.672 3.781) 4.630 18.985 ( 0.000 7.246 -0.043) 7.246 18.997 ( 0.000 4.537 -0.764) 4.601 19.319 ( 0.000 2.144 9.075) 9.325 19.552 ( 0.000 0.886 -3.512) 3.622 ======================= Grid point 262 (87/120) ======================= q-point: ( 0.11 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( -0.789 2.215 11.393) 11.633 2.186 ( 6.511 -4.585 14.222) 16.300 2.407 ( -0.056 0.596 -1.236) 1.373 2.797 ( -0.977 -2.600 -7.757) 8.239 2.881 ( 6.028 2.973 -8.781) 11.058 2.991 ( -1.987 0.432 -1.670) 2.631 3.093 ( 5.227 6.900 -5.539) 10.276 3.230 ( -1.348 -3.087 -4.400) 5.541 3.357 ( 0.489 -5.793 0.834) 5.873 3.518 ( -5.381 -6.766 -4.114) 9.574 3.961 ( 0.880 -9.127 11.668) 14.840 4.330 ( -5.539 -11.444 -8.331) 15.200 4.978 ( -1.009 17.520 6.451) 18.697 5.183 ( -1.283 19.739 -4.110) 20.203 5.719 ( -7.497 1.946 20.732) 22.132 5.767 ( -8.022 4.348 21.757) 23.593 6.390 ( -0.310 2.382 -10.310) 10.586 6.514 ( 2.584 -2.267 13.075) 13.519 6.843 ( 3.753 -3.400 7.189) 8.793 6.949 ( -13.000 -1.737 -23.232) 26.678 7.041 ( 3.974 0.143 -8.031) 8.961 7.280 ( 7.847 -6.949 -0.546) 10.496 7.339 ( -0.604 -0.355 -11.152) 11.174 7.526 ( 7.532 -1.875 -9.857) 12.547 8.033 ( -7.387 9.703 1.326) 12.267 8.186 ( -2.446 4.413 -6.356) 8.115 8.755 ( 2.823 -6.147 4.118) 7.919 8.796 ( -5.474 -10.362 0.460) 11.728 9.025 ( 2.599 3.423 2.501) 4.973 9.243 ( 3.684 -2.561 -3.502) 5.692 9.325 ( 3.528 0.577 -5.642) 6.680 9.401 ( 6.262 -1.810 -6.286) 9.056 10.417 ( 4.380 2.729 10.171) 11.405 10.772 ( 3.572 -1.472 -6.739) 7.768 11.230 ( -10.761 -2.906 7.846) 13.631 11.340 ( -5.351 -1.001 7.789) 9.503 11.363 ( 1.980 6.420 5.492) 8.678 11.513 ( 8.382 9.474 -1.279) 12.714 11.766 ( 2.170 4.026 8.462) 9.619 12.218 ( 5.458 0.490 0.510) 5.504 12.313 ( 3.537 3.108 5.930) 7.572 12.673 ( 10.540 0.610 -10.383) 14.807 12.961 ( 0.083 -2.963 1.649) 3.392 13.240 ( 1.014 -12.115 -9.361) 15.344 13.433 ( -3.340 5.713 1.845) 6.870 13.923 ( 5.595 17.589 7.572) 19.950 14.239 ( -6.387 3.332 -6.543) 9.732 14.825 ( 4.633 -0.112 15.988) 16.646 15.142 ( 8.447 4.631 -22.974) 24.911 15.676 ( 5.230 -0.594 -22.106) 22.724 16.261 ( -1.802 -14.708 8.830) 17.249 16.357 ( 2.729 -23.663 4.067) 24.165 16.493 ( 0.343 -7.356 1.178) 7.458 16.670 ( 1.571 -6.842 -6.840) 9.801 17.236 ( -2.146 2.284 6.176) 6.925 17.270 ( -0.585 1.832 3.489) 3.984 18.942 ( -5.125 5.390 -0.584) 7.460 18.949 ( -3.476 7.508 -0.707) 8.304 19.291 ( -2.670 2.304 8.552) 9.250 19.521 ( -3.097 1.018 -3.700) 4.932 ======================= Grid point 263 (88/120) ======================= q-point: ( 0.22 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( 0.841 2.655 5.825) 6.457 2.320 ( 4.468 -5.288 0.463) 6.939 2.439 ( 4.299 1.394 3.039) 5.446 2.784 ( -1.132 -5.637 -4.416) 7.249 2.899 ( -5.766 -0.411 3.975) 7.015 2.974 ( 2.510 -2.690 -1.008) 3.814 3.127 ( -2.993 2.770 -5.696) 7.006 3.236 ( 0.609 5.352 -7.583) 9.301 3.396 ( 2.085 -4.831 -2.572) 5.857 3.435 ( -0.481 -4.724 -2.469) 5.352 4.020 ( 5.725 -12.773 6.634) 15.490 4.205 ( -5.424 -11.964 -4.678) 13.944 4.945 ( -1.839 16.848 6.772) 18.251 5.146 ( -2.292 20.075 -3.742) 20.549 5.561 ( -11.054 1.671 21.375) 24.122 5.596 ( -4.533 4.612 14.633) 15.998 6.288 ( -9.818 3.148 -19.225) 21.815 6.526 ( -9.675 -1.593 -10.206) 14.153 6.695 ( -1.992 -1.256 -0.596) 2.429 6.958 ( 5.858 -4.909 1.978) 7.895 7.178 ( 8.302 3.420 0.016) 8.979 7.341 ( 1.372 1.478 -3.521) 4.058 7.453 ( 8.445 -6.746 1.036) 10.858 7.642 ( 3.280 -2.915 -6.333) 7.704 7.918 ( -3.344 9.946 2.076) 10.697 8.110 ( -4.430 2.838 -5.924) 7.922 8.662 ( -6.528 -8.504 1.555) 10.833 8.694 ( -7.909 -8.748 -0.642) 11.811 9.184 ( 11.201 9.765 7.644) 16.710 9.333 ( 5.959 -0.727 1.764) 6.257 9.439 ( 6.859 2.073 -6.425) 9.624 9.562 ( 8.503 1.812 -7.806) 11.684 10.477 ( -0.271 0.103 6.306) 6.313 10.701 ( -11.097 -1.231 -3.557) 11.718 11.101 ( -1.607 -5.960 8.392) 10.418 11.290 ( 4.008 -9.149 1.472) 10.096 11.485 ( 7.281 9.932 14.813) 19.264 11.724 ( 10.265 7.608 2.130) 12.954 11.843 ( 7.630 6.262 -4.111) 10.693 12.120 ( -7.110 6.025 0.245) 9.323 12.515 ( 7.125 -4.202 9.010) 12.232 12.895 ( 10.464 -1.558 -3.108) 11.026 13.027 ( 6.604 -2.130 -5.482) 8.843 13.212 ( -3.517 -6.088 -10.974) 13.033 13.358 ( -3.573 3.972 -7.674) 9.350 13.874 ( -11.335 12.817 -20.796) 26.930 14.322 ( 15.169 3.398 26.001) 30.293 14.965 ( 9.570 0.823 19.693) 21.911 15.313 ( 7.364 3.236 -20.489) 22.012 15.826 ( 9.508 -0.221 -19.448) 21.649 16.207 ( -3.905 -9.257 10.481) 14.519 16.431 ( 4.392 -22.560 2.270) 23.096 16.506 ( 1.094 -11.147 0.102) 11.201 16.703 ( 1.308 -6.536 -6.963) 9.639 17.184 ( -2.730 0.146 7.333) 7.826 17.251 ( -1.401 -0.684 3.051) 3.426 18.811 ( -7.221 7.212 -0.584) 10.222 18.857 ( -5.445 9.100 -2.568) 10.911 19.219 ( -4.191 2.567 6.966) 8.525 19.432 ( -5.622 1.365 -4.097) 7.089 ======================= Grid point 264 (89/120) ======================= q-point: ( 0.33 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 3.191 2.505 0.713) 4.119 2.343 ( -1.205 -2.175 -9.263) 9.591 2.522 ( 1.553 1.190 2.583) 3.241 2.709 ( -6.287 -0.067 -4.174) 7.547 2.832 ( -0.034 -5.637 8.587) 10.272 2.988 ( -1.110 -6.653 1.816) 6.985 3.075 ( 0.144 1.039 -2.264) 2.495 3.226 ( -0.909 1.641 -4.688) 5.050 3.396 ( -0.809 -0.683 -2.300) 2.532 3.451 ( -0.913 -0.638 -3.954) 4.108 4.136 ( 3.647 -17.522 2.961) 18.141 4.220 ( 8.069 -16.441 0.266) 18.316 4.945 ( 3.140 14.456 4.273) 15.398 5.100 ( -1.839 19.185 -3.873) 19.658 5.324 ( -11.250 0.790 13.555) 17.632 5.573 ( 1.644 9.167 9.160) 13.063 6.015 ( -17.181 0.151 -18.543) 25.279 6.183 ( -18.577 3.670 -19.452) 27.147 6.818 ( 9.106 0.679 10.190) 13.682 7.064 ( 4.153 -4.356 -0.608) 6.049 7.331 ( 6.064 1.998 3.004) 7.056 7.385 ( 2.398 1.185 1.264) 2.959 7.575 ( 2.892 -3.892 2.261) 5.350 7.691 ( 3.727 1.502 -3.074) 5.059 7.886 ( -1.098 7.592 -0.401) 7.681 8.027 ( -3.499 6.256 -4.248) 8.333 8.530 ( -6.990 -9.050 2.118) 11.630 8.538 ( -5.805 -8.279 1.379) 10.205 9.399 ( 9.497 9.657 5.772) 14.723 9.488 ( 9.072 0.253 3.154) 9.608 9.568 ( 5.329 5.203 -2.789) 7.953 9.715 ( 6.537 2.136 -5.876) 9.046 10.385 ( -7.970 -2.248 1.107) 8.354 10.441 ( -12.618 -2.915 -0.888) 12.980 11.151 ( 5.631 -8.492 10.229) 14.438 11.391 ( 3.278 -10.002 1.096) 10.583 11.613 ( 5.247 11.621 16.818) 21.105 11.865 ( 2.068 6.646 0.688) 6.994 12.016 ( 2.170 3.381 1.877) 4.434 12.098 ( 13.134 7.071 -4.635) 15.619 12.605 ( 4.088 -6.289 3.405) 8.238 12.991 ( -1.157 -2.127 -1.155) 2.683 13.114 ( -7.092 -6.725 -13.942) 17.026 13.193 ( 8.430 1.141 -7.464) 11.317 13.342 ( 2.804 6.268 -9.998) 12.129 13.599 ( -14.502 10.948 -17.243) 25.050 14.687 ( 19.280 1.585 18.890) 27.038 15.203 ( 12.845 -1.025 16.786) 21.162 15.411 ( 2.794 2.969 -8.978) 9.860 16.040 ( 10.117 -0.551 -15.990) 18.930 16.093 ( -6.522 -3.352 13.250) 15.144 16.498 ( 1.069 -14.849 -5.076) 15.729 16.557 ( 4.320 -17.832 3.471) 18.673 16.708 ( -0.847 -8.405 -4.205) 9.436 17.139 ( -1.456 -3.417 7.168) 8.073 17.214 ( -2.161 -4.362 3.028) 5.733 18.680 ( -5.200 10.268 -1.836) 11.656 18.744 ( -5.406 11.426 -4.552) 13.435 19.141 ( -3.111 2.553 4.124) 5.763 19.305 ( -6.717 1.771 -4.140) 8.087 ======================= Grid point 265 (90/120) ======================= q-point: ( 0.44 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 4.321 1.557 -3.642) 5.862 2.289 ( -3.805 -0.436 -7.297) 8.241 2.525 ( 0.640 2.813 -3.076) 4.218 2.584 ( -5.161 2.766 -4.420) 7.336 2.865 ( 2.952 -5.556 6.167) 8.810 2.936 ( -3.613 -6.118 3.474) 7.909 3.130 ( 3.723 -2.390 -0.111) 4.425 3.193 ( -2.510 -2.605 -1.679) 3.988 3.390 ( 0.535 2.037 -0.994) 2.329 3.415 ( -1.726 2.102 -2.068) 3.417 4.244 ( 6.278 -20.841 6.032) 22.586 4.323 ( 0.102 -21.363 3.676) 21.678 5.033 ( 2.161 14.270 1.959) 14.565 5.088 ( -2.888 14.769 2.385) 15.236 5.236 ( 10.762 0.275 -6.825) 12.747 5.601 ( -18.106 -2.552 -13.996) 23.026 5.669 ( 3.524 11.826 -1.156) 12.394 5.863 ( -12.984 11.703 -9.694) 19.988 6.999 ( 7.887 0.423 6.721) 10.371 7.098 ( -1.473 -1.902 1.932) 3.085 7.400 ( 1.401 -0.695 3.571) 3.898 7.413 ( 0.139 -1.098 3.154) 3.342 7.640 ( 4.853 0.818 0.629) 4.961 7.735 ( -2.466 4.317 -2.234) 5.451 7.884 ( 2.895 7.468 -1.211) 8.100 7.962 ( -3.599 10.352 -2.537) 11.250 8.435 ( -2.045 -10.201 3.363) 10.934 8.447 ( -2.955 -10.166 2.626) 10.908 9.551 ( 5.526 8.546 3.592) 10.792 9.609 ( 0.199 6.861 0.027) 6.864 9.692 ( 8.778 2.149 3.293) 9.618 9.798 ( 0.159 1.911 -1.980) 2.756 10.219 ( -5.015 -4.455 -0.542) 6.730 10.251 ( -6.597 -4.351 -1.890) 8.125 11.281 ( 6.527 -9.979 8.806) 14.823 11.387 ( -3.345 -10.151 5.027) 11.811 11.706 ( 4.342 11.831 11.896) 17.330 11.798 ( -4.920 10.156 6.157) 12.855 12.181 ( 9.573 2.154 2.785) 10.200 12.281 ( 2.016 2.882 0.569) 3.563 12.726 ( 8.323 -7.525 -6.582) 13.008 12.925 ( -10.369 -7.876 -12.926) 18.347 13.011 ( 5.718 1.974 -7.850) 9.910 13.213 ( -10.137 0.143 -13.454) 16.846 13.401 ( 1.553 7.991 -6.707) 10.548 13.411 ( -0.391 12.165 -8.356) 14.764 15.045 ( 15.523 -1.280 7.197) 17.158 15.277 ( -6.614 -3.456 -3.479) 8.234 15.586 ( 14.855 3.569 19.230) 24.560 15.875 ( -12.911 0.422 16.129) 20.664 16.279 ( 10.935 -1.786 -12.006) 16.337 16.455 ( -5.824 -6.332 -10.170) 13.321 16.640 ( 3.283 -18.533 3.248) 19.100 16.684 ( -1.371 -15.054 1.133) 15.159 17.132 ( 0.797 -6.686 5.971) 8.999 17.167 ( -2.383 -7.050 4.181) 8.536 18.621 ( -0.557 13.040 -3.978) 13.644 18.653 ( -3.422 13.402 -5.248) 14.794 19.115 ( 0.954 2.271 0.283) 2.479 19.180 ( -5.206 2.052 -2.878) 6.292 ======================= Grid point 270 (91/120) ======================= q-point: ( 0.00 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( 0.000 -0.310 8.094) 8.100 2.167 ( 0.000 1.891 0.732) 2.028 2.537 ( 0.000 12.277 13.001) 17.882 2.727 ( 0.000 -9.941 -3.197) 10.443 2.883 ( 0.000 2.652 -0.834) 2.780 3.021 ( 0.000 -13.389 -8.003) 15.598 3.098 ( 0.000 6.648 -10.726) 12.619 3.125 ( 0.000 3.725 4.479) 5.826 3.268 ( 0.000 -1.906 -7.157) 7.406 3.500 ( 0.000 -2.630 -8.799) 9.184 3.761 ( 0.000 -11.137 7.660) 13.517 4.144 ( 0.000 -14.141 -10.065) 17.357 5.396 ( 0.000 24.604 9.702) 26.447 5.611 ( 0.000 22.586 -3.239) 22.817 5.891 ( 0.000 6.552 22.951) 23.868 6.002 ( 0.000 8.616 19.696) 21.498 6.363 ( 0.000 -3.314 10.087) 10.617 6.431 ( 0.000 -3.107 12.926) 13.294 6.756 ( 0.000 -1.198 0.716) 1.396 6.920 ( 0.000 -4.475 -9.658) 10.644 6.992 ( 0.000 -12.682 2.230) 12.876 7.146 ( 0.000 -11.898 -8.223) 14.464 7.214 ( 0.000 3.924 -30.535) 30.786 7.433 ( 0.000 -1.114 -16.619) 16.656 8.349 ( 0.000 10.175 -1.739) 10.323 8.408 ( 0.000 12.652 -4.132) 13.310 8.573 ( 0.000 -3.402 6.052) 6.943 8.668 ( 0.000 -10.276 -2.938) 10.687 8.946 ( 0.000 -5.299 -1.351) 5.468 9.070 ( 0.000 -9.199 -5.256) 10.595 9.242 ( 0.000 -2.155 -3.764) 4.338 9.279 ( 0.000 -3.170 -5.003) 5.923 10.472 ( 0.000 6.638 11.907) 13.632 10.704 ( 0.000 -0.270 1.771) 1.792 11.370 ( 0.000 -1.452 6.587) 6.745 11.395 ( 0.000 -3.029 7.584) 8.166 11.566 ( 0.000 11.241 0.624) 11.258 11.621 ( 0.000 11.369 -6.665) 13.179 11.785 ( 0.000 5.372 16.417) 17.273 12.037 ( 0.000 0.536 8.503) 8.519 12.437 ( 0.000 1.171 -2.941) 3.165 12.574 ( 0.000 0.564 -14.137) 14.149 12.954 ( 0.000 -0.509 -10.641) 10.654 12.960 ( 0.000 -11.059 -3.574) 11.622 13.639 ( 0.000 12.365 17.541) 21.462 14.135 ( 0.000 10.356 19.497) 22.077 14.508 ( 0.000 12.425 -24.613) 27.572 14.771 ( 0.000 1.857 11.358) 11.508 15.149 ( 0.000 4.623 -19.199) 19.747 15.611 ( 0.000 -0.790 -20.446) 20.462 15.797 ( 0.000 -29.389 5.005) 29.812 15.912 ( 0.000 -18.851 2.727) 19.047 16.359 ( 0.000 -7.817 1.974) 8.062 16.475 ( 0.000 -10.826 -6.633) 12.696 17.295 ( 0.000 0.973 6.162) 6.239 17.308 ( 0.000 0.722 5.485) 5.532 19.091 ( 0.000 4.678 1.318) 4.860 19.116 ( 0.000 5.276 1.113) 5.392 19.389 ( 0.000 5.220 5.538) 7.610 19.569 ( 0.000 0.535 -3.199) 3.244 ======================= Grid point 271 (92/120) ======================= q-point: ( 0.11 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 4.673 -0.202 5.477) 7.203 2.177 ( 1.337 2.287 2.299) 3.508 2.506 ( -1.850 10.014 6.797) 12.243 2.696 ( -2.062 -8.514 -2.347) 9.069 2.903 ( -0.566 -4.854 5.322) 7.225 2.987 ( -5.411 -1.347 0.929) 5.653 3.092 ( 6.613 -2.368 -10.996) 13.048 3.236 ( 2.401 -2.759 -5.252) 6.400 3.266 ( 2.122 3.275 -5.314) 6.593 3.444 ( -4.312 -0.991 -9.203) 10.211 3.763 ( 0.414 -10.280 6.045) 11.933 4.095 ( -4.562 -12.731 -9.262) 16.392 5.382 ( -2.587 23.118 9.687) 25.198 5.593 ( -2.275 20.814 -1.823) 21.018 5.787 ( -6.824 5.648 23.372) 24.994 5.881 ( -9.354 7.790 16.774) 20.725 6.431 ( 3.684 0.796 0.775) 3.848 6.484 ( 3.364 0.100 7.463) 8.187 6.773 ( 2.145 -4.044 3.007) 5.477 6.877 ( -12.609 -6.062 -16.125) 21.348 7.010 ( 5.157 -4.160 -4.255) 7.874 7.097 ( 7.857 -11.160 0.892) 13.677 7.327 ( 3.617 0.096 -17.730) 18.095 7.494 ( 5.599 -1.996 -12.285) 13.648 8.221 ( -10.157 7.126 0.615) 12.422 8.252 ( -7.662 2.135 -2.316) 8.284 8.589 ( -3.565 -8.507 1.159) 9.296 8.681 ( -2.215 -1.267 -3.671) 4.471 9.056 ( 13.258 0.107 3.743) 13.776 9.209 ( 7.907 -0.952 -3.383) 8.652 9.306 ( 5.622 -2.228 -5.225) 7.992 9.359 ( 10.077 -2.501 -7.017) 12.531 10.496 ( 1.757 5.452 11.706) 13.033 10.750 ( 3.444 -0.983 0.428) 3.607 11.174 ( -14.093 -2.828 7.484) 16.206 11.246 ( -12.003 -5.456 5.199) 14.172 11.594 ( 4.165 13.607 5.693) 15.327 11.698 ( 6.650 8.487 -4.984) 11.878 11.881 ( 6.261 8.648 9.431) 14.245 12.209 ( 12.538 -1.195 5.953) 13.931 12.373 ( -4.804 1.906 -0.589) 5.202 12.667 ( 7.107 -2.890 -10.825) 13.268 12.893 ( 0.116 -3.869 -4.378) 5.843 13.058 ( 4.305 -5.644 -13.583) 15.326 13.595 ( -4.126 11.529 13.607) 18.305 14.204 ( 5.859 5.614 22.306) 23.736 14.366 ( -10.083 14.826 -20.718) 27.399 14.853 ( 6.210 3.718 12.027) 14.037 15.225 ( 6.105 2.081 -20.232) 21.236 15.663 ( 5.079 -1.636 -18.814) 19.556 15.832 ( 3.617 -28.186 4.456) 28.764 15.934 ( 2.074 -16.171 2.925) 16.564 16.348 ( -0.832 -7.643 1.865) 7.911 16.501 ( 2.343 -10.450 -7.464) 13.054 17.258 ( -3.605 0.277 6.652) 7.571 17.284 ( -2.459 -0.298 5.229) 5.786 19.050 ( -3.737 5.448 1.477) 6.770 19.091 ( -2.435 5.796 0.320) 6.295 19.362 ( -2.548 5.211 5.142) 7.751 19.540 ( -2.833 0.669 -3.398) 4.475 ======================= Grid point 272 (93/120) ======================= q-point: ( 0.22 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 2.031 4.223 0.100) 4.687 2.251 ( 5.450 -1.074 2.036) 5.916 2.504 ( 2.040 5.855 2.271) 6.603 2.663 ( -1.150 -6.768 0.213) 6.868 2.847 ( -5.613 -7.816 7.354) 12.111 2.889 ( -2.987 -3.609 4.480) 6.482 3.162 ( -3.073 -0.042 -7.844) 8.425 3.221 ( -1.677 -5.648 -8.343) 10.214 3.320 ( 4.015 -2.173 -3.535) 5.774 3.432 ( 2.503 3.129 -8.414) 9.319 3.795 ( 3.124 -9.128 2.187) 9.892 3.983 ( -5.714 -10.406 -6.657) 13.611 5.264 ( -7.883 13.962 10.925) 19.401 5.476 ( -9.229 7.873 8.553) 14.843 5.673 ( -9.126 14.437 5.398) 17.912 5.768 ( 2.986 14.915 14.329) 20.898 6.361 ( -11.474 3.671 -18.715) 22.258 6.510 ( -8.844 0.510 -13.885) 16.471 6.673 ( 4.503 -0.519 8.637) 9.754 6.872 ( 6.133 -5.009 3.418) 8.625 7.164 ( 7.833 -4.470 -0.174) 9.020 7.304 ( 10.829 -8.453 3.032) 14.068 7.383 ( 3.400 2.762 -6.900) 8.173 7.602 ( 4.500 -1.995 -6.410) 8.082 8.077 ( -4.062 4.201 0.947) 5.920 8.110 ( -5.738 -3.445 -1.902) 6.958 8.486 ( -6.488 -6.967 1.598) 9.653 8.567 ( -7.527 -3.311 -2.393) 8.564 9.320 ( 8.972 0.577 3.763) 9.746 9.384 ( 10.712 6.646 0.867) 12.636 9.455 ( 11.319 2.616 -5.198) 12.727 9.627 ( 13.306 3.961 -8.021) 16.033 10.493 ( -3.636 2.324 9.122) 10.091 10.696 ( -12.015 1.160 -0.780) 12.096 10.973 ( -4.611 -7.184 7.643) 11.458 11.079 ( -0.482 -12.579 4.638) 13.415 11.725 ( 8.572 14.073 11.182) 19.914 11.868 ( 9.010 6.207 -3.348) 11.442 11.985 ( 4.462 10.186 -0.931) 11.159 12.266 ( -3.187 7.031 -2.128) 8.007 12.412 ( 4.472 -5.822 5.839) 9.380 12.800 ( 6.094 -10.584 -4.269) 12.938 12.996 ( 8.149 0.198 -7.767) 11.259 13.122 ( 2.750 -1.001 -14.590) 14.880 13.500 ( -4.039 9.890 6.914) 12.725 14.085 ( -13.018 6.069 -13.882) 19.975 14.436 ( 12.281 10.339 18.473) 24.474 15.003 ( 8.599 3.371 13.121) 16.046 15.337 ( 4.640 -3.260 -14.889) 15.932 15.797 ( 7.308 -8.268 -11.698) 16.081 15.940 ( 6.396 -17.026 -0.187) 18.189 15.995 ( 4.499 -13.001 3.682) 14.242 16.332 ( -0.691 -6.676 1.734) 6.932 16.555 ( 2.649 -9.047 -8.798) 12.894 17.158 ( -6.037 -2.158 7.408) 9.798 17.209 ( -4.988 -3.238 4.645) 7.546 18.961 ( -4.603 7.555 1.069) 8.911 19.029 ( -3.430 7.304 -1.510) 8.209 19.291 ( -4.325 5.017 4.080) 7.779 19.458 ( -5.198 1.027 -3.841) 6.544 ======================= Grid point 273 (94/120) ======================= q-point: ( 0.33 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 2.608 4.730 -0.493) 5.424 2.321 ( 0.922 0.339 -4.141) 4.256 2.571 ( 2.865 3.976 0.454) 4.922 2.656 ( 0.900 -5.380 2.029) 5.820 2.724 ( -5.212 -5.452 7.428) 10.586 2.847 ( -1.773 -7.123 6.401) 9.740 3.082 ( -2.352 -0.978 -6.571) 7.048 3.183 ( -2.656 -5.409 -6.570) 8.915 3.391 ( 2.722 0.146 -3.763) 4.647 3.460 ( -0.025 0.570 -5.458) 5.488 3.854 ( 0.868 -10.543 0.961) 10.623 3.930 ( 1.834 -12.931 -2.745) 13.346 5.149 ( -2.002 6.647 6.165) 9.284 5.283 ( -8.188 0.280 10.341) 13.194 5.484 ( -9.577 14.626 -6.571) 18.676 5.846 ( -0.651 13.037 1.982) 13.202 6.027 ( -14.273 6.907 -11.928) 19.842 6.343 ( -7.377 13.421 -13.112) 20.161 6.849 ( 9.661 2.307 10.453) 14.419 6.996 ( 5.533 -3.731 2.954) 7.298 7.299 ( 5.542 -3.675 -0.496) 6.668 7.397 ( 1.138 -0.871 -2.774) 3.122 7.531 ( 7.029 -1.818 4.692) 8.644 7.712 ( 8.078 -0.188 -2.059) 8.339 7.999 ( -4.210 0.059 0.475) 4.237 8.067 ( 0.964 -2.576 -0.027) 2.750 8.337 ( -7.817 -7.553 3.034) 11.285 8.408 ( -8.304 -3.135 -0.682) 8.902 9.497 ( 9.574 0.859 2.029) 9.824 9.558 ( 8.060 2.582 -0.325) 8.470 9.723 ( 12.280 13.553 0.353) 18.292 9.832 ( 6.449 10.215 -3.656) 12.621 10.335 ( -10.731 -2.506 2.725) 11.352 10.402 ( -14.656 -0.334 -0.087) 14.660 10.957 ( 2.647 -11.423 9.368) 15.008 11.137 ( 2.474 -16.052 3.633) 16.643 11.894 ( 6.010 16.474 14.536) 22.778 11.993 ( 3.652 6.642 -2.137) 7.875 12.085 ( 5.569 5.496 -5.853) 9.771 12.292 ( 6.733 9.640 -1.444) 11.847 12.463 ( 2.696 -7.514 -0.063) 7.983 12.852 ( -1.378 -13.020 -9.206) 16.006 13.042 ( -4.543 1.168 -3.384) 5.784 13.223 ( 4.809 0.831 -8.648) 9.930 13.507 ( 5.285 11.186 -0.220) 12.374 13.842 ( -9.667 13.222 -13.320) 21.111 14.700 ( 13.239 -0.874 13.296) 18.783 15.151 ( 3.865 -6.170 0.667) 7.311 15.448 ( 8.289 0.547 5.068) 9.731 15.911 ( 2.773 -14.676 2.398) 15.126 16.046 ( 5.095 -2.021 -2.805) 6.157 16.128 ( 6.780 -14.917 -0.996) 16.416 16.331 ( 1.287 -4.627 1.228) 4.957 16.586 ( -0.167 -5.738 -7.826) 9.705 17.035 ( -5.640 -6.557 6.915) 11.073 17.092 ( -6.251 -7.661 3.897) 10.628 18.888 ( -2.232 10.267 -0.526) 10.520 18.965 ( -2.733 9.970 -3.735) 10.992 19.203 ( -3.942 3.939 2.486) 6.102 19.339 ( -6.365 1.427 -4.013) 7.659 ======================= Grid point 274 (95/120) ======================= q-point: ( 0.44 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( 2.792 3.576 -0.617) 4.579 2.303 ( -2.130 2.276 -2.044) 3.728 2.592 ( 0.685 3.047 -3.147) 4.433 2.627 ( -2.862 0.495 -1.830) 3.433 2.733 ( 4.040 -6.522 7.402) 10.660 2.806 ( -2.765 -5.984 5.665) 8.692 3.073 ( 0.866 -3.962 -6.334) 7.521 3.116 ( -3.343 -5.480 -5.467) 8.432 3.437 ( 1.818 2.960 -1.054) 3.630 3.458 ( -0.010 2.137 -2.037) 2.952 3.885 ( 3.051 -15.846 3.811) 16.581 3.948 ( -1.783 -17.178 1.521) 17.337 5.195 ( 2.008 3.547 1.133) 4.230 5.225 ( 6.198 0.952 -3.715) 7.288 5.311 ( -5.367 6.901 -7.983) 11.839 5.540 ( -18.767 -3.355 -14.293) 23.828 6.051 ( 6.729 26.027 3.370) 27.093 6.195 ( -7.411 22.833 -4.325) 24.392 7.014 ( 5.984 0.666 6.921) 9.173 7.067 ( 0.848 -1.884 4.043) 4.541 7.377 ( 2.092 -0.999 -0.435) 2.359 7.399 ( -0.570 -0.343 -0.908) 1.125 7.661 ( 7.416 -0.915 3.083) 8.083 7.806 ( -4.269 -0.673 -2.906) 5.208 7.996 ( 7.405 2.711 3.402) 8.588 8.098 ( 0.838 0.687 0.451) 1.174 8.206 ( -4.486 -9.695 4.064) 11.430 8.236 ( -7.977 -7.536 1.698) 11.105 9.692 ( 8.575 2.461 0.814) 8.958 9.719 ( 7.356 5.111 -0.257) 8.961 9.866 ( -0.563 14.124 4.919) 14.967 9.896 ( 1.181 10.924 3.019) 11.395 10.131 ( -6.131 -4.181 -1.987) 7.682 10.174 ( -7.469 -1.110 -3.104) 8.164 11.041 ( 5.015 -15.151 8.134) 17.913 11.130 ( -3.054 -16.695 5.444) 17.824 11.959 ( 2.010 12.755 4.112) 13.552 11.998 ( -1.752 10.388 0.427) 10.543 12.272 ( 10.463 8.064 4.015) 13.807 12.396 ( -0.136 7.544 3.705) 8.406 12.567 ( 7.782 -7.753 -8.258) 13.743 12.750 ( -8.963 -9.410 -13.859) 18.999 12.994 ( 4.178 -3.754 -2.035) 5.974 13.167 ( -9.266 -4.543 -7.020) 12.481 13.646 ( 6.507 17.642 -4.391) 19.310 13.732 ( -2.816 20.320 -9.018) 22.409 14.947 ( 11.025 -10.888 3.012) 15.785 15.122 ( -5.860 -14.393 -5.124) 16.363 15.672 ( 12.235 5.131 15.875) 20.688 15.873 ( -6.602 -1.055 11.928) 13.674 16.149 ( 4.422 -12.412 -1.392) 13.250 16.198 ( 0.050 -15.161 -1.066) 15.198 16.412 ( 6.277 -1.128 -1.506) 6.553 16.534 ( -4.910 -1.840 -4.503) 6.912 16.958 ( -1.464 -10.785 4.752) 11.876 16.984 ( -3.804 -11.465 3.342) 12.534 18.878 ( 1.085 12.513 -2.799) 12.868 18.916 ( -2.310 12.773 -4.470) 13.729 19.161 ( 0.325 2.030 -0.150) 2.062 19.219 ( -5.055 1.579 -2.992) 6.083 ======================= Grid point 279 (96/120) ======================= q-point: ( 0.00 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 0.000 7.358 4.929) 8.857 2.208 ( 0.000 -0.120 2.083) 2.087 2.529 ( 0.000 -3.736 -2.687) 4.602 2.668 ( 0.000 -14.957 -1.013) 14.992 2.848 ( 0.000 16.450 10.745) 19.648 3.018 ( 0.000 4.907 -7.367) 8.851 3.116 ( 0.000 -7.742 2.703) 8.200 3.117 ( 0.000 -3.861 -1.743) 4.236 3.326 ( 0.000 6.414 -7.713) 10.031 3.447 ( 0.000 -5.031 -8.859) 10.188 3.656 ( 0.000 4.632 -3.305) 5.690 3.868 ( 0.000 -14.322 -9.797) 17.352 5.856 ( 0.000 20.997 6.116) 21.869 5.964 ( 0.000 10.711 -0.968) 10.754 6.039 ( 0.000 8.743 23.236) 24.826 6.169 ( 0.000 8.466 18.717) 20.542 6.244 ( 0.000 -9.295 16.336) 18.795 6.325 ( 0.000 -8.345 20.677) 22.298 6.767 ( 0.000 -6.262 1.506) 6.440 6.785 ( 0.000 3.391 -8.479) 9.132 6.813 ( 0.000 -7.189 -6.460) 9.665 6.912 ( 0.000 -10.465 -7.805) 13.056 7.299 ( 0.000 4.756 -26.927) 27.344 7.383 ( 0.000 -3.842 -22.112) 22.444 8.444 ( 0.000 1.113 1.231) 1.660 8.499 ( 0.000 -5.045 0.904) 5.126 8.646 ( 0.000 9.951 -6.312) 11.784 8.653 ( 0.000 10.587 -0.954) 10.630 8.819 ( 0.000 -7.800 -3.039) 8.371 8.871 ( 0.000 -11.266 -2.857) 11.623 9.218 ( 0.000 -0.406 -4.260) 4.279 9.230 ( 0.000 -1.751 -4.659) 4.978 10.597 ( 0.000 5.952 11.184) 12.669 10.681 ( 0.000 -2.667 7.546) 8.003 11.342 ( 0.000 -0.931 6.231) 6.301 11.347 ( 0.000 -1.562 6.806) 6.983 11.716 ( 0.000 4.652 -1.452) 4.874 11.753 ( 0.000 1.677 -2.680) 3.161 11.958 ( 0.000 10.511 16.140) 19.261 12.065 ( 0.000 0.393 8.477) 8.486 12.426 ( 0.000 0.425 -3.660) 3.685 12.515 ( 0.000 -6.699 -11.620) 13.413 12.854 ( 0.000 0.529 -7.864) 7.882 12.914 ( 0.000 -3.804 -13.771) 14.287 13.935 ( 0.000 17.128 15.684) 23.224 14.180 ( 0.000 -6.146 12.853) 14.247 14.793 ( 0.000 15.775 -10.648) 19.032 14.870 ( 0.000 8.249 16.030) 18.028 15.130 ( 0.000 -7.384 -19.350) 20.711 15.255 ( 0.000 -22.784 4.315) 23.189 15.639 ( 0.000 1.016 -18.765) 18.793 15.672 ( 0.000 -4.922 -9.335) 10.553 16.239 ( 0.000 -3.165 0.599) 3.221 16.284 ( 0.000 -7.677 -3.540) 8.453 17.305 ( 0.000 0.326 6.339) 6.347 17.311 ( 0.000 -0.201 6.132) 6.136 19.158 ( 0.000 2.210 2.999) 3.726 19.172 ( 0.000 0.869 3.173) 3.290 19.494 ( 0.000 5.013 0.775) 5.072 19.560 ( 0.000 -1.809 -1.947) 2.657 ======================= Grid point 280 (97/120) ======================= q-point: ( 0.11 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 3.892 6.205 4.288) 8.487 2.227 ( 1.844 0.539 2.613) 3.243 2.538 ( 0.829 -3.222 -2.298) 4.044 2.663 ( -0.669 -12.561 -1.269) 12.643 2.751 ( -5.942 12.240 7.162) 15.376 2.954 ( -7.789 -6.233 2.944) 10.401 3.122 ( 4.595 3.582 -7.335) 9.367 3.197 ( 0.490 -2.376 -6.609) 7.040 3.301 ( -1.433 3.123 -0.833) 3.536 3.414 ( -1.479 -5.580 -6.048) 8.361 3.686 ( 2.434 4.892 -4.780) 7.260 3.861 ( -0.890 -11.549 -9.416) 14.928 5.736 ( -13.485 10.602 12.930) 21.481 5.807 ( -14.240 1.954 15.181) 20.906 5.994 ( 3.055 15.199 13.271) 20.407 6.089 ( -2.275 10.299 2.525) 10.846 6.423 ( 10.168 -0.503 13.403) 16.831 6.478 ( 9.360 -3.088 12.589) 15.989 6.682 ( -5.986 -4.519 -6.374) 9.843 6.723 ( -10.492 -8.371 -9.679) 16.548 6.905 ( 7.342 -3.011 -1.593) 8.093 6.939 ( 8.885 -5.209 -2.940) 10.711 7.363 ( 4.521 3.442 -19.566) 20.375 7.437 ( 4.727 -3.865 -16.597) 17.684 8.234 ( -12.627 -0.335 -0.196) 12.633 8.265 ( -13.867 -2.986 -1.399) 14.253 8.575 ( -3.018 5.466 0.964) 6.318 8.665 ( -5.977 -2.470 -3.087) 7.167 9.078 ( 20.008 3.158 0.834) 20.273 9.162 ( 16.775 -4.502 -3.027) 17.631 9.283 ( 7.035 0.565 -5.412) 8.894 9.313 ( 10.189 -2.186 -6.798) 12.442 10.614 ( 1.203 6.412 11.392) 13.128 10.713 ( 2.952 -3.526 7.139) 8.492 11.135 ( -16.285 -0.739 6.361) 17.499 11.159 ( -15.215 -3.184 5.505) 16.491 11.796 ( 6.113 5.849 -0.725) 8.492 11.819 ( 5.422 3.778 -1.579) 6.794 12.074 ( 8.958 9.933 11.396) 17.572 12.190 ( 10.115 -1.478 7.337) 12.583 12.383 ( -3.655 1.555 -2.015) 4.453 12.520 ( -0.160 -10.594 -8.478) 13.570 12.889 ( 4.726 3.379 -10.099) 11.651 12.975 ( 5.072 -4.634 -14.304) 15.869 13.875 ( -5.503 16.777 13.374) 22.150 14.146 ( -3.881 -9.747 10.396) 14.770 14.736 ( -1.825 21.212 -4.342) 21.728 14.977 ( 7.390 8.368 12.495) 16.756 15.126 ( -0.962 -12.580 -17.254) 21.375 15.286 ( 3.591 -22.618 7.833) 24.204 15.709 ( 6.978 2.152 -16.813) 18.331 15.752 ( 6.707 -3.428 -10.765) 13.138 16.241 ( 0.502 -1.995 0.262) 2.074 16.309 ( 2.347 -8.390 -4.647) 9.874 17.260 ( -4.482 0.222 6.552) 7.941 17.270 ( -4.029 -0.799 6.067) 7.327 19.131 ( -2.493 2.784 2.880) 4.718 19.151 ( -1.948 0.792 2.626) 3.364 19.468 ( -2.588 5.006 0.446) 5.653 19.533 ( -2.647 -1.747 -2.210) 3.866 ======================= Grid point 281 (98/120) ======================= q-point: ( 0.22 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.236 ( 4.535 4.376 1.753) 6.541 2.276 ( 3.075 1.564 4.366) 5.565 2.556 ( 0.790 -2.075 -0.894) 2.394 2.641 ( -0.684 -2.100 -3.325) 3.991 2.664 ( -3.141 1.071 9.230) 9.808 2.813 ( -5.662 -6.155 3.209) 8.958 3.117 ( -3.107 -1.568 -9.596) 10.207 3.144 ( -4.853 -3.033 -8.498) 10.245 3.333 ( 3.890 3.374 -0.838) 5.217 3.420 ( 1.062 -4.507 -1.605) 4.901 3.733 ( 1.997 2.469 -5.582) 6.422 3.825 ( -2.648 -6.454 -7.866) 10.514 5.439 ( -13.979 5.538 14.455) 20.857 5.505 ( -14.635 -1.616 16.172) 21.870 5.984 ( -9.825 13.957 -7.254) 18.545 6.075 ( 0.371 9.256 1.461) 9.378 6.416 ( -10.261 6.719 -10.484) 16.135 6.570 ( 1.387 3.412 -10.105) 10.755 6.670 ( 10.301 -0.927 10.780) 14.939 6.712 ( 7.602 -11.860 11.279) 18.046 7.085 ( 9.161 -1.016 0.365) 9.224 7.152 ( 10.755 -6.835 0.800) 12.768 7.449 ( 4.122 4.349 -9.040) 10.846 7.541 ( 5.176 -4.605 -8.304) 10.815 8.024 ( -8.043 -2.681 -0.135) 8.479 8.048 ( -7.554 -4.452 -0.383) 8.776 8.477 ( -6.250 3.689 1.229) 7.360 8.535 ( -6.897 -1.726 -1.206) 7.211 9.339 ( 8.706 1.678 1.149) 8.940 9.380 ( 8.084 -2.371 -1.204) 8.510 9.596 ( 20.618 6.891 -4.497) 22.199 9.668 ( 20.088 -0.508 -7.277) 21.371 10.594 ( -5.774 8.752 11.114) 15.279 10.749 ( -9.206 3.968 2.058) 10.233 10.810 ( -6.000 -11.588 9.022) 15.864 10.861 ( -11.241 -7.662 4.535) 14.340 11.945 ( 8.924 6.524 2.251) 11.281 11.963 ( 8.479 3.869 -2.305) 9.601 12.230 ( 4.996 13.984 2.866) 15.124 12.310 ( -1.957 0.904 0.755) 2.284 12.346 ( 2.977 -2.333 0.928) 3.894 12.537 ( 2.894 -15.452 -4.917) 16.472 13.040 ( 8.807 3.491 -9.320) 13.290 13.102 ( 7.196 -2.336 -12.592) 14.689 13.752 ( -5.080 16.184 10.029) 19.706 14.033 ( -6.125 -10.689 3.954) 12.938 14.730 ( 0.043 18.885 -2.463) 19.045 15.047 ( -3.696 -6.810 -12.310) 14.546 15.196 ( 11.463 -1.637 14.497) 18.554 15.408 ( 8.575 -19.504 12.257) 24.580 15.879 ( 8.178 1.139 -10.828) 13.617 15.901 ( 7.650 -0.812 -10.327) 12.878 16.268 ( 2.458 1.084 -1.304) 2.986 16.376 ( 4.302 -8.917 -7.175) 12.227 17.129 ( -8.383 -0.378 6.974) 10.911 17.150 ( -7.889 -2.424 5.878) 10.132 19.074 ( -2.720 4.007 2.019) 5.247 19.105 ( -2.225 0.900 1.240) 2.702 19.393 ( -4.694 4.911 -0.401) 6.806 19.456 ( -4.880 -1.561 -2.854) 5.864 ======================= Grid point 282 (99/120) ======================= q-point: ( 0.33 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.297 ( 2.256 5.306 2.528) 6.295 2.346 ( 2.936 0.909 2.459) 3.936 2.560 ( -1.045 -2.976 5.051) 5.955 2.597 ( -3.214 -5.479 7.523) 9.847 2.671 ( 3.384 4.440 -5.459) 7.808 2.749 ( -0.168 -3.725 1.123) 3.895 3.044 ( -3.510 -1.845 -6.253) 7.405 3.070 ( -3.249 -4.834 -7.818) 9.749 3.403 ( 3.603 1.327 -2.364) 4.509 3.442 ( 1.364 -2.268 -2.078) 3.365 3.747 ( -1.793 -1.654 -3.362) 4.154 3.767 ( -2.432 -4.151 -4.654) 6.694 5.229 ( -5.883 2.698 8.057) 10.335 5.268 ( -7.853 -1.475 9.880) 12.707 5.711 ( -15.768 9.148 -13.303) 22.567 5.847 ( -18.741 -5.393 -16.052) 25.259 6.420 ( 7.024 24.407 5.538) 25.994 6.634 ( 3.763 12.274 -6.296) 14.298 6.851 ( 6.403 -6.823 9.259) 13.164 6.882 ( 8.563 -5.524 7.904) 12.897 7.249 ( 7.344 -0.141 -0.430) 7.358 7.320 ( 5.633 -6.283 -1.486) 8.568 7.525 ( 2.648 2.514 -0.519) 3.688 7.639 ( 3.746 -7.797 -3.284) 9.253 7.918 ( -1.618 -1.743 2.127) 3.190 7.969 ( -0.105 -5.875 1.057) 5.970 8.335 ( -7.752 3.794 2.321) 8.937 8.387 ( -8.011 -1.198 0.026) 8.101 9.521 ( 9.789 1.561 0.743) 9.941 9.552 ( 9.343 -1.567 -0.891) 9.516 9.960 ( 13.523 8.941 -1.226) 16.258 10.021 ( 14.013 4.718 -4.567) 15.475 10.353 ( -14.700 6.869 6.705) 17.557 10.435 ( -13.705 2.295 1.909) 14.026 10.750 ( -2.415 -8.220 7.497) 11.385 10.821 ( -0.426 -14.997 6.006) 16.160 12.092 ( 4.258 6.261 -1.601) 7.739 12.169 ( 11.444 3.552 1.064) 12.030 12.249 ( -0.491 11.399 -8.793) 14.405 12.330 ( 2.084 1.429 5.459) 6.015 12.410 ( 6.133 -0.927 -4.510) 7.670 12.583 ( 1.392 -14.490 -3.945) 15.081 13.106 ( -4.916 5.034 -1.188) 7.136 13.197 ( -0.844 -3.584 -5.580) 6.686 13.779 ( 9.520 16.302 2.620) 19.059 13.993 ( 4.400 -1.549 -3.708) 5.959 14.698 ( -3.527 4.662 -2.264) 6.270 14.926 ( -7.985 -15.755 -11.282) 20.959 15.476 ( 15.285 3.694 17.220) 23.320 15.617 ( 11.654 -12.117 13.165) 21.353 15.989 ( 2.912 -0.050 -2.361) 3.749 16.024 ( 3.162 -2.679 -5.468) 6.861 16.352 ( 5.995 5.117 -4.037) 8.856 16.471 ( 4.779 -6.477 -7.643) 11.100 16.938 ( -10.127 -2.423 6.681) 12.372 16.964 ( -10.240 -4.811 5.193) 12.449 19.039 ( -0.367 5.275 0.226) 5.292 19.077 ( -0.217 1.608 -0.847) 1.830 19.286 ( -5.712 4.356 -1.317) 7.303 19.343 ( -6.149 -1.318 -3.431) 7.163 ======================= Grid point 283 (100/120) ======================= q-point: ( 0.44 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( 2.570 6.202 3.954) 7.791 2.378 ( 0.056 5.120 2.919) 5.894 2.519 ( -1.276 -7.776 7.513) 10.888 2.540 ( -2.641 -7.240 5.421) 9.422 2.764 ( 5.042 6.255 -5.936) 9.990 2.794 ( 2.789 3.336 -2.658) 5.097 2.972 ( -3.251 -5.708 -7.513) 9.980 2.989 ( -4.280 -6.940 -6.228) 10.260 3.496 ( 3.967 2.449 -0.354) 4.676 3.500 ( 5.019 2.429 -1.207) 5.705 3.673 ( -3.656 -5.840 0.872) 6.945 3.702 ( -4.751 -8.239 -0.600) 9.530 5.226 ( 3.979 0.717 -1.531) 4.324 5.233 ( 6.454 -0.013 -2.932) 7.089 5.409 ( -13.051 3.938 -10.834) 17.413 5.476 ( -16.485 -3.356 -12.765) 21.118 6.569 ( 6.791 26.166 4.894) 27.472 6.662 ( -1.807 23.439 0.171) 23.509 6.953 ( 3.963 -10.449 6.057) 12.711 6.988 ( 1.380 -8.012 5.185) 9.642 7.380 ( 4.807 1.546 -0.751) 5.105 7.404 ( 2.928 0.845 -1.830) 3.555 7.544 ( 0.904 -7.639 1.004) 7.758 7.622 ( -4.790 -13.639 -2.481) 14.667 8.004 ( 8.555 0.931 4.041) 9.507 8.038 ( 6.451 -2.168 2.766) 7.346 8.174 ( -8.105 2.444 3.471) 9.149 8.211 ( -9.428 -0.570 1.621) 9.584 9.733 ( 11.163 2.029 0.842) 11.377 9.758 ( 11.004 -0.140 -0.177) 11.007 9.979 ( -9.733 1.770 2.135) 10.121 10.026 ( -12.868 -3.272 1.024) 13.317 10.280 ( 7.219 20.225 2.513) 21.621 10.340 ( 1.371 16.049 0.469) 16.114 10.720 ( 0.201 -17.414 6.575) 18.615 10.773 ( -3.787 -19.758 5.006) 20.731 12.150 ( 2.681 9.154 -4.731) 10.647 12.209 ( -2.774 11.084 -7.060) 13.431 12.333 ( 4.233 -9.584 -6.581) 12.373 12.393 ( 0.045 -4.325 -4.881) 6.522 12.565 ( 11.298 7.836 2.275) 13.936 12.695 ( 7.997 1.026 0.875) 8.110 12.915 ( -9.187 -0.411 4.055) 10.051 13.040 ( -12.395 -8.612 -0.211) 15.095 14.042 ( 12.859 22.569 -3.955) 26.274 14.143 ( 4.988 20.065 -8.292) 22.277 14.625 ( -1.041 -19.063 -2.613) 19.270 14.738 ( -9.891 -23.393 -7.789) 26.565 15.766 ( 12.403 4.437 13.104) 18.581 15.835 ( 8.299 -2.745 9.224) 12.708 15.985 ( -3.169 -3.029 4.718) 6.441 16.014 ( -3.664 -5.170 1.948) 6.629 16.489 ( 6.730 6.862 -2.365) 9.898 16.548 ( 1.996 2.040 -3.651) 4.634 16.759 ( -6.339 -8.574 3.609) 11.257 16.773 ( -7.274 -9.065 2.585) 11.907 19.064 ( 2.641 6.655 -1.871) 7.400 19.097 ( 1.272 4.898 -3.158) 5.965 19.183 ( -3.355 0.967 -1.483) 3.793 19.223 ( -5.371 -1.499 -3.157) 6.408 ======================= Grid point 315 (101/120) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( 0.000 0.000 -16.876) 16.876 2.430 ( 0.000 0.000 16.876) 16.876 2.533 ( 0.000 0.000 -16.616) 16.616 2.533 ( 0.000 0.000 16.616) 16.616 2.578 ( 0.000 0.000 -14.445) 14.445 2.578 ( 0.000 0.000 14.445) 14.445 3.148 ( 0.000 0.000 -6.792) 6.792 3.148 ( 0.000 0.000 6.792) 6.792 3.575 ( 0.000 0.000 -7.030) 7.030 3.575 ( 0.000 0.000 7.030) 7.030 4.331 ( 0.000 0.000 -12.152) 12.152 4.331 ( 0.000 0.000 12.152) 12.152 4.873 ( 0.000 0.000 -4.613) 4.613 4.873 ( 0.000 0.000 4.613) 4.613 6.130 ( 0.000 0.000 -15.873) 15.873 6.130 ( 0.000 0.000 15.873) 15.873 6.383 ( 0.000 0.000 -32.925) 32.925 6.383 ( 0.000 0.000 32.925) 32.925 6.827 ( 0.000 0.000 -8.778) 8.778 6.827 ( 0.000 0.000 8.778) 8.778 7.104 ( 0.000 0.000 -15.559) 15.559 7.104 ( 0.000 0.000 15.559) 15.559 7.295 ( 0.000 0.000 -5.152) 5.152 7.295 ( 0.000 0.000 5.152) 5.152 8.035 ( 0.000 0.000 -0.308) 0.308 8.035 ( 0.000 0.000 0.308) 0.308 8.971 ( 0.000 0.000 -0.459) 0.459 8.971 ( 0.000 0.000 0.459) 0.459 9.001 ( 0.000 0.000 -12.093) 12.093 9.001 ( 0.000 0.000 12.093) 12.093 9.329 ( 0.000 0.000 -1.574) 1.574 9.329 ( 0.000 0.000 1.574) 1.574 10.523 ( 0.000 0.000 -10.661) 10.661 10.523 ( 0.000 0.000 10.661) 10.661 11.284 ( 0.000 0.000 -0.285) 0.285 11.284 ( 0.000 0.000 0.285) 0.285 11.510 ( 0.000 0.000 -1.951) 1.951 11.510 ( 0.000 0.000 1.951) 1.951 12.053 ( 0.000 0.000 -17.634) 17.634 12.053 ( 0.000 0.000 17.634) 17.634 12.286 ( 0.000 0.000 -11.977) 11.977 12.286 ( 0.000 0.000 11.977) 11.977 13.198 ( 0.000 0.000 -12.472) 12.472 13.198 ( 0.000 0.000 12.472) 12.472 13.554 ( 0.000 0.000 -13.699) 13.699 13.554 ( 0.000 0.000 13.699) 13.699 14.478 ( 0.000 0.000 -26.694) 26.694 14.478 ( 0.000 0.000 26.694) 26.694 15.181 ( 0.000 0.000 -22.950) 22.950 15.181 ( 0.000 0.000 22.950) 22.950 16.557 ( 0.000 0.000 -1.760) 1.760 16.557 ( 0.000 0.000 1.760) 1.760 16.655 ( 0.000 0.000 -3.693) 3.693 16.655 ( 0.000 0.000 3.693) 3.693 17.255 ( 0.000 0.000 -0.214) 0.214 17.255 ( 0.000 0.000 0.214) 0.214 18.919 ( 0.000 0.000 -1.208) 1.208 18.919 ( 0.000 0.000 1.208) 1.208 19.451 ( 0.000 0.000 -6.217) 6.217 19.451 ( 0.000 0.000 6.217) 6.217 ======================= Grid point 317 (102/120) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( -5.959 0.000 -9.825) 11.491 2.317 ( -5.959 0.000 9.825) 11.491 2.577 ( 3.897 0.000 -15.425) 15.910 2.577 ( 3.897 0.000 15.425) 15.910 2.756 ( 11.498 0.000 -6.649) 13.282 2.756 ( 11.498 0.000 6.649) 13.282 3.113 ( -3.113 0.000 -6.318) 7.044 3.113 ( -3.113 0.000 6.318) 7.044 3.542 ( -2.869 0.000 -5.623) 6.312 3.542 ( -2.869 0.000 5.623) 6.312 4.307 ( -1.907 0.000 -9.926) 10.107 4.307 ( -1.907 0.000 9.926) 10.107 4.859 ( -1.390 0.000 -4.605) 4.810 4.859 ( -1.390 0.000 4.605) 4.810 6.057 ( -6.924 0.000 -18.413) 19.672 6.057 ( -6.924 0.000 18.413) 19.672 6.295 ( -8.635 0.000 -32.816) 33.933 6.295 ( -8.635 0.000 32.816) 33.933 6.825 ( 1.037 0.000 -10.519) 10.570 6.825 ( 1.037 0.000 10.519) 10.570 7.141 ( 3.718 0.000 -12.375) 12.922 7.141 ( 3.718 0.000 12.375) 12.922 7.396 ( 8.303 0.000 -5.943) 10.211 7.396 ( 8.303 0.000 5.943) 10.211 8.001 ( -3.277 0.000 -5.674) 6.552 8.001 ( -3.277 0.000 5.674) 6.552 8.923 ( -5.188 0.000 -2.115) 5.602 8.923 ( -5.188 0.000 2.115) 5.602 9.079 ( 7.179 0.000 -11.159) 13.269 9.079 ( 7.179 0.000 11.159) 13.269 9.332 ( 1.660 0.000 -3.180) 3.587 9.332 ( 1.660 0.000 3.180) 3.587 10.584 ( 4.227 0.000 -10.593) 11.405 10.584 ( 4.227 0.000 10.593) 11.405 11.369 ( 8.309 0.000 -3.447) 8.996 11.369 ( 8.309 0.000 3.447) 8.996 11.391 ( -8.081 0.000 -4.002) 9.018 11.391 ( -8.081 0.000 4.002) 9.018 12.011 ( -3.872 0.000 -16.766) 17.208 12.011 ( -3.872 0.000 16.766) 17.208 12.472 ( 15.090 0.000 -10.045) 18.127 12.472 ( 15.090 0.000 10.045) 18.127 13.169 ( -2.691 0.000 -12.134) 12.429 13.169 ( -2.691 0.000 12.134) 12.429 13.495 ( -5.539 0.000 -15.671) 16.621 13.495 ( -5.539 0.000 15.671) 16.621 14.576 ( 9.092 0.000 -28.295) 29.720 14.576 ( 9.092 0.000 28.295) 29.720 15.238 ( 5.657 0.000 -23.312) 23.989 15.238 ( 5.657 0.000 23.312) 23.989 16.540 ( -1.697 0.000 -4.964) 5.246 16.540 ( -1.697 0.000 4.964) 5.246 16.677 ( 2.154 0.000 -3.405) 4.030 16.677 ( 2.154 0.000 3.405) 4.030 17.253 ( -0.160 0.000 -0.655) 0.674 17.253 ( -0.160 0.000 0.655) 0.674 18.866 ( -5.154 0.000 -0.749) 5.209 18.866 ( -5.154 0.000 0.749) 5.209 19.417 ( -3.369 0.000 -6.165) 7.025 19.417 ( -3.369 0.000 6.165) 7.025 ======================= Grid point 319 (103/120) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -2.961 0.000 -9.063) 9.534 2.229 ( -2.961 0.000 9.063) 9.534 2.646 ( 1.170 0.000 -10.916) 10.978 2.646 ( 1.170 0.000 10.916) 10.978 2.943 ( 5.876 0.000 -5.787) 8.247 2.943 ( 5.876 0.000 5.787) 8.247 3.060 ( -0.545 0.000 -4.104) 4.140 3.060 ( -0.545 0.000 4.104) 4.140 3.484 ( -2.713 0.000 -1.709) 3.207 3.484 ( -2.713 0.000 1.709) 3.207 4.299 ( 2.698 0.000 -3.602) 4.501 4.299 ( 2.698 0.000 3.602) 4.501 4.817 ( -2.717 0.000 -4.588) 5.332 4.817 ( -2.717 0.000 4.588) 5.332 5.883 ( -9.529 0.000 -18.892) 21.160 5.883 ( -9.529 0.000 18.892) 21.160 6.054 ( -14.902 0.000 -29.349) 32.915 6.054 ( -14.902 0.000 29.349) 32.915 6.886 ( 4.738 0.000 -10.821) 11.813 6.886 ( 4.738 0.000 10.821) 11.813 7.245 ( 6.336 0.000 -6.759) 9.264 7.245 ( 6.336 0.000 6.759) 9.264 7.566 ( 7.795 0.000 -5.289) 9.420 7.566 ( 7.795 0.000 5.289) 9.420 7.910 ( -5.584 0.000 -8.206) 9.925 7.910 ( -5.584 0.000 8.206) 9.925 8.781 ( -7.814 0.000 -1.093) 7.890 8.781 ( -7.814 0.000 1.093) 7.890 9.254 ( 9.401 0.000 -8.767) 12.854 9.254 ( 9.401 0.000 8.767) 12.854 9.422 ( 6.877 0.000 -5.748) 8.963 9.422 ( 6.877 0.000 5.748) 8.963 10.595 ( -4.532 0.000 -6.853) 8.216 10.595 ( -4.532 0.000 6.853) 8.216 11.316 ( 1.882 0.000 -6.665) 6.925 11.316 ( 1.882 0.000 6.665) 6.925 11.596 ( 13.225 0.000 -7.608) 15.257 11.596 ( 13.225 0.000 7.608) 15.257 11.921 ( -4.110 0.000 -14.020) 14.610 11.921 ( -4.110 0.000 14.020) 14.610 12.778 ( 13.354 0.000 -10.618) 17.061 12.778 ( 13.354 0.000 10.618) 17.061 13.103 ( -3.162 0.000 -8.363) 8.941 13.103 ( -3.162 0.000 8.363) 8.941 13.344 ( -9.264 0.000 -16.183) 18.647 13.344 ( -9.264 0.000 16.183) 18.647 14.805 ( 12.762 0.000 -26.692) 29.586 14.805 ( 12.762 0.000 26.692) 29.586 15.406 ( 10.965 0.000 -23.618) 26.039 15.406 ( 10.965 0.000 23.618) 26.039 16.489 ( -3.423 0.000 -9.104) 9.726 16.489 ( -3.423 0.000 9.104) 9.726 16.738 ( 3.767 0.000 -2.732) 4.654 16.738 ( 3.767 0.000 2.732) 4.654 17.250 ( -0.047 0.000 -1.691) 1.692 17.250 ( -0.047 0.000 1.691) 1.692 18.727 ( -8.254 0.000 -0.793) 8.292 18.727 ( -8.254 0.000 0.793) 8.292 19.323 ( -5.740 0.000 -5.806) 8.164 19.323 ( -5.740 0.000 5.806) 8.164 ======================= Grid point 321 (104/120) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( -1.419 0.000 -7.358) 7.493 2.187 ( -1.419 0.000 7.358) 7.493 2.589 ( -5.626 0.000 -4.764) 7.372 2.589 ( -5.626 0.000 4.764) 7.372 2.990 ( -0.075 0.000 -5.682) 5.683 2.990 ( -0.075 0.000 5.682) 5.683 3.124 ( 5.707 0.000 -3.466) 6.677 3.124 ( 5.707 0.000 3.466) 6.677 3.423 ( -3.557 0.000 -2.127) 4.144 3.423 ( -3.557 0.000 2.127) 4.144 4.459 ( 13.182 0.000 -4.202) 13.836 4.459 ( 13.182 0.000 4.202) 13.836 4.758 ( -2.897 0.000 -3.973) 4.917 4.758 ( -2.897 0.000 3.973) 4.917 5.705 ( -7.604 0.000 -13.590) 15.573 5.705 ( -7.604 0.000 13.590) 15.573 5.712 ( -18.912 0.000 -23.796) 30.396 5.712 ( -18.912 0.000 23.796) 30.396 6.998 ( 5.858 0.000 -8.670) 10.464 6.998 ( 5.858 0.000 8.670) 10.464 7.379 ( 6.680 0.000 -1.933) 6.954 7.379 ( 6.680 0.000 1.933) 6.954 7.687 ( 3.980 0.000 -3.838) 5.529 7.687 ( 3.980 0.000 3.838) 5.529 7.788 ( -6.330 0.000 -8.268) 10.413 7.788 ( -6.330 0.000 8.268) 10.413 8.644 ( -5.441 0.000 -0.537) 5.468 8.644 ( -5.441 0.000 0.537) 5.468 9.426 ( 7.243 0.000 -5.579) 9.142 9.426 ( 7.243 0.000 5.579) 9.142 9.583 ( 8.543 0.000 -5.937) 10.404 9.583 ( 8.543 0.000 5.937) 10.404 10.436 ( -9.591 0.000 -2.123) 9.823 10.436 ( -9.591 0.000 2.123) 9.823 11.423 ( 6.803 0.000 -7.751) 10.313 11.423 ( 6.803 0.000 7.751) 10.313 11.752 ( -1.040 0.000 -8.413) 8.477 11.752 ( -1.040 0.000 8.413) 8.477 11.983 ( 13.039 0.000 -0.771) 13.062 11.983 ( 13.039 0.000 0.771) 13.062 12.904 ( -1.350 0.000 -17.628) 17.679 12.904 ( -1.350 0.000 17.628) 17.679 13.122 ( 5.663 0.000 -2.878) 6.352 13.122 ( 5.663 0.000 2.878) 6.352 13.135 ( -11.278 0.000 -13.765) 17.795 13.135 ( -11.278 0.000 13.765) 17.795 15.048 ( 10.542 0.000 -18.950) 21.685 15.048 ( 10.542 0.000 18.950) 21.685 15.663 ( 14.126 0.000 -22.324) 26.418 15.663 ( 14.126 0.000 22.324) 26.418 16.396 ( -6.070 0.000 -13.091) 14.430 16.396 ( -6.070 0.000 13.091) 14.430 16.820 ( 4.057 0.000 -1.904) 4.481 16.820 ( 4.057 0.000 1.904) 4.481 17.256 ( 0.620 0.000 -2.223) 2.308 17.256 ( 0.620 0.000 2.223) 2.308 18.557 ( -7.978 0.000 -1.486) 8.115 18.557 ( -7.978 0.000 1.486) 8.115 19.202 ( -5.823 0.000 -4.555) 7.392 19.202 ( -5.823 0.000 4.555) 7.392 ======================= Grid point 323 (105/120) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -0.523 0.000 -2.971) 3.016 2.168 ( -0.523 0.000 2.971) 3.016 2.488 ( -3.176 0.000 -1.458) 3.495 2.488 ( -3.176 0.000 1.458) 3.495 2.979 ( -0.511 0.000 -2.415) 2.469 2.979 ( -0.511 0.000 2.415) 2.469 3.224 ( 3.134 0.000 -1.625) 3.530 3.224 ( 3.134 0.000 1.625) 3.530 3.360 ( -1.997 0.000 -0.955) 2.214 3.360 ( -1.997 0.000 0.955) 2.214 4.714 ( -1.291 0.000 -1.689) 2.126 4.714 ( -1.291 0.000 1.689) 2.126 4.778 ( 15.973 0.000 -8.614) 18.147 4.778 ( 15.973 0.000 8.614) 18.147 5.327 ( -17.344 0.000 -15.071) 22.977 5.327 ( -17.344 0.000 15.071) 22.977 5.597 ( -2.887 0.000 -4.858) 5.651 5.597 ( -2.887 0.000 4.858) 5.651 7.094 ( 2.945 0.000 -3.508) 4.581 7.094 ( 2.945 0.000 3.508) 4.581 7.502 ( 5.023 0.000 -2.248) 5.503 7.502 ( 5.023 0.000 2.248) 5.503 7.668 ( -4.995 0.000 -5.549) 7.465 7.668 ( -4.995 0.000 5.549) 7.465 7.730 ( 0.726 0.000 -1.456) 1.627 7.730 ( 0.726 0.000 1.456) 1.627 8.571 ( -1.774 0.000 -0.383) 1.815 8.571 ( -1.774 0.000 0.383) 1.815 9.528 ( 2.679 0.000 -1.920) 3.296 9.528 ( 2.679 0.000 1.920) 3.296 9.731 ( 5.011 0.000 -2.926) 5.803 9.731 ( 5.011 0.000 2.926) 5.803 10.269 ( -5.561 0.000 -0.904) 5.634 10.269 ( -5.561 0.000 0.904) 5.634 11.532 ( 3.207 0.000 -3.616) 4.834 11.532 ( 3.207 0.000 3.616) 4.834 11.710 ( -1.442 0.000 -3.094) 3.413 11.710 ( -1.442 0.000 3.094) 3.413 12.247 ( 9.698 0.000 -3.366) 10.265 12.247 ( 9.698 0.000 3.366) 10.265 12.852 ( -2.017 0.000 -7.054) 7.337 12.852 ( -2.017 0.000 7.054) 7.337 12.925 ( -7.838 0.000 -7.132) 10.597 12.925 ( -7.838 0.000 7.132) 10.597 13.219 ( 2.699 0.000 -0.894) 2.843 13.219 ( 2.699 0.000 0.894) 2.843 15.199 ( 4.022 0.000 -6.822) 7.919 15.199 ( 4.022 0.000 6.822) 7.919 15.937 ( 11.603 0.000 -16.878) 20.482 15.937 ( 11.603 0.000 16.878) 20.482 16.246 ( -8.095 0.000 -13.842) 16.035 16.246 ( -8.095 0.000 13.842) 16.035 16.884 ( 1.893 0.000 -0.747) 2.035 16.884 ( 1.893 0.000 0.747) 2.035 17.271 ( 0.591 0.000 -1.102) 1.251 17.271 ( 0.591 0.000 1.102) 1.251 18.436 ( -3.481 0.000 -0.839) 3.581 18.436 ( -3.481 0.000 0.839) 3.581 19.112 ( -2.569 0.000 -1.813) 3.144 19.112 ( -2.569 0.000 1.813) 3.144 ======================= Grid point 333 (106/120) ======================= q-point: ( 0.00 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( 0.000 -10.544 -0.217) 10.547 2.257 ( 0.000 -10.544 0.217) 10.547 2.612 ( 0.000 7.366 -13.845) 15.682 2.612 ( 0.000 7.366 13.845) 15.682 2.711 ( 0.000 7.937 -0.648) 7.964 2.711 ( 0.000 7.937 0.648) 7.964 3.160 ( 0.000 -0.054 -5.322) 5.322 3.160 ( 0.000 -0.054 5.322) 5.322 3.454 ( 0.000 -10.738 -6.687) 12.650 3.454 ( 0.000 -10.738 6.687) 12.650 4.192 ( 0.000 -11.576 -11.193) 16.103 4.192 ( 0.000 -11.576 11.193) 16.103 5.099 ( 0.000 19.813 -5.501) 20.563 5.099 ( 0.000 19.813 5.501) 20.563 6.167 ( 0.000 3.715 -15.687) 16.121 6.167 ( 0.000 3.715 15.687) 16.121 6.412 ( 0.000 3.063 -31.281) 31.430 6.412 ( 0.000 3.063 31.281) 31.430 6.807 ( 0.000 -2.012 -7.756) 8.013 6.807 ( 0.000 -2.012 7.756) 8.013 7.071 ( 0.000 -3.517 -15.376) 15.773 7.071 ( 0.000 -3.517 15.376) 15.773 7.250 ( 0.000 -4.700 -6.685) 8.172 7.250 ( 0.000 -4.700 6.685) 8.172 8.131 ( 0.000 9.421 -0.337) 9.427 8.131 ( 0.000 9.421 0.337) 9.427 8.823 ( 0.000 -9.962 -3.872) 10.688 8.823 ( 0.000 -9.962 3.872) 10.688 9.049 ( 0.000 -0.373 -6.059) 6.071 9.049 ( 0.000 -0.373 6.059) 6.071 9.286 ( 0.000 -3.776 -1.478) 4.055 9.286 ( 0.000 -3.776 1.478) 4.055 10.563 ( 0.000 3.912 -9.524) 10.296 10.563 ( 0.000 3.912 9.524) 10.296 11.370 ( 0.000 8.184 -0.148) 8.185 11.370 ( 0.000 8.184 0.149) 8.185 11.492 ( 0.000 -1.720 -1.476) 2.267 11.492 ( 0.000 -1.720 1.476) 2.267 12.052 ( 0.000 0.776 -14.742) 14.762 12.052 ( 0.000 0.776 14.742) 14.762 12.325 ( 0.000 3.104 -8.212) 8.779 12.325 ( 0.000 3.104 8.212) 8.779 13.059 ( 0.000 -10.597 -8.108) 13.344 13.059 ( 0.000 -10.597 8.108) 13.344 13.736 ( 0.000 15.126 -18.405) 23.823 13.736 ( 0.000 15.126 18.405) 23.823 14.512 ( 0.000 3.196 -26.176) 26.371 14.512 ( 0.000 3.196 26.176) 26.371 15.181 ( 0.000 0.352 -22.149) 22.152 15.181 ( 0.000 0.352 22.149) 22.152 16.372 ( 0.000 -20.734 -1.265) 20.773 16.372 ( 0.000 -20.734 1.265) 20.773 16.544 ( 0.000 -6.877 -4.331) 8.127 16.544 ( 0.000 -6.877 4.331) 8.127 17.311 ( 0.000 3.696 -0.254) 3.705 17.311 ( 0.000 3.696 0.254) 3.705 18.986 ( 0.000 6.214 -0.305) 6.222 18.986 ( 0.000 6.214 0.305) 6.222 19.463 ( 0.000 1.138 -6.009) 6.116 19.463 ( 0.000 1.138 6.009) 6.116 ======================= Grid point 335 (107/120) ======================= q-point: ( 0.11 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( -1.908 -6.746 -5.133) 8.689 2.237 ( -1.908 -6.746 5.133) 8.689 2.574 ( 0.584 2.351 -13.951) 14.159 2.574 ( 0.584 2.351 13.951) 14.159 2.868 ( 9.808 7.935 -6.193) 14.054 2.868 ( 9.808 7.935 6.193) 14.054 3.131 ( -2.663 0.874 -4.928) 5.669 3.131 ( -2.663 0.874 4.928) 5.669 3.423 ( -2.452 -10.803 -5.081) 12.187 3.423 ( -2.452 -10.803 5.081) 12.187 4.160 ( -2.827 -12.012 -9.450) 15.543 4.160 ( -2.827 -12.012 9.450) 15.543 5.090 ( -0.975 20.041 -5.349) 20.765 5.090 ( -0.975 20.041 5.349) 20.765 6.089 ( -7.127 3.307 -18.324) 19.937 6.089 ( -7.127 3.307 18.324) 19.937 6.315 ( -9.524 1.885 -31.293) 32.764 6.315 ( -9.524 1.885 31.293) 32.764 6.803 ( 1.064 -1.955 -9.269) 9.533 6.803 ( 1.064 -1.955 9.269) 9.533 7.126 ( 5.062 -1.940 -11.100) 12.353 7.126 ( 5.062 -1.940 11.100) 12.353 7.354 ( 8.524 -4.163 -7.501) 12.094 7.354 ( 8.524 -4.163 7.501) 12.094 8.083 ( -4.209 7.658 -4.080) 9.643 8.083 ( -4.209 7.658 4.080) 9.643 8.794 ( -3.651 -10.070 -0.849) 10.745 8.794 ( -3.651 -10.070 0.849) 10.745 9.130 ( 7.852 2.421 -7.204) 10.927 9.130 ( 7.852 2.421 7.204) 10.927 9.309 ( 2.941 -2.049 -2.943) 4.637 9.309 ( 2.941 -2.049 2.943) 4.637 10.610 ( 3.284 2.744 -9.680) 10.584 10.610 ( 3.284 2.744 9.680) 10.584 11.335 ( -7.994 -3.016 -3.408) 9.199 11.335 ( -7.994 -3.016 3.408) 9.199 11.473 ( 6.321 7.539 -3.562) 10.464 11.473 ( 6.321 7.539 3.562) 10.464 12.041 ( -2.313 3.397 -15.983) 16.503 12.041 ( -2.313 3.397 15.983) 16.503 12.480 ( 13.438 0.403 -9.847) 16.665 12.480 ( 13.438 0.403 9.847) 16.665 13.038 ( -1.991 -9.891 -8.567) 13.236 13.038 ( -1.991 -9.891 8.567) 13.236 13.666 ( -6.429 13.950 -18.565) 24.096 13.666 ( -6.429 13.950 18.565) 24.096 14.610 ( 8.954 3.275 -27.610) 29.210 14.610 ( 8.954 3.275 27.610) 29.210 15.241 ( 5.929 0.617 -22.359) 23.140 15.241 ( 5.929 0.617 22.359) 23.140 16.379 ( 0.504 -19.218 -2.824) 19.431 16.379 ( 0.504 -19.218 2.824) 19.431 16.548 ( 0.538 -7.759 -5.319) 9.423 16.548 ( 0.538 -7.759 5.319) 9.423 17.300 ( -1.116 2.820 -0.679) 3.108 17.300 ( -1.116 2.820 0.679) 3.108 18.938 ( -4.552 6.769 -0.260) 8.161 18.938 ( -4.552 6.769 0.260) 8.161 19.430 ( -3.215 1.283 -5.941) 6.876 19.430 ( -3.215 1.283 5.941) 6.876 ======================= Grid point 337 (108/120) ======================= q-point: ( 0.22 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -1.450 -2.258 -6.996) 7.493 2.199 ( -1.450 -2.258 6.996) 7.493 2.625 ( 2.623 -1.229 -10.710) 11.095 2.625 ( 2.623 -1.229 10.710) 11.095 2.985 ( 0.101 2.824 -1.763) 3.331 2.985 ( 0.101 2.824 1.763) 3.331 3.091 ( 0.229 2.269 -5.543) 5.993 3.091 ( 0.229 2.269 5.543) 5.993 3.394 ( 0.052 -7.986 -1.498) 8.125 3.394 ( 0.052 -7.986 1.498) 8.125 4.117 ( -0.121 -13.967 -4.480) 14.669 4.117 ( -0.121 -13.967 4.480) 14.669 5.058 ( -2.091 19.741 -5.240) 20.531 5.058 ( -2.091 19.741 5.240) 20.531 5.913 ( -10.100 2.839 -17.734) 20.605 5.913 ( -10.100 2.839 17.734) 20.605 6.063 ( -14.264 1.246 -26.973) 30.537 6.063 ( -14.264 1.246 26.973) 30.537 6.869 ( 5.152 -1.226 -9.095) 10.525 6.869 ( 5.152 -1.226 9.095) 10.525 7.252 ( 6.873 -0.283 -5.278) 8.670 7.252 ( 6.873 -0.283 5.278) 8.670 7.525 ( 7.459 -3.208 -5.638) 9.885 7.525 ( 7.459 -3.208 5.638) 9.885 7.992 ( -4.157 6.901 -5.567) 9.793 7.992 ( -4.157 6.901 5.567) 9.793 8.682 ( -6.768 -8.999 -0.752) 11.285 8.682 ( -6.768 -8.999 0.752) 11.285 9.317 ( 9.404 5.118 -6.312) 12.428 9.317 ( 9.404 5.118 6.312) 12.428 9.420 ( 8.054 0.401 -6.591) 10.415 9.420 ( 8.054 0.401 6.591) 10.415 10.601 ( -5.840 0.805 -6.363) 8.674 10.601 ( -5.840 0.805 6.363) 8.674 11.240 ( 0.817 -6.908 -5.686) 8.984 11.240 ( 0.817 -6.908 5.686) 8.984 11.680 ( 13.065 7.309 -6.450) 16.301 11.680 ( 13.065 7.309 6.450) 16.301 11.969 ( -4.076 5.246 -13.105) 14.693 11.969 ( -4.076 5.246 13.105) 14.693 12.749 ( 10.132 -3.947 -12.610) 16.651 12.749 ( 10.132 -3.947 12.610) 16.651 13.001 ( -0.059 -5.976 -4.897) 7.726 13.001 ( -0.059 -5.976 4.897) 7.726 13.503 ( -9.307 12.580 -16.445) 22.700 13.503 ( -9.307 12.580 16.445) 22.700 14.828 ( 11.702 1.908 -25.558) 28.174 14.828 ( 11.702 1.908 25.558) 28.174 15.416 ( 11.320 1.234 -22.337) 25.072 15.416 ( 11.320 1.234 22.337) 25.072 16.380 ( -0.758 -13.942 -6.713) 15.493 16.380 ( -0.758 -13.942 6.713) 15.493 16.574 ( 2.151 -11.222 -5.973) 12.893 16.574 ( 2.151 -11.222 5.973) 12.893 17.268 ( -1.963 0.192 -1.553) 2.511 17.268 ( -1.963 0.192 1.553) 2.511 18.818 ( -6.966 8.471 -1.288) 11.043 18.818 ( -6.966 8.471 1.288) 11.043 19.340 ( -5.519 1.634 -5.573) 8.012 19.340 ( -5.519 1.634 5.573) 8.012 ======================= Grid point 339 (109/120) ======================= q-point: ( 0.33 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( -0.052 0.327 -5.963) 5.972 2.185 ( -0.052 0.327 5.963) 5.972 2.609 ( -4.355 1.428 -5.651) 7.276 2.609 ( -4.355 1.428 5.651) 7.276 2.964 ( -0.584 -2.276 -4.360) 4.953 2.964 ( -0.584 -2.276 4.360) 4.953 3.117 ( 2.013 -1.841 -5.722) 6.339 3.117 ( 2.013 -1.841 5.722) 6.339 3.394 ( -0.623 -2.080 -1.754) 2.792 3.394 ( -0.623 -2.080 1.754) 2.792 4.190 ( 7.023 -18.243 -2.640) 19.726 4.190 ( 7.023 -18.243 2.640) 19.726 5.022 ( -0.790 17.351 -4.090) 17.844 5.022 ( -0.790 17.351 4.090) 17.844 5.653 ( -16.250 -2.608 -17.836) 24.269 5.653 ( -16.250 -2.608 17.836) 24.269 5.825 ( -8.089 9.660 -15.507) 19.980 5.825 ( -8.089 9.660 15.507) 19.980 6.990 ( 6.366 -0.278 -6.881) 9.378 6.990 ( 6.366 -0.278 6.881) 9.378 7.376 ( 4.885 -1.610 -1.728) 5.426 7.376 ( 4.885 -1.610 1.728) 5.426 7.633 ( 3.460 -0.586 -3.133) 4.704 7.633 ( 3.460 -0.586 3.133) 4.704 7.931 ( -1.972 9.225 -4.764) 10.568 7.931 ( -1.972 9.225 4.764) 10.568 8.552 ( -5.653 -8.877 -0.272) 10.527 8.552 ( -5.653 -8.877 0.272) 10.527 9.486 ( 7.405 4.892 -3.706) 9.617 9.486 ( 7.405 4.892 3.706) 9.617 9.602 ( 9.077 3.218 -5.808) 11.246 9.602 ( 9.077 3.218 5.808) 11.246 10.413 ( -11.014 -2.066 -1.739) 11.340 10.413 ( -11.014 -2.066 1.739) 11.340 11.325 ( 5.488 -8.964 -7.211) 12.747 11.325 ( 5.488 -8.964 7.211) 12.747 11.858 ( -1.002 8.672 -5.049) 10.085 11.858 ( -1.002 8.672 5.049) 10.085 12.009 ( 13.472 3.762 -3.604) 14.445 12.009 ( 13.472 3.762 3.604) 14.445 12.791 ( -3.315 -9.708 -15.099) 18.254 12.791 ( -3.315 -9.708 15.099) 18.254 13.074 ( 2.496 0.335 -5.882) 6.399 13.074 ( 2.496 0.335 5.882) 6.399 13.332 ( -5.378 12.982 -8.294) 16.317 13.332 ( -5.378 12.982 8.294) 16.317 15.045 ( 9.246 -0.946 -17.790) 20.071 15.045 ( 9.246 -0.946 17.790) 20.071 15.678 ( 14.163 1.580 -20.982) 25.363 15.678 ( 14.163 1.580 20.982) 25.363 16.335 ( -3.962 -7.515 -11.230) 14.082 16.335 ( -3.962 -7.515 11.230) 14.082 16.631 ( 3.209 -14.975 -3.903) 15.805 16.631 ( 3.209 -14.975 3.903) 15.805 17.227 ( -1.894 -3.862 -1.893) 4.699 17.227 ( -1.894 -3.862 1.893) 4.699 18.681 ( -6.161 11.201 -1.844) 12.916 18.681 ( -6.161 11.201 1.844) 12.916 19.223 ( -5.671 1.966 -4.379) 7.429 19.223 ( -5.671 1.966 4.379) 7.429 ======================= Grid point 341 (110/120) ======================= q-point: ( 0.44 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 0.330 2.431 -2.406) 3.436 2.190 ( 0.330 2.431 2.406) 3.436 2.515 ( -3.248 2.610 -1.990) 4.617 2.515 ( -3.248 2.610 1.990) 4.617 2.957 ( -0.241 -2.528 -2.347) 3.458 2.957 ( -0.241 -2.528 2.347) 3.458 3.147 ( 0.511 -6.720 -2.258) 7.108 3.147 ( 0.511 -6.720 2.258) 7.108 3.389 ( 0.363 2.163 -0.690) 2.299 3.389 ( 0.363 2.163 0.690) 2.299 4.330 ( 4.817 -22.067 -2.519) 22.727 4.330 ( 4.817 -22.067 2.519) 22.727 5.068 ( 6.183 11.905 -3.066) 13.761 5.068 ( 6.183 11.905 3.066) 13.761 5.322 ( -14.838 -0.516 -12.923) 19.683 5.322 ( -14.838 -0.516 12.923) 19.683 5.721 ( -2.547 14.074 -5.174) 15.209 5.721 ( -2.547 14.074 5.174) 15.209 7.094 ( 3.183 0.200 -2.720) 4.192 7.094 ( 3.183 0.200 2.720) 4.192 7.435 ( 1.152 -4.625 -0.484) 4.791 7.435 ( 1.152 -4.625 0.484) 4.791 7.681 ( 1.482 3.830 -3.095) 5.142 7.681 ( 1.482 3.830 3.095) 5.142 7.903 ( -0.938 11.373 -2.871) 11.768 7.903 ( -0.938 11.373 2.871) 11.768 8.472 ( -2.107 -10.038 -0.309) 10.261 8.472 ( -2.107 -10.038 0.309) 10.261 9.598 ( 3.135 6.729 -1.352) 7.546 9.598 ( 3.135 6.729 1.352) 7.546 9.755 ( 5.262 3.262 -2.818) 6.803 9.755 ( 5.262 3.262 2.818) 6.803 10.220 ( -6.572 -4.672 -0.899) 8.113 10.220 ( -6.572 -4.672 0.899) 8.113 11.406 ( 2.056 -10.435 -3.270) 11.127 11.406 ( 2.056 -10.435 3.270) 11.127 11.833 ( -0.508 8.894 -1.859) 9.100 11.833 ( -0.508 8.894 1.859) 9.100 12.274 ( 9.589 3.826 -4.384) 11.216 12.274 ( 9.589 3.826 4.384) 11.216 12.715 ( -3.103 -9.779 -6.656) 12.229 12.715 ( -3.103 -9.779 6.656) 12.229 12.997 ( -5.548 3.378 -6.982) 9.536 12.997 ( -5.548 3.378 6.982) 9.536 13.332 ( 1.922 11.324 -0.226) 11.488 13.332 ( 1.922 11.324 0.226) 11.488 15.177 ( 3.500 -3.119 -6.368) 7.907 15.177 ( 3.500 -3.119 6.368) 7.907 15.948 ( 11.448 0.996 -16.374) 20.004 15.948 ( 11.448 0.996 16.374) 20.004 16.218 ( -7.191 -3.181 -13.226) 15.387 16.218 ( -7.191 -3.181 13.226) 15.387 16.684 ( 1.644 -16.775 -1.200) 16.898 16.684 ( 1.644 -16.775 1.200) 16.898 17.199 ( -0.778 -7.387 -0.939) 7.487 17.199 ( -0.778 -7.387 0.939) 7.487 18.591 ( -2.429 13.740 -0.937) 13.985 18.591 ( -2.429 13.740 0.937) 13.985 19.135 ( -2.537 2.080 -1.754) 3.720 19.135 ( -2.537 2.080 1.754) 3.720 ======================= Grid point 351 (111/120) ======================= q-point: ( 0.00 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( 0.000 -2.062 -3.550) 4.105 2.126 ( 0.000 -2.062 3.550) 4.105 2.752 ( 0.000 -0.873 -7.058) 7.112 2.752 ( 0.000 -0.873 7.058) 7.112 2.832 ( 0.000 8.929 -14.802) 17.287 2.832 ( 0.000 8.929 14.802) 17.287 3.091 ( 0.000 -4.279 -7.858) 8.948 3.091 ( 0.000 -4.279 7.858) 8.948 3.304 ( 0.000 -3.444 -10.058) 10.631 3.304 ( 0.000 -3.444 10.058) 10.631 3.945 ( 0.000 -14.027 -10.476) 17.507 3.945 ( 0.000 -14.027 10.476) 17.507 5.526 ( 0.000 23.579 -5.223) 24.151 5.526 ( 0.000 23.579 5.223) 24.151 6.263 ( 0.000 6.092 -14.768) 15.975 6.263 ( 0.000 6.092 14.768) 15.975 6.487 ( 0.000 4.077 -22.887) 23.248 6.487 ( 0.000 4.077 22.887) 23.248 6.763 ( 0.000 -1.994 -2.365) 3.093 6.763 ( 0.000 -1.994 2.365) 3.093 6.967 ( 0.000 -7.417 -11.018) 13.282 6.967 ( 0.000 -7.417 11.018) 13.282 7.120 ( 0.000 -8.670 -13.213) 15.804 7.120 ( 0.000 -8.670 13.213) 15.804 8.349 ( 0.000 12.196 -1.722) 12.317 8.349 ( 0.000 12.196 1.722) 12.317 8.637 ( 0.000 -8.497 -1.346) 8.603 8.637 ( 0.000 -8.497 1.346) 8.603 8.975 ( 0.000 -6.817 -4.004) 7.906 8.975 ( 0.000 -6.817 4.004) 7.906 9.219 ( 0.000 -2.824 -1.135) 3.044 9.219 ( 0.000 -2.824 1.135) 3.044 10.654 ( 0.000 5.088 -6.581) 8.319 10.654 ( 0.000 5.088 6.581) 8.319 11.439 ( 0.000 -2.425 -1.401) 2.800 11.439 ( 0.000 -2.425 1.401) 2.800 11.564 ( 0.000 9.964 -0.423) 9.973 11.564 ( 0.000 9.964 0.423) 9.973 12.108 ( 0.000 5.115 -10.023) 11.253 12.108 ( 0.000 5.115 10.023) 11.253 12.364 ( 0.000 0.183 -4.410) 4.414 12.364 ( 0.000 0.183 4.410) 4.414 12.870 ( 0.000 -8.347 -2.527) 8.721 12.870 ( 0.000 -8.347 2.527) 8.721 14.042 ( 0.000 15.357 -23.283) 27.892 14.042 ( 0.000 15.357 23.283) 27.892 14.587 ( 0.000 5.049 -24.377) 24.894 14.587 ( 0.000 5.049 24.377) 24.894 15.210 ( 0.000 2.808 -19.412) 19.614 15.210 ( 0.000 2.808 19.412) 19.614 15.898 ( 0.000 -26.663 -3.928) 26.950 15.898 ( 0.000 -26.663 3.928) 26.950 16.393 ( 0.000 -8.745 -2.295) 9.041 16.393 ( 0.000 -8.745 2.295) 9.041 17.357 ( 0.000 1.207 -0.338) 1.253 17.357 ( 0.000 1.207 0.338) 1.253 19.113 ( 0.000 6.112 -0.911) 6.180 19.113 ( 0.000 6.112 0.911) 6.180 19.492 ( 0.000 1.795 -4.848) 5.169 19.492 ( 0.000 1.795 4.848) 5.169 ======================= Grid point 353 (112/120) ======================= q-point: ( 0.11 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( 1.945 -0.934 -3.266) 3.915 2.149 ( 1.945 -0.934 3.266) 3.915 2.649 ( -4.368 3.065 -5.629) 7.756 2.649 ( -4.368 3.065 5.629) 7.756 2.950 ( 4.982 -2.826 -2.965) 6.450 2.950 ( 4.982 -2.826 2.965) 6.450 3.107 ( 1.087 -0.824 -9.554) 9.651 3.107 ( 1.087 -0.824 9.554) 9.651 3.271 ( -1.916 -1.956 -7.298) 7.795 3.271 ( -1.916 -1.956 7.298) 7.795 3.916 ( -2.559 -12.989 -9.176) 16.108 3.916 ( -2.559 -12.989 9.176) 16.108 5.516 ( -1.562 23.020 -5.345) 23.684 5.516 ( -1.562 23.020 5.345) 23.684 6.175 ( -7.612 5.475 -17.393) 19.760 6.175 ( -7.612 5.475 17.393) 19.760 6.354 ( -11.740 1.834 -26.205) 28.773 6.354 ( -11.740 1.834 26.205) 28.773 6.764 ( 1.892 -2.244 -6.979) 7.571 6.764 ( 1.892 -2.244 6.979) 7.571 7.063 ( 7.763 -4.229 -9.291) 12.825 7.063 ( 7.763 -4.229 9.291) 12.825 7.245 ( 10.026 -7.127 -12.787) 17.744 7.245 ( 10.026 -7.127 12.787) 17.744 8.227 ( -8.430 5.234 -0.499) 9.935 8.227 ( -8.430 5.234 0.499) 9.935 8.623 ( -3.076 -5.812 -2.411) 7.004 8.623 ( -3.076 -5.812 2.411) 7.004 9.140 ( 14.106 -1.023 -4.401) 14.812 9.140 ( 14.106 -1.023 4.401) 14.812 9.268 ( 4.930 -2.100 -1.779) 5.646 9.268 ( 4.930 -2.100 1.779) 5.646 10.682 ( 1.795 4.398 -7.162) 8.594 10.682 ( 1.795 4.398 7.162) 8.594 11.265 ( -12.715 -3.980 -2.226) 13.508 11.265 ( -12.715 -3.980 2.226) 13.508 11.643 ( 6.713 9.446 -1.576) 11.695 11.643 ( 6.713 9.446 1.576) 11.695 12.146 ( 0.840 7.350 -13.404) 15.310 12.146 ( 0.840 7.350 13.404) 15.310 12.458 ( 8.922 -3.394 -10.047) 13.859 12.458 ( 8.922 -3.394 10.047) 13.859 12.871 ( 0.627 -6.701 -4.624) 8.165 12.871 ( 0.627 -6.701 4.624) 8.165 13.945 ( -8.292 14.072 -21.214) 26.774 13.945 ( -8.292 14.072 21.214) 26.774 14.683 ( 7.937 4.211 -24.700) 26.283 14.683 ( 7.937 4.211 24.700) 26.283 15.275 ( 6.446 3.150 -19.451) 20.732 15.275 ( 6.446 3.150 19.451) 20.732 15.926 ( 2.756 -25.337 -3.558) 25.734 15.926 ( 2.756 -25.337 3.558) 25.734 16.396 ( 0.303 -8.481 -3.641) 9.235 16.396 ( 0.303 -8.481 3.641) 9.235 17.328 ( -2.918 0.307 -0.654) 3.006 17.328 ( -2.918 0.307 0.654) 3.006 19.077 ( -3.383 6.722 -1.286) 7.634 19.077 ( -3.383 6.722 1.286) 7.634 19.461 ( -2.978 1.885 -4.795) 5.951 19.461 ( -2.978 1.885 4.795) 5.951 ======================= Grid point 355 (113/120) ======================= q-point: ( 0.22 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( 1.830 2.088 -4.188) 5.025 2.188 ( 1.830 2.088 4.188) 5.025 2.615 ( 0.545 -0.244 -5.699) 5.731 2.615 ( 0.545 -0.244 5.699) 5.731 2.993 ( -0.353 -3.849 -5.492) 6.716 2.993 ( -0.353 -3.849 5.492) 6.716 3.050 ( -5.441 -6.609 -9.005) 12.425 3.050 ( -5.441 -6.609 9.005) 12.425 3.314 ( 4.593 2.014 -2.776) 5.732 3.314 ( 4.593 2.014 2.776) 5.732 3.866 ( -1.502 -11.436 -5.215) 12.658 3.866 ( -1.502 -11.436 5.215) 12.658 5.439 ( -6.290 18.138 -7.197) 20.502 5.439 ( -6.290 18.138 7.197) 20.502 5.955 ( -15.885 0.351 -15.092) 21.914 5.955 ( -15.885 0.351 15.092) 21.914 6.146 ( -5.338 9.120 -16.574) 19.656 6.146 ( -5.338 9.120 16.574) 19.656 6.853 ( 6.438 -0.720 -5.944) 8.792 6.853 ( 6.438 -0.720 5.944) 8.792 7.218 ( 6.832 -2.851 -6.322) 9.735 7.218 ( 6.832 -2.851 6.322) 9.735 7.457 ( 10.315 -4.394 -8.682) 14.180 7.457 ( 10.315 -4.394 8.682) 14.180 8.088 ( -4.896 0.868 -0.571) 5.006 8.088 ( -4.896 0.868 0.571) 5.006 8.523 ( -6.325 -5.143 -2.192) 8.442 8.523 ( -6.325 -5.143 2.192) 8.442 9.367 ( 7.795 0.075 -2.609) 8.221 9.367 ( 7.795 0.075 2.609) 8.221 9.484 ( 15.497 5.710 -6.584) 17.779 9.484 ( 15.497 5.710 6.584) 17.779 10.637 ( -8.586 3.384 -5.483) 10.734 10.637 ( -8.586 3.384 5.483) 10.734 11.083 ( -2.740 -9.254 -3.535) 10.278 11.083 ( -2.740 -9.254 3.535) 10.278 11.824 ( 10.846 7.351 -2.343) 13.310 11.824 ( 10.846 7.351 2.343) 13.310 12.122 ( -2.082 10.108 -11.261) 15.274 12.122 ( -2.082 10.108 11.261) 15.274 12.608 ( 3.042 -9.895 -12.870) 16.517 12.608 ( 3.042 -9.895 12.870) 16.517 12.947 ( 7.994 -0.316 -3.088) 8.576 12.947 ( 7.994 -0.316 3.088) 8.576 13.755 ( -9.756 13.217 -17.245) 23.817 13.755 ( -9.756 13.217 17.245) 23.817 14.847 ( 7.561 -0.685 -21.172) 22.492 14.847 ( 7.561 -0.685 21.172) 22.492 15.462 ( 11.821 3.733 -18.895) 22.598 15.462 ( 11.821 3.733 18.895) 22.598 16.002 ( 4.507 -21.334 -2.767) 21.980 16.002 ( 4.507 -21.334 2.767) 21.980 16.407 ( 0.851 -7.669 -6.211) 9.905 16.407 ( 0.851 -7.669 6.211) 9.905 17.242 ( -5.534 -2.397 -1.290) 6.167 17.242 ( -5.534 -2.397 1.290) 6.167 18.991 ( -4.738 8.431 -2.005) 9.877 18.991 ( -4.738 8.431 2.005) 9.877 19.377 ( -5.217 2.075 -4.541) 7.221 19.377 ( -5.217 2.075 4.541) 7.221 ======================= Grid point 357 (114/120) ======================= q-point: ( 0.33 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( 2.096 4.495 -4.086) 6.426 2.226 ( 2.096 4.495 4.086) 6.426 2.622 ( -1.118 -0.196 -3.634) 3.807 2.622 ( -1.118 -0.196 3.634) 3.807 2.907 ( -4.204 -4.392 -7.012) 9.281 2.907 ( -4.204 -4.392 7.012) 9.281 3.025 ( 0.070 -7.058 -7.812) 10.528 3.025 ( 0.070 -7.058 7.812) 10.528 3.381 ( 2.386 0.861 -2.281) 3.411 3.381 ( 2.386 0.861 2.281) 3.411 3.882 ( 2.897 -13.059 -2.081) 13.537 3.882 ( 2.897 -13.059 2.081) 13.537 5.291 ( -7.153 10.295 -8.142) 14.948 5.291 ( -7.153 10.295 8.143) 14.948 5.601 ( -17.534 -2.930 -16.773) 24.441 5.601 ( -17.534 -2.930 16.773) 24.441 6.111 ( 0.260 20.397 -10.783) 23.073 6.111 ( 0.260 20.397 10.783) 23.073 6.994 ( 6.890 0.244 -3.792) 7.869 6.994 ( 6.890 0.244 3.792) 7.869 7.323 ( 3.746 -2.992 -3.434) 5.897 7.323 ( 3.746 -2.992 3.434) 5.897 7.637 ( 7.266 -1.284 -5.595) 9.260 7.637 ( 7.266 -1.284 5.595) 9.260 8.037 ( -0.295 -0.455 -2.694) 2.748 8.037 ( -0.295 -0.455 2.694) 2.748 8.384 ( -7.232 -5.377 -1.848) 9.199 8.384 ( -7.232 -5.377 1.848) 9.199 9.533 ( 8.893 0.519 -1.866) 9.102 9.533 ( 8.893 0.519 1.866) 9.102 9.763 ( 11.463 12.209 -3.270) 17.064 9.763 ( 11.463 12.209 3.270) 17.064 10.382 ( -14.391 -0.264 -1.932) 14.523 10.382 ( -14.391 -0.264 1.932) 14.523 11.111 ( 3.047 -13.179 -5.809) 14.721 11.111 ( 3.047 -13.179 5.809) 14.721 11.984 ( 1.577 5.168 -2.205) 5.835 11.984 ( 1.577 5.168 2.205) 5.835 12.170 ( 10.305 10.979 -10.946) 18.616 12.170 ( 10.305 10.979 10.946) 18.616 12.593 ( -2.937 -10.155 -12.822) 16.618 12.593 ( -2.937 -10.155 12.822) 16.618 13.098 ( 2.961 1.585 -5.080) 6.090 13.098 ( 2.961 1.585 5.080) 6.090 13.604 ( -3.416 15.367 -10.057) 18.680 13.604 ( -3.416 15.367 10.057) 18.680 14.968 ( 4.351 -8.439 -13.778) 16.733 14.968 ( 4.351 -8.439 13.778) 16.733 15.723 ( 13.335 3.037 -16.591) 21.501 15.723 ( 13.335 3.037 16.591) 21.501 16.088 ( 3.386 -15.166 -4.344) 16.135 16.088 ( 3.386 -15.166 4.344) 16.135 16.429 ( 1.226 -6.153 -7.819) 10.025 16.429 ( 1.226 -6.153 7.819) 10.025 17.117 ( -6.480 -6.846 -1.462) 9.539 17.117 ( -6.480 -6.846 1.462) 9.539 18.905 ( -3.436 10.880 -2.224) 11.624 18.905 ( -3.436 10.880 2.224) 11.624 19.264 ( -5.620 2.067 -3.708) 7.044 19.264 ( -5.620 2.067 3.708) 7.044 ======================= Grid point 359 (115/120) ======================= q-point: ( 0.44 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( 1.548 5.948 -1.851) 6.419 2.268 ( 1.548 5.948 1.851) 6.419 2.574 ( -2.331 3.179 -1.947) 4.397 2.574 ( -2.331 3.179 1.947) 4.397 2.873 ( 0.099 -6.369 -3.748) 7.390 2.873 ( 0.099 -6.369 3.748) 7.390 3.004 ( -1.610 -7.859 -3.602) 8.794 3.004 ( -1.610 -7.859 3.602) 8.794 3.433 ( 2.220 2.579 -0.525) 3.443 3.433 ( 2.220 2.579 0.525) 3.443 3.944 ( 2.140 -17.613 -1.949) 17.849 3.944 ( 2.140 -17.613 1.949) 17.849 5.204 ( -0.372 3.775 -2.387) 4.482 5.204 ( -0.372 3.775 2.387) 4.482 5.307 ( -10.613 -1.094 -9.319) 14.166 5.307 ( -10.613 -1.094 9.319) 14.166 6.122 ( 0.392 26.369 -3.716) 26.633 6.122 ( 0.392 26.369 3.716) 26.633 7.099 ( 2.902 -0.292 -1.368) 3.222 7.099 ( 2.902 -0.292 1.368) 3.222 7.375 ( 1.422 -1.532 -0.725) 2.212 7.375 ( 1.422 -1.532 0.725) 2.212 7.735 ( 2.341 -1.112 -4.179) 4.918 7.735 ( 2.341 -1.112 4.179) 4.918 8.066 ( 2.467 3.601 -3.256) 5.446 8.066 ( 2.467 3.601 3.256) 5.446 8.251 ( -5.128 -9.179 -0.608) 10.532 8.251 ( -5.128 -9.179 0.608) 10.532 9.705 ( 6.924 3.306 -0.829) 7.718 9.705 ( 6.924 3.306 0.829) 7.718 9.929 ( 5.088 15.231 -0.958) 16.087 9.929 ( 5.088 15.231 0.958) 16.087 10.122 ( -10.081 -4.292 -1.630) 11.077 10.122 ( -10.081 -4.292 1.630) 11.077 11.156 ( 1.123 -15.996 -2.911) 16.297 11.156 ( 1.123 -15.996 2.911) 16.297 11.980 ( -0.342 6.533 -0.952) 6.610 11.980 ( -0.342 6.533 0.952) 6.610 12.412 ( 10.404 7.116 -6.634) 14.244 12.412 ( 10.404 7.116 6.634) 14.244 12.529 ( -3.081 -6.378 -8.378) 10.971 12.529 ( -3.081 -6.378 8.378) 10.971 13.031 ( -5.810 0.068 -5.956) 8.321 13.031 ( -5.810 0.068 5.956) 8.321 13.623 ( 2.436 18.893 -2.224) 19.179 13.623 ( 2.436 18.893 2.224) 19.179 15.024 ( 1.328 -14.670 -4.807) 15.494 15.024 ( 1.328 -14.670 4.807) 15.494 15.956 ( 8.552 -0.721 -11.046) 13.988 15.956 ( 8.552 -0.721 11.046) 13.988 16.112 ( -1.164 -7.247 -6.290) 9.666 16.112 ( -1.164 -7.247 6.290) 9.666 16.449 ( 0.589 -4.437 -4.049) 6.035 16.449 ( 0.589 -4.437 4.049) 6.035 17.011 ( -3.233 -11.681 -0.652) 12.137 17.011 ( -3.233 -11.681 0.652) 12.137 18.861 ( -0.981 13.142 -1.093) 13.224 18.861 ( -0.981 13.142 1.093) 13.224 19.174 ( -2.695 1.594 -1.594) 3.513 19.174 ( -2.695 1.594 1.594) 3.513 ======================= Grid point 369 (116/120) ======================= q-point: ( 0.00 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( 0.000 6.969 -4.094) 8.082 2.187 ( 0.000 6.969 4.094) 8.082 2.546 ( 0.000 -13.152 -6.639) 14.733 2.546 ( 0.000 -13.152 6.639) 14.733 3.037 ( 0.000 8.809 -3.943) 9.651 3.037 ( 0.000 8.809 3.943) 9.651 3.104 ( 0.000 1.728 -3.011) 3.472 3.104 ( 0.000 1.728 3.011) 3.472 3.270 ( 0.000 -0.232 -6.941) 6.945 3.270 ( 0.000 -0.232 6.941) 6.945 3.696 ( 0.000 -9.963 -6.994) 12.173 3.696 ( 0.000 -9.963 6.994) 12.173 5.917 ( 0.000 14.304 -2.646) 14.547 5.917 ( 0.000 14.304 2.646) 14.547 6.377 ( 0.000 4.871 -9.713) 10.866 6.377 ( 0.000 4.871 9.713) 10.866 6.524 ( 0.000 -0.591 -2.082) 2.164 6.524 ( 0.000 -0.591 2.082) 2.164 6.740 ( 0.000 -2.811 -3.795) 4.722 6.740 ( 0.000 -2.811 3.795) 4.722 6.838 ( 0.000 -1.165 -8.552) 8.631 6.838 ( 0.000 -1.165 8.552) 8.631 6.949 ( 0.000 -8.329 -20.915) 22.512 6.949 ( 0.000 -8.329 20.915) 22.512 8.482 ( 0.000 -1.289 -2.530) 2.839 8.482 ( 0.000 -1.289 2.530) 2.839 8.609 ( 0.000 8.319 -2.119) 8.584 8.609 ( 0.000 8.319 2.119) 8.584 8.821 ( 0.000 -8.550 -2.102) 8.804 8.821 ( 0.000 -8.550 2.102) 8.804 9.181 ( 0.000 -1.080 -0.393) 1.149 9.181 ( 0.000 -1.080 0.393) 1.149 10.730 ( 0.000 2.355 -2.390) 3.355 10.730 ( 0.000 2.355 2.390) 3.355 11.399 ( 0.000 -1.342 -0.350) 1.387 11.399 ( 0.000 -1.342 0.350) 1.387 11.720 ( 0.000 5.169 -1.216) 5.310 11.720 ( 0.000 5.169 1.216) 5.310 12.213 ( 0.000 4.438 -1.594) 4.715 12.213 ( 0.000 4.438 1.594) 4.715 12.329 ( 0.000 -2.892 -0.392) 2.918 12.329 ( 0.000 -2.892 0.392) 2.918 12.766 ( 0.000 -2.536 -0.398) 2.567 12.766 ( 0.000 -2.536 0.399) 2.567 14.238 ( 0.000 4.401 -12.226) 12.994 14.238 ( 0.000 4.401 12.226) 12.994 14.745 ( 0.000 10.658 -13.182) 16.951 14.745 ( 0.000 10.658 13.182) 16.951 15.250 ( 0.000 -1.383 -18.531) 18.583 15.250 ( 0.000 -1.383 18.531) 18.583 15.459 ( 0.000 -14.670 -11.213) 18.465 15.459 ( 0.000 -14.670 11.213) 18.465 16.251 ( 0.000 -4.814 -0.741) 4.871 16.251 ( 0.000 -4.814 0.741) 4.871 17.367 ( 0.000 0.140 -0.155) 0.209 17.367 ( 0.000 0.140 0.155) 0.209 19.194 ( 0.000 2.200 -0.602) 2.281 19.194 ( 0.000 2.200 0.602) 2.281 19.521 ( 0.000 0.983 -1.917) 2.155 19.521 ( 0.000 0.983 1.917) 2.155 ======================= Grid point 371 (117/120) ======================= q-point: ( 0.11 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( 2.736 6.706 -3.638) 8.105 2.216 ( 2.736 6.706 3.638) 8.105 2.549 ( 0.359 -10.763 -5.825) 12.243 2.549 ( 0.359 -10.763 5.825) 12.243 2.956 ( -4.654 6.020 -10.634) 13.076 2.956 ( -4.654 6.020 10.634) 13.076 3.079 ( -4.528 -4.505 -5.343) 8.328 3.079 ( -4.528 -4.505 5.343) 8.328 3.321 ( 4.089 4.613 -3.611) 7.144 3.321 ( 4.089 4.613 3.611) 7.144 3.699 ( 0.205 -8.233 -6.249) 10.338 3.699 ( 0.205 -8.233 6.249) 10.338 5.880 ( -5.119 12.359 -3.359) 13.792 5.880 ( -5.119 12.359 3.359) 13.792 6.268 ( -11.458 2.709 -8.004) 14.237 6.268 ( -11.458 2.709 8.004) 14.237 6.391 ( -7.391 2.981 -11.420) 13.926 6.391 ( -7.391 2.981 11.420) 13.926 6.695 ( 2.234 -4.961 -3.092) 6.258 6.695 ( 2.234 -4.961 3.092) 6.258 7.007 ( 9.756 -0.533 -11.641) 15.198 7.007 ( 9.756 -0.533 11.641) 15.198 7.110 ( 12.407 -5.701 -14.386) 19.835 7.110 ( 12.407 -5.701 14.386) 19.835 8.241 ( -13.129 -1.614 -0.941) 13.262 8.241 ( -13.129 -1.614 0.941) 13.262 8.609 ( -3.723 1.930 -2.533) 4.899 8.609 ( -3.723 1.930 2.533) 4.899 9.113 ( 21.870 -1.235 -2.401) 22.036 9.113 ( 21.870 -1.235 2.401) 22.036 9.236 ( 5.134 -1.025 -0.770) 5.292 9.236 ( 5.134 -1.025 0.770) 5.292 10.754 ( 1.945 2.488 -2.856) 4.258 10.754 ( 1.945 2.488 2.856) 4.258 11.202 ( -15.933 -2.152 -0.733) 16.094 11.202 ( -15.933 -2.152 0.733) 16.094 11.796 ( 6.135 5.389 -0.804) 8.206 11.796 ( 6.135 5.389 0.804) 8.206 12.280 ( 3.369 5.363 -6.422) 9.020 12.280 ( 3.369 5.363 6.422) 9.020 12.363 ( 3.705 -5.064 -6.644) 9.138 12.363 ( 3.705 -5.064 6.644) 9.138 12.795 ( 3.869 -1.712 -2.418) 4.873 12.795 ( 3.869 -1.712 2.418) 4.873 14.143 ( -8.217 5.539 -11.621) 15.273 14.143 ( -8.217 5.539 11.621) 15.273 14.780 ( 2.280 5.321 -13.160) 14.377 14.780 ( 2.280 5.321 13.160) 14.377 15.340 ( 8.292 2.313 -19.565) 21.375 15.340 ( 8.292 2.313 19.565) 21.375 15.516 ( 5.724 -14.426 -13.230) 20.394 15.516 ( 5.724 -14.426 13.230) 20.394 16.258 ( 0.784 -4.654 -1.419) 4.928 16.258 ( 0.784 -4.654 1.419) 4.928 17.325 ( -4.169 -0.221 -0.280) 4.184 17.325 ( -4.169 -0.221 0.280) 4.184 19.167 ( -2.522 2.465 -0.765) 3.609 19.167 ( -2.522 2.465 0.765) 3.609 19.491 ( -2.911 0.990 -1.916) 3.623 19.491 ( -2.911 0.990 1.916) 3.623 ======================= Grid point 373 (118/120) ======================= q-point: ( 0.22 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 3.378 6.408 -2.874) 7.793 2.281 ( 3.378 6.408 2.874) 7.793 2.562 ( 1.076 -5.882 -3.693) 7.028 2.562 ( 1.076 -5.882 3.693) 7.028 2.892 ( -2.517 -1.045 -12.673) 12.963 2.892 ( -2.517 -1.045 12.673) 12.963 2.957 ( -5.618 -4.586 -10.302) 12.598 2.957 ( -5.618 -4.586 10.302) 12.598 3.384 ( 1.689 3.221 -3.535) 5.072 3.384 ( 1.689 3.221 3.535) 5.072 3.705 ( 0.475 -5.004 -3.431) 6.086 3.705 ( 0.475 -5.004 3.431) 6.086 5.685 ( -12.952 7.146 -7.000) 16.365 5.685 ( -12.952 7.146 7.000) 16.365 5.931 ( -19.723 -1.842 -10.402) 22.374 5.931 ( -19.723 -1.842 10.402) 22.374 6.385 ( 5.170 12.340 -6.684) 14.956 6.385 ( 5.170 12.340 6.684) 14.956 6.810 ( 7.707 -4.053 -1.552) 8.845 6.810 ( 7.707 -4.053 1.552) 8.845 7.170 ( 6.478 -1.616 -5.759) 8.817 7.170 ( 6.478 -1.616 5.759) 8.817 7.367 ( 12.083 -3.710 -6.679) 14.296 7.367 ( 12.083 -3.710 6.679) 14.296 8.035 ( -7.224 -3.352 -0.887) 8.013 8.035 ( -7.224 -3.352 0.887) 8.013 8.505 ( -6.108 1.064 -1.647) 6.415 8.505 ( -6.108 1.064 1.647) 6.415 9.362 ( 7.655 -0.238 -1.044) 7.729 9.362 ( 7.655 -0.238 1.044) 7.729 9.571 ( 22.088 2.619 -2.225) 22.354 9.571 ( 22.089 2.619 2.225) 22.354 10.738 ( -9.138 7.197 -3.732) 12.216 10.738 ( -9.138 7.197 3.732) 12.216 10.901 ( -7.833 -9.479 -0.906) 12.330 10.901 ( -7.833 -9.479 0.906) 12.330 11.950 ( 8.950 4.972 -0.796) 10.269 11.950 ( 8.950 4.972 0.796) 10.269 12.280 ( -2.242 4.166 -4.463) 6.504 12.280 ( -2.242 4.166 4.463) 6.504 12.441 ( 2.672 -5.338 -6.849) 9.086 12.441 ( 2.672 -5.338 6.849) 9.086 12.953 ( 11.033 0.355 -1.531) 11.144 12.953 ( 11.033 0.355 1.531) 11.144 13.963 ( -8.406 7.047 -9.908) 14.782 13.963 ( -8.406 7.047 9.908) 14.782 14.800 ( -0.706 -2.995 -10.113) 10.571 14.800 ( -0.706 -2.995 10.113) 10.571 15.548 ( 11.733 4.990 -18.114) 22.151 15.548 ( 11.733 4.990 18.114) 22.151 15.682 ( 10.219 -11.074 -12.825) 19.787 15.682 ( 10.219 -11.074 12.825) 19.787 16.286 ( 2.138 -4.058 -2.679) 5.311 16.286 ( 2.138 -4.058 2.679) 5.311 17.202 ( -8.088 -1.317 -0.537) 8.213 17.202 ( -8.088 -1.317 0.537) 8.213 19.106 ( -3.202 3.191 -1.077) 4.647 19.106 ( -3.202 3.191 1.077) 4.647 19.408 ( -5.216 0.973 -1.886) 5.631 19.408 ( -5.216 0.973 1.886) 5.631 ======================= Grid point 375 (119/120) ======================= q-point: ( 0.33 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( 3.264 6.721 -2.531) 7.889 2.346 ( 3.264 6.721 2.531) 7.889 2.595 ( 1.881 -2.865 -1.770) 3.858 2.595 ( 1.881 -2.865 1.770) 3.858 2.788 ( -5.542 -5.710 -3.261) 8.599 2.788 ( -5.542 -5.710 3.261) 8.599 2.927 ( -0.374 -2.448 -1.185) 2.745 2.927 ( -0.374 -2.448 1.185) 2.745 3.407 ( 1.974 1.203 -1.653) 2.842 3.407 ( 1.974 1.203 1.653) 2.842 3.716 ( 0.165 -4.421 -0.521) 4.455 3.716 ( 0.165 -4.421 0.521) 4.455 5.425 ( -11.860 4.220 -8.935) 15.437 5.425 ( -11.860 4.220 8.935) 15.437 5.545 ( -17.449 -2.622 -11.574) 21.102 5.545 ( -17.449 -2.622 11.574) 21.102 6.524 ( 7.439 19.067 -5.409) 21.169 6.524 ( 7.439 19.067 5.409) 21.169 6.958 ( 6.024 -5.079 -0.955) 7.937 6.958 ( 6.024 -5.079 0.955) 7.937 7.279 ( 4.954 -1.465 -2.966) 5.957 7.279 ( 4.954 -1.465 2.966) 5.957 7.552 ( 5.252 -5.500 -4.189) 8.682 7.552 ( 5.252 -5.500 4.189) 8.682 7.964 ( 0.675 -3.187 -1.723) 3.685 7.964 ( 0.675 -3.187 1.723) 3.685 8.371 ( -7.263 1.139 -1.465) 7.496 8.371 ( -7.263 1.139 1.465) 7.496 9.535 ( 9.680 -0.030 -0.851) 9.717 9.535 ( 9.680 -0.030 0.851) 9.717 9.961 ( 15.298 6.148 -1.565) 16.562 9.961 ( 15.298 6.148 1.565) 16.562 10.436 ( -15.074 5.468 -2.029) 16.163 10.436 ( -15.074 5.468 2.029) 16.163 10.857 ( -1.508 -11.350 -2.492) 11.718 10.857 ( -1.508 -11.350 2.492) 11.718 12.100 ( 3.452 6.982 -3.633) 8.594 12.100 ( 3.452 6.982 3.633) 8.594 12.260 ( 1.890 -4.183 -6.709) 8.129 12.260 ( 1.890 -4.183 6.709) 8.129 12.488 ( 4.004 0.679 -6.929) 8.032 12.488 ( 4.004 0.679 6.929) 8.032 13.120 ( 1.857 0.627 -2.228) 2.967 13.120 ( 1.857 0.627 2.228) 2.967 13.882 ( 2.569 11.407 -7.010) 13.633 13.882 ( 2.569 11.407 7.010) 13.633 14.744 ( -4.784 -11.275 -6.781) 14.000 14.744 ( -4.784 -11.275 6.781) 14.000 15.782 ( 10.726 2.658 -9.643) 14.666 15.782 ( 10.726 2.658 9.643) 14.666 15.885 ( 8.891 -5.657 -5.147) 11.728 15.885 ( 8.891 -5.657 5.147) 11.728 16.354 ( 4.887 -2.039 -3.865) 6.556 16.354 ( 4.887 -2.039 3.865) 6.556 17.009 ( -10.763 -3.444 -0.635) 11.319 17.009 ( -10.763 -3.444 0.635) 11.319 19.056 ( -1.404 4.333 -1.263) 4.727 19.056 ( -1.404 4.333 1.263) 4.727 19.291 ( -6.160 0.684 -1.737) 6.436 19.291 ( -6.160 0.684 1.737) 6.436 ======================= Grid point 377 (120/120) ======================= q-point: ( 0.44 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( 2.761 8.544 -1.482) 9.100 2.412 ( 2.761 8.544 1.482) 9.100 2.599 ( -1.721 -2.825 -0.764) 3.395 2.599 ( -1.721 -2.825 0.764) 3.395 2.749 ( 2.178 -3.751 -3.230) 5.408 2.749 ( 2.178 -3.751 3.230) 5.408 2.874 ( -4.247 -4.805 -2.093) 6.746 2.874 ( -4.247 -4.805 2.093) 6.746 3.492 ( 5.169 3.318 -0.083) 6.142 3.492 ( 5.169 3.318 0.083) 6.142 3.691 ( -2.470 -8.377 -0.756) 8.767 3.691 ( -2.470 -8.377 0.756) 8.767 5.251 ( -4.435 1.685 -4.481) 6.526 5.251 ( -4.435 1.685 4.481) 6.526 5.283 ( -7.652 -1.334 -6.451) 10.097 5.283 ( -7.652 -1.334 6.451) 10.097 6.642 ( 3.495 25.821 -2.463) 26.173 6.642 ( 3.495 25.821 2.463) 26.173 7.030 ( 1.420 -9.229 -1.263) 9.423 7.030 ( 1.420 -9.229 1.263) 9.423 7.377 ( 4.028 1.653 -0.663) 4.404 7.377 ( 4.028 1.653 0.663) 4.404 7.572 ( -1.608 -11.694 -2.212) 12.010 7.572 ( -1.608 -11.694 2.212) 12.010 8.056 ( 7.300 -0.396 -1.047) 7.385 8.056 ( 7.300 -0.396 1.047) 7.385 8.217 ( -8.015 0.917 -0.961) 8.124 8.217 ( -8.015 0.917 0.961) 8.124 9.747 ( 11.031 1.275 -0.738) 11.129 9.747 ( 11.031 1.275 0.738) 11.129 10.014 ( -10.049 -2.279 -1.562) 10.422 10.014 ( -10.049 -2.279 1.562) 10.422 10.330 ( 4.205 20.302 -1.801) 20.811 10.330 ( 4.205 20.302 1.801) 20.811 10.809 ( -2.471 -19.301 -1.722) 19.535 10.809 ( -2.471 -19.301 1.722) 19.535 12.111 ( -0.258 7.943 -1.646) 8.116 12.111 ( -0.258 7.943 1.646) 8.116 12.287 ( -0.043 -10.221 -2.651) 10.560 12.287 ( -0.043 -10.221 2.651) 10.560 12.664 ( 11.612 8.195 -4.508) 14.911 12.664 ( 11.612 8.195 4.508) 14.911 13.003 ( -10.351 -2.312 -3.771) 11.256 13.003 ( -10.351 -2.312 3.771) 11.256 14.031 ( 7.809 22.404 -2.915) 23.905 14.031 ( 7.809 22.404 2.915) 23.905 14.630 ( -5.073 -23.388 -3.157) 24.139 14.630 ( -5.073 -23.388 3.157) 24.139 15.944 ( 4.716 0.610 -1.987) 5.154 15.944 ( 4.716 0.610 1.987) 5.154 16.005 ( 2.775 -3.855 -1.757) 5.065 16.005 ( 2.775 -3.855 1.757) 5.065 16.481 ( 6.773 4.805 -2.284) 8.613 16.481 ( 6.773 4.805 2.284) 8.613 16.797 ( -8.962 -9.032 -0.330) 12.728 16.797 ( -8.962 -9.032 0.330) 12.728 19.055 ( 1.061 6.606 -0.971) 6.761 19.055 ( 1.061 6.606 0.971) 6.761 19.180 ( -4.106 -0.999 -1.137) 4.376 19.180 ( -4.106 -0.999 1.137) 4.376 =================== 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 3/37800 10.0 2759.687 3936.750 3804.097 0.000 0.000 -0.000 3/37800 20.0 596.291 642.827 534.958 0.000 0.000 -0.000 3/37800 30.0 243.670 261.734 217.094 0.000 0.000 -0.000 3/37800 40.0 136.923 150.037 124.231 0.000 0.000 -0.000 3/37800 50.0 87.206 97.818 81.081 0.000 0.000 -0.000 3/37800 60.0 60.446 69.084 57.365 0.000 0.000 -0.000 3/37800 70.0 44.697 51.745 43.083 0.000 0.000 -0.000 3/37800 80.0 34.742 40.539 33.868 0.000 0.000 -0.000 3/37800 90.0 28.066 32.893 27.583 0.000 0.000 -0.000 3/37800 100.0 23.365 27.440 23.097 0.000 0.000 -0.000 3/37800 110.0 19.920 23.410 19.774 0.000 0.000 -0.000 3/37800 120.0 17.311 20.341 17.238 0.000 0.000 -0.000 3/37800 130.0 15.281 17.944 15.251 0.000 0.000 -0.000 3/37800 140.0 13.664 16.032 13.662 0.000 0.000 -0.000 3/37800 150.0 12.350 14.479 12.367 0.000 0.000 -0.000 3/37800 160.0 11.265 13.195 11.294 0.000 0.000 -0.000 3/37800 170.0 10.356 12.120 10.393 0.000 0.000 -0.000 3/37800 180.0 9.584 11.208 9.627 0.000 0.000 -0.000 3/37800 190.0 8.920 10.425 8.968 0.000 0.000 -0.000 3/37800 200.0 8.345 9.747 8.396 0.000 0.000 -0.000 3/37800 210.0 7.841 9.153 7.895 0.000 0.000 -0.000 3/37800 220.0 7.396 8.630 7.452 0.000 0.000 -0.000 3/37800 230.0 7.001 8.165 7.058 0.000 0.000 -0.000 3/37800 240.0 6.647 7.750 6.705 0.000 0.000 -0.000 3/37800 250.0 6.328 7.376 6.387 0.000 0.000 -0.000 3/37800 260.0 6.040 7.038 6.099 0.000 0.000 -0.000 3/37800 270.0 5.778 6.731 5.837 0.000 0.000 -0.000 3/37800 280.0 5.538 6.451 5.598 0.000 0.000 -0.000 3/37800 290.0 5.319 6.194 5.378 0.000 0.000 -0.000 3/37800 300.0 5.116 5.957 5.176 0.000 0.000 -0.000 3/37800 310.0 4.930 5.739 4.989 0.000 0.000 -0.000 3/37800 320.0 4.756 5.537 4.815 0.000 0.000 -0.000 3/37800 330.0 4.595 5.349 4.653 0.000 0.000 -0.000 3/37800 340.0 4.445 5.173 4.503 0.000 0.000 -0.000 3/37800 350.0 4.305 5.010 4.362 0.000 0.000 -0.000 3/37800 360.0 4.173 4.857 4.230 0.000 0.000 -0.000 3/37800 370.0 4.050 4.713 4.106 0.000 0.000 -0.000 3/37800 380.0 3.934 4.577 3.990 0.000 0.000 -0.000 3/37800 390.0 3.825 4.450 3.880 0.000 0.000 -0.000 3/37800 400.0 3.721 4.330 3.776 0.000 0.000 -0.000 3/37800 410.0 3.624 4.216 3.677 0.000 0.000 -0.000 3/37800 420.0 3.531 4.108 3.584 0.000 0.000 -0.000 3/37800 430.0 3.443 4.006 3.496 0.000 0.000 -0.000 3/37800 440.0 3.360 3.908 3.412 0.000 0.000 -0.000 3/37800 450.0 3.281 3.816 3.332 0.000 0.000 -0.000 3/37800 460.0 3.205 3.728 3.255 0.000 0.000 -0.000 3/37800 470.0 3.133 3.644 3.182 0.000 0.000 -0.000 3/37800 480.0 3.064 3.564 3.113 0.000 0.000 -0.000 3/37800 490.0 2.998 3.487 3.046 0.000 0.000 -0.000 3/37800 500.0 2.935 3.414 2.983 0.000 0.000 -0.000 3/37800 510.0 2.875 3.343 2.922 0.000 0.000 -0.000 3/37800 520.0 2.817 3.276 2.863 0.000 0.000 -0.000 3/37800 530.0 2.761 3.211 2.807 0.000 0.000 -0.000 3/37800 540.0 2.708 3.149 2.753 0.000 0.000 -0.000 3/37800 550.0 2.657 3.090 2.701 0.000 0.000 -0.000 3/37800 560.0 2.607 3.032 2.651 0.000 0.000 -0.000 3/37800 570.0 2.560 2.977 2.603 0.000 0.000 -0.000 3/37800 580.0 2.514 2.924 2.557 0.000 0.000 -0.000 3/37800 590.0 2.470 2.872 2.512 0.000 0.000 -0.000 3/37800 600.0 2.427 2.823 2.469 0.000 0.000 -0.000 3/37800 610.0 2.386 2.775 2.428 0.000 0.000 -0.000 3/37800 620.0 2.346 2.729 2.387 0.000 0.000 -0.000 3/37800 630.0 2.308 2.684 2.348 0.000 0.000 -0.000 3/37800 640.0 2.271 2.641 2.311 0.000 0.000 -0.000 3/37800 650.0 2.235 2.599 2.274 0.000 0.000 -0.000 3/37800 660.0 2.200 2.558 2.239 0.000 0.000 -0.000 3/37800 670.0 2.166 2.519 2.205 0.000 0.000 -0.000 3/37800 680.0 2.133 2.481 2.172 0.000 0.000 -0.000 3/37800 690.0 2.102 2.444 2.139 0.000 0.000 -0.000 3/37800 700.0 2.071 2.408 2.108 0.000 0.000 -0.000 3/37800 710.0 2.041 2.373 2.078 0.000 0.000 -0.000 3/37800 720.0 2.012 2.340 2.048 0.000 0.000 -0.000 3/37800 730.0 1.984 2.307 2.020 0.000 0.000 -0.000 3/37800 740.0 1.956 2.275 1.992 0.000 0.000 -0.000 3/37800 750.0 1.930 2.244 1.965 0.000 0.000 -0.000 3/37800 760.0 1.904 2.214 1.939 0.000 0.000 -0.000 3/37800 770.0 1.878 2.184 1.913 0.000 0.000 -0.000 3/37800 780.0 1.854 2.156 1.888 0.000 0.000 -0.000 3/37800 790.0 1.830 2.128 1.864 0.000 0.000 -0.000 3/37800 800.0 1.807 2.101 1.840 0.000 0.000 -0.000 3/37800 810.0 1.784 2.074 1.817 0.000 0.000 -0.000 3/37800 820.0 1.762 2.049 1.794 0.000 0.000 -0.000 3/37800 830.0 1.740 2.024 1.773 0.000 0.000 -0.000 3/37800 840.0 1.719 1.999 1.751 0.000 0.000 -0.000 3/37800 850.0 1.699 1.975 1.730 0.000 0.000 -0.000 3/37800 860.0 1.678 1.952 1.710 0.000 0.000 -0.000 3/37800 870.0 1.659 1.929 1.690 0.000 0.000 -0.000 3/37800 880.0 1.640 1.907 1.670 0.000 0.000 -0.000 3/37800 890.0 1.621 1.885 1.651 0.000 0.000 -0.000 3/37800 900.0 1.603 1.864 1.633 0.000 0.000 -0.000 3/37800 910.0 1.585 1.843 1.615 0.000 0.000 -0.000 3/37800 920.0 1.567 1.823 1.597 0.000 0.000 -0.000 3/37800 930.0 1.550 1.803 1.580 0.000 0.000 -0.000 3/37800 940.0 1.534 1.783 1.563 0.000 0.000 -0.000 3/37800 950.0 1.517 1.764 1.546 0.000 0.000 -0.000 3/37800 960.0 1.501 1.746 1.530 0.000 0.000 -0.000 3/37800 970.0 1.485 1.727 1.514 0.000 0.000 -0.000 3/37800 980.0 1.470 1.710 1.498 0.000 0.000 -0.000 3/37800 990.0 1.455 1.692 1.483 0.000 0.000 -0.000 3/37800 1000.0 1.440 1.675 1.468 0.000 0.000 -0.000 3/37800 Thermal conductivity related properties were written into "kappa-m9710.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:49:03]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|