----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 21:07:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.786027370248453 0.000000000000000 0.000000000000000 b 0.000000000000000 5.887387039999999 0.000000000000000 c -5.754722978793306 0.000000000000000 8.224905220250596 Atomic positions (fractional): *1 O 0.26643032893155 0.80264502053522 0.54346604691055 15.999 2 O 0.73356967106846 0.30264502053522 0.95653395308945 15.999 3 O 0.73356967106846 0.19735497946478 0.45653395308945 15.999 4 O 0.26643032893155 0.69735497946478 0.04346604691055 15.999 *5 O 0.35305188820832 0.27721275119340 0.54785108439732 15.999 6 O 0.64694811179168 0.77721275119340 0.95214891560268 15.999 7 O 0.64694811179168 0.72278724880660 0.45214891560268 15.999 8 O 0.35305188820832 0.22278724880660 0.04785108439732 15.999 *9 O 0.82169579688522 0.97309101351931 0.73617839032293 15.999 10 O 0.17830420311478 0.47309101351931 0.76382160967707 15.999 11 O 0.17830420311478 0.02690898648069 0.26382160967707 15.999 12 O 0.82169579688522 0.52690898648069 0.23617839032293 15.999 *13 Sr 0.74075313216380 0.54047721110361 0.75065612108923 87.620 14 Sr 0.25924686783620 0.04047721110361 0.74934387891077 87.620 15 Sr 0.74075313216380 0.95952278889639 0.25065612108923 87.620 16 Sr 0.25924686783620 0.45952278889639 0.24934387891077 87.620 *17 Y 0.00000000000000 0.50000000000000 0.50000000000000 88.906 18 Y 0.00000000000000 0.00000000000000 0.00000000000000 88.906 *19 Nb 0.50000000000000 0.00000000000000 0.50000000000000 92.906 20 Nb 0.50000000000000 0.50000000000000 0.00000000000000 92.906 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.786027370248453 0.000000000000000 0.000000000000000 b 0.000000000000000 5.887387039999999 0.000000000000000 c -5.754722978793306 0.000000000000000 8.224905220250596 Atomic positions (fractional): *1 O 0.26643032893155 0.80264502053522 0.54346604691055 15.999 > 1 2 O 0.73356967106846 0.30264502053522 0.95653395308945 15.999 > 2 3 O 0.73356967106846 0.19735497946478 0.45653395308945 15.999 > 3 4 O 0.26643032893155 0.69735497946478 0.04346604691055 15.999 > 4 *5 O 0.35305188820832 0.27721275119340 0.54785108439732 15.999 > 5 6 O 0.64694811179168 0.77721275119340 0.95214891560268 15.999 > 6 7 O 0.64694811179168 0.72278724880660 0.45214891560268 15.999 > 7 8 O 0.35305188820832 0.22278724880660 0.04785108439732 15.999 > 8 *9 O 0.82169579688522 0.97309101351931 0.73617839032293 15.999 > 9 10 O 0.17830420311478 0.47309101351931 0.76382160967707 15.999 > 10 11 O 0.17830420311478 0.02690898648069 0.26382160967707 15.999 > 11 12 O 0.82169579688522 0.52690898648069 0.23617839032293 15.999 > 12 *13 Sr 0.74075313216380 0.54047721110361 0.75065612108923 87.620 > 13 14 Sr 0.25924686783620 0.04047721110361 0.74934387891077 87.620 > 14 15 Sr 0.74075313216380 0.95952278889639 0.25065612108923 87.620 > 15 16 Sr 0.25924686783620 0.45952278889639 0.24934387891077 87.620 > 16 *17 Y 0.00000000000000 0.50000000000000 0.50000000000000 88.906 > 17 18 Y 0.00000000000000 0.00000000000000 0.00000000000000 88.906 > 18 *19 Nb 0.50000000000000 0.00000000000000 0.50000000000000 92.906 > 19 20 Nb 0.50000000000000 0.50000000000000 0.00000000000000 92.906 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.572054740496906 0.000000000000000 0.000000000000000 b 0.000000000000000 11.774774079999998 0.000000000000000 c -5.754722978793306 0.000000000000000 8.224905220250596 Atomic positions (fractional): *1 O 0.13321516446577 0.40132251026761 0.54346604691055 15.999 > 1 2 O 0.63321516446577 0.40132251026761 0.54346604691055 15.999 > 1 3 O 0.13321516446577 0.90132251026761 0.54346604691055 15.999 > 1 4 O 0.63321516446577 0.90132251026761 0.54346604691055 15.999 > 1 5 O 0.36678483553423 0.15132251026761 0.95653395308945 15.999 > 2 6 O 0.86678483553423 0.15132251026761 0.95653395308945 15.999 > 2 7 O 0.36678483553423 0.65132251026761 0.95653395308945 15.999 > 2 8 O 0.86678483553423 0.65132251026761 0.95653395308945 15.999 > 2 9 O 0.36678483553423 0.09867748973239 0.45653395308945 15.999 > 3 10 O 0.86678483553423 0.09867748973239 0.45653395308945 15.999 > 3 11 O 0.36678483553423 0.59867748973239 0.45653395308945 15.999 > 3 12 O 0.86678483553423 0.59867748973239 0.45653395308945 15.999 > 3 13 O 0.13321516446577 0.34867748973239 0.04346604691055 15.999 > 4 14 O 0.63321516446577 0.34867748973239 0.04346604691055 15.999 > 4 15 O 0.13321516446577 0.84867748973239 0.04346604691055 15.999 > 4 16 O 0.63321516446577 0.84867748973239 0.04346604691055 15.999 > 4 *17 O 0.17652594410416 0.13860637559670 0.54785108439732 15.999 > 5 18 O 0.67652594410416 0.13860637559670 0.54785108439732 15.999 > 5 19 O 0.17652594410416 0.63860637559670 0.54785108439732 15.999 > 5 20 O 0.67652594410416 0.63860637559670 0.54785108439732 15.999 > 5 21 O 0.32347405589584 0.38860637559670 0.95214891560268 15.999 > 6 22 O 0.82347405589584 0.38860637559670 0.95214891560268 15.999 > 6 23 O 0.32347405589584 0.88860637559670 0.95214891560268 15.999 > 6 24 O 0.82347405589584 0.88860637559670 0.95214891560268 15.999 > 6 25 O 0.32347405589584 0.36139362440330 0.45214891560268 15.999 > 7 26 O 0.82347405589584 0.36139362440330 0.45214891560268 15.999 > 7 27 O 0.32347405589584 0.86139362440330 0.45214891560268 15.999 > 7 28 O 0.82347405589584 0.86139362440330 0.45214891560268 15.999 > 7 29 O 0.17652594410416 0.11139362440330 0.04785108439732 15.999 > 8 30 O 0.67652594410416 0.11139362440330 0.04785108439732 15.999 > 8 31 O 0.17652594410416 0.61139362440330 0.04785108439732 15.999 > 8 32 O 0.67652594410416 0.61139362440330 0.04785108439732 15.999 > 8 *33 O 0.41084789844261 0.48654550675966 0.73617839032293 15.999 > 9 34 O 0.91084789844261 0.48654550675966 0.73617839032293 15.999 > 9 35 O 0.41084789844261 0.98654550675966 0.73617839032293 15.999 > 9 36 O 0.91084789844261 0.98654550675966 0.73617839032293 15.999 > 9 37 O 0.08915210155739 0.23654550675966 0.76382160967707 15.999 > 10 38 O 0.58915210155739 0.23654550675966 0.76382160967707 15.999 > 10 39 O 0.08915210155739 0.73654550675966 0.76382160967707 15.999 > 10 40 O 0.58915210155739 0.73654550675966 0.76382160967707 15.999 > 10 41 O 0.08915210155739 0.01345449324034 0.26382160967707 15.999 > 11 42 O 0.58915210155739 0.01345449324034 0.26382160967707 15.999 > 11 43 O 0.08915210155739 0.51345449324034 0.26382160967707 15.999 > 11 44 O 0.58915210155739 0.51345449324034 0.26382160967707 15.999 > 11 45 O 0.41084789844261 0.26345449324034 0.23617839032293 15.999 > 12 46 O 0.91084789844261 0.26345449324034 0.23617839032293 15.999 > 12 47 O 0.41084789844261 0.76345449324034 0.23617839032293 15.999 > 12 48 O 0.91084789844261 0.76345449324034 0.23617839032293 15.999 > 12 *49 Sr 0.37037656608190 0.27023860555180 0.75065612108923 87.620 > 13 50 Sr 0.87037656608190 0.27023860555180 0.75065612108923 87.620 > 13 51 Sr 0.37037656608190 0.77023860555180 0.75065612108923 87.620 > 13 52 Sr 0.87037656608190 0.77023860555180 0.75065612108923 87.620 > 13 53 Sr 0.12962343391810 0.02023860555180 0.74934387891077 87.620 > 14 54 Sr 0.62962343391810 0.02023860555180 0.74934387891077 87.620 > 14 55 Sr 0.12962343391810 0.52023860555180 0.74934387891077 87.620 > 14 56 Sr 0.62962343391810 0.52023860555180 0.74934387891077 87.620 > 14 57 Sr 0.37037656608190 0.47976139444820 0.25065612108923 87.620 > 15 58 Sr 0.87037656608190 0.47976139444820 0.25065612108923 87.620 > 15 59 Sr 0.37037656608190 0.97976139444820 0.25065612108923 87.620 > 15 60 Sr 0.87037656608190 0.97976139444820 0.25065612108923 87.620 > 15 61 Sr 0.12962343391810 0.22976139444820 0.24934387891077 87.620 > 16 62 Sr 0.62962343391810 0.22976139444820 0.24934387891077 87.620 > 16 63 Sr 0.12962343391810 0.72976139444820 0.24934387891077 87.620 > 16 64 Sr 0.62962343391810 0.72976139444820 0.24934387891077 87.620 > 16 *65 Y 0.00000000000000 0.25000000000000 0.50000000000000 88.906 > 17 66 Y 0.50000000000000 0.25000000000000 0.50000000000000 88.906 > 17 67 Y 0.00000000000000 0.75000000000000 0.50000000000000 88.906 > 17 68 Y 0.50000000000000 0.75000000000000 0.50000000000000 88.906 > 17 69 Y 0.00000000000000 0.00000000000000 0.00000000000000 88.906 > 18 70 Y 0.50000000000000 0.00000000000000 0.00000000000000 88.906 > 18 71 Y 0.00000000000000 0.50000000000000 0.00000000000000 88.906 > 18 72 Y 0.50000000000000 0.50000000000000 0.00000000000000 88.906 > 18 *73 Nb 0.25000000000000 0.00000000000000 0.50000000000000 92.906 > 19 74 Nb 0.75000000000000 0.00000000000000 0.50000000000000 92.906 > 19 75 Nb 0.25000000000000 0.50000000000000 0.50000000000000 92.906 > 19 76 Nb 0.75000000000000 0.50000000000000 0.50000000000000 92.906 > 19 77 Nb 0.25000000000000 0.25000000000000 0.00000000000000 92.906 > 20 78 Nb 0.75000000000000 0.25000000000000 0.00000000000000 92.906 > 20 79 Nb 0.25000000000000 0.75000000000000 0.00000000000000 92.906 > 20 80 Nb 0.75000000000000 0.75000000000000 0.00000000000000 92.906 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.7443323 0.0000000 -0.0246555 0.0000000 4.7960278 0.0000000 -0.0246710 0.0000000 4.7080875 -------------------------- Born effective charges -------------------------- 1 O -3.4027190 -1.3438171 0.1797357 -1.3263314 -3.0445922 0.1007080 0.2214931 0.0800635 -1.8410594 2 O -3.4027190 1.3438171 0.1797357 1.3263314 -3.0445922 -0.1007080 0.2214931 -0.0800635 -1.8410594 3 O -3.4027190 -1.3438171 0.1797357 -1.3263314 -3.0445922 0.1007080 0.2214931 0.0800635 -1.8410594 4 O -3.4027190 1.3438171 0.1797357 1.3263314 -3.0445922 -0.1007080 0.2214931 -0.0800635 -1.8410594 5 O -2.9320240 1.3038285 0.1759513 1.3722575 -3.5299537 -0.2960806 0.2172434 -0.3216071 -1.8580311 6 O -2.9320240 -1.3038285 0.1759513 -1.3722575 -3.5299537 0.2960806 0.2172434 0.3216071 -1.8580311 7 O -2.9320240 1.3038285 0.1759513 1.3722575 -3.5299537 -0.2960806 0.2172434 -0.3216071 -1.8580311 8 O -2.9320240 -1.3038285 0.1759513 -1.3722575 -3.5299537 0.2960806 0.2172434 0.3216071 -1.8580311 9 O -2.0064327 -0.0239166 -0.3748073 -0.1010647 -1.7581508 0.1345947 -0.3413272 0.1273707 -4.5339811 10 O -2.0064327 0.0239166 -0.3748073 0.1010647 -1.7581508 -0.1345947 -0.3413272 -0.1273707 -4.5339811 11 O -2.0064327 -0.0239166 -0.3748073 -0.1010647 -1.7581508 0.1345947 -0.3413272 0.1273707 -4.5339811 12 O -2.0064327 0.0239166 -0.3748073 0.1010647 -1.7581508 -0.1345947 -0.3413272 -0.1273707 -4.5339811 13 Sr 2.5474490 0.1382198 -0.0818814 0.1673329 2.4839865 -0.0490486 0.0427603 -0.1147616 2.4276319 14 Sr 2.5474490 -0.1382198 -0.0818814 -0.1673329 2.4839865 0.0490486 0.0427603 0.1147616 2.4276319 15 Sr 2.5474490 -0.1382198 -0.0818814 -0.1673329 2.4839865 0.0490486 0.0427603 0.1147616 2.4276319 16 Sr 2.5474490 0.1382198 -0.0818814 0.1673329 2.4839865 -0.0490486 0.0427603 -0.1147616 2.4276319 17 Y 4.7044471 0.4002100 0.6074774 -0.2959775 4.7866269 -0.0737631 -0.4680084 -0.2056635 4.7266691 18 Y 4.7044471 -0.4002100 0.6074774 0.2959775 4.7866269 0.0737631 -0.4680084 0.2056635 4.7266691 19 Nb 6.8830064 -0.3073968 -0.4054738 0.0549623 6.9107937 -0.1129590 0.1876692 -0.1381286 6.8842104 20 Nb 6.8830064 0.3073968 -0.4054738 -0.0549623 6.9107937 0.1129590 0.1876692 0.1381286 6.8842104 ---------------------------------------------------------------------------- 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: 1908 Number of blocks in projector: 1908 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: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.350 Solver_block: 200 / 640 - Time: 2.434 Solver_block: 300 / 640 - Time: 2.383 Solver_block: 400 / 640 - Time: 2.305 Solver_block: 500 / 640 - Time: 2.365 Solver_block: 600 / 640 - Time: 2.329 Solver_block: 640 / 640 - Time: 1.005 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 15.391 --------------------------------- 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: 1908 Number of blocks in projector: 1908 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: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), 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 2026-01-07 21:08:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:08:02]------------------------- 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 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.786027370248453 0.000000000000000 0.000000000000000 b 0.000000000000000 5.887387039999999 0.000000000000000 c -5.754722978793306 0.000000000000000 8.224905220250596 Atomic positions (fractional): 1 O 0.26643032893155 0.80264502053522 0.54346604691055 15.999 2 O 0.73356967106846 0.30264502053522 0.95653395308945 15.999 3 O 0.73356967106846 0.19735497946478 0.45653395308945 15.999 4 O 0.26643032893155 0.69735497946478 0.04346604691055 15.999 5 O 0.35305188820832 0.27721275119340 0.54785108439732 15.999 6 O 0.64694811179168 0.77721275119340 0.95214891560268 15.999 7 O 0.64694811179168 0.72278724880660 0.45214891560268 15.999 8 O 0.35305188820832 0.22278724880660 0.04785108439732 15.999 9 O 0.82169579688522 0.97309101351931 0.73617839032293 15.999 10 O 0.17830420311478 0.47309101351931 0.76382160967707 15.999 11 O 0.17830420311478 0.02690898648069 0.26382160967707 15.999 12 O 0.82169579688522 0.52690898648069 0.23617839032293 15.999 13 Sr 0.74075313216380 0.54047721110361 0.75065612108923 87.620 14 Sr 0.25924686783620 0.04047721110361 0.74934387891077 87.620 15 Sr 0.74075313216380 0.95952278889639 0.25065612108923 87.620 16 Sr 0.25924686783620 0.45952278889639 0.24934387891077 87.620 17 Y 0.00000000000000 0.50000000000000 0.50000000000000 88.906 18 Y 0.00000000000000 0.00000000000000 0.00000000000000 88.906 19 Nb 0.50000000000000 0.00000000000000 0.50000000000000 92.906 20 Nb 0.50000000000000 0.50000000000000 0.00000000000000 92.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.572054740496906 0.000000000000000 0.000000000000000 b 0.000000000000000 11.774774079999998 0.000000000000000 c -5.754722978793306 0.000000000000000 8.224905220250596 Atomic positions (fractional): 1 O 0.13321516446577 0.40132251026761 0.54346604691055 15.999 > 1 2 O 0.63321516446577 0.40132251026761 0.54346604691055 15.999 > 1 3 O 0.13321516446577 0.90132251026761 0.54346604691055 15.999 > 1 4 O 0.63321516446577 0.90132251026761 0.54346604691055 15.999 > 1 5 O 0.36678483553423 0.15132251026761 0.95653395308945 15.999 > 5 6 O 0.86678483553423 0.15132251026761 0.95653395308945 15.999 > 5 7 O 0.36678483553423 0.65132251026761 0.95653395308945 15.999 > 5 8 O 0.86678483553423 0.65132251026761 0.95653395308945 15.999 > 5 9 O 0.36678483553423 0.09867748973239 0.45653395308945 15.999 > 9 10 O 0.86678483553423 0.09867748973239 0.45653395308945 15.999 > 9 11 O 0.36678483553423 0.59867748973239 0.45653395308945 15.999 > 9 12 O 0.86678483553423 0.59867748973239 0.45653395308945 15.999 > 9 13 O 0.13321516446577 0.34867748973239 0.04346604691055 15.999 > 13 14 O 0.63321516446577 0.34867748973239 0.04346604691055 15.999 > 13 15 O 0.13321516446577 0.84867748973239 0.04346604691055 15.999 > 13 16 O 0.63321516446577 0.84867748973239 0.04346604691055 15.999 > 13 17 O 0.17652594410416 0.13860637559670 0.54785108439732 15.999 > 17 18 O 0.67652594410416 0.13860637559670 0.54785108439732 15.999 > 17 19 O 0.17652594410416 0.63860637559670 0.54785108439732 15.999 > 17 20 O 0.67652594410416 0.63860637559670 0.54785108439732 15.999 > 17 21 O 0.32347405589584 0.38860637559670 0.95214891560268 15.999 > 21 22 O 0.82347405589584 0.38860637559670 0.95214891560268 15.999 > 21 23 O 0.32347405589584 0.88860637559670 0.95214891560268 15.999 > 21 24 O 0.82347405589584 0.88860637559670 0.95214891560268 15.999 > 21 25 O 0.32347405589584 0.36139362440330 0.45214891560268 15.999 > 25 26 O 0.82347405589584 0.36139362440330 0.45214891560268 15.999 > 25 27 O 0.32347405589584 0.86139362440330 0.45214891560268 15.999 > 25 28 O 0.82347405589584 0.86139362440330 0.45214891560268 15.999 > 25 29 O 0.17652594410416 0.11139362440330 0.04785108439732 15.999 > 29 30 O 0.67652594410416 0.11139362440330 0.04785108439732 15.999 > 29 31 O 0.17652594410416 0.61139362440330 0.04785108439732 15.999 > 29 32 O 0.67652594410416 0.61139362440330 0.04785108439732 15.999 > 29 33 O 0.41084789844261 0.48654550675966 0.73617839032293 15.999 > 33 34 O 0.91084789844261 0.48654550675966 0.73617839032293 15.999 > 33 35 O 0.41084789844261 0.98654550675966 0.73617839032293 15.999 > 33 36 O 0.91084789844261 0.98654550675966 0.73617839032293 15.999 > 33 37 O 0.08915210155739 0.23654550675966 0.76382160967707 15.999 > 37 38 O 0.58915210155739 0.23654550675966 0.76382160967707 15.999 > 37 39 O 0.08915210155739 0.73654550675966 0.76382160967707 15.999 > 37 40 O 0.58915210155739 0.73654550675966 0.76382160967707 15.999 > 37 41 O 0.08915210155739 0.01345449324034 0.26382160967707 15.999 > 41 42 O 0.58915210155739 0.01345449324034 0.26382160967707 15.999 > 41 43 O 0.08915210155739 0.51345449324034 0.26382160967707 15.999 > 41 44 O 0.58915210155739 0.51345449324034 0.26382160967707 15.999 > 41 45 O 0.41084789844261 0.26345449324034 0.23617839032293 15.999 > 45 46 O 0.91084789844261 0.26345449324034 0.23617839032293 15.999 > 45 47 O 0.41084789844261 0.76345449324034 0.23617839032293 15.999 > 45 48 O 0.91084789844261 0.76345449324034 0.23617839032293 15.999 > 45 49 Sr 0.37037656608190 0.27023860555180 0.75065612108923 87.620 > 49 50 Sr 0.87037656608190 0.27023860555180 0.75065612108923 87.620 > 49 51 Sr 0.37037656608190 0.77023860555180 0.75065612108923 87.620 > 49 52 Sr 0.87037656608190 0.77023860555180 0.75065612108923 87.620 > 49 53 Sr 0.12962343391810 0.02023860555180 0.74934387891077 87.620 > 53 54 Sr 0.62962343391810 0.02023860555180 0.74934387891077 87.620 > 53 55 Sr 0.12962343391810 0.52023860555180 0.74934387891077 87.620 > 53 56 Sr 0.62962343391810 0.52023860555180 0.74934387891077 87.620 > 53 57 Sr 0.37037656608190 0.47976139444820 0.25065612108923 87.620 > 57 58 Sr 0.87037656608190 0.47976139444820 0.25065612108923 87.620 > 57 59 Sr 0.37037656608190 0.97976139444820 0.25065612108923 87.620 > 57 60 Sr 0.87037656608190 0.97976139444820 0.25065612108923 87.620 > 57 61 Sr 0.12962343391810 0.22976139444820 0.24934387891077 87.620 > 61 62 Sr 0.62962343391810 0.22976139444820 0.24934387891077 87.620 > 61 63 Sr 0.12962343391810 0.72976139444820 0.24934387891077 87.620 > 61 64 Sr 0.62962343391810 0.72976139444820 0.24934387891077 87.620 > 61 65 Y 0.00000000000000 0.25000000000000 0.50000000000000 88.906 > 65 66 Y 0.50000000000000 0.25000000000000 0.50000000000000 88.906 > 65 67 Y 0.00000000000000 0.75000000000000 0.50000000000000 88.906 > 65 68 Y 0.50000000000000 0.75000000000000 0.50000000000000 88.906 > 65 69 Y 0.00000000000000 0.00000000000000 0.00000000000000 88.906 > 69 70 Y 0.50000000000000 0.00000000000000 0.00000000000000 88.906 > 69 71 Y 0.00000000000000 0.50000000000000 0.00000000000000 88.906 > 69 72 Y 0.50000000000000 0.50000000000000 0.00000000000000 88.906 > 69 73 Nb 0.25000000000000 0.00000000000000 0.50000000000000 92.906 > 73 74 Nb 0.75000000000000 0.00000000000000 0.50000000000000 92.906 > 73 75 Nb 0.25000000000000 0.50000000000000 0.50000000000000 92.906 > 73 76 Nb 0.75000000000000 0.50000000000000 0.50000000000000 92.906 > 73 77 Nb 0.25000000000000 0.25000000000000 0.00000000000000 92.906 > 77 78 Nb 0.75000000000000 0.25000000000000 0.00000000000000 92.906 > 77 79 Nb 0.25000000000000 0.75000000000000 0.00000000000000 92.906 > 77 80 Nb 0.75000000000000 0.75000000000000 0.00000000000000 92.906 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.7443323 0.0000000 -0.0246555 0.0000000 4.7960278 0.0000000 -0.0246710 0.0000000 4.7080875 -------------------------- Born effective charges -------------------------- 1 O -3.4027190 -1.3438171 0.1797357 -1.3263314 -3.0445922 0.1007080 0.2214931 0.0800635 -1.8410594 2 O -3.4027190 1.3438171 0.1797357 1.3263314 -3.0445922 -0.1007080 0.2214931 -0.0800635 -1.8410594 3 O -3.4027190 -1.3438171 0.1797357 -1.3263314 -3.0445922 0.1007080 0.2214931 0.0800635 -1.8410594 4 O -3.4027190 1.3438171 0.1797357 1.3263314 -3.0445922 -0.1007080 0.2214931 -0.0800635 -1.8410594 5 O -2.9320240 1.3038285 0.1759513 1.3722575 -3.5299537 -0.2960806 0.2172434 -0.3216071 -1.8580311 6 O -2.9320240 -1.3038285 0.1759513 -1.3722575 -3.5299537 0.2960806 0.2172434 0.3216071 -1.8580311 7 O -2.9320240 1.3038285 0.1759513 1.3722575 -3.5299537 -0.2960806 0.2172434 -0.3216071 -1.8580311 8 O -2.9320240 -1.3038285 0.1759513 -1.3722575 -3.5299537 0.2960806 0.2172434 0.3216071 -1.8580311 9 O -2.0064327 -0.0239166 -0.3748073 -0.1010647 -1.7581508 0.1345947 -0.3413272 0.1273707 -4.5339811 10 O -2.0064327 0.0239166 -0.3748073 0.1010647 -1.7581508 -0.1345947 -0.3413272 -0.1273707 -4.5339811 11 O -2.0064327 -0.0239166 -0.3748073 -0.1010647 -1.7581508 0.1345947 -0.3413272 0.1273707 -4.5339811 12 O -2.0064327 0.0239166 -0.3748073 0.1010647 -1.7581508 -0.1345947 -0.3413272 -0.1273707 -4.5339811 13 Sr 2.5474490 0.1382198 -0.0818814 0.1673329 2.4839865 -0.0490486 0.0427603 -0.1147616 2.4276319 14 Sr 2.5474490 -0.1382198 -0.0818814 -0.1673329 2.4839865 0.0490486 0.0427603 0.1147616 2.4276319 15 Sr 2.5474490 -0.1382198 -0.0818814 -0.1673329 2.4839865 0.0490486 0.0427603 0.1147616 2.4276319 16 Sr 2.5474490 0.1382198 -0.0818814 0.1673329 2.4839865 -0.0490486 0.0427603 -0.1147616 2.4276319 17 Y 4.7044471 0.4002100 0.6074774 -0.2959775 4.7866269 -0.0737631 -0.4680084 -0.2056635 4.7266691 18 Y 4.7044471 -0.4002100 0.6074774 0.2959775 4.7866269 0.0737631 -0.4680084 0.2056635 4.7266691 19 Nb 6.8830064 -0.3073968 -0.4054738 0.0549623 6.9107937 -0.1129590 0.1876692 -0.1381286 6.8842104 20 Nb 6.8830064 0.3073968 -0.4054738 -0.0549623 6.9107937 0.1129590 0.1876692 0.1381286 6.8842104 ---------------------------------------------------------------------------- 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 65, 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 73, 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] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000003 (zzz) -0.00000003 (zzz) -0.00000003 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000013 (xy) -0.00000013 (xy) 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 2026-01-07 21:08:18]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:08:19]------------------------- 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 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.786027370248453 0.000000000000000 0.000000000000000 b 0.000000000000000 5.887387039999999 0.000000000000000 c -5.754722978793306 0.000000000000000 8.224905220250596 Atomic positions (fractional): 1 O 0.26643032893155 0.80264502053522 0.54346604691055 15.999 2 O 0.73356967106846 0.30264502053522 0.95653395308945 15.999 3 O 0.73356967106846 0.19735497946478 0.45653395308945 15.999 4 O 0.26643032893155 0.69735497946478 0.04346604691055 15.999 5 O 0.35305188820832 0.27721275119340 0.54785108439732 15.999 6 O 0.64694811179168 0.77721275119340 0.95214891560268 15.999 7 O 0.64694811179168 0.72278724880660 0.45214891560268 15.999 8 O 0.35305188820832 0.22278724880660 0.04785108439732 15.999 9 O 0.82169579688522 0.97309101351931 0.73617839032293 15.999 10 O 0.17830420311478 0.47309101351931 0.76382160967707 15.999 11 O 0.17830420311478 0.02690898648069 0.26382160967707 15.999 12 O 0.82169579688522 0.52690898648069 0.23617839032293 15.999 13 Sr 0.74075313216380 0.54047721110361 0.75065612108923 87.620 14 Sr 0.25924686783620 0.04047721110361 0.74934387891077 87.620 15 Sr 0.74075313216380 0.95952278889639 0.25065612108923 87.620 16 Sr 0.25924686783620 0.45952278889639 0.24934387891077 87.620 17 Y 0.00000000000000 0.50000000000000 0.50000000000000 88.906 18 Y 0.00000000000000 0.00000000000000 0.00000000000000 88.906 19 Nb 0.50000000000000 0.00000000000000 0.50000000000000 92.906 20 Nb 0.50000000000000 0.50000000000000 0.00000000000000 92.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.572054740496906 0.000000000000000 0.000000000000000 b 0.000000000000000 11.774774079999998 0.000000000000000 c -5.754722978793306 0.000000000000000 8.224905220250596 Atomic positions (fractional): 1 O 0.13321516446577 0.40132251026761 0.54346604691055 15.999 > 1 2 O 0.63321516446577 0.40132251026761 0.54346604691055 15.999 > 1 3 O 0.13321516446577 0.90132251026761 0.54346604691055 15.999 > 1 4 O 0.63321516446577 0.90132251026761 0.54346604691055 15.999 > 1 5 O 0.36678483553423 0.15132251026761 0.95653395308945 15.999 > 5 6 O 0.86678483553423 0.15132251026761 0.95653395308945 15.999 > 5 7 O 0.36678483553423 0.65132251026761 0.95653395308945 15.999 > 5 8 O 0.86678483553423 0.65132251026761 0.95653395308945 15.999 > 5 9 O 0.36678483553423 0.09867748973239 0.45653395308945 15.999 > 9 10 O 0.86678483553423 0.09867748973239 0.45653395308945 15.999 > 9 11 O 0.36678483553423 0.59867748973239 0.45653395308945 15.999 > 9 12 O 0.86678483553423 0.59867748973239 0.45653395308945 15.999 > 9 13 O 0.13321516446577 0.34867748973239 0.04346604691055 15.999 > 13 14 O 0.63321516446577 0.34867748973239 0.04346604691055 15.999 > 13 15 O 0.13321516446577 0.84867748973239 0.04346604691055 15.999 > 13 16 O 0.63321516446577 0.84867748973239 0.04346604691055 15.999 > 13 17 O 0.17652594410416 0.13860637559670 0.54785108439732 15.999 > 17 18 O 0.67652594410416 0.13860637559670 0.54785108439732 15.999 > 17 19 O 0.17652594410416 0.63860637559670 0.54785108439732 15.999 > 17 20 O 0.67652594410416 0.63860637559670 0.54785108439732 15.999 > 17 21 O 0.32347405589584 0.38860637559670 0.95214891560268 15.999 > 21 22 O 0.82347405589584 0.38860637559670 0.95214891560268 15.999 > 21 23 O 0.32347405589584 0.88860637559670 0.95214891560268 15.999 > 21 24 O 0.82347405589584 0.88860637559670 0.95214891560268 15.999 > 21 25 O 0.32347405589584 0.36139362440330 0.45214891560268 15.999 > 25 26 O 0.82347405589584 0.36139362440330 0.45214891560268 15.999 > 25 27 O 0.32347405589584 0.86139362440330 0.45214891560268 15.999 > 25 28 O 0.82347405589584 0.86139362440330 0.45214891560268 15.999 > 25 29 O 0.17652594410416 0.11139362440330 0.04785108439732 15.999 > 29 30 O 0.67652594410416 0.11139362440330 0.04785108439732 15.999 > 29 31 O 0.17652594410416 0.61139362440330 0.04785108439732 15.999 > 29 32 O 0.67652594410416 0.61139362440330 0.04785108439732 15.999 > 29 33 O 0.41084789844261 0.48654550675966 0.73617839032293 15.999 > 33 34 O 0.91084789844261 0.48654550675966 0.73617839032293 15.999 > 33 35 O 0.41084789844261 0.98654550675966 0.73617839032293 15.999 > 33 36 O 0.91084789844261 0.98654550675966 0.73617839032293 15.999 > 33 37 O 0.08915210155739 0.23654550675966 0.76382160967707 15.999 > 37 38 O 0.58915210155739 0.23654550675966 0.76382160967707 15.999 > 37 39 O 0.08915210155739 0.73654550675966 0.76382160967707 15.999 > 37 40 O 0.58915210155739 0.73654550675966 0.76382160967707 15.999 > 37 41 O 0.08915210155739 0.01345449324034 0.26382160967707 15.999 > 41 42 O 0.58915210155739 0.01345449324034 0.26382160967707 15.999 > 41 43 O 0.08915210155739 0.51345449324034 0.26382160967707 15.999 > 41 44 O 0.58915210155739 0.51345449324034 0.26382160967707 15.999 > 41 45 O 0.41084789844261 0.26345449324034 0.23617839032293 15.999 > 45 46 O 0.91084789844261 0.26345449324034 0.23617839032293 15.999 > 45 47 O 0.41084789844261 0.76345449324034 0.23617839032293 15.999 > 45 48 O 0.91084789844261 0.76345449324034 0.23617839032293 15.999 > 45 49 Sr 0.37037656608190 0.27023860555180 0.75065612108923 87.620 > 49 50 Sr 0.87037656608190 0.27023860555180 0.75065612108923 87.620 > 49 51 Sr 0.37037656608190 0.77023860555180 0.75065612108923 87.620 > 49 52 Sr 0.87037656608190 0.77023860555180 0.75065612108923 87.620 > 49 53 Sr 0.12962343391810 0.02023860555180 0.74934387891077 87.620 > 53 54 Sr 0.62962343391810 0.02023860555180 0.74934387891077 87.620 > 53 55 Sr 0.12962343391810 0.52023860555180 0.74934387891077 87.620 > 53 56 Sr 0.62962343391810 0.52023860555180 0.74934387891077 87.620 > 53 57 Sr 0.37037656608190 0.47976139444820 0.25065612108923 87.620 > 57 58 Sr 0.87037656608190 0.47976139444820 0.25065612108923 87.620 > 57 59 Sr 0.37037656608190 0.97976139444820 0.25065612108923 87.620 > 57 60 Sr 0.87037656608190 0.97976139444820 0.25065612108923 87.620 > 57 61 Sr 0.12962343391810 0.22976139444820 0.24934387891077 87.620 > 61 62 Sr 0.62962343391810 0.22976139444820 0.24934387891077 87.620 > 61 63 Sr 0.12962343391810 0.72976139444820 0.24934387891077 87.620 > 61 64 Sr 0.62962343391810 0.72976139444820 0.24934387891077 87.620 > 61 65 Y 0.00000000000000 0.25000000000000 0.50000000000000 88.906 > 65 66 Y 0.50000000000000 0.25000000000000 0.50000000000000 88.906 > 65 67 Y 0.00000000000000 0.75000000000000 0.50000000000000 88.906 > 65 68 Y 0.50000000000000 0.75000000000000 0.50000000000000 88.906 > 65 69 Y 0.00000000000000 0.00000000000000 0.00000000000000 88.906 > 69 70 Y 0.50000000000000 0.00000000000000 0.00000000000000 88.906 > 69 71 Y 0.00000000000000 0.50000000000000 0.00000000000000 88.906 > 69 72 Y 0.50000000000000 0.50000000000000 0.00000000000000 88.906 > 69 73 Nb 0.25000000000000 0.00000000000000 0.50000000000000 92.906 > 73 74 Nb 0.75000000000000 0.00000000000000 0.50000000000000 92.906 > 73 75 Nb 0.25000000000000 0.50000000000000 0.50000000000000 92.906 > 73 76 Nb 0.75000000000000 0.50000000000000 0.50000000000000 92.906 > 73 77 Nb 0.25000000000000 0.25000000000000 0.00000000000000 92.906 > 77 78 Nb 0.75000000000000 0.25000000000000 0.00000000000000 92.906 > 77 79 Nb 0.25000000000000 0.75000000000000 0.00000000000000 92.906 > 77 80 Nb 0.75000000000000 0.75000000000000 0.00000000000000 92.906 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.7443323 0.0000000 -0.0246555 0.0000000 4.7960278 0.0000000 -0.0246710 0.0000000 4.7080875 -------------------------- Born effective charges -------------------------- 1 O -3.4027190 -1.3438171 0.1797357 -1.3263314 -3.0445922 0.1007080 0.2214931 0.0800635 -1.8410594 2 O -3.4027190 1.3438171 0.1797357 1.3263314 -3.0445922 -0.1007080 0.2214931 -0.0800635 -1.8410594 3 O -3.4027190 -1.3438171 0.1797357 -1.3263314 -3.0445922 0.1007080 0.2214931 0.0800635 -1.8410594 4 O -3.4027190 1.3438171 0.1797357 1.3263314 -3.0445922 -0.1007080 0.2214931 -0.0800635 -1.8410594 5 O -2.9320240 1.3038285 0.1759513 1.3722575 -3.5299537 -0.2960806 0.2172434 -0.3216071 -1.8580311 6 O -2.9320240 -1.3038285 0.1759513 -1.3722575 -3.5299537 0.2960806 0.2172434 0.3216071 -1.8580311 7 O -2.9320240 1.3038285 0.1759513 1.3722575 -3.5299537 -0.2960806 0.2172434 -0.3216071 -1.8580311 8 O -2.9320240 -1.3038285 0.1759513 -1.3722575 -3.5299537 0.2960806 0.2172434 0.3216071 -1.8580311 9 O -2.0064327 -0.0239166 -0.3748073 -0.1010647 -1.7581508 0.1345947 -0.3413272 0.1273707 -4.5339811 10 O -2.0064327 0.0239166 -0.3748073 0.1010647 -1.7581508 -0.1345947 -0.3413272 -0.1273707 -4.5339811 11 O -2.0064327 -0.0239166 -0.3748073 -0.1010647 -1.7581508 0.1345947 -0.3413272 0.1273707 -4.5339811 12 O -2.0064327 0.0239166 -0.3748073 0.1010647 -1.7581508 -0.1345947 -0.3413272 -0.1273707 -4.5339811 13 Sr 2.5474490 0.1382198 -0.0818814 0.1673329 2.4839865 -0.0490486 0.0427603 -0.1147616 2.4276319 14 Sr 2.5474490 -0.1382198 -0.0818814 -0.1673329 2.4839865 0.0490486 0.0427603 0.1147616 2.4276319 15 Sr 2.5474490 -0.1382198 -0.0818814 -0.1673329 2.4839865 0.0490486 0.0427603 0.1147616 2.4276319 16 Sr 2.5474490 0.1382198 -0.0818814 0.1673329 2.4839865 -0.0490486 0.0427603 -0.1147616 2.4276319 17 Y 4.7044471 0.4002100 0.6074774 -0.2959775 4.7866269 -0.0737631 -0.4680084 -0.2056635 4.7266691 18 Y 4.7044471 -0.4002100 0.6074774 0.2959775 4.7866269 0.0737631 -0.4680084 0.2056635 4.7266691 19 Nb 6.8830064 -0.3073968 -0.4054738 0.0549623 6.9107937 -0.1129590 0.1876692 -0.1381286 6.8842104 20 Nb 6.8830064 0.3073968 -0.4054738 -0.0549623 6.9107937 0.1129590 0.1876692 0.1381286 6.8842104 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000003 (zzz) -0.00000003 (zzz) -0.00000003 (zzz) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 8 6 ] 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: 0.63, Number of G-points: 317, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/170) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 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 2.648 ( 0.000 0.000 0.000) 0.000 2.783 ( 0.000 0.000 0.000) 0.000 2.957 ( 0.000 0.000 0.000) 0.000 3.128 ( 0.000 0.000 0.000) 0.000 3.198 ( 0.000 0.000 0.000) 0.000 3.322 ( 0.000 0.000 0.000) 0.000 3.533 ( 0.000 0.000 0.000) 0.000 3.711 ( 0.000 0.000 0.000) 0.000 3.712 ( 0.000 0.000 0.000) 0.000 3.847 ( 0.000 0.000 0.000) 0.000 4.047 ( 0.000 0.000 0.000) 0.000 4.198 ( 0.000 0.000 0.000) 0.000 4.365 ( 0.000 0.000 0.000) 0.000 4.441 ( 0.000 0.000 0.000) 0.000 4.512 ( 0.000 0.000 0.000) 0.000 4.661 ( 0.000 0.000 0.000) 0.000 5.090 ( 0.000 0.000 0.000) 0.000 5.271 ( 0.000 0.000 0.000) 0.000 5.419 ( 0.000 0.000 0.000) 0.000 5.666 ( 0.000 0.000 0.000) 0.000 5.785 ( 0.000 0.000 0.000) 0.000 5.861 ( 0.000 0.000 0.000) 0.000 6.188 ( 0.000 0.000 0.000) 0.000 6.335 ( 0.000 0.000 0.000) 0.000 6.777 ( 0.000 0.000 0.000) 0.000 6.943 ( 0.000 0.000 0.000) 0.000 7.188 ( 0.000 0.000 0.000) 0.000 7.425 ( 0.000 0.000 0.000) 0.000 7.553 ( 0.000 0.000 0.000) 0.000 8.181 ( 0.000 0.000 0.000) 0.000 8.206 ( 0.000 0.000 0.000) 0.000 8.315 ( 0.000 0.000 0.000) 0.000 9.358 ( 0.000 0.000 0.000) 0.000 9.539 ( 0.000 0.000 0.000) 0.000 9.677 ( 0.000 0.000 0.000) 0.000 9.762 ( 0.000 0.000 0.000) 0.000 9.868 ( 0.000 0.000 0.000) 0.000 10.729 ( 0.000 0.000 0.000) 0.000 10.758 ( 0.000 0.000 0.000) 0.000 11.181 ( 0.000 0.000 0.000) 0.000 11.623 ( 0.000 0.000 0.000) 0.000 11.935 ( 0.000 0.000 0.000) 0.000 12.094 ( 0.000 0.000 0.000) 0.000 12.759 ( 0.000 0.000 0.000) 0.000 12.918 ( 0.000 0.000 0.000) 0.000 14.360 ( 0.000 0.000 0.000) 0.000 14.598 ( 0.000 0.000 0.000) 0.000 14.894 ( 0.000 0.000 0.000) 0.000 14.942 ( 0.000 0.000 0.000) 0.000 15.238 ( 0.000 0.000 0.000) 0.000 15.455 ( 0.000 0.000 0.000) 0.000 16.067 ( 0.000 0.000 0.000) 0.000 16.172 ( 0.000 0.000 0.000) 0.000 16.387 ( 0.000 0.000 0.000) 0.000 20.382 ( 0.000 0.000 0.000) 0.000 22.534 ( 0.000 0.000 0.000) 0.000 22.956 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/170) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.569 ( 12.318 0.000 34.013) 36.175 0.760 ( 31.095 0.000 21.974) 38.076 1.225 ( 54.133 0.000 31.098) 62.430 2.680 ( 5.216 0.000 -4.103) 6.636 2.827 ( -5.377 0.000 -0.108) 5.378 2.935 ( -0.061 0.000 -2.349) 2.350 3.134 ( 5.544 0.000 -7.590) 9.399 3.184 ( -1.995 0.000 -9.797) 9.998 3.353 ( -13.596 0.000 -10.111) 16.944 3.483 ( -8.109 0.000 25.737) 26.985 3.643 ( -16.598 0.000 8.683) 18.732 3.687 ( -2.034 0.000 -0.989) 2.262 3.982 ( 1.650 0.000 12.707) 12.814 3.998 ( -10.307 0.000 12.019) 15.833 4.248 ( 0.233 0.000 1.179) 1.202 4.394 ( -0.489 0.000 -2.928) 2.968 4.532 ( 5.554 0.000 1.345) 5.714 4.535 ( -0.854 0.000 -8.712) 8.754 4.748 ( 8.744 0.000 1.063) 8.809 5.133 ( 2.420 0.000 5.375) 5.894 5.256 ( -13.712 0.000 -6.243) 15.067 5.396 ( 14.599 0.000 -2.938) 14.892 5.852 ( 15.971 0.000 3.839) 16.426 5.913 ( 8.218 0.000 4.167) 9.214 6.183 ( 1.132 0.000 -11.738) 11.793 6.280 ( 10.254 0.000 4.396) 11.156 6.682 ( -9.453 0.000 1.492) 9.570 6.957 ( -5.855 0.000 1.785) 6.121 7.038 ( 8.051 0.000 3.090) 8.624 7.431 ( 0.182 0.000 -0.391) 0.432 7.639 ( 8.681 0.000 1.313) 8.780 7.874 ( -3.918 0.000 -5.039) 6.383 8.142 ( 0.829 0.000 -2.129) 2.285 8.344 ( 11.284 0.000 -0.988) 11.327 8.392 ( 3.341 0.000 5.206) 6.186 9.330 ( -3.467 0.000 0.189) 3.472 9.469 ( -6.602 0.000 -7.109) 9.702 9.649 ( -7.458 0.000 3.033) 8.051 9.945 ( 3.415 0.000 0.783) 3.504 10.628 ( -7.857 0.000 -10.801) 13.357 10.658 ( -4.249 0.000 6.496) 7.762 11.180 ( -6.528 0.000 8.377) 10.620 11.545 ( -7.182 0.000 -2.738) 7.686 11.914 ( -2.473 0.000 -1.161) 2.732 12.137 ( 7.035 0.000 -1.007) 7.106 12.279 ( 22.472 0.000 -19.763) 29.926 12.809 ( 6.726 0.000 -1.577) 6.908 12.925 ( 2.890 0.000 -3.057) 4.207 14.414 ( 2.641 0.000 3.951) 4.752 14.632 ( 4.238 0.000 -0.366) 4.254 14.937 ( 3.553 0.000 2.606) 4.406 15.181 ( -2.287 0.000 8.122) 8.438 15.456 ( 1.132 0.000 -0.732) 1.348 16.050 ( -1.756 0.000 -0.559) 1.843 16.149 ( -3.082 0.000 0.001) 3.082 16.371 ( -1.501 0.000 -0.809) 1.705 20.467 ( 8.370 0.000 3.060) 8.911 20.871 ( 3.143 0.000 -0.325) 3.160 22.534 ( -0.182 0.000 0.157) 0.241 22.932 ( -0.823 0.000 -3.199) 3.304 ======================= Grid point 2 (3/170) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.131 ( 15.166 0.000 28.548) 32.327 1.436 ( 25.484 0.000 19.450) 32.058 2.311 ( 38.406 0.000 23.926) 45.249 2.641 ( 0.239 0.000 -13.033) 13.036 2.750 ( 0.411 0.000 -1.098) 1.173 2.925 ( -2.328 0.000 -4.993) 5.509 3.020 ( -11.286 0.000 -0.213) 11.288 3.028 ( 0.464 0.000 -12.172) 12.181 3.162 ( 4.767 0.000 -3.971) 6.204 3.400 ( -22.561 0.000 5.977) 23.339 3.599 ( -9.749 0.000 15.031) 17.916 3.639 ( -1.973 0.000 0.922) 2.178 3.982 ( -8.177 0.000 7.093) 10.825 4.186 ( 8.519 0.000 5.581) 10.184 4.224 ( -2.320 0.000 3.357) 4.081 4.390 ( 2.514 0.000 -1.663) 3.014 4.433 ( 1.218 0.000 -2.190) 2.505 4.746 ( 10.745 0.000 10.302) 14.886 4.927 ( 12.065 0.000 1.161) 12.121 4.957 ( -13.811 0.000 -4.406) 14.497 5.299 ( 6.960 0.000 11.099) 13.101 5.604 ( 15.951 0.000 -4.014) 16.448 5.905 ( -10.339 0.000 -10.286) 14.584 6.078 ( 9.229 0.000 0.550) 9.245 6.201 ( 10.622 0.000 5.196) 11.825 6.570 ( -9.065 0.000 3.137) 9.592 6.658 ( 24.844 0.000 10.911) 27.135 6.867 ( -4.490 0.000 -0.828) 4.566 7.179 ( 6.853 0.000 -2.052) 7.154 7.370 ( -8.380 0.000 -0.807) 8.419 7.684 ( 5.053 0.000 -14.800) 15.639 7.884 ( 4.295 0.000 5.109) 6.674 8.243 ( 9.044 0.000 4.174) 9.961 8.459 ( 8.380 0.000 -7.034) 10.941 8.521 ( 7.203 0.000 6.501) 9.703 9.266 ( -4.359 0.000 0.147) 4.362 9.309 ( -1.793 0.000 -7.429) 7.642 9.563 ( -6.723 0.000 1.922) 6.993 9.934 ( -2.072 0.000 -4.704) 5.140 10.320 ( -11.005 0.000 -15.673) 19.151 10.664 ( -6.264 0.000 8.995) 10.962 11.144 ( -11.898 0.000 10.661) 15.976 11.379 ( -7.677 0.000 -3.966) 8.641 11.831 ( -4.212 0.000 -3.842) 5.701 12.286 ( 9.590 0.000 3.012) 10.052 12.455 ( 15.556 0.000 -3.341) 15.911 12.903 ( 7.401 0.000 -3.326) 8.114 12.937 ( 4.846 0.000 -5.649) 7.443 14.539 ( 7.663 0.000 3.901) 8.598 14.712 ( 7.224 0.000 -1.823) 7.450 15.051 ( 5.760 0.000 4.024) 7.026 15.256 ( 5.649 0.000 0.406) 5.663 15.497 ( 4.372 0.000 1.284) 4.557 16.000 ( -3.783 0.000 -0.698) 3.847 16.071 ( -6.790 0.000 -0.142) 6.792 16.320 ( -3.343 0.000 -1.490) 3.660 20.691 ( 13.616 0.000 4.940) 14.484 20.939 ( 6.049 0.000 -0.532) 6.073 22.530 ( -0.680 0.000 0.137) 0.694 22.861 ( -2.010 0.000 -5.710) 6.054 ======================= Grid point 3 (4/170) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( 15.643 0.000 20.897) 26.103 1.977 ( 18.288 0.000 16.121) 24.379 2.436 ( -4.324 0.000 -13.076) 13.773 2.532 ( -3.790 0.000 -3.578) 5.212 2.728 ( -8.734 0.000 -4.058) 9.630 2.821 ( 2.803 0.000 -13.016) 13.315 3.034 ( 0.288 0.000 3.689) 3.700 3.114 ( -19.188 0.000 3.169) 19.447 3.117 ( 5.322 0.000 -1.561) 5.546 3.250 ( 3.128 0.000 7.370) 8.007 3.436 ( -16.217 0.000 -0.052) 16.217 3.748 ( 9.623 0.000 15.729) 18.439 3.865 ( -7.346 0.000 -4.428) 8.577 4.266 ( -1.013 0.000 5.920) 6.006 4.438 ( 3.084 0.000 2.070) 3.714 4.439 ( 21.899 0.000 3.267) 22.142 4.544 ( 5.045 0.000 0.877) 5.121 4.846 ( 1.685 0.000 10.236) 10.374 5.024 ( 13.872 0.000 3.872) 14.402 5.163 ( 9.615 0.000 11.092) 14.679 5.557 ( 7.995 0.000 10.922) 13.536 5.595 ( -12.023 0.000 -10.189) 15.760 5.791 ( 12.241 0.000 -2.092) 12.418 6.223 ( 11.481 0.000 -1.321) 11.556 6.373 ( 1.381 0.000 3.532) 3.793 6.424 ( -10.409 0.000 -1.698) 10.547 6.872 ( 3.054 0.000 5.973) 6.708 7.095 ( -18.446 0.000 2.341) 18.594 7.168 ( 17.929 0.000 4.190) 18.412 7.269 ( 8.906 0.000 -2.142) 9.160 7.537 ( -0.763 0.000 -17.905) 17.921 8.003 ( 4.536 0.000 2.435) 5.148 8.350 ( -1.717 0.000 3.358) 3.771 8.458 ( 3.461 0.000 -9.355) 9.975 8.845 ( 16.749 0.000 12.697) 21.018 9.205 ( -1.649 0.000 -2.300) 2.830 9.259 ( 1.907 0.000 -3.182) 3.710 9.503 ( 0.441 0.000 -2.398) 2.438 9.800 ( -7.267 0.000 -4.324) 8.456 10.021 ( -2.974 0.000 -13.531) 13.854 10.640 ( -8.497 0.000 6.873) 10.929 11.007 ( -14.324 0.000 1.300) 14.383 11.268 ( -5.908 0.000 3.962) 7.113 11.710 ( -4.638 0.000 -4.735) 6.628 12.476 ( 8.843 0.000 4.201) 9.790 12.673 ( 12.538 0.000 1.708) 12.654 12.923 ( 4.192 0.000 -7.454) 8.552 12.975 ( 5.201 0.000 -4.487) 6.869 14.733 ( 10.969 0.000 4.073) 11.701 14.819 ( 9.570 0.000 -2.534) 9.900 15.188 ( 6.570 0.000 2.864) 7.167 15.359 ( 8.976 0.000 -3.087) 9.492 15.622 ( 6.709 0.000 4.480) 8.068 15.918 ( -5.835 0.000 -0.276) 5.842 15.935 ( -10.155 0.000 0.025) 10.155 16.234 ( -5.271 0.000 -1.766) 5.559 20.973 ( 14.268 0.000 5.037) 15.131 21.046 ( 7.698 0.000 -0.046) 7.698 22.514 ( -1.366 0.000 -0.048) 1.367 22.748 ( -3.347 0.000 -6.832) 7.607 ======================= Grid point 4 (5/170) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.025 ( 6.818 0.000 11.578) 13.436 2.270 ( 1.033 0.000 -4.664) 4.777 2.387 ( 10.589 0.000 9.469) 14.205 2.436 ( -1.772 0.000 -3.490) 3.914 2.550 ( -10.280 0.000 -1.347) 10.368 2.735 ( 2.336 0.000 -9.165) 9.458 2.889 ( -10.952 0.000 0.004) 10.952 2.950 ( -11.704 0.000 -6.804) 13.538 3.068 ( -0.327 0.000 2.637) 2.657 3.228 ( -1.967 0.000 -3.570) 4.076 3.318 ( -4.044 0.000 3.442) 5.311 3.688 ( -6.299 0.000 -7.143) 9.524 4.137 ( 9.373 0.000 17.267) 19.647 4.288 ( -1.829 0.000 2.281) 2.923 4.436 ( -2.333 0.000 -5.290) 5.781 4.513 ( 3.028 0.000 2.061) 3.663 5.052 ( 27.638 0.000 9.190) 29.126 5.094 ( 6.743 0.000 5.449) 8.669 5.272 ( 12.643 0.000 2.963) 12.986 5.426 ( 3.339 0.000 9.834) 10.386 5.455 ( 10.369 0.000 12.279) 16.071 5.701 ( 4.547 0.000 -2.077) 4.999 5.985 ( 8.014 0.000 7.174) 10.756 6.233 ( -8.854 0.000 -2.710) 9.259 6.325 ( -6.930 0.000 -1.907) 7.188 6.404 ( 13.626 0.000 -5.177) 14.576 6.771 ( -23.883 0.000 5.398) 24.485 7.046 ( 6.775 0.000 6.908) 9.676 7.161 ( 0.859 0.000 -9.037) 9.078 7.257 ( -8.768 0.000 -19.624) 21.494 7.648 ( 15.183 0.000 10.776) 18.618 8.075 ( 1.882 0.000 1.896) 2.671 8.310 ( -5.405 0.000 0.999) 5.497 8.377 ( -0.632 0.000 -8.405) 8.429 8.987 ( -5.666 0.000 -4.535) 7.257 9.254 ( -1.365 0.000 0.179) 1.377 9.346 ( 14.765 0.000 9.693) 17.662 9.502 ( 5.445 0.000 -12.338) 13.486 9.709 ( 0.124 0.000 5.742) 5.744 10.010 ( 11.947 0.000 -3.095) 12.341 10.534 ( -11.651 0.000 2.506) 11.918 10.748 ( -14.152 0.000 -6.440) 15.549 11.253 ( -4.916 0.000 7.464) 8.937 11.597 ( -3.373 0.000 -3.642) 4.964 12.638 ( 6.007 0.000 3.351) 6.878 12.865 ( 8.440 0.000 2.417) 8.780 12.897 ( 3.041 0.000 -7.225) 7.839 12.982 ( 1.889 0.000 -3.743) 4.193 14.955 ( 11.334 0.000 3.380) 11.827 14.956 ( 10.694 0.000 -2.010) 10.882 15.314 ( 6.126 0.000 1.364) 6.276 15.462 ( 9.067 0.000 -4.033) 9.924 15.748 ( -4.750 0.000 -0.224) 4.756 15.788 ( -1.564 0.000 5.321) 5.546 15.813 ( -7.443 0.000 0.126) 7.444 16.126 ( -5.834 0.000 -1.273) 5.971 21.169 ( 7.043 0.000 0.598) 7.068 21.222 ( 10.623 0.000 3.546) 11.200 22.489 ( -1.568 0.000 -0.166) 1.577 22.618 ( -3.766 0.000 -5.877) 6.980 ======================= Grid point 5 (6/170) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.129 ( -0.852 0.000 3.166) 3.279 2.245 ( 1.770 0.000 -2.777) 3.293 2.391 ( -7.017 0.000 0.423) 7.030 2.405 ( -0.224 0.000 -0.517) 0.564 2.602 ( -4.605 0.000 -5.798) 7.404 2.612 ( 4.901 0.000 5.088) 7.064 2.779 ( -2.874 0.000 -0.860) 3.000 2.909 ( 6.913 0.000 0.280) 6.918 3.088 ( -0.076 0.000 1.551) 1.553 3.118 ( -5.440 0.000 -3.328) 6.378 3.328 ( -0.270 0.000 2.058) 2.076 3.541 ( -3.115 0.000 -4.129) 5.173 4.274 ( -1.105 0.000 0.354) 1.160 4.285 ( -2.280 0.000 2.039) 3.059 4.470 ( 6.128 0.000 2.786) 6.732 4.567 ( 1.502 0.000 0.704) 1.659 5.018 ( -4.764 0.000 -2.722) 5.487 5.423 ( 10.252 0.000 4.226) 11.089 5.456 ( 4.086 0.000 4.649) 6.189 5.645 ( -0.313 0.000 2.078) 2.101 5.824 ( 21.720 0.000 -5.780) 22.476 5.872 ( 11.007 0.000 10.507) 15.217 6.072 ( -12.145 0.000 7.154) 14.095 6.138 ( -4.962 0.000 -0.023) 4.962 6.264 ( 9.941 0.000 11.432) 15.150 6.398 ( -2.068 0.000 -5.049) 5.456 6.648 ( -1.150 0.000 5.085) 5.214 6.789 ( -17.775 0.000 -24.381) 30.173 7.084 ( -0.946 0.000 -3.209) 3.345 7.204 ( 2.555 0.000 4.010) 4.754 7.910 ( 6.249 0.000 5.319) 8.206 8.114 ( 0.291 0.000 2.061) 2.081 8.225 ( -4.223 0.000 -1.038) 4.348 8.284 ( -0.823 0.000 -4.718) 4.789 8.845 ( -2.848 0.000 -4.267) 5.131 9.224 ( -1.675 0.000 -0.135) 1.680 9.430 ( 0.183 0.000 -4.502) 4.506 9.654 ( 9.291 0.000 6.909) 11.578 9.881 ( 9.266 0.000 3.437) 9.883 10.192 ( 7.797 0.000 2.022) 8.055 10.353 ( -10.155 0.000 -0.711) 10.180 10.465 ( -9.567 0.000 -6.940) 11.819 11.259 ( -2.181 0.000 3.421) 4.057 11.534 ( -1.149 0.000 -1.291) 1.728 12.728 ( 2.114 0.000 1.271) 2.467 12.870 ( 1.144 0.000 -3.128) 3.331 12.967 ( 0.251 0.000 -1.435) 1.457 12.976 ( 2.995 0.000 1.008) 3.160 15.086 ( 6.370 0.000 -0.835) 6.424 15.127 ( 5.664 0.000 1.349) 5.823 15.396 ( 2.702 0.000 0.306) 2.719 15.559 ( 7.721 0.000 -1.898) 7.951 15.608 ( -6.543 0.000 0.157) 6.545 15.689 ( -7.965 0.000 0.015) 7.965 15.870 ( 1.544 0.000 2.169) 2.663 16.044 ( -2.751 0.000 -0.296) 2.767 21.259 ( 3.028 0.000 0.449) 3.061 21.365 ( 3.927 0.000 1.237) 4.117 22.468 ( -0.721 0.000 -0.082) 0.726 22.522 ( -1.817 0.000 -2.421) 3.027 ======================= Grid point 11 (7/170) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.786 ( 0.000 35.942 0.000) 35.942 0.848 ( 0.000 37.990 0.000) 37.990 1.375 ( 0.000 60.886 0.000) 60.886 2.740 ( 0.000 7.488 0.000) 7.488 2.777 ( 0.000 -2.610 0.000) 2.610 2.995 ( 0.000 -2.759 0.000) 2.759 3.164 ( 0.000 2.133 0.000) 2.133 3.252 ( 0.000 -4.525 0.000) 4.525 3.304 ( 0.000 -5.904 0.000) 5.904 3.505 ( 0.000 4.599 0.000) 4.599 3.568 ( 0.000 -8.131 0.000) 8.131 3.586 ( 0.000 -8.278 0.000) 8.278 3.770 ( 0.000 1.344 0.000) 1.344 4.068 ( 0.000 -11.461 0.000) 11.461 4.133 ( 0.000 8.639 0.000) 8.639 4.419 ( 0.000 5.322 0.000) 5.322 4.569 ( 0.000 9.642 0.000) 9.642 4.661 ( 0.000 -9.294 0.000) 9.294 4.941 ( 0.000 17.955 0.000) 17.955 5.090 ( 0.000 2.739 0.000) 2.739 5.398 ( 0.000 -1.437 0.000) 1.437 5.635 ( 0.000 5.950 0.000) 5.950 5.809 ( 0.000 1.579 0.000) 1.579 5.873 ( 0.000 5.520 0.000) 5.520 6.048 ( 0.000 16.769 0.000) 16.769 6.324 ( 0.000 -0.864 0.000) 0.864 6.666 ( 0.000 -4.732 0.000) 4.732 6.838 ( 0.000 10.579 0.000) 10.579 7.069 ( 0.000 6.997 0.000) 6.997 7.439 ( 0.000 21.523 0.000) 21.523 7.531 ( 0.000 -1.834 0.000) 1.834 7.777 ( 0.000 -3.749 0.000) 3.749 8.189 ( 0.000 -1.406 0.000) 1.406 8.283 ( 0.000 -3.053 0.000) 3.053 9.046 ( 0.000 -6.846 0.000) 6.846 9.450 ( 0.000 -7.897 0.000) 7.897 9.690 ( 0.000 0.717 0.000) 0.717 9.773 ( 0.000 1.638 0.000) 1.638 9.838 ( 0.000 -2.880 0.000) 2.880 10.610 ( 0.000 -8.505 0.000) 8.505 10.850 ( 0.000 6.507 0.000) 6.507 11.057 ( 0.000 -5.837 0.000) 5.837 11.457 ( 0.000 7.585 0.000) 7.585 11.696 ( 0.000 6.636 0.000) 6.636 11.883 ( 0.000 -4.751 0.000) 4.751 12.056 ( 0.000 -3.428 0.000) 3.428 12.779 ( 0.000 0.160 0.000) 0.160 12.920 ( 0.000 0.024 0.000) 0.024 14.492 ( 0.000 11.354 0.000) 11.354 14.860 ( 0.000 1.580 0.000) 1.580 14.956 ( 0.000 1.683 0.000) 1.683 15.279 ( 0.000 3.949 0.000) 3.949 15.384 ( 0.000 -4.953 0.000) 4.953 16.102 ( 0.000 2.275 0.000) 2.275 16.154 ( 0.000 -1.699 0.000) 1.699 16.368 ( 0.000 -1.784 0.000) 1.784 20.445 ( 0.000 6.034 0.000) 6.034 20.845 ( 0.000 3.141 0.000) 3.141 22.510 ( 0.000 -2.169 0.000) 2.169 22.940 ( 0.000 -1.728 0.000) 1.728 ======================= Grid point 12 (8/170) ======================= q-point: ( 0.09 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( 4.857 27.063 17.702) 32.700 1.051 ( 19.955 23.302 9.561) 32.134 1.860 ( 31.942 45.473 23.230) 60.230 2.750 ( 3.696 4.239 -6.953) 8.943 2.787 ( -2.458 -2.298 4.013) 5.237 2.947 ( -1.422 -1.261 -3.768) 4.220 3.021 ( -4.701 -10.211 -12.647) 16.921 3.176 ( 1.342 1.962 -5.749) 6.221 3.368 ( -5.127 -3.614 -1.159) 6.379 3.472 ( -5.793 -1.487 5.324) 8.007 3.589 ( -2.100 4.387 8.285) 9.607 3.628 ( -3.301 -12.903 7.083) 15.085 3.818 ( -1.121 0.724 8.263) 8.370 3.996 ( -6.167 -4.183 3.176) 8.100 4.188 ( -3.665 0.942 9.491) 10.217 4.431 ( 1.384 2.818 -4.596) 5.566 4.496 ( -1.195 3.990 4.102) 5.846 4.776 ( 8.691 2.625 -4.089) 9.957 4.921 ( 1.606 14.774 -2.594) 15.086 5.113 ( -0.288 -3.153 -2.308) 3.918 5.251 ( -7.943 4.788 -0.260) 9.278 5.638 ( 0.887 14.630 -3.791) 15.139 5.843 ( 9.401 -0.250 3.692) 10.103 5.974 ( 7.914 4.067 2.797) 9.327 6.197 ( 4.748 4.062 -5.545) 8.354 6.283 ( 8.189 0.406 1.496) 8.334 6.692 ( -3.709 0.659 6.156) 7.217 6.999 ( 6.586 6.601 7.255) 11.815 7.055 ( -0.225 2.221 2.111) 3.072 7.462 ( 1.146 13.156 -2.003) 13.357 7.618 ( 7.986 -3.320 -3.113) 9.191 7.784 ( 2.090 0.641 4.924) 5.388 8.169 ( -4.057 -1.447 2.280) 4.874 8.284 ( 0.660 -2.327 -0.635) 2.501 8.850 ( -11.446 7.176 -4.012) 14.093 9.358 ( -2.101 -0.234 -7.891) 8.169 9.466 ( -7.734 5.926 -11.623) 15.167 9.678 ( -3.378 1.334 1.739) 4.026 9.916 ( 3.242 -2.388 -0.300) 4.038 10.556 ( -5.231 -8.323 7.009) 12.073 10.664 ( -9.022 2.814 -12.281) 15.496 11.133 ( -4.729 -4.025 9.275) 11.162 11.581 ( -7.660 2.467 -4.151) 9.055 11.830 ( 4.374 -6.120 -0.985) 7.587 11.985 ( 22.000 -7.043 4.955) 23.625 12.131 ( 8.508 -1.432 1.477) 8.754 12.815 ( 5.731 -0.033 -1.965) 6.059 12.936 ( 3.677 0.631 -2.849) 4.694 14.528 ( 2.485 10.267 2.709) 10.905 14.842 ( -0.852 8.471 -3.938) 9.380 14.955 ( 3.043 1.883 0.906) 3.692 15.220 ( -3.988 3.560 4.363) 6.900 15.397 ( 1.842 -4.120 0.240) 4.519 16.075 ( -4.397 0.161 -0.541) 4.433 16.145 ( -0.671 0.015 -0.589) 0.893 16.346 ( -2.037 -2.277 -1.023) 3.222 20.521 ( 7.356 5.108 2.754) 9.370 20.890 ( 5.628 1.987 -2.374) 6.423 22.508 ( -0.332 -2.344 0.006) 2.367 22.915 ( -0.869 -1.772 -3.251) 3.803 ======================= Grid point 13 (9/170) ======================= q-point: ( 0.18 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.282 ( 11.252 13.694 23.285) 29.263 1.549 ( 22.590 8.733 15.243) 28.616 2.584 ( 11.008 14.474 2.905) 18.415 2.665 ( 13.561 5.504 -1.968) 14.767 2.759 ( -5.010 -0.587 1.252) 5.197 2.837 ( -1.659 -4.619 -4.167) 6.438 2.966 ( 2.588 -0.715 0.387) 2.713 3.082 ( -6.550 1.580 -7.622) 10.174 3.207 ( -0.448 3.524 -5.809) 6.809 3.384 ( -14.721 -2.889 6.571) 16.378 3.569 ( -7.452 -5.016 2.499) 9.324 3.668 ( -4.243 4.405 8.541) 10.505 3.946 ( 9.245 -11.170 -1.245) 14.553 3.997 ( -3.498 -0.541 12.779) 13.260 4.215 ( -3.824 -0.365 8.252) 9.102 4.420 ( 1.094 1.625 2.455) 3.141 4.517 ( -1.464 8.685 1.007) 8.865 4.867 ( -8.810 -0.948 -5.520) 10.439 4.915 ( 9.488 4.735 6.016) 12.192 5.033 ( 7.765 8.182 -0.673) 11.300 5.342 ( 6.950 3.362 6.476) 10.077 5.677 ( 7.104 7.154 -2.857) 10.479 5.951 ( -3.823 0.656 -8.995) 9.796 6.022 ( 5.232 -1.134 2.262) 5.812 6.241 ( 8.389 2.831 5.029) 10.182 6.536 ( 3.265 -2.647 3.999) 5.801 6.721 ( 4.457 6.502 6.434) 10.175 7.099 ( 3.069 11.285 6.909) 13.583 7.125 ( 2.729 -0.789 -0.652) 2.915 7.371 ( -7.355 3.222 -3.897) 8.925 7.639 ( 5.522 -3.044 -10.827) 12.529 7.962 ( 7.038 6.390 5.371) 10.919 8.187 ( 2.663 -4.733 7.760) 9.471 8.297 ( -0.261 -4.361 1.228) 4.538 8.776 ( 5.008 6.551 -1.680) 8.415 9.263 ( -0.905 5.679 -10.600) 12.060 9.284 ( 0.620 -0.263 -5.155) 5.199 9.660 ( -1.884 4.879 0.847) 5.298 9.895 ( -3.065 -3.524 -2.996) 5.549 10.337 ( -10.499 1.452 -16.323) 19.462 10.585 ( -4.597 -5.871 10.002) 12.476 11.121 ( -10.586 -2.191 10.239) 14.890 11.383 ( -8.719 -0.041 -5.944) 10.552 11.773 ( -4.273 -5.106 -3.205) 7.389 12.297 ( 10.582 1.407 4.829) 11.717 12.372 ( 17.997 -4.677 0.904) 18.616 12.894 ( 7.239 -0.923 -3.442) 8.069 12.962 ( 5.270 1.877 -5.528) 7.865 14.619 ( 4.411 6.881 3.550) 8.911 14.812 ( 3.091 7.355 -3.046) 8.539 15.067 ( 6.068 1.684 4.167) 7.551 15.262 ( 4.538 0.275 0.348) 4.560 15.466 ( 5.302 -1.713 2.744) 6.211 15.962 ( -8.958 -3.055 -0.113) 9.465 16.101 ( -3.774 0.860 -1.465) 4.138 16.286 ( -3.351 -2.696 -2.026) 4.754 20.717 ( 11.591 2.460 4.704) 12.749 20.954 ( 5.916 1.035 -2.104) 6.364 22.499 ( -0.628 -2.582 -0.132) 2.660 22.843 ( -1.943 -1.758 -5.734) 6.305 ======================= Grid point 14 (10/170) ======================= q-point: ( 0.27 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 13.585 6.280 18.483) 23.782 2.030 ( 16.289 3.742 14.930) 22.411 2.412 ( -2.378 -1.531 -11.612) 11.952 2.643 ( -8.784 3.444 -0.711) 9.462 2.680 ( -4.392 -2.906 -5.141) 7.360 2.843 ( -0.988 1.626 -10.027) 10.206 3.026 ( 0.077 -1.389 2.106) 2.524 3.053 ( 4.276 -1.627 -5.855) 7.431 3.098 ( -12.984 -0.530 2.998) 13.336 3.289 ( -6.355 1.547 1.891) 6.808 3.433 ( -13.801 -0.830 -0.145) 13.826 3.776 ( 4.731 1.559 8.469) 9.825 3.892 ( -2.626 4.422 5.356) 7.425 4.242 ( 9.117 -5.220 7.412) 12.857 4.352 ( 14.732 -5.885 4.460) 16.479 4.531 ( 0.641 0.574 9.532) 9.570 4.570 ( 9.565 10.183 -0.950) 14.003 4.703 ( -3.253 -2.573 0.683) 4.203 5.131 ( 3.463 -0.711 13.067) 13.537 5.237 ( 14.975 10.024 1.678) 18.098 5.535 ( 5.562 -0.641 4.671) 7.291 5.663 ( -2.949 3.213 -2.397) 4.977 5.882 ( 5.396 8.213 -1.650) 9.964 6.152 ( 9.887 -4.517 -0.281) 10.873 6.363 ( -2.617 -2.313 4.789) 5.927 6.453 ( -8.978 2.287 -1.176) 9.339 6.899 ( 4.666 0.599 9.097) 10.242 6.985 ( -16.212 -8.342 -2.588) 18.415 7.233 ( -2.520 1.070 -6.066) 6.655 7.397 ( 18.153 15.094 8.987) 25.261 7.550 ( 1.527 1.374 -15.268) 15.405 8.078 ( 2.779 4.871 4.161) 6.983 8.276 ( -3.788 -6.737 0.112) 7.730 8.323 ( 0.955 -7.092 5.184) 8.836 8.973 ( 17.252 5.491 4.039) 18.550 9.201 ( 4.151 3.781 -6.940) 8.927 9.269 ( 3.768 3.294 -4.646) 6.829 9.619 ( -1.575 7.155 -2.985) 7.911 9.786 ( -6.015 -1.381 -2.076) 6.512 10.059 ( -1.599 3.196 -12.230) 12.741 10.598 ( -6.625 -2.879 6.979) 10.044 10.990 ( -14.282 -1.526 0.301) 14.366 11.240 ( -6.071 -2.669 2.787) 7.194 11.657 ( -4.461 -4.812 -4.535) 7.976 12.506 ( 8.758 2.757 4.979) 10.445 12.634 ( 13.180 -2.831 2.157) 13.652 12.947 ( 5.269 -0.125 -5.323) 7.491 12.974 ( 4.666 1.613 -6.643) 8.277 14.733 ( 5.837 0.789 2.218) 6.294 14.882 ( 8.463 4.371 -0.795) 9.559 15.206 ( 6.680 1.980 2.180) 7.301 15.346 ( 6.723 -1.303 -1.915) 7.111 15.619 ( 7.401 0.348 5.804) 9.412 15.807 ( -10.307 -5.494 0.545) 11.693 15.993 ( -7.712 -0.703 -1.621) 7.912 16.201 ( -4.068 -1.785 -2.545) 5.120 20.960 ( 11.648 -1.308 4.896) 12.702 21.032 ( 5.949 -1.431 -0.643) 6.152 22.485 ( -0.736 -2.350 -0.425) 2.499 22.733 ( -3.005 -1.421 -6.780) 7.551 ======================= Grid point 15 (11/170) ======================= q-point: ( 0.36 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( 6.980 2.957 10.971) 13.335 2.273 ( 2.170 1.259 -1.888) 3.140 2.398 ( 5.105 1.181 6.674) 8.485 2.541 ( -6.281 0.078 -4.241) 7.580 2.555 ( -1.147 5.346 2.368) 5.959 2.741 ( 0.047 0.623 -7.639) 7.664 2.862 ( -10.526 -2.531 -1.900) 10.991 2.968 ( -8.898 1.561 -5.631) 10.645 3.045 ( -0.621 -2.970 0.089) 3.035 3.163 ( -1.573 -3.638 -3.814) 5.501 3.299 ( -5.139 -1.230 2.757) 5.960 3.667 ( -6.476 -1.916 -6.386) 9.294 4.157 ( 4.316 4.370 15.833) 16.983 4.389 ( 1.102 6.151 2.364) 6.681 4.467 ( 0.250 3.302 -3.856) 5.083 4.594 ( 7.652 5.091 2.317) 9.478 4.826 ( 13.094 -16.234 6.814) 21.942 4.973 ( 23.565 -5.648 5.536) 24.857 5.231 ( -5.374 -2.859 7.773) 9.873 5.506 ( 6.988 0.231 2.621) 7.467 5.598 ( 10.061 9.300 7.881) 15.806 5.712 ( 4.395 0.904 0.887) 4.574 5.988 ( 1.808 1.629 7.009) 7.419 6.230 ( -0.595 -1.842 -2.361) 3.053 6.242 ( -11.652 -6.279 -0.606) 13.250 6.435 ( 6.459 3.690 -1.035) 7.511 6.670 ( -18.666 -8.589 6.178) 21.456 7.033 ( 0.192 -4.514 -5.297) 6.962 7.152 ( 0.532 4.743 3.358) 5.836 7.344 ( -4.760 6.360 -16.469) 18.285 7.739 ( 11.843 6.561 6.600) 15.062 8.158 ( 1.821 6.835 -0.176) 7.076 8.192 ( -4.707 -7.940 2.124) 9.472 8.343 ( 0.136 -2.886 -0.808) 3.000 9.100 ( -4.179 8.688 -10.475) 14.236 9.259 ( 3.943 -0.812 5.573) 6.875 9.372 ( 15.039 3.133 2.104) 15.505 9.586 ( 3.256 7.653 -7.903) 11.472 9.746 ( 3.114 3.016 5.438) 6.955 10.054 ( 9.887 3.670 -3.374) 11.073 10.513 ( -10.789 -0.990 2.321) 11.080 10.714 ( -14.642 -2.873 -7.373) 16.643 11.222 ( -4.469 -2.799 7.242) 8.958 11.551 ( -2.931 -4.201 -3.529) 6.220 12.668 ( 5.684 2.672 3.449) 7.165 12.828 ( 7.950 -3.021 2.222) 8.790 12.943 ( 3.529 3.422 -7.043) 8.589 12.969 ( 2.303 -1.078 -3.928) 4.680 14.856 ( 7.933 -4.351 0.668) 9.072 15.036 ( 9.746 2.381 0.757) 10.061 15.308 ( 5.031 -2.093 -1.510) 5.654 15.411 ( 2.733 -2.671 0.093) 3.823 15.680 ( -6.009 -4.207 1.855) 7.566 15.796 ( 5.348 2.301 4.640) 7.444 15.832 ( -9.121 -2.549 -1.783) 9.637 16.109 ( -4.178 -0.390 -1.948) 4.626 21.115 ( 5.132 -5.036 0.105) 7.191 21.172 ( 8.012 -4.605 3.987) 10.064 22.469 ( -0.467 -1.493 -0.578) 1.668 22.612 ( -3.240 -0.673 -5.721) 6.609 ======================= Grid point 16 (12/170) ======================= q-point: ( 0.45 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( 0.398 4.231 3.881) 5.755 2.290 ( 3.075 3.948 -1.849) 5.335 2.396 ( -7.684 0.527 1.527) 7.852 2.466 ( 0.592 4.756 -1.457) 5.009 2.604 ( -4.627 0.655 -3.667) 5.941 2.649 ( 3.853 0.911 3.965) 5.604 2.750 ( -3.507 -1.800 -1.392) 4.180 2.897 ( 2.634 -2.228 -1.486) 3.756 3.033 ( 0.172 -4.398 -0.559) 4.436 3.118 ( -0.910 0.254 -1.190) 1.519 3.289 ( -0.745 -2.117 1.888) 2.933 3.521 ( -3.502 -1.563 -3.599) 5.259 4.292 ( -0.079 3.663 4.476) 5.784 4.328 ( -2.404 4.055 -1.768) 5.034 4.551 ( 4.606 7.369 1.743) 8.863 4.699 ( 3.274 10.545 0.950) 11.082 4.994 ( 0.584 -5.162 0.224) 5.199 5.255 ( 11.562 -11.749 2.009) 16.606 5.358 ( 5.385 -10.129 7.687) 13.809 5.552 ( 2.829 -13.819 -6.794) 15.656 5.694 ( 2.281 -5.369 2.550) 6.366 5.877 ( -3.822 -6.004 3.297) 7.844 6.023 ( -2.755 -0.535 2.142) 3.531 6.058 ( -7.923 -8.228 -1.152) 11.481 6.333 ( 12.452 6.016 11.653) 18.084 6.391 ( -1.752 3.434 4.044) 5.586 6.725 ( 1.559 6.791 -0.235) 6.972 6.808 ( -8.276 -0.397 -8.739) 12.043 7.088 ( -5.401 3.545 -10.606) 12.419 7.249 ( 1.797 3.289 3.433) 5.082 7.920 ( 3.667 -2.079 6.595) 7.827 8.049 ( -3.343 -3.942 -7.170) 8.839 8.265 ( 1.154 5.850 5.320) 7.991 8.329 ( 0.595 3.199 -2.893) 4.354 8.934 ( -2.817 7.212 -5.540) 9.520 9.301 ( -0.296 4.029 1.179) 4.208 9.521 ( 0.610 7.751 -3.079) 8.362 9.679 ( 9.975 2.652 6.081) 11.979 9.949 ( 11.649 6.152 3.388) 13.602 10.191 ( 6.076 -0.151 0.583) 6.106 10.325 ( -12.078 -0.850 -1.043) 12.152 10.418 ( -9.598 -4.202 -7.023) 12.614 11.235 ( -1.767 -2.071 3.437) 4.385 11.494 ( -0.921 -3.585 -1.214) 3.896 12.753 ( 1.887 1.939 1.110) 2.925 12.899 ( 1.147 0.949 -1.951) 2.454 12.949 ( 2.186 -0.697 0.395) 2.329 12.963 ( 1.198 -0.536 -2.024) 2.412 14.993 ( 8.262 -7.286 0.330) 11.020 15.119 ( -2.056 -1.099 -0.327) 2.354 15.366 ( 7.254 -6.953 -1.161) 10.115 15.448 ( -0.496 -2.932 2.333) 3.779 15.619 ( -6.564 -5.642 -0.779) 8.691 15.681 ( -2.349 3.251 -0.676) 4.067 15.914 ( 3.013 3.358 2.047) 4.954 16.038 ( -2.584 -0.007 -0.770) 2.696 21.176 ( 2.040 -7.473 0.277) 7.752 21.291 ( 2.882 -6.901 1.467) 7.621 22.462 ( 0.108 -0.467 -0.173) 0.510 22.523 ( -1.732 -0.060 -2.413) 2.971 ======================= Grid point 22 (13/170) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 0.000 30.959 0.000) 30.959 1.584 ( 0.000 31.012 0.000) 31.012 2.426 ( 0.000 31.640 0.000) 31.640 2.673 ( 0.000 -6.501 0.000) 6.501 2.877 ( 0.000 -2.529 0.000) 2.529 2.919 ( 0.000 2.015 0.000) 2.015 2.924 ( 0.000 -15.528 0.000) 15.528 3.094 ( 0.000 -7.532 0.000) 7.532 3.315 ( 0.000 9.609 0.000) 9.609 3.428 ( 0.000 -3.254 0.000) 3.254 3.472 ( 0.000 -5.723 0.000) 5.723 3.756 ( 0.000 -2.820 0.000) 2.820 3.760 ( 0.000 -1.199 0.000) 1.199 3.861 ( 0.000 4.138 0.000) 4.138 4.396 ( 0.000 5.822 0.000) 5.822 4.451 ( 0.000 2.050 0.000) 2.050 4.582 ( 0.000 10.349 0.000) 10.349 4.833 ( 0.000 14.279 0.000) 14.279 5.161 ( 0.000 7.307 0.000) 7.307 5.344 ( 0.000 15.212 0.000) 15.212 5.378 ( 0.000 -0.286 0.000) 0.286 5.774 ( 0.000 3.537 0.000) 3.537 5.858 ( 0.000 5.280 0.000) 5.280 6.006 ( 0.000 4.705 0.000) 4.705 6.244 ( 0.000 0.222 0.000) 0.222 6.504 ( 0.000 19.380 0.000) 19.380 6.568 ( 0.000 -3.973 0.000) 3.973 7.097 ( 0.000 9.340 0.000) 9.340 7.251 ( 0.000 12.662 0.000) 12.662 7.483 ( 0.000 -2.791 0.000) 2.791 7.670 ( 0.000 -5.692 0.000) 5.692 7.933 ( 0.000 18.645 0.000) 18.645 8.145 ( 0.000 -3.300 0.000) 3.300 8.198 ( 0.000 -2.622 0.000) 2.622 8.894 ( 0.000 -5.726 0.000) 5.726 9.257 ( 0.000 -9.020 0.000) 9.020 9.650 ( 0.000 -5.989 0.000) 5.989 9.744 ( 0.000 -5.987 0.000) 5.987 9.843 ( 0.000 4.686 0.000) 4.686 10.466 ( 0.000 -1.399 0.000) 1.399 10.845 ( 0.000 -13.400 0.000) 13.400 11.018 ( 0.000 9.062 0.000) 9.062 11.609 ( 0.000 -0.643 0.000) 0.643 11.774 ( 0.000 -1.892 0.000) 1.892 11.885 ( 0.000 10.438 0.000) 10.438 11.977 ( 0.000 -1.620 0.000) 1.620 12.777 ( 0.000 -0.471 0.000) 0.471 12.907 ( 0.000 -1.567 0.000) 1.567 14.741 ( 0.000 8.680 0.000) 8.680 14.902 ( 0.000 1.763 0.000) 1.763 15.064 ( 0.000 10.501 0.000) 10.501 15.296 ( 0.000 -1.911 0.000) 1.911 15.402 ( 0.000 7.383 0.000) 7.383 16.097 ( 0.000 -3.586 0.000) 3.586 16.116 ( 0.000 -1.804 0.000) 1.804 16.308 ( 0.000 -3.903 0.000) 3.903 20.636 ( 0.000 11.580 0.000) 11.580 20.936 ( 0.000 5.096 0.000) 5.096 22.454 ( 0.000 -2.649 0.000) 2.649 22.869 ( 0.000 -5.254 0.000) 5.254 ======================= Grid point 23 (14/170) ======================= q-point: ( 0.09 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -1.909 27.772 2.129) 27.918 1.573 ( 5.320 24.359 3.154) 25.132 2.637 ( -1.415 -7.325 -0.773) 7.500 2.675 ( 8.424 11.511 5.613) 15.329 2.809 ( 0.004 -0.352 -8.674) 8.681 2.878 ( 2.081 -1.060 0.952) 2.522 2.919 ( 3.045 3.943 0.081) 4.982 3.167 ( -1.885 -7.063 9.469) 11.963 3.268 ( -1.141 2.664 -4.815) 5.620 3.353 ( -6.244 -8.376 -0.427) 10.456 3.410 ( -0.358 -1.292 -8.060) 8.170 3.753 ( -0.407 -0.342 -1.521) 1.611 3.859 ( -2.342 4.411 17.635) 18.329 3.939 ( 0.060 1.912 8.377) 8.593 4.390 ( -7.434 11.578 1.632) 13.856 4.408 ( -1.383 0.562 2.245) 2.696 4.629 ( 6.299 9.176 2.508) 11.409 4.874 ( 3.991 9.641 -1.183) 10.502 5.114 ( -8.013 4.180 -4.424) 10.062 5.231 ( -4.085 9.781 0.754) 10.626 5.370 ( -2.750 8.199 3.392) 9.290 5.822 ( 3.221 -1.950 -0.937) 3.880 5.905 ( 5.519 9.807 -0.890) 11.288 6.016 ( 1.400 -1.848 -0.191) 2.326 6.284 ( -1.942 4.386 0.862) 4.873 6.400 ( 4.107 8.245 -1.332) 9.307 6.741 ( 7.363 4.400 5.831) 10.372 7.066 ( -5.282 2.203 -0.877) 5.790 7.261 ( 1.325 12.441 6.681) 14.184 7.497 ( -3.090 -5.655 -0.512) 6.464 7.701 ( 4.775 4.971 -1.066) 6.975 7.951 ( 1.054 8.783 2.421) 9.171 8.122 ( -2.688 -2.352 1.297) 3.800 8.227 ( 3.992 0.386 -1.204) 4.188 8.837 ( -5.480 -1.684 0.251) 5.739 9.232 ( -1.780 -8.040 -1.199) 8.321 9.621 ( 1.290 0.455 -5.177) 5.355 9.689 ( 1.328 -1.385 -4.455) 4.850 9.888 ( 0.100 3.308 -2.450) 4.118 10.396 ( -4.574 -3.888 3.991) 7.209 10.694 ( -8.483 -2.032 -10.165) 13.395 11.062 ( -3.051 -0.195 7.341) 7.952 11.574 ( -3.957 -5.009 -7.460) 9.818 11.736 ( -10.064 -5.126 3.140) 11.723 11.986 ( 19.992 6.377 1.697) 21.053 12.140 ( 10.398 3.190 4.701) 11.849 12.805 ( 4.819 -0.930 -2.216) 5.386 12.938 ( 4.886 -0.764 -2.112) 5.377 14.769 ( 0.462 9.741 3.110) 10.236 14.956 ( 3.796 3.128 3.126) 5.828 15.032 ( -0.590 6.117 -2.681) 6.705 15.289 ( -4.587 0.742 -0.246) 4.653 15.386 ( 2.652 6.660 1.824) 7.397 16.031 ( -7.780 -3.704 0.765) 8.651 16.124 ( -0.461 -3.248 -1.741) 3.714 16.280 ( -1.729 -3.784 -1.559) 4.443 20.680 ( 3.564 9.521 2.530) 10.476 20.953 ( 3.460 3.689 -2.549) 5.664 22.450 ( -0.166 -2.586 -0.485) 2.636 22.846 ( -0.638 -4.990 -3.267) 5.999 ======================= Grid point 24 (15/170) ======================= q-point: ( 0.18 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( 4.962 16.439 12.930) 21.496 1.772 ( 12.910 12.818 6.579) 19.346 2.505 ( -2.722 -8.621 -13.138) 15.948 2.619 ( -4.227 -4.664 -1.410) 6.451 2.742 ( -2.925 -3.891 -2.891) 5.662 2.949 ( 2.390 0.360 -0.826) 2.554 3.032 ( -3.973 -1.915 -4.941) 6.624 3.187 ( -9.795 -7.103 2.552) 12.365 3.254 ( 3.231 8.970 -0.546) 9.549 3.308 ( 0.452 -1.151 -0.439) 1.312 3.381 ( 6.683 -3.765 6.453) 10.024 3.699 ( -0.605 2.520 -2.290) 3.458 3.957 ( -0.941 7.742 6.386) 10.080 4.065 ( -4.888 5.428 19.050) 20.402 4.261 ( -11.333 7.548 3.552) 14.072 4.442 ( -3.008 1.804 12.976) 13.441 4.783 ( 4.158 14.334 2.964) 15.216 4.876 ( -8.371 2.881 -4.038) 9.730 4.957 ( 10.461 2.911 -4.396) 11.714 5.256 ( 3.347 9.077 5.494) 11.126 5.442 ( 5.036 5.760 3.224) 8.303 5.792 ( -2.559 -0.992 -4.936) 5.648 5.942 ( 3.182 2.876 -1.822) 4.660 6.061 ( 0.092 2.465 2.002) 3.177 6.274 ( -1.396 -0.966 5.061) 5.338 6.507 ( 3.572 0.911 0.998) 3.819 6.831 ( -4.101 -4.426 4.366) 7.448 7.028 ( -0.126 6.486 1.387) 6.634 7.323 ( -4.498 -7.334 -0.932) 8.654 7.450 ( 3.611 13.661 5.101) 15.023 7.727 ( 2.399 9.656 -5.446) 11.342 7.988 ( -2.600 -5.672 5.254) 8.157 8.144 ( 1.311 -1.687 4.525) 5.004 8.285 ( 4.630 5.548 -1.417) 7.363 8.825 ( 5.213 2.649 1.603) 6.063 9.193 ( -0.923 -5.113 -1.504) 5.409 9.583 ( 7.599 12.777 -12.945) 19.712 9.721 ( 4.184 2.112 -0.386) 4.702 9.802 ( -6.243 -1.677 0.179) 6.467 10.355 ( -5.766 -0.938 -12.929) 14.188 10.511 ( -2.290 1.010 6.551) 7.013 11.062 ( -7.723 -2.648 7.982) 11.418 11.354 ( -9.683 -3.167 -9.492) 13.925 11.623 ( -5.959 -9.122 -1.588) 11.011 12.326 ( 18.573 1.280 1.606) 18.686 12.366 ( 10.576 4.276 5.892) 12.839 12.865 ( 6.421 -1.640 -3.659) 7.570 12.993 ( 6.162 0.522 -4.584) 7.698 14.791 ( -2.499 8.505 3.204) 9.426 14.958 ( -0.757 5.941 -2.764) 6.596 15.125 ( 7.525 3.187 5.065) 9.614 15.246 ( 1.067 -1.901 0.325) 2.204 15.501 ( 7.479 6.309 2.833) 10.186 15.876 ( -12.365 -4.913 0.626) 13.320 16.035 ( -8.000 -7.012 -1.440) 10.735 16.240 ( 0.090 -1.852 -3.702) 4.140 20.789 ( 5.068 4.058 4.206) 7.736 20.974 ( 2.543 0.758 -2.410) 3.585 22.441 ( 0.303 -2.220 -1.043) 2.471 22.780 ( -1.324 -4.259 -5.708) 7.244 ======================= Grid point 25 (16/170) ======================= q-point: ( 0.27 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( 8.373 8.892 13.097) 17.908 2.099 ( 14.627 2.737 10.762) 18.365 2.360 ( 1.435 -2.517 -9.287) 9.728 2.544 ( -4.441 -5.711 0.804) 7.279 2.666 ( -4.576 -2.201 -1.056) 5.186 2.840 ( -4.906 -1.458 -7.078) 8.734 2.966 ( -2.478 -4.817 -3.435) 6.414 3.043 ( -7.985 -2.729 -1.591) 8.587 3.172 ( -1.963 4.858 -6.023) 7.983 3.259 ( -7.021 -1.751 -2.073) 7.527 3.407 ( -7.091 -2.483 -0.645) 7.540 3.740 ( -1.639 -4.946 -2.098) 5.617 4.081 ( -0.110 5.499 16.397) 17.295 4.158 ( 4.067 9.857 6.126) 12.298 4.235 ( 5.607 -5.083 5.765) 9.514 4.586 ( -5.734 3.185 21.213) 22.205 4.731 ( -3.688 6.112 -4.620) 8.503 4.886 ( 9.240 15.988 0.838) 18.485 5.121 ( 7.065 -0.157 2.625) 7.539 5.394 ( 5.400 4.134 1.898) 7.060 5.559 ( 4.586 3.169 3.708) 6.695 5.724 ( -0.941 1.544 0.914) 2.026 5.949 ( -3.509 -8.142 -0.480) 8.879 6.103 ( 3.603 0.780 3.128) 4.835 6.250 ( -7.638 -4.190 7.915) 11.770 6.514 ( -5.876 1.016 1.209) 6.085 6.718 ( -7.849 -8.599 -6.444) 13.307 7.027 ( -2.425 7.412 4.274) 8.893 7.232 ( -2.269 -2.919 -1.378) 3.945 7.620 ( 6.150 8.094 -8.381) 13.175 7.718 ( 5.044 10.631 6.441) 13.415 8.015 ( -2.997 -5.721 7.771) 10.104 8.197 ( -0.263 -4.597 3.508) 5.789 8.325 ( 2.562 6.715 -1.277) 7.299 9.030 ( 14.289 2.600 3.439) 14.925 9.193 ( 3.487 -2.379 -0.875) 4.312 9.554 ( 3.620 14.701 -12.595) 19.694 9.735 ( -3.848 -2.617 4.790) 6.678 9.776 ( 5.728 9.823 -4.494) 12.227 10.139 ( 1.229 4.290 -12.185) 12.976 10.572 ( -2.507 1.071 5.906) 6.505 10.950 ( -13.154 -1.966 -1.952) 13.443 11.155 ( -6.036 -5.201 0.626) 7.992 11.513 ( -3.918 -8.742 -3.860) 10.328 12.577 ( 9.061 1.762 4.582) 10.305 12.592 ( 12.375 0.864 1.281) 12.471 12.914 ( 5.219 -1.698 -4.162) 6.888 13.021 ( 5.085 1.551 -6.365) 8.293 14.776 ( -1.109 3.152 0.427) 3.368 14.950 ( 1.761 1.554 0.477) 2.397 15.265 ( 4.187 1.574 -1.524) 4.725 15.319 ( 4.855 0.511 4.431) 6.593 15.655 ( -1.535 1.094 6.410) 6.682 15.706 ( -0.012 -1.760 -1.419) 2.260 15.871 ( -10.935 -9.014 -0.147) 14.172 16.190 ( -0.593 -0.350 -4.835) 4.884 20.913 ( 4.315 -2.968 3.927) 6.546 20.983 ( 0.579 -3.119 0.212) 3.179 22.438 ( 1.099 -1.492 -1.540) 2.410 22.685 ( -1.904 -3.144 -6.638) 7.588 ======================= Grid point 26 (17/170) ======================= q-point: ( 0.36 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( 5.734 3.218 8.220) 10.526 2.328 ( 3.398 3.755 2.692) 5.735 2.403 ( 6.025 -0.555 3.653) 7.068 2.518 ( -4.751 -0.712 3.293) 5.824 2.620 ( 5.260 0.617 -0.960) 5.382 2.732 ( -3.300 -2.621 -2.140) 4.727 2.808 ( -6.588 -1.875 -6.123) 9.187 2.919 ( -5.044 -6.153 -5.500) 9.672 3.016 ( -8.366 3.123 -6.045) 10.784 3.158 ( -1.575 1.523 -0.965) 2.394 3.305 ( -4.215 1.761 0.688) 4.620 3.616 ( -7.480 -3.202 -2.904) 8.639 4.261 ( 3.664 -4.132 10.638) 11.986 4.312 ( 12.123 -10.143 0.878) 15.831 4.517 ( 10.228 -0.218 8.933) 13.582 4.616 ( -0.327 5.494 1.368) 5.671 4.733 ( 1.929 7.022 4.695) 8.664 5.033 ( 6.107 10.042 0.764) 11.778 5.149 ( -7.597 -5.611 5.159) 10.762 5.423 ( -10.029 -8.231 1.681) 13.083 5.680 ( 3.050 -1.389 0.126) 3.354 5.704 ( 2.535 -2.414 -0.111) 3.502 5.854 ( -5.148 -14.199 0.301) 15.107 6.176 ( -11.551 1.593 1.163) 11.718 6.255 ( 5.551 3.945 7.043) 9.798 6.476 ( -4.055 -6.242 14.213) 16.044 6.591 ( 3.824 10.104 -0.870) 10.838 7.003 ( -0.225 1.142 -8.709) 8.787 7.234 ( -0.312 1.848 4.523) 4.896 7.498 ( -4.309 7.207 -10.294) 13.285 7.856 ( 1.053 4.414 2.280) 5.079 8.030 ( -3.318 -5.478 1.713) 6.630 8.285 ( 6.294 0.401 5.303) 8.240 8.358 ( 2.083 6.826 1.561) 7.305 9.199 ( 0.340 0.259 -1.055) 1.138 9.260 ( 2.265 0.340 0.134) 2.294 9.488 ( 10.494 7.427 -5.899) 14.145 9.759 ( -1.397 4.188 4.018) 5.969 9.874 ( 13.021 12.354 -2.804) 18.167 10.130 ( 8.161 3.834 -6.154) 10.917 10.516 ( -8.476 -0.673 -1.843) 8.700 10.674 ( -13.717 1.979 -5.237) 14.816 11.141 ( -2.851 -4.688 6.799) 8.736 11.427 ( -1.887 -7.325 -3.021) 8.145 12.722 ( 4.537 1.190 2.071) 5.127 12.756 ( 7.266 -3.174 0.467) 7.943 12.944 ( 3.348 -0.120 -2.136) 3.973 13.018 ( 3.548 2.725 -6.200) 7.646 14.783 ( 2.476 -2.344 -0.773) 3.496 15.022 ( 5.896 -4.247 1.385) 7.398 15.209 ( -7.594 -3.710 -1.454) 8.576 15.417 ( 0.200 -0.571 2.538) 2.609 15.585 ( -3.045 -4.119 -0.409) 5.139 15.736 ( -5.056 -3.490 1.909) 6.434 15.865 ( 8.136 3.916 3.311) 9.618 16.120 ( -1.697 0.649 -4.139) 4.521 20.969 ( 0.584 -8.047 -0.033) 8.069 21.033 ( 1.581 -8.172 4.648) 9.534 22.442 ( 1.455 -0.817 -1.515) 2.254 22.585 ( -1.979 -1.874 -5.499) 6.137 ======================= Grid point 27 (18/170) ======================= q-point: ( 0.45 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 3.757 3.868 5.976) 8.049 2.393 ( 2.562 5.595 -1.331) 6.296 2.421 ( -5.260 2.021 0.878) 5.703 2.546 ( 4.308 1.231 3.227) 5.522 2.625 ( -2.049 1.066 -2.838) 3.659 2.637 ( -3.067 1.594 -4.156) 5.405 2.745 ( -4.724 1.566 3.488) 6.077 2.781 ( -1.575 -7.302 -4.758) 8.857 2.956 ( 3.780 -2.148 -0.387) 4.365 3.139 ( -0.027 1.053 -0.811) 1.329 3.280 ( -0.972 0.902 0.992) 1.656 3.486 ( -4.235 -1.763 -1.912) 4.970 4.421 ( 3.505 3.926 6.314) 8.220 4.434 ( 1.622 0.816 -1.644) 2.449 4.660 ( 11.398 -5.278 0.115) 12.561 4.785 ( 6.779 -7.691 -2.551) 10.564 4.825 ( 5.947 -2.136 6.394) 8.989 5.020 ( -5.173 -7.858 -2.713) 9.791 5.121 ( -10.903 -16.964 7.866) 21.646 5.195 ( -7.065 -6.483 -0.122) 9.590 5.531 ( -7.507 -3.021 -7.424) 10.982 5.750 ( -0.130 -7.092 0.443) 7.107 5.881 ( 0.806 -4.979 4.384) 6.683 6.028 ( -2.412 -1.282 -4.170) 4.985 6.474 ( 6.189 8.463 6.261) 12.212 6.556 ( -0.232 7.917 16.118) 17.959 6.797 ( 0.025 1.195 -6.679) 6.785 6.883 ( 8.792 6.048 2.304) 10.918 7.191 ( -8.651 2.941 -7.333) 11.716 7.350 ( -0.944 7.088 -1.862) 7.389 7.853 ( -1.519 -1.591 0.750) 2.324 7.977 ( -1.820 -3.457 -1.314) 4.121 8.389 ( 2.077 4.768 0.785) 5.259 8.446 ( 2.971 6.676 3.076) 7.929 9.081 ( -2.827 5.217 -5.014) 7.769 9.319 ( 0.996 -1.892 2.228) 3.088 9.668 ( 7.857 4.950 2.659) 9.660 9.782 ( 1.211 6.338 1.129) 6.551 10.055 ( 8.833 -1.579 -1.022) 9.031 10.223 ( 9.316 8.223 -1.593) 12.528 10.300 ( -8.456 -4.842 -5.409) 11.145 10.439 ( -12.808 10.764 -1.013) 16.761 11.178 ( -0.622 -3.340 3.395) 4.803 11.388 ( -0.448 -6.313 -0.966) 6.402 12.771 ( 1.113 -1.280 -0.201) 1.708 12.832 ( 2.147 -5.022 0.157) 5.464 12.974 ( 1.197 2.162 0.378) 2.500 13.005 ( 1.543 3.608 -3.046) 4.967 14.828 ( 3.333 -7.366 -0.683) 8.114 15.074 ( -6.272 -4.175 -0.030) 7.534 15.159 ( 9.523 -8.371 1.014) 12.720 15.330 ( -10.449 -10.403 -0.152) 14.745 15.576 ( 1.104 3.071 -0.138) 3.267 15.741 ( 0.884 2.180 0.994) 2.554 15.989 ( 3.939 3.458 1.692) 5.507 16.055 ( -2.037 1.424 -1.949) 3.159 20.972 ( -0.077 -10.759 0.196) 10.761 21.088 ( 0.615 -11.454 1.862) 11.621 22.451 ( 1.025 -0.535 -0.481) 1.253 22.513 ( -1.223 -0.941 -2.347) 2.809 ======================= Grid point 33 (19/170) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( 0.000 22.787 0.000) 22.787 2.173 ( 0.000 24.737 0.000) 24.737 2.525 ( 0.000 -4.883 0.000) 4.883 2.661 ( 0.000 -4.589 0.000) 4.589 2.767 ( 0.000 -3.774 0.000) 3.774 2.810 ( 0.000 3.678 0.000) 3.678 2.866 ( 0.000 -8.146 0.000) 8.146 2.935 ( 0.000 -6.365 0.000) 6.365 3.260 ( 0.000 -12.915 0.000) 12.915 3.283 ( 0.000 -9.388 0.000) 9.388 3.577 ( 0.000 4.648 0.000) 4.648 3.645 ( 0.000 -2.414 0.000) 2.414 3.784 ( 0.000 3.186 0.000) 3.186 3.953 ( 0.000 -0.335 0.000) 0.335 4.568 ( 0.000 23.937 0.000) 23.937 4.767 ( 0.000 14.575 0.000) 14.575 4.815 ( 0.000 9.374 0.000) 9.374 5.124 ( 0.000 11.770 0.000) 11.770 5.336 ( 0.000 8.687 0.000) 8.687 5.377 ( 0.000 -0.336 0.000) 0.336 5.566 ( 0.000 2.123 0.000) 2.123 5.733 ( 0.000 -5.568 0.000) 5.568 5.947 ( 0.000 -5.267 0.000) 5.267 6.009 ( 0.000 4.684 0.000) 4.684 6.383 ( 0.000 10.255 0.000) 10.255 6.515 ( 0.000 -0.170 0.000) 0.170 6.907 ( 0.000 17.583 0.000) 17.583 7.182 ( 0.000 0.451 0.000) 0.451 7.398 ( 0.000 -5.151 0.000) 5.151 7.482 ( 0.000 -1.347 0.000) 1.347 7.670 ( 0.000 12.139 0.000) 12.139 7.950 ( 0.000 -7.679 0.000) 7.679 8.050 ( 0.000 -3.172 0.000) 3.172 8.333 ( 0.000 4.606 0.000) 4.606 8.859 ( 0.000 2.519 0.000) 2.519 9.097 ( 0.000 -6.074 0.000) 6.074 9.449 ( 0.000 -9.177 0.000) 9.177 9.589 ( 0.000 -8.416 0.000) 8.416 9.983 ( 0.000 8.772 0.000) 8.772 10.525 ( 0.000 -15.735 0.000) 15.735 10.624 ( 0.000 14.837 0.000) 14.837 11.230 ( 0.000 10.730 0.000) 10.730 11.385 ( 0.000 -15.704 0.000) 15.704 11.681 ( 0.000 -8.691 0.000) 8.691 12.100 ( 0.000 9.251 0.000) 9.251 12.102 ( 0.000 8.992 0.000) 8.992 12.758 ( 0.000 -0.972 0.000) 0.972 12.847 ( 0.000 -3.966 0.000) 3.966 14.835 ( 0.000 2.022 0.000) 2.022 14.907 ( 0.000 -1.247 0.000) 1.247 15.340 ( 0.000 5.628 0.000) 5.628 15.362 ( 0.000 13.680 0.000) 13.680 15.570 ( 0.000 7.844 0.000) 7.844 16.008 ( 0.000 -8.327 0.000) 8.327 16.025 ( 0.000 -1.938 0.000) 1.938 16.204 ( 0.000 -5.914 0.000) 5.914 20.897 ( 0.000 11.452 0.000) 11.452 21.039 ( 0.000 3.875 0.000) 3.875 22.427 ( 0.000 0.976 0.000) 0.976 22.714 ( 0.000 -9.074 0.000) 9.074 ======================= Grid point 34 (20/170) ======================= q-point: ( 0.09 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( -6.730 18.020 -5.122) 19.906 2.101 ( -0.188 23.262 -2.998) 23.455 2.459 ( -2.792 -6.225 -6.430) 9.375 2.658 ( -1.823 -6.588 0.725) 6.874 2.701 ( -4.295 -2.214 -4.093) 6.333 2.860 ( -1.820 -8.149 0.596) 8.371 2.900 ( 1.949 -4.010 3.308) 5.552 3.031 ( 6.718 -4.567 8.208) 11.548 3.213 ( -2.156 -4.484 -10.388) 11.518 3.257 ( 1.432 -3.837 1.014) 4.220 3.480 ( 1.080 2.507 -9.095) 9.496 3.720 ( 7.921 -7.502 -5.607) 12.266 3.920 ( -5.678 2.687 26.757) 27.484 4.012 ( -2.514 3.314 13.148) 13.790 4.576 ( -0.384 22.451 2.270) 22.569 4.769 ( -4.429 16.493 3.697) 17.473 4.841 ( 5.352 9.343 -0.458) 10.777 5.098 ( -3.164 9.312 -0.611) 9.854 5.207 ( -9.243 3.600 -6.086) 11.637 5.374 ( 0.060 5.047 2.539) 5.650 5.564 ( -6.515 4.729 4.289) 9.122 5.738 ( 1.772 -5.427 -2.870) 6.390 5.897 ( -4.547 -4.306 1.979) 6.568 6.070 ( 3.311 3.981 5.813) 7.785 6.405 ( -4.774 4.826 1.037) 6.867 6.458 ( -2.233 -2.152 3.361) 4.573 6.856 ( -5.630 5.040 -7.252) 10.474 7.213 ( 1.942 -0.061 -1.852) 2.685 7.235 ( -2.169 3.648 -0.972) 4.354 7.652 ( -0.940 11.196 8.905) 14.336 7.743 ( 10.926 0.668 1.737) 11.083 7.926 ( -3.798 -6.773 -0.739) 7.800 8.037 ( 0.756 -0.898 -0.169) 1.186 8.350 ( 2.318 1.860 -1.548) 3.351 8.861 ( 1.438 3.500 -1.111) 3.943 9.069 ( -1.358 -6.804 -0.535) 6.958 9.489 ( 4.264 -6.293 0.814) 7.645 9.639 ( 4.352 -4.113 2.055) 6.331 10.025 ( 2.965 7.259 0.354) 7.849 10.392 ( -6.394 -3.759 -4.615) 8.735 10.653 ( -0.028 6.832 -0.151) 6.834 11.160 ( -5.186 7.362 -2.448) 9.332 11.359 ( -1.877 -13.582 -3.326) 14.109 11.588 ( -10.870 -8.675 -1.055) 13.947 12.167 ( 12.922 8.685 -1.143) 15.612 12.252 ( 9.809 5.684 4.114) 12.060 12.783 ( 4.339 -0.653 -1.903) 4.783 12.893 ( 5.736 -3.505 -1.151) 6.820 14.891 ( 3.937 2.952 3.476) 6.025 14.975 ( 5.498 -1.087 4.010) 6.891 15.209 ( -8.654 9.038 -1.361) 12.587 15.346 ( -7.401 4.305 -1.197) 8.645 15.597 ( 4.659 10.895 0.362) 11.855 15.949 ( -8.876 -3.274 1.560) 9.589 16.001 ( -2.951 -6.883 -2.216) 7.810 16.179 ( -0.410 -6.062 -1.798) 6.336 20.892 ( -2.064 9.273 2.053) 9.719 21.027 ( -1.012 2.592 -1.013) 2.961 22.428 ( 1.169 1.331 -1.439) 2.282 22.701 ( 0.552 -8.337 -3.070) 8.902 ======================= Grid point 35 (21/170) ======================= q-point: ( 0.18 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( 0.718 10.826 1.376) 10.937 2.097 ( 3.029 14.840 -1.860) 15.260 2.345 ( -0.480 -5.749 -7.076) 9.130 2.581 ( -5.062 -0.578 -2.829) 5.828 2.628 ( -3.325 -4.148 1.329) 5.480 2.824 ( 0.441 -11.850 -4.565) 12.707 2.983 ( -0.991 -4.256 6.810) 8.092 3.032 ( -6.332 -2.990 -4.075) 8.101 3.099 ( -0.624 -4.441 -1.545) 4.743 3.336 ( 3.880 -5.235 -9.328) 11.379 3.430 ( 2.884 5.127 -1.268) 6.018 3.710 ( 0.192 -6.451 -8.230) 10.459 4.127 ( -5.726 6.131 22.502) 24.015 4.138 ( -6.889 1.638 24.359) 25.367 4.597 ( -6.341 15.393 9.008) 18.929 4.655 ( -13.626 23.844 4.031) 27.757 4.971 ( 5.582 2.953 -2.868) 6.935 4.999 ( -1.724 7.628 1.282) 7.925 5.085 ( 2.031 6.570 -4.138) 8.025 5.407 ( -1.426 4.731 6.909) 8.494 5.533 ( -0.607 1.598 2.863) 3.335 5.703 ( -0.568 -4.851 -3.367) 5.933 5.896 ( -4.548 -6.556 3.779) 8.829 6.102 ( -9.731 -6.707 5.572) 13.066 6.251 ( -7.672 5.468 -0.116) 9.422 6.522 ( -1.076 -3.169 2.541) 4.201 6.717 ( 0.322 1.489 -3.995) 4.275 7.098 ( -2.375 -11.424 -4.156) 12.387 7.308 ( -1.095 15.634 2.637) 15.893 7.754 ( 1.915 9.618 9.508) 13.660 7.826 ( -3.445 -0.083 -3.779) 5.115 7.912 ( 6.393 0.272 1.508) 6.574 8.073 ( 1.263 -1.291 2.278) 2.907 8.366 ( 1.991 -1.814 -1.448) 3.058 8.913 ( 7.691 4.235 -0.649) 8.804 9.080 ( 1.604 -5.131 1.789) 5.666 9.587 ( 5.296 -1.450 2.432) 6.006 9.732 ( 1.930 -1.105 3.182) 3.882 10.039 ( 4.482 12.861 -5.970) 14.870 10.301 ( 0.321 -3.369 -5.896) 6.798 10.641 ( -0.322 11.192 1.124) 11.253 11.049 ( -7.525 2.188 0.649) 7.863 11.237 ( -5.138 -8.326 -10.338) 14.234 11.385 ( -9.953 -12.609 -1.229) 16.111 12.391 ( 14.399 4.200 -0.174) 15.000 12.463 ( 11.289 3.477 2.717) 12.120 12.842 ( 6.010 0.244 -2.608) 6.556 12.972 ( 6.675 -2.595 -3.189) 7.840 14.958 ( -4.565 6.754 3.817) 9.002 15.076 ( -5.600 5.205 -2.121) 7.934 15.149 ( 7.575 -1.128 5.700) 9.547 15.225 ( -0.945 0.505 0.685) 1.272 15.684 ( 4.136 6.213 0.650) 7.491 15.779 ( -13.875 -2.676 1.379) 14.197 15.871 ( -8.331 -4.860 -1.909) 9.832 16.168 ( 2.269 -5.483 -4.022) 7.169 20.877 ( -3.531 3.969 3.294) 6.251 20.981 ( -3.977 -0.382 -0.147) 3.998 22.433 ( 2.293 1.879 -2.649) 3.976 22.663 ( 0.490 -6.539 -5.326) 8.448 ======================= Grid point 36 (22/170) ======================= q-point: ( 0.27 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( 5.865 4.134 8.119) 10.835 2.171 ( 8.209 2.870 0.601) 8.717 2.331 ( 5.549 0.538 -2.242) 6.009 2.502 ( -1.765 0.683 -0.444) 1.944 2.587 ( -3.790 -3.369 1.594) 5.316 2.750 ( -2.142 -8.514 -5.491) 10.355 2.905 ( -3.253 2.022 -5.139) 6.410 2.986 ( -4.489 -0.663 0.904) 4.627 3.128 ( 0.868 -7.094 5.598) 9.078 3.250 ( 0.239 -4.852 -8.147) 9.485 3.354 ( -6.647 2.435 -6.937) 9.912 3.609 ( -2.093 -8.069 -6.695) 10.691 4.189 ( -9.505 3.499 10.047) 14.266 4.248 ( -10.195 10.807 13.218) 19.886 4.460 ( -10.693 8.661 11.120) 17.692 4.688 ( -7.622 11.081 21.751) 25.573 4.920 ( 0.548 10.629 -3.665) 11.256 5.082 ( 3.396 -5.311 -3.419) 7.171 5.117 ( 2.595 0.290 -2.290) 3.473 5.463 ( -3.846 4.013 5.090) 7.537 5.564 ( -3.668 -11.051 1.048) 11.691 5.649 ( -3.513 -4.505 -0.715) 5.757 5.750 ( -6.643 2.245 4.774) 8.483 6.107 ( 0.372 -4.752 7.146) 8.589 6.233 ( 1.283 1.369 9.567) 9.749 6.378 ( -12.190 -6.900 -5.546) 15.066 6.762 ( 7.450 7.514 -3.714) 11.214 7.075 ( 2.177 -5.675 -3.943) 7.245 7.280 ( -5.742 10.586 5.544) 13.258 7.686 ( -7.881 -4.243 -0.687) 8.977 7.945 ( 6.568 12.725 4.678) 15.065 7.991 ( 0.927 2.638 2.363) 3.661 8.121 ( 2.648 -2.841 3.307) 5.101 8.382 ( 1.949 -2.622 -0.699) 3.341 9.084 ( 11.778 1.661 1.419) 11.979 9.143 ( 2.636 -1.998 3.018) 4.478 9.694 ( 2.509 0.366 5.507) 6.063 9.720 ( -3.764 2.839 -2.568) 5.369 10.085 ( 10.191 13.695 -8.456) 19.050 10.246 ( 5.809 5.025 -10.368) 12.903 10.650 ( -3.967 7.272 1.663) 8.448 10.925 ( -7.436 0.185 -3.115) 8.064 11.031 ( -6.673 -6.084 -1.638) 9.177 11.282 ( -1.727 -12.905 -2.822) 13.322 12.583 ( 9.721 0.996 0.077) 9.772 12.637 ( 8.458 0.515 -0.406) 8.483 12.908 ( 5.455 1.633 -1.703) 5.943 13.024 ( 5.297 -1.362 -4.370) 7.001 14.860 ( -7.020 4.452 -1.084) 8.383 14.961 ( -5.821 -0.105 0.348) 5.833 15.255 ( 0.175 -0.560 1.361) 1.482 15.344 ( 3.446 -1.353 3.547) 5.127 15.580 ( -8.388 -3.092 1.433) 9.054 15.681 ( -6.947 -6.355 4.264) 10.336 15.840 ( 7.053 8.496 -1.514) 11.146 16.149 ( 1.744 -3.879 -5.246) 6.753 20.854 ( -4.096 -2.000 3.310) 5.633 20.907 ( -6.316 -3.691 2.258) 7.656 22.440 ( 2.620 1.765 -3.264) 4.542 22.602 ( -0.034 -4.457 -6.135) 7.583 ======================= Grid point 37 (23/170) ======================= q-point: ( 0.36 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 4.604 3.229 6.205) 8.374 2.359 ( 5.462 -2.034 9.456) 11.108 2.430 ( 5.574 3.089 0.941) 6.442 2.551 ( 5.963 2.661 -1.018) 6.609 2.571 ( 3.138 -4.708 2.100) 6.035 2.664 ( 0.433 -2.708 -5.878) 6.486 2.797 ( -2.582 3.902 -5.758) 7.419 2.902 ( -6.068 3.809 -0.293) 7.170 3.101 ( -6.525 3.540 -5.609) 9.304 3.175 ( -1.234 0.427 -2.195) 2.554 3.264 ( -0.195 -7.872 2.568) 8.282 3.504 ( -3.400 -7.631 -3.579) 9.088 4.132 ( -6.903 1.247 1.896) 7.267 4.135 ( -3.994 -2.556 2.765) 5.489 4.531 ( -9.220 -6.606 17.171) 20.579 4.797 ( -2.905 9.296 13.504) 16.650 4.898 ( -22.630 -24.131 0.015) 33.082 4.941 ( 3.787 12.461 -1.955) 13.170 5.015 ( -6.606 -5.254 -5.932) 10.316 5.410 ( -4.497 8.940 2.680) 10.360 5.539 ( 3.706 -9.052 -0.866) 9.819 5.693 ( 0.142 -3.600 0.236) 3.610 5.713 ( 0.942 5.144 -2.063) 5.621 6.091 ( -4.252 -8.172 -8.433) 12.489 6.358 ( 3.941 4.709 18.551) 19.541 6.461 ( 5.308 1.412 18.981) 19.760 6.806 ( 4.639 8.892 -4.699) 11.075 7.019 ( 0.556 -0.694 -9.735) 9.776 7.278 ( -3.115 4.210 5.203) 7.382 7.561 ( -7.189 -2.637 -0.269) 7.662 7.961 ( -5.335 5.509 0.187) 7.671 7.991 ( -2.190 1.538 -1.433) 3.036 8.297 ( 10.861 1.302 5.069) 12.056 8.439 ( 3.506 -0.204 4.120) 5.414 9.197 ( -1.139 -0.079 2.950) 3.163 9.239 ( 3.597 -1.641 0.503) 3.986 9.644 ( 3.995 6.793 -4.748) 9.200 9.788 ( 2.072 -0.108 5.427) 5.810 10.100 ( 4.323 6.200 -11.133) 13.456 10.276 ( 9.149 4.842 -10.343) 14.633 10.497 ( -8.304 5.793 -3.464) 10.701 10.813 ( -5.173 8.288 0.064) 9.770 11.020 ( -0.178 -6.856 5.464) 8.769 11.243 ( -0.229 -9.780 -1.901) 9.965 12.692 ( 3.960 -1.890 0.258) 4.396 12.711 ( 3.923 -2.142 -3.190) 5.492 12.979 ( 4.215 2.783 0.569) 5.083 13.050 ( 3.976 0.251 -3.865) 5.551 14.758 ( -3.281 0.168 -1.988) 3.840 14.910 ( -1.520 -5.084 0.331) 5.317 15.173 ( -8.498 -0.679 0.312) 8.531 15.277 ( -9.764 -8.304 0.029) 12.818 15.608 ( 3.873 3.666 2.326) 5.818 15.699 ( 2.048 -0.929 4.023) 4.609 15.958 ( 7.376 4.700 0.511) 8.761 16.113 ( 0.867 -1.554 -4.559) 4.894 20.812 ( -4.373 -5.740 1.338) 7.339 20.857 ( -4.601 -7.370 4.605) 9.833 22.442 ( 2.004 0.931 -2.815) 3.578 22.535 ( -0.499 -2.700 -5.043) 5.742 ======================= Grid point 38 (24/170) ======================= q-point: ( 0.45 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( 4.727 3.371 8.466) 10.265 2.467 ( -2.203 1.344 3.908) 4.683 2.498 ( 0.290 2.034 -2.558) 3.281 2.528 ( 2.059 -1.559 -5.143) 5.755 2.660 ( 5.647 0.661 0.368) 5.697 2.717 ( 0.091 6.613 -1.608) 6.806 2.735 ( 1.878 4.018 -1.301) 4.622 2.832 ( -1.506 5.997 2.205) 6.565 2.967 ( -3.638 5.355 -2.217) 6.843 3.138 ( -0.412 -1.180 -1.465) 1.925 3.277 ( -0.970 -2.912 1.207) 3.298 3.431 ( -2.733 -4.305 -0.535) 5.127 4.159 ( 8.626 -14.397 0.656) 16.796 4.202 ( 10.695 -16.884 0.545) 19.994 4.432 ( -17.473 -19.846 5.981) 27.110 4.496 ( -22.486 -24.362 -1.780) 33.201 4.851 ( -2.431 5.516 -2.382) 6.481 4.932 ( 0.429 7.384 8.802) 11.497 4.993 ( 2.521 8.296 -3.425) 9.323 5.399 ( -1.033 11.298 2.603) 11.640 5.569 ( 1.386 -3.075 -3.301) 4.720 5.587 ( -2.217 -0.880 -2.296) 3.311 5.818 ( 2.231 -1.535 5.861) 6.456 5.967 ( -0.399 -4.439 -7.571) 8.785 6.628 ( 3.375 4.872 15.759) 16.836 6.694 ( 0.165 5.729 9.062) 10.723 6.847 ( 1.250 1.988 -4.245) 4.852 6.925 ( 5.931 -1.788 -6.082) 8.681 7.258 ( -3.738 5.110 0.375) 6.342 7.465 ( -3.368 1.174 -0.835) 3.663 7.873 ( -3.683 2.636 -0.539) 4.561 7.923 ( -1.817 -0.920 -2.227) 3.018 8.482 ( 6.523 3.945 1.893) 7.854 8.546 ( 1.302 2.538 4.491) 5.321 9.142 ( -2.717 1.272 -2.378) 3.828 9.252 ( -1.278 -3.849 0.978) 4.172 9.763 ( 8.810 4.219 3.238) 10.291 9.879 ( 1.805 1.268 3.374) 4.031 9.993 ( -1.574 -0.530 -9.682) 9.823 10.157 ( -5.140 -5.699 -6.994) 10.383 10.538 ( 9.512 15.742 1.425) 18.447 10.705 ( -8.372 12.426 -1.104) 15.024 11.085 ( 1.035 -5.545 3.059) 6.417 11.227 ( -0.193 -8.808 -0.634) 8.833 12.713 ( 0.306 -3.048 -0.953) 3.208 12.729 ( 1.280 -4.103 -0.744) 4.362 13.037 ( 1.535 2.864 0.927) 3.379 13.064 ( 1.756 1.716 -1.804) 3.047 14.714 ( -0.445 -2.575 -0.968) 2.787 14.904 ( 0.078 -9.366 -0.126) 9.367 15.084 ( -2.022 -1.119 0.474) 2.359 15.137 ( -6.720 -5.881 -0.099) 8.931 15.667 ( 1.533 4.545 0.516) 4.824 15.768 ( 1.675 0.254 1.523) 2.278 16.052 ( 3.299 2.366 0.506) 4.092 16.083 ( -0.093 0.897 -1.836) 2.045 20.770 ( -1.960 -7.080 0.673) 7.377 20.847 ( -1.543 -10.024 1.962) 10.330 22.444 ( 0.940 0.020 -1.028) 1.393 22.485 ( -0.504 -1.564 -2.092) 2.660 ======================= Grid point 44 (25/170) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( 0.000 -13.795 0.000) 13.795 2.481 ( 0.000 13.795 0.000) 13.795 2.540 ( 0.000 -8.531 0.000) 8.531 2.540 ( 0.000 8.531 0.000) 8.531 2.636 ( 0.000 -18.069 0.000) 18.069 2.636 ( 0.000 18.069 0.000) 18.069 2.931 ( 0.000 -1.491 0.000) 1.491 2.931 ( 0.000 1.491 0.000) 1.491 3.066 ( 0.000 -3.648 0.000) 3.648 3.066 ( 0.000 3.648 0.000) 3.648 3.619 ( 0.000 -0.874 0.000) 0.874 3.619 ( 0.000 0.874 0.000) 0.874 3.881 ( 0.000 -5.224 0.000) 5.224 3.881 ( 0.000 5.224 0.000) 5.224 4.900 ( 0.000 -2.654 0.000) 2.654 4.900 ( 0.000 2.654 0.000) 2.654 5.184 ( 0.000 -18.322 0.000) 18.322 5.184 ( 0.000 18.322 0.000) 18.322 5.356 ( 0.000 -1.197 0.000) 1.197 5.356 ( 0.000 1.197 0.000) 1.197 5.571 ( 0.000 -8.525 0.000) 8.525 5.571 ( 0.000 8.525 0.000) 8.525 5.986 ( 0.000 -5.215 0.000) 5.215 5.986 ( 0.000 5.215 0.000) 5.215 6.530 ( 0.000 -1.779 0.000) 1.779 6.530 ( 0.000 1.779 0.000) 1.779 7.161 ( 0.000 -3.335 0.000) 3.335 7.161 ( 0.000 3.335 0.000) 3.335 7.367 ( 0.000 -5.825 0.000) 5.825 7.367 ( 0.000 5.825 0.000) 5.825 7.818 ( 0.000 -3.647 0.000) 3.647 7.818 ( 0.000 3.647 0.000) 3.647 8.207 ( 0.000 -13.675 0.000) 13.675 8.207 ( 0.000 13.675 0.000) 13.675 8.966 ( 0.000 -6.481 0.000) 6.481 8.966 ( 0.000 6.481 0.000) 6.481 9.418 ( 0.000 -5.868 0.000) 5.868 9.418 ( 0.000 5.868 0.000) 5.868 10.214 ( 0.000 -12.959 0.000) 12.959 10.214 ( 0.000 12.959 0.000) 12.959 11.005 ( 0.000 -19.246 0.000) 19.246 11.005 ( 0.000 19.246 0.000) 19.246 11.464 ( 0.000 -11.056 0.000) 11.056 11.464 ( 0.000 11.056 0.000) 11.056 12.214 ( 0.000 -0.172 0.000) 0.172 12.214 ( 0.000 0.172 0.000) 0.172 12.767 ( 0.000 -2.501 0.000) 2.501 12.767 ( 0.000 2.501 0.000) 2.501 14.871 ( 0.000 -1.746 0.000) 1.746 14.871 ( 0.000 1.746 0.000) 1.746 15.467 ( 0.000 -3.842 0.000) 3.842 15.467 ( 0.000 3.842 0.000) 3.842 15.782 ( 0.000 -12.038 0.000) 12.038 15.782 ( 0.000 12.038 0.000) 12.038 16.070 ( 0.000 -5.707 0.000) 5.707 16.070 ( 0.000 5.707 0.000) 5.707 21.059 ( 0.000 -3.017 0.000) 3.017 21.059 ( 0.000 3.017 0.000) 3.017 22.521 ( 0.000 -7.751 0.000) 7.751 22.521 ( 0.000 7.751 0.000) 7.751 ======================= Grid point 46 (26/170) ======================= q-point: ( 0.09 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( -7.350 -10.149 -10.802) 16.545 2.305 ( -7.350 10.149 -10.802) 16.545 2.522 ( -2.981 -13.068 -2.118) 13.570 2.522 ( -2.981 13.068 -2.118) 13.570 2.632 ( 0.009 -6.589 1.503) 6.759 2.632 ( 0.009 6.589 1.503) 6.759 2.949 ( -2.344 -6.015 2.759) 7.021 2.949 ( -2.344 6.015 2.759) 7.021 3.171 ( 7.704 -2.220 0.117) 8.019 3.171 ( 7.704 2.220 0.117) 8.019 3.559 ( 3.912 -5.638 -9.565) 11.772 3.559 ( 3.912 5.638 -9.565) 11.772 3.993 ( -4.983 -3.422 22.158) 22.968 3.993 ( -4.983 3.422 22.158) 22.968 4.908 ( 1.302 -3.321 -1.136) 3.743 4.908 ( 1.302 3.321 -1.136) 3.743 5.169 ( -2.615 -12.506 -0.288) 12.780 5.169 ( -2.615 12.506 -0.288) 12.780 5.279 ( -6.324 -12.003 1.186) 13.619 5.279 ( -6.324 12.003 1.186) 13.619 5.598 ( 2.083 -7.182 0.395) 7.489 5.598 ( 2.083 7.182 0.395) 7.489 6.013 ( -7.277 -9.192 6.690) 13.498 6.013 ( -7.277 9.192 6.690) 13.498 6.433 ( -6.277 -0.867 1.180) 6.446 6.433 ( -6.277 0.867 1.180) 6.446 7.001 ( -8.156 -9.343 -6.307) 13.914 7.001 ( -8.156 9.343 -6.307) 13.914 7.562 ( 12.750 -14.341 0.690) 19.202 7.562 ( 12.750 14.341 0.690) 19.202 7.811 ( -1.209 -2.555 2.897) 4.047 7.811 ( -1.209 2.555 2.897) 4.047 8.208 ( -0.435 -12.653 0.502) 12.670 8.208 ( -0.435 12.653 0.502) 12.670 8.947 ( 0.706 -4.741 -1.937) 5.170 8.947 ( 0.706 4.741 -1.937) 5.170 9.507 ( 7.120 -6.474 3.289) 10.170 9.507 ( 7.120 6.474 3.289) 10.170 10.206 ( -0.820 -9.833 0.271) 9.871 10.206 ( -0.820 9.833 0.271) 9.871 10.978 ( 0.222 -18.318 -3.659) 18.682 10.978 ( 0.222 18.318 -3.659) 18.682 11.384 ( -8.788 -10.010 -2.145) 13.491 11.384 ( -8.788 10.010 -2.145) 13.491 12.297 ( 9.667 -2.485 0.035) 9.981 12.297 ( 9.667 2.485 0.035) 9.981 12.809 ( 5.296 -3.386 -0.748) 6.330 12.809 ( 5.296 3.386 -0.748) 6.330 14.938 ( 5.471 -1.938 3.765) 6.918 14.938 ( 5.471 1.938 3.765) 6.918 15.364 ( -10.198 -4.149 -1.155) 11.070 15.364 ( -10.198 4.149 -1.155) 11.070 15.797 ( -0.802 -8.732 0.114) 8.770 15.797 ( -0.802 8.732 0.114) 8.770 16.028 ( -2.910 -7.063 -1.337) 7.755 16.028 ( -2.910 7.063 -1.337) 7.755 21.029 ( -4.290 -3.062 0.857) 5.340 21.029 ( -4.290 3.062 0.857) 5.340 22.523 ( 1.898 -7.347 -2.478) 7.983 22.523 ( 1.898 7.347 -2.478) 7.983 ======================= Grid point 48 (27/170) ======================= q-point: ( 0.18 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( -1.594 -9.067 -6.909) 11.510 2.123 ( -1.594 9.067 -6.909) 11.510 2.459 ( -1.126 -12.766 -2.571) 13.071 2.459 ( -1.126 12.766 -2.571) 13.071 2.627 ( -2.576 -4.905 1.246) 5.679 2.627 ( -2.576 4.905 1.246) 5.679 2.946 ( -2.677 -2.258 4.894) 6.018 2.946 ( -2.677 2.258 4.894) 6.018 3.179 ( 3.492 -7.649 -11.749) 14.448 3.179 ( 3.492 7.649 -11.749) 14.448 3.557 ( 0.859 -6.781 -3.642) 7.745 3.557 ( 0.859 6.781 -3.642) 7.745 4.162 ( -7.806 -0.872 26.587) 27.723 4.162 ( -7.806 0.872 26.587) 27.723 4.897 ( -1.037 -8.158 -2.214) 8.517 4.897 ( -1.037 8.158 -2.214) 8.517 5.074 ( -6.838 -7.561 -1.144) 10.258 5.074 ( -6.838 7.561 -1.144) 10.258 5.260 ( -7.110 -16.810 9.976) 20.800 5.260 ( -7.110 16.810 9.976) 20.800 5.605 ( 0.318 -5.812 -3.324) 6.703 5.605 ( 0.318 5.812 -3.324) 6.703 5.889 ( -10.695 -8.510 7.496) 15.588 5.889 ( -10.695 8.510 7.496) 15.588 6.403 ( -4.755 -6.735 -0.300) 8.250 6.403 ( -4.755 6.735 -0.300) 8.250 6.866 ( 1.637 -9.990 -4.153) 10.942 6.866 ( 1.637 9.990 -4.153) 10.942 7.621 ( -5.018 -12.590 1.266) 13.612 7.621 ( -5.018 12.590 1.266) 13.612 7.913 ( 8.129 -0.724 3.106) 8.732 7.913 ( 8.129 0.724 3.106) 8.732 8.206 ( -0.361 -11.083 0.544) 11.102 8.206 ( -0.361 11.083 0.544) 11.102 8.987 ( 5.660 -3.511 0.277) 6.666 8.987 ( 5.660 3.511 0.277) 6.666 9.653 ( 4.852 -5.625 4.036) 8.454 9.653 ( 4.852 5.625 4.036) 8.454 10.216 ( 3.849 -5.108 -2.096) 6.731 10.216 ( 3.849 5.108 -2.096) 6.731 10.960 ( 2.427 -16.513 -3.245) 17.003 10.960 ( 2.427 16.513 -3.245) 17.003 11.161 ( -13.066 -7.761 -5.067) 16.020 11.161 ( -13.066 7.761 -5.067) 16.020 12.472 ( 11.580 -2.524 -0.668) 11.871 12.472 ( 11.580 2.524 -0.668) 11.871 12.894 ( 6.634 -4.044 -1.768) 7.968 12.894 ( 6.634 4.044 -1.768) 7.968 15.069 ( -1.207 -3.840 4.154) 5.785 15.069 ( -1.207 3.840 4.154) 5.785 15.205 ( -2.519 -3.432 -0.148) 4.260 15.205 ( -2.519 3.432 -0.148) 4.260 15.702 ( -11.067 -2.088 1.197) 11.326 15.702 ( -11.067 2.088 1.197) 11.326 16.003 ( 2.841 -9.674 -3.193) 10.576 16.003 ( 2.841 9.674 -3.193) 10.576 20.949 ( -7.577 -2.600 2.030) 8.264 20.949 ( -7.577 2.600 2.030) 8.264 22.522 ( 2.558 -6.085 -4.297) 7.876 22.522 ( 2.558 6.085 -4.297) 7.876 ======================= Grid point 50 (28/170) ======================= q-point: ( 0.27 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( 5.813 -5.014 0.883) 7.727 2.126 ( 5.813 5.014 0.883) 7.727 2.443 ( 0.698 -7.382 0.648) 7.443 2.443 ( 0.698 7.382 0.648) 7.443 2.594 ( -0.606 -3.969 -1.623) 4.331 2.594 ( -0.606 3.969 -1.623) 4.331 2.975 ( -1.675 -4.744 6.110) 7.915 2.975 ( -1.675 4.744 6.110) 7.915 3.093 ( 1.938 -8.366 -10.500) 13.564 3.093 ( 1.938 8.366 -10.500) 13.564 3.451 ( -5.886 -5.985 -6.025) 10.332 3.451 ( -5.886 5.985 -6.025) 10.332 4.300 ( -10.094 -4.916 21.215) 24.003 4.300 ( -10.094 4.916 21.215) 24.003 4.746 ( -18.135 -19.550 -0.473) 26.671 4.746 ( -18.135 19.550 -0.473) 26.671 4.974 ( -6.487 -11.058 3.000) 13.166 4.974 ( -6.487 11.058 3.000) 13.166 5.227 ( -3.130 -15.265 2.775) 15.828 5.227 ( -3.130 15.265 2.775) 15.828 5.597 ( 1.245 -3.684 -0.451) 3.915 5.597 ( 1.245 3.684 -0.451) 3.915 5.904 ( -0.550 -10.824 5.407) 12.112 5.904 ( -0.550 10.824 5.407) 12.112 6.291 ( -4.036 -3.091 2.467) 5.651 6.291 ( -4.036 3.091 2.467) 5.651 6.928 ( 7.066 -7.597 -2.842) 10.758 6.928 ( 7.066 7.597 -2.842) 10.758 7.519 ( -9.349 -10.467 2.875) 14.326 7.519 ( -9.349 10.467 2.875) 14.326 8.054 ( 3.333 -3.470 2.735) 5.534 8.054 ( 3.333 3.470 2.735) 5.534 8.222 ( 3.104 -11.359 1.013) 11.819 8.222 ( 3.104 11.359 1.013) 11.819 9.109 ( 6.619 -1.244 2.666) 7.244 9.109 ( 6.619 1.244 2.666) 7.244 9.729 ( 0.252 -1.665 2.909) 3.361 9.729 ( 0.252 1.665 2.909) 3.361 10.266 ( 8.011 -3.890 -8.269) 12.153 10.266 ( 8.011 3.890 -8.269) 12.153 10.877 ( -10.004 -9.771 -4.100) 14.573 10.877 ( -10.004 9.771 -4.100) 14.573 11.009 ( 1.801 -9.273 -1.018) 9.501 11.009 ( 1.801 9.273 -1.018) 9.501 12.616 ( 7.958 -1.774 -1.804) 8.350 12.616 ( 7.958 1.774 -1.804) 8.350 12.970 ( 5.620 -3.352 -1.899) 6.814 12.970 ( 5.620 3.352 -1.899) 6.814 14.940 ( -9.635 -2.420 -0.913) 9.976 14.940 ( -9.635 2.420 -0.913) 9.976 15.273 ( -1.423 -2.859 1.797) 3.664 15.273 ( -1.423 2.859 1.797) 3.664 15.584 ( -3.238 -2.766 4.328) 6.072 15.584 ( -3.238 2.766 4.328) 6.072 16.023 ( 4.328 -7.760 -3.922) 9.712 16.023 ( 4.328 7.760 -3.922) 9.712 20.847 ( -8.677 -1.490 3.237) 9.380 20.847 ( -8.677 1.490 3.237) 9.380 22.507 ( 1.988 -4.212 -4.980) 6.819 22.507 ( 1.988 4.212 -4.980) 6.819 ======================= Grid point 52 (29/170) ======================= q-point: ( 0.36 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 5.825 -4.662 7.494) 10.575 2.281 ( 5.825 4.662 7.494) 10.575 2.492 ( 2.675 -2.744 2.013) 4.328 2.492 ( 2.675 2.744 2.013) 4.328 2.600 ( 6.532 -2.528 -3.943) 8.037 2.600 ( 6.532 2.528 -3.943) 8.037 2.969 ( -0.361 -7.608 -5.997) 9.694 2.969 ( -0.361 7.608 -5.997) 9.694 3.069 ( 0.789 -4.080 4.132) 5.860 3.069 ( 0.789 4.080 4.132) 5.860 3.306 ( -3.895 -9.078 -4.645) 10.916 3.306 ( -3.895 9.078 -4.645) 10.916 4.253 ( -17.552 -9.710 9.490) 22.190 4.253 ( -17.552 9.710 9.490) 22.190 4.400 ( -22.000 -16.535 -0.478) 27.526 4.400 ( -22.000 16.535 -0.478) 27.526 4.932 ( -4.605 -3.950 6.342) 8.776 4.932 ( -4.605 3.950 6.342) 8.776 5.255 ( 4.276 -14.858 -1.295) 15.515 5.255 ( 4.276 14.858 -1.295) 15.515 5.601 ( -0.758 -5.778 0.838) 5.887 5.601 ( -0.758 5.778 0.838) 5.887 5.894 ( 1.041 -9.991 -5.737) 11.568 5.894 ( 1.041 9.991 -5.737) 11.568 6.442 ( 4.418 -3.023 19.265) 19.995 6.442 ( 4.418 3.023 19.265) 19.995 6.955 ( 3.416 -5.167 -7.972) 10.095 6.955 ( 3.416 5.167 -7.972) 10.095 7.427 ( -7.082 -8.322 4.633) 11.870 7.427 ( -7.082 8.322 4.633) 11.870 8.027 ( -4.917 -0.602 -2.405) 5.507 8.027 ( -4.917 0.602 -2.405) 5.507 8.368 ( 8.932 -5.049 5.252) 11.527 8.368 ( 8.932 5.049 5.252) 11.527 9.207 ( 0.299 -1.162 2.955) 3.189 9.207 ( 0.299 1.162 2.955) 3.189 9.756 ( 2.817 -3.351 -0.074) 4.378 9.756 ( 2.817 3.351 -0.074) 4.378 10.217 ( 0.347 -5.453 -13.164) 14.253 10.217 ( 0.347 5.453 -13.164) 14.253 10.771 ( -0.174 -13.181 0.799) 13.206 10.771 ( -0.174 13.181 0.799) 13.206 11.035 ( 0.582 -9.058 0.753) 9.108 11.035 ( 0.582 9.058 0.753) 9.108 12.677 ( 2.945 -0.589 -2.264) 3.761 12.677 ( 2.945 0.589 -2.264) 3.761 13.032 ( 4.222 -1.818 -0.894) 4.683 13.032 ( 4.222 1.818 -0.894) 4.683 14.806 ( -5.478 -4.308 -1.401) 7.108 14.806 ( -5.478 4.308 -1.401) 7.108 15.175 ( -8.428 -1.491 0.295) 8.564 15.175 ( -8.428 1.491 0.295) 8.564 15.671 ( 4.149 -2.041 3.964) 6.090 15.671 ( 4.149 2.041 3.964) 6.090 16.053 ( 4.232 -3.934 -2.801) 6.421 16.053 ( 4.232 3.934 -2.801) 6.421 20.759 ( -6.846 -1.199 3.356) 7.718 20.759 ( -6.846 1.199 3.356) 7.718 22.479 ( 1.005 -2.360 -4.121) 4.854 22.479 ( 1.005 2.360 -4.121) 4.854 ======================= Grid point 54 (30/170) ======================= q-point: ( 0.45 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.426 ( 1.215 -3.943 8.128) 9.115 2.426 ( 1.215 3.943 8.128) 9.115 2.515 ( 1.503 -0.499 -4.349) 4.629 2.515 ( 1.503 0.499 -4.349) 4.629 2.714 ( 7.264 -3.145 -0.092) 7.916 2.714 ( 7.264 3.145 -0.092) 7.916 2.906 ( 0.122 -6.091 -3.794) 7.177 2.906 ( 0.122 6.091 -3.794) 7.177 3.127 ( -0.252 -8.819 3.473) 9.481 3.127 ( -0.252 8.819 3.473) 9.481 3.240 ( 0.012 -12.802 -1.978) 12.953 3.240 ( 0.012 12.802 -1.978) 12.953 4.050 ( -11.183 -1.690 1.818) 11.456 4.050 ( -11.183 1.690 1.818) 11.456 4.128 ( -9.983 -2.428 -0.372) 10.281 4.128 ( -9.983 2.428 -0.372) 10.281 4.952 ( -0.552 -2.754 2.862) 4.010 4.952 ( -0.552 2.754 2.862) 4.010 5.296 ( 1.874 -14.481 -0.668) 14.617 5.296 ( 1.874 14.481 -0.668) 14.617 5.607 ( -0.657 -4.265 2.052) 4.778 5.607 ( -0.657 4.265 2.052) 4.778 5.854 ( 1.263 -5.219 -4.175) 6.802 5.854 ( 1.263 5.219 -4.175) 6.802 6.719 ( 2.251 -3.583 17.381) 17.889 6.719 ( 2.251 3.583 17.381) 17.889 6.880 ( 1.487 -2.175 -11.448) 11.747 6.880 ( 1.487 2.175 -11.448) 11.747 7.393 ( -2.631 -6.374 2.393) 7.299 7.393 ( -2.631 6.374 2.393) 7.299 7.918 ( -3.341 -0.850 -2.583) 4.308 7.918 ( -3.341 0.850 -2.583) 4.308 8.550 ( 5.378 -2.014 4.022) 7.011 8.550 ( 5.378 2.014 4.022) 7.011 9.177 ( -3.502 -2.704 -0.389) 4.442 9.177 ( -3.502 2.704 -0.389) 4.442 9.841 ( 6.294 -3.162 1.118) 7.131 9.841 ( 6.294 3.162 1.118) 7.131 10.051 ( -4.772 -4.319 -7.111) 9.592 10.051 ( -4.772 4.319 -7.111) 9.592 10.820 ( 2.681 -7.733 0.644) 8.210 10.820 ( 2.681 7.733 0.644) 8.210 11.037 ( -0.904 -6.769 0.579) 6.854 11.037 ( -0.904 6.769 0.579) 6.854 12.679 ( 0.353 -0.325 -1.074) 1.176 12.679 ( 0.353 0.325 -1.074) 1.176 13.075 ( 1.698 -0.661 -0.127) 1.826 13.075 ( 1.698 0.661 -0.127) 1.826 14.740 ( -1.586 -5.013 -0.656) 5.299 14.740 ( -1.586 5.013 -0.656) 5.299 15.078 ( -3.457 -0.632 0.082) 3.515 15.078 ( -3.457 0.632 0.082) 3.515 15.745 ( 1.488 -2.486 1.140) 3.113 15.745 ( 1.488 2.486 1.140) 3.113 16.086 ( 1.950 -0.718 -0.807) 2.229 16.086 ( 1.950 0.718 -0.807) 2.229 20.711 ( -2.584 -2.018 1.480) 3.597 20.711 ( -2.584 2.018 1.480) 3.597 22.455 ( 0.264 -1.062 -1.628) 1.962 22.455 ( 0.264 1.062 -1.628) 1.962 ======================= Grid point 99 (31/170) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.673 ( -1.533 0.000 32.447) 32.483 0.740 ( 4.803 0.000 35.528) 35.851 1.417 ( -6.753 0.000 67.219) 67.557 2.573 ( 0.037 0.000 -8.692) 8.692 2.865 ( -3.126 0.000 -3.235) 4.499 2.900 ( 0.831 0.000 -3.959) 4.045 2.976 ( 5.491 0.000 -5.996) 8.130 3.131 ( -2.905 0.000 -12.001) 12.347 3.380 ( 0.163 0.000 -7.434) 7.436 3.660 ( 3.903 0.000 0.739) 3.972 3.716 ( 0.293 0.000 8.213) 8.218 3.858 ( -1.880 0.000 4.616) 4.985 4.160 ( 2.031 0.000 -2.814) 3.471 4.207 ( 6.639 0.000 6.115) 9.026 4.325 ( 15.350 0.000 10.300) 18.485 4.357 ( -10.456 0.000 1.075) 10.511 4.457 ( -2.254 0.000 -5.141) 5.613 4.554 ( -7.414 0.000 19.007) 20.402 4.682 ( 1.432 0.000 1.771) 2.277 5.131 ( 1.983 0.000 5.161) 5.529 5.313 ( -4.948 0.000 1.910) 5.304 5.357 ( -5.949 0.000 -5.802) 8.310 5.704 ( 5.488 0.000 4.536) 7.120 5.783 ( 0.640 0.000 -1.890) 1.995 6.137 ( -6.485 0.000 -7.214) 9.701 6.261 ( -0.758 0.000 6.921) 6.962 6.743 ( -1.173 0.000 -2.916) 3.143 6.964 ( 3.386 0.000 0.640) 3.446 7.054 ( 0.779 0.000 -4.799) 4.862 7.333 ( 10.506 0.000 -5.834) 12.018 7.421 ( 0.595 0.000 1.170) 1.312 8.015 ( -6.156 0.000 -8.274) 10.313 8.177 ( -4.886 0.000 1.158) 5.021 8.367 ( -9.656 0.000 5.418) 11.072 8.376 ( 4.343 0.000 4.517) 6.266 9.381 ( -1.402 0.000 2.296) 2.690 9.458 ( -5.219 0.000 -13.545) 14.515 9.693 ( 5.508 0.000 -3.304) 6.423 9.848 ( 10.300 0.000 -2.502) 10.599 10.604 ( -2.653 0.000 -12.779) 13.052 10.819 ( -3.121 0.000 8.642) 9.188 11.278 ( 3.519 0.000 6.912) 7.757 11.602 ( -2.271 0.000 -1.599) 2.777 11.885 ( -9.745 0.000 6.870) 11.923 12.022 ( -0.703 0.000 7.054) 7.089 12.057 ( 4.286 0.000 -2.335) 4.880 12.731 ( -0.244 0.000 -3.251) 3.260 12.864 ( -0.213 0.000 -5.150) 5.154 14.455 ( -2.405 0.000 1.383) 2.775 14.602 ( -0.605 0.000 -0.099) 0.613 14.982 ( -2.685 0.000 8.740) 9.143 15.192 ( 7.186 0.000 -1.127) 7.274 15.404 ( 2.319 0.000 -4.263) 4.853 16.034 ( 0.900 0.000 -3.571) 3.683 16.181 ( -0.532 0.000 0.846) 0.999 16.361 ( 0.822 0.000 -2.443) 2.577 20.438 ( 0.158 0.000 5.232) 5.234 20.849 ( -1.248 0.000 -1.292) 1.796 22.535 ( 0.279 0.000 0.228) 0.361 22.899 ( -0.074 0.000 -5.341) 5.342 ======================= Grid point 100 (32/170) ======================= q-point: ( 0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( 13.918 0.000 26.361) 29.809 1.312 ( 17.882 0.000 29.409) 34.419 2.188 ( 16.031 0.000 50.555) 53.035 2.477 ( 3.590 0.000 -14.888) 15.315 2.690 ( -0.292 0.000 -14.563) 14.566 2.888 ( 1.115 0.000 -2.900) 3.107 2.943 ( -3.252 0.000 -8.922) 9.496 3.091 ( 4.498 0.000 5.205) 6.880 3.198 ( -11.673 0.000 -3.801) 12.276 3.636 ( -0.916 0.000 -3.263) 3.389 3.760 ( -13.727 0.000 1.731) 13.836 3.866 ( 0.153 0.000 13.516) 13.517 4.082 ( -6.355 0.000 -4.108) 7.567 4.259 ( -1.915 0.000 -3.031) 3.585 4.308 ( -10.276 0.000 15.990) 19.008 4.349 ( 1.976 0.000 -4.445) 4.864 4.389 ( -2.271 0.000 -5.630) 6.071 4.722 ( 0.573 0.000 7.004) 7.027 4.876 ( 10.153 0.000 22.294) 24.497 5.114 ( -11.732 0.000 -6.122) 13.233 5.297 ( 9.335 0.000 7.538) 11.999 5.353 ( 5.883 0.000 2.344) 6.333 5.922 ( -0.511 0.000 -13.965) 13.974 5.960 ( 11.973 0.000 7.190) 13.966 6.003 ( 13.163 0.000 2.248) 13.353 6.435 ( 13.618 0.000 10.762) 17.357 6.693 ( -2.540 0.000 -0.121) 2.543 6.953 ( -7.422 0.000 -4.306) 8.580 7.026 ( 5.618 0.000 -4.730) 7.344 7.358 ( 11.010 0.000 -19.711) 22.578 7.479 ( -1.060 0.000 5.678) 5.776 7.851 ( -1.091 0.000 -2.359) 2.599 8.181 ( 3.133 0.000 6.103) 6.860 8.347 ( 0.117 0.000 -0.458) 0.473 8.501 ( 4.442 0.000 5.853) 7.348 9.231 ( -1.610 0.000 -14.769) 14.856 9.357 ( -4.844 0.000 2.412) 5.412 9.679 ( -3.405 0.000 -0.944) 3.533 9.939 ( 1.717 0.000 -0.670) 1.843 10.336 ( -9.899 0.000 -16.778) 19.480 10.841 ( -6.157 0.000 10.193) 11.908 11.376 ( -1.714 0.000 8.643) 8.811 11.464 ( -10.822 0.000 -3.741) 11.450 11.850 ( -4.904 0.000 -2.469) 5.491 12.189 ( 15.877 0.000 3.164) 16.189 12.217 ( 6.554 0.000 9.101) 11.215 12.741 ( 7.015 0.000 -5.646) 9.005 12.813 ( 2.762 0.000 -7.683) 8.165 14.492 ( 3.233 0.000 3.550) 4.802 14.614 ( 3.162 0.000 -1.572) 3.531 15.063 ( 0.001 0.000 8.341) 8.341 15.202 ( 0.853 0.000 -1.941) 2.120 15.427 ( 4.861 0.000 -0.270) 4.868 15.999 ( 0.664 0.000 -5.179) 5.221 16.157 ( -3.757 0.000 0.833) 3.848 16.331 ( -0.885 0.000 -2.922) 3.053 20.573 ( 7.968 0.000 6.800) 10.476 20.850 ( 3.605 0.000 -1.947) 4.097 22.542 ( -0.242 0.000 0.941) 0.972 22.822 ( -0.877 0.000 -7.048) 7.102 ======================= Grid point 101 (33/170) ======================= q-point: ( 0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( 12.226 0.000 20.681) 24.025 1.880 ( 16.661 0.000 23.161) 28.531 2.342 ( 0.642 0.000 -15.485) 15.499 2.455 ( 1.510 0.000 -15.405) 15.479 2.713 ( -0.224 0.000 -3.019) 3.028 2.784 ( -5.912 0.000 -6.722) 8.952 3.044 ( 9.663 0.000 10.753) 14.457 3.095 ( -2.772 0.000 5.242) 5.930 3.269 ( 5.232 0.000 15.938) 16.775 3.499 ( -21.707 0.000 3.219) 21.945 3.611 ( -0.706 0.000 2.165) 2.278 3.895 ( -6.690 0.000 -9.144) 11.330 3.900 ( -14.383 0.000 10.930) 18.064 4.233 ( 3.733 0.000 -3.509) 5.123 4.237 ( 6.503 0.000 1.550) 6.686 4.400 ( 7.538 0.000 -2.075) 7.818 4.483 ( 5.443 0.000 5.279) 7.582 4.775 ( 5.740 0.000 -4.760) 7.457 4.953 ( -4.659 0.000 5.289) 7.049 5.273 ( 7.998 0.000 19.944) 21.488 5.485 ( 11.589 0.000 -3.956) 12.246 5.592 ( 7.731 0.000 18.335) 19.898 5.661 ( -8.932 0.000 -12.108) 15.046 6.141 ( 4.927 0.000 5.342) 7.267 6.294 ( 13.138 0.000 2.041) 13.295 6.579 ( -11.051 0.000 -3.354) 11.548 6.862 ( 2.358 0.000 -0.165) 2.364 6.920 ( 24.443 0.000 15.235) 28.803 7.039 ( 6.956 0.000 -8.538) 11.013 7.261 ( 9.110 0.000 -25.268) 26.860 7.407 ( -13.903 0.000 2.762) 14.175 7.882 ( 7.504 0.000 -5.054) 9.047 8.330 ( 1.319 0.000 -4.265) 4.464 8.372 ( 4.926 0.000 6.333) 8.024 8.724 ( 13.907 0.000 15.078) 20.513 9.116 ( 5.897 0.000 -11.880) 13.263 9.285 ( -7.362 0.000 1.445) 7.503 9.578 ( -7.715 0.000 -1.093) 7.792 9.905 ( -5.940 0.000 1.941) 6.249 9.976 ( -9.296 0.000 -17.117) 19.479 10.836 ( -7.641 0.000 7.898) 10.989 11.210 ( -13.514 0.000 -6.662) 15.067 11.423 ( -5.421 0.000 10.416) 11.742 11.719 ( -4.979 0.000 -6.025) 7.816 12.428 ( 6.457 0.000 9.950) 11.861 12.487 ( 14.742 0.000 5.558) 15.755 12.766 ( 5.335 0.000 -9.793) 11.152 12.814 ( 8.211 0.000 -6.649) 10.565 14.624 ( 7.829 0.000 4.182) 8.876 14.668 ( 6.575 0.000 -2.270) 6.956 15.145 ( 2.437 0.000 3.370) 4.159 15.219 ( 4.607 0.000 -2.591) 5.286 15.562 ( 7.009 0.000 6.473) 9.541 15.942 ( -0.170 0.000 -5.792) 5.794 16.080 ( -7.347 0.000 1.112) 7.431 16.268 ( -2.746 0.000 -3.416) 4.383 20.812 ( 12.302 0.000 6.359) 13.848 20.917 ( 7.444 0.000 -1.873) 7.676 22.546 ( -1.348 0.000 1.833) 2.275 22.721 ( -1.828 0.000 -7.365) 7.589 ======================= Grid point 102 (34/170) ======================= q-point: ( 0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( 10.832 0.000 13.334) 17.179 2.201 ( 1.641 0.000 -9.065) 9.212 2.322 ( 4.584 0.000 -15.104) 15.784 2.330 ( 11.212 0.000 16.211) 19.710 2.646 ( -4.858 0.000 -2.470) 5.450 2.652 ( -0.965 0.000 -3.092) 3.239 3.093 ( -7.273 0.000 -2.129) 7.578 3.110 ( -6.714 0.000 3.397) 7.525 3.192 ( -17.681 0.000 4.205) 18.174 3.292 ( -12.643 0.000 -3.047) 13.005 3.457 ( -8.745 0.000 5.459) 10.309 3.691 ( -5.255 0.000 -10.407) 11.659 4.136 ( 10.497 0.000 16.695) 19.721 4.265 ( 3.795 0.000 -3.353) 5.064 4.415 ( 1.619 0.000 -3.576) 3.925 4.495 ( 3.438 0.000 1.299) 3.675 4.704 ( 22.765 0.000 12.544) 25.993 4.867 ( 21.370 0.000 -13.279) 25.160 5.121 ( 5.292 0.000 13.931) 14.902 5.457 ( -1.698 0.000 -1.223) 2.092 5.540 ( 10.624 0.000 -2.621) 10.942 5.596 ( 2.215 0.000 8.092) 8.390 5.854 ( 4.894 0.000 8.615) 9.908 6.325 ( 6.543 0.000 12.104) 13.759 6.336 ( -8.269 0.000 -5.366) 9.858 6.368 ( -3.199 0.000 -7.617) 8.262 6.956 ( 6.776 0.000 -4.815) 8.313 7.017 ( 3.938 0.000 -8.075) 8.984 7.145 ( 5.345 0.000 -11.265) 12.469 7.145 ( -18.533 0.000 1.863) 18.627 7.484 ( 20.529 0.000 13.844) 24.761 7.936 ( 9.562 0.000 -9.825) 13.710 8.300 ( 0.625 0.000 -3.929) 3.979 8.410 ( -4.484 0.000 2.762) 5.267 9.107 ( -10.143 0.000 1.848) 10.310 9.148 ( 12.446 0.000 -9.409) 15.602 9.219 ( 15.346 0.000 13.986) 20.763 9.428 ( -8.657 0.000 -1.875) 8.858 9.802 ( 7.262 0.000 -6.498) 9.745 9.832 ( -6.907 0.000 4.988) 8.520 10.759 ( -11.498 0.000 4.968) 12.526 10.902 ( -14.426 0.000 -9.128) 17.072 11.436 ( -7.246 0.000 9.752) 12.149 11.582 ( -2.770 0.000 -7.054) 7.579 12.620 ( 4.255 0.000 8.997) 9.952 12.745 ( 6.021 0.000 -9.391) 11.155 12.754 ( 10.626 0.000 6.022) 12.214 12.867 ( 7.048 0.000 -5.848) 9.159 14.773 ( 9.671 0.000 -1.855) 9.847 14.817 ( 10.495 0.000 4.052) 11.250 15.225 ( 5.381 0.000 0.220) 5.386 15.287 ( 7.831 0.000 -3.043) 8.402 15.741 ( 4.555 0.000 6.814) 8.196 15.869 ( -1.473 0.000 -5.185) 5.390 15.960 ( -9.742 0.000 2.802) 10.137 16.171 ( -4.107 0.000 -4.060) 5.775 21.035 ( 9.429 0.000 -1.261) 9.513 21.068 ( 12.358 0.000 3.790) 12.927 22.540 ( -2.731 0.000 3.015) 4.068 22.611 ( -2.496 0.000 -5.984) 6.483 ======================= Grid point 103 (35/170) ======================= q-point: ( 0.36 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( 1.944 0.000 0.121) 1.948 2.178 ( 3.835 0.000 -3.871) 5.449 2.310 ( 5.789 0.000 -4.406) 7.275 2.538 ( -2.887 0.000 3.151) 4.274 2.623 ( 0.731 0.000 8.397) 8.429 2.634 ( -0.716 0.000 0.006) 0.716 2.856 ( -7.722 0.000 -2.557) 8.134 2.862 ( -14.762 0.000 -0.764) 14.782 3.123 ( -2.831 0.000 -6.426) 7.022 3.159 ( -3.273 0.000 5.242) 6.180 3.461 ( -5.874 0.000 10.447) 11.985 3.524 ( -2.061 0.000 -7.807) 8.074 4.255 ( 1.149 0.000 -4.868) 5.001 4.324 ( -3.468 0.000 -5.125) 6.189 4.410 ( 7.245 0.000 8.583) 11.231 4.545 ( 2.089 0.000 1.088) 2.355 5.081 ( -1.865 0.000 -1.523) 2.408 5.161 ( 30.414 0.000 -10.073) 32.038 5.244 ( 15.027 0.000 8.234) 17.135 5.531 ( 5.703 0.000 -15.909) 16.901 5.720 ( -2.746 0.000 8.883) 9.298 5.753 ( 15.382 0.000 11.496) 19.203 5.998 ( 11.227 0.000 -2.478) 11.498 6.127 ( -2.660 0.000 -17.376) 17.578 6.274 ( 2.157 0.000 7.723) 8.018 6.469 ( -9.870 0.000 8.964) 13.333 6.814 ( -8.518 0.000 -14.746) 17.029 6.926 ( -7.797 0.000 7.149) 10.578 6.998 ( 0.060 0.000 -4.964) 4.964 7.213 ( 2.230 0.000 4.312) 4.854 7.855 ( 10.196 0.000 8.651) 13.371 7.968 ( 10.126 0.000 -12.613) 16.174 8.273 ( -0.189 0.000 -0.504) 0.538 8.317 ( -8.142 0.000 -0.587) 8.163 8.926 ( -8.552 0.000 1.873) 8.755 9.248 ( 9.377 0.000 -11.608) 14.922 9.307 ( -3.220 0.000 4.381) 5.437 9.585 ( 10.014 0.000 11.406) 15.178 9.836 ( 0.354 0.000 5.765) 5.776 10.019 ( 16.053 0.000 4.091) 16.567 10.569 ( -13.273 0.000 -10.217) 16.749 10.585 ( -15.239 0.000 2.596) 15.459 11.399 ( -8.692 0.000 5.878) 10.493 11.492 ( 0.731 0.000 -6.070) 6.114 12.748 ( 0.811 0.000 6.811) 6.859 12.761 ( 6.845 0.000 -5.564) 8.821 12.910 ( 4.772 0.000 -2.863) 5.565 12.940 ( 5.156 0.000 4.834) 7.068 14.924 ( 11.238 0.000 -1.150) 11.297 15.022 ( 9.709 0.000 3.095) 10.191 15.312 ( 6.014 0.000 -1.436) 6.183 15.396 ( 9.562 0.000 -2.063) 9.782 15.754 ( -8.280 0.000 0.945) 8.334 15.778 ( -3.930 0.000 -3.728) 5.417 15.918 ( -2.442 0.000 6.822) 7.246 16.061 ( -3.184 0.000 -4.801) 5.761 21.168 ( 8.245 0.000 -0.927) 8.297 21.263 ( 9.118 0.000 0.218) 9.121 22.525 ( -1.668 0.000 -2.786) 3.247 22.528 ( -3.772 0.000 4.229) 5.667 ======================= Grid point 104 (36/170) ======================= q-point: ( 0.45 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.153 ( -4.669 0.000 -0.171) 4.672 2.215 ( 4.010 0.000 -0.132) 4.012 2.314 ( 5.190 0.000 -6.482) 8.304 2.493 ( -9.043 0.000 8.709) 12.555 2.627 ( -0.049 0.000 6.842) 6.842 2.665 ( -0.914 0.000 -0.571) 1.078 2.699 ( -3.238 0.000 -5.302) 6.212 2.912 ( 7.408 0.000 -0.421) 7.420 3.035 ( 0.649 0.000 -3.656) 3.713 3.143 ( -4.652 0.000 2.928) 5.497 3.453 ( -8.935 0.000 8.117) 12.072 3.499 ( 4.561 0.000 -0.068) 4.562 4.220 ( 2.211 0.000 -5.876) 6.278 4.228 ( -0.345 0.000 -6.828) 6.837 4.526 ( -1.297 0.000 1.682) 2.124 4.574 ( 0.193 0.000 -0.005) 0.193 5.017 ( -1.193 0.000 2.845) 3.085 5.369 ( 3.588 0.000 -17.404) 17.770 5.444 ( 1.750 0.000 -5.188) 5.475 5.565 ( 17.297 0.000 -2.279) 17.446 5.751 ( 9.421 0.000 -3.922) 10.205 5.830 ( 3.321 0.000 -11.372) 11.848 6.020 ( 6.125 0.000 -4.742) 7.746 6.127 ( 8.035 0.000 -4.158) 9.047 6.241 ( -20.212 0.000 1.653) 20.279 6.425 ( -20.976 0.000 -9.056) 22.847 6.712 ( 20.366 0.000 24.049) 31.514 6.903 ( -10.036 0.000 3.707) 10.698 7.021 ( 5.243 0.000 5.236) 7.410 7.222 ( -2.989 0.000 -2.497) 3.895 7.969 ( -3.362 0.000 0.112) 3.364 7.979 ( 8.064 0.000 -10.864) 13.530 8.209 ( -1.951 0.000 -0.172) 1.958 8.298 ( 2.124 0.000 1.988) 2.909 8.911 ( -2.456 0.000 9.892) 10.193 9.214 ( 1.443 0.000 -2.242) 2.666 9.403 ( 5.079 0.000 3.517) 6.178 9.733 ( -3.957 0.000 0.379) 3.975 9.917 ( 1.828 0.000 -0.207) 1.840 10.201 ( 2.323 0.000 -2.612) 3.496 10.395 ( -10.577 0.000 4.626) 11.544 10.404 ( 4.425 0.000 2.432) 5.049 11.295 ( -8.219 0.000 0.263) 8.223 11.471 ( 3.969 0.000 -4.508) 6.006 12.791 ( -3.271 0.000 4.477) 5.544 12.839 ( 6.635 0.000 0.084) 6.636 12.957 ( 2.796 0.000 0.499) 2.841 13.016 ( -0.901 0.000 2.710) 2.856 15.078 ( 7.889 0.000 -0.165) 7.891 15.154 ( 2.550 0.000 1.321) 2.871 15.364 ( 2.993 0.000 -2.600) 3.965 15.536 ( 9.465 0.000 -0.646) 9.487 15.633 ( -6.853 0.000 2.045) 7.152 15.674 ( -4.774 0.000 -1.375) 4.968 15.922 ( -4.469 0.000 2.533) 5.137 15.985 ( 1.123 0.000 -5.175) 5.296 21.251 ( 3.270 0.000 -1.230) 3.494 21.350 ( 3.391 0.000 -2.482) 4.203 22.514 ( 1.462 0.000 1.464) 2.069 22.516 ( -3.803 0.000 4.503) 5.894 ======================= Grid point 105 (37/170) ======================= q-point: (-0.45 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( -7.021 0.000 -4.351) 8.260 2.299 ( 3.664 0.000 2.000) 4.174 2.359 ( 6.579 0.000 -3.511) 7.457 2.478 ( -7.523 0.000 -1.381) 7.649 2.507 ( -6.035 0.000 5.742) 8.331 2.720 ( 8.950 0.000 -6.001) 10.776 2.800 ( 7.718 0.000 11.592) 13.927 2.903 ( -1.696 0.000 -0.113) 1.699 3.100 ( -3.784 0.000 2.057) 4.307 3.137 ( 10.065 0.000 -1.344) 10.154 3.370 ( -8.167 0.000 3.349) 8.827 3.613 ( 7.755 0.000 0.535) 7.774 4.102 ( -4.553 0.000 -13.892) 14.620 4.189 ( 3.429 0.000 -8.457) 9.126 4.471 ( -2.535 0.000 2.085) 3.283 4.545 ( -2.571 0.000 -1.318) 2.889 5.098 ( -1.083 0.000 1.862) 2.154 5.190 ( 0.218 0.000 -17.822) 17.823 5.294 ( 0.103 0.000 -6.540) 6.541 5.550 ( -28.856 0.000 -10.974) 30.872 5.591 ( -5.786 0.000 -0.487) 5.806 5.895 ( -9.513 0.000 -3.192) 10.034 5.986 ( -5.447 0.000 2.045) 5.818 6.111 ( 8.542 0.000 0.471) 8.555 6.229 ( 4.153 0.000 -0.082) 4.154 6.279 ( 25.427 0.000 -6.294) 26.195 6.743 ( -14.318 0.000 2.741) 14.578 7.068 ( -6.056 0.000 -8.662) 10.569 7.186 ( 5.349 0.000 8.749) 10.255 7.255 ( 14.625 0.000 19.696) 24.532 7.789 ( -13.164 0.000 -6.298) 14.594 7.989 ( 6.073 0.000 -7.751) 9.847 8.235 ( 3.199 0.000 -0.142) 3.202 8.371 ( 4.871 0.000 0.940) 4.961 9.016 ( -0.325 0.000 9.663) 9.668 9.249 ( 2.284 0.000 1.732) 2.866 9.505 ( -14.689 0.000 -6.007) 15.870 9.549 ( 6.252 0.000 7.772) 9.975 9.805 ( -10.529 0.000 -3.590) 11.125 10.164 ( -4.195 0.000 -1.224) 4.370 10.410 ( 2.944 0.000 4.285) 5.198 10.599 ( 10.755 0.000 4.979) 11.852 11.180 ( -3.066 0.000 -3.225) 4.450 11.517 ( 6.937 0.000 -2.855) 7.502 12.746 ( -7.395 0.000 2.817) 7.914 12.954 ( 3.867 0.000 4.556) 5.976 12.974 ( -6.439 0.000 0.596) 6.466 13.005 ( 1.406 0.000 1.952) 2.406 15.098 ( -8.999 0.000 -1.541) 9.130 15.113 ( -5.094 0.000 1.797) 5.402 15.353 ( -0.354 0.000 -2.948) 2.970 15.612 ( -4.704 0.000 2.743) 5.445 15.631 ( 3.957 0.000 2.244) 4.549 15.666 ( 8.613 0.000 -2.158) 8.880 15.836 ( -6.765 0.000 -1.603) 6.952 16.004 ( 7.725 0.000 -3.521) 8.489 21.239 ( -2.706 0.000 -1.211) 2.964 21.310 ( -4.275 0.000 -3.645) 5.618 22.510 ( -2.445 0.000 3.433) 4.215 22.599 ( 4.644 0.000 4.550) 6.502 ======================= Grid point 106 (38/170) ======================= q-point: (-0.36 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( -18.464 0.000 -14.529) 23.495 2.133 ( -16.133 0.000 -10.214) 19.094 2.441 ( 7.118 0.000 -1.285) 7.233 2.473 ( 5.247 0.000 9.499) 10.851 2.621 ( 5.299 0.000 5.771) 7.834 2.832 ( 12.391 0.000 -4.219) 13.090 2.946 ( 2.572 0.000 9.001) 9.362 3.069 ( -2.932 0.000 1.447) 3.270 3.100 ( 12.943 0.000 7.167) 14.795 3.234 ( 5.707 0.000 -4.825) 7.474 3.305 ( -4.673 0.000 2.707) 5.400 3.705 ( 9.569 0.000 -10.417) 14.145 3.795 ( -12.454 0.000 -12.399) 17.574 4.143 ( 3.381 0.000 -7.930) 8.621 4.489 ( -3.184 0.000 0.413) 3.211 4.543 ( 4.934 0.000 4.550) 6.712 4.857 ( -14.765 0.000 -12.159) 19.127 4.892 ( -34.873 0.000 -5.495) 35.304 5.006 ( -3.463 0.000 -10.953) 11.487 5.431 ( -14.443 0.000 1.561) 14.527 5.493 ( 12.589 0.000 10.580) 16.444 5.630 ( -13.841 0.000 -6.822) 15.431 5.901 ( -5.341 0.000 -1.138) 5.461 6.284 ( 9.908 0.000 1.570) 10.031 6.313 ( 4.635 0.000 -2.080) 5.081 6.523 ( -16.993 0.000 5.652) 17.909 6.703 ( 27.098 0.000 -1.475) 27.138 6.862 ( -5.066 0.000 -8.918) 10.256 7.348 ( 1.410 0.000 8.576) 8.691 7.434 ( -19.673 0.000 -10.601) 22.347 7.609 ( 6.972 0.000 13.037) 14.784 7.980 ( 2.014 0.000 -6.385) 6.696 8.278 ( 3.467 0.000 -2.200) 4.106 8.469 ( 6.997 0.000 -0.632) 7.026 8.985 ( -11.114 0.000 -3.416) 11.627 9.294 ( -8.305 0.000 3.185) 8.895 9.299 ( 0.144 0.000 3.410) 3.413 9.617 ( -9.419 0.000 1.097) 9.483 9.763 ( 7.537 0.000 10.067) 12.576 10.112 ( -1.479 0.000 5.617) 5.808 10.482 ( 3.923 0.000 -2.620) 4.717 10.780 ( 10.236 0.000 -3.628) 10.860 11.166 ( 4.182 0.000 0.012) 4.182 11.621 ( 8.799 0.000 -1.271) 8.890 12.626 ( -10.906 0.000 1.790) 11.052 12.844 ( -10.008 0.000 0.236) 10.011 13.024 ( -1.565 0.000 3.906) 4.208 13.051 ( 0.416 0.000 3.594) 3.618 14.889 ( -12.832 0.000 -2.918) 13.160 15.004 ( -10.347 0.000 2.640) 10.678 15.279 ( -6.079 0.000 -1.120) 6.181 15.524 ( -8.659 0.000 0.501) 8.673 15.686 ( -6.549 0.000 -4.244) 7.804 15.779 ( 9.436 0.000 1.834) 9.612 15.790 ( 9.071 0.000 -1.129) 9.141 16.124 ( 9.202 0.000 -0.772) 9.234 21.142 ( -11.508 0.000 -3.720) 12.094 21.155 ( -6.254 0.000 -0.478) 6.273 22.515 ( -0.730 0.000 1.780) 1.924 22.736 ( 5.268 0.000 5.074) 7.314 ======================= Grid point 107 (39/170) ======================= q-point: (-0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( -24.489 0.000 -16.963) 29.791 1.701 ( -24.195 0.000 -10.343) 26.313 2.515 ( 0.811 0.000 -1.920) 2.084 2.732 ( 2.778 0.000 12.024) 12.341 2.770 ( 16.284 0.000 2.577) 16.486 2.969 ( 4.143 0.000 -2.719) 4.955 2.987 ( -26.033 0.000 -6.973) 26.951 3.068 ( 8.268 0.000 -2.040) 8.516 3.127 ( 1.681 0.000 13.783) 13.885 3.240 ( -1.436 0.000 2.660) 3.023 3.362 ( 7.470 0.000 -5.302) 9.160 3.600 ( 0.584 0.000 -3.484) 3.533 3.697 ( 11.416 0.000 -17.177) 20.625 4.156 ( 3.839 0.000 -0.774) 3.916 4.385 ( -19.887 0.000 -1.263) 19.927 4.463 ( -2.945 0.000 3.505) 4.578 4.501 ( -10.343 0.000 -3.564) 10.939 4.777 ( 11.975 0.000 1.283) 12.043 4.822 ( -8.550 0.000 -6.008) 10.450 5.206 ( -18.259 0.000 4.404) 18.783 5.332 ( -10.177 0.000 -10.368) 14.528 5.799 ( -6.847 0.000 -1.024) 6.923 5.828 ( 12.515 0.000 12.379) 17.603 6.270 ( -5.098 0.000 -4.024) 6.495 6.322 ( -17.303 0.000 7.884) 19.015 6.411 ( 7.216 0.000 -3.253) 7.915 6.801 ( 4.514 0.000 -0.672) 4.564 6.947 ( -24.372 0.000 -11.590) 26.988 7.062 ( 17.903 0.000 -1.443) 17.961 7.404 ( -4.240 0.000 4.834) 6.429 7.764 ( 3.018 0.000 0.955) 3.165 7.903 ( -4.545 0.000 -3.394) 5.673 8.286 ( 0.441 0.000 -2.366) 2.407 8.546 ( 3.418 0.000 -2.052) 3.986 8.682 ( -18.548 0.000 -3.774) 18.928 9.249 ( -1.837 0.000 2.240) 2.897 9.338 ( 0.781 0.000 3.955) 4.031 9.563 ( -3.630 0.000 7.123) 7.995 9.970 ( 3.416 0.000 9.733) 10.315 10.281 ( 9.796 0.000 10.281) 14.201 10.480 ( 4.908 0.000 -8.829) 10.102 10.863 ( 10.853 0.000 -8.868) 14.016 11.287 ( 7.646 0.000 2.853) 8.161 11.748 ( 8.201 0.000 -0.762) 8.236 12.452 ( -12.433 0.000 0.541) 12.444 12.695 ( -10.689 0.000 3.673) 11.303 13.013 ( -3.591 0.000 1.565) 3.917 13.059 ( -4.460 0.000 3.425) 5.623 14.663 ( -11.563 0.000 -2.313) 11.792 14.869 ( -10.084 0.000 2.267) 10.336 15.155 ( -8.718 0.000 0.702) 8.747 15.362 ( -9.322 0.000 -3.719) 10.036 15.543 ( -4.890 0.000 -3.982) 6.306 15.914 ( 7.051 0.000 0.187) 7.054 15.950 ( 9.149 0.000 1.359) 9.250 16.248 ( 6.707 0.000 0.017) 6.707 20.889 ( -15.255 0.000 -2.770) 15.504 21.047 ( -7.034 0.000 0.227) 7.037 22.523 ( 0.150 0.000 0.411) 0.437 22.858 ( 3.912 0.000 3.452) 5.217 ======================= Grid point 108 (40/170) ======================= q-point: (-0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( -25.281 0.000 3.280) 25.493 1.159 ( -32.148 0.000 -6.057) 32.714 2.047 ( -54.772 0.000 1.153) 54.784 2.755 ( 1.117 0.000 1.284) 1.702 2.770 ( -2.558 0.000 -0.823) 2.687 2.941 ( -0.213 0.000 -1.163) 1.182 3.155 ( 18.695 0.000 3.699) 19.058 3.235 ( 0.295 0.000 -3.120) 3.134 3.267 ( -3.092 0.000 1.918) 3.639 3.270 ( 20.707 0.000 -2.508) 20.858 3.301 ( -1.085 0.000 0.422) 1.164 3.627 ( 4.898 0.000 -2.255) 5.392 3.763 ( 10.409 0.000 -1.216) 10.479 4.088 ( -15.303 0.000 -1.662) 15.393 4.204 ( 3.331 0.000 -2.458) 4.140 4.468 ( -3.357 0.000 6.162) 7.017 4.489 ( 6.157 0.000 -0.219) 6.161 4.625 ( -8.428 0.000 -3.192) 9.013 4.940 ( -16.506 0.000 -1.160) 16.546 5.023 ( 16.843 0.000 -0.329) 16.846 5.149 ( -4.672 0.000 -2.170) 5.151 5.654 ( -11.736 0.000 1.127) 11.790 6.035 ( -4.995 0.000 7.722) 9.196 6.122 ( -19.329 0.000 4.394) 19.822 6.239 ( 4.573 0.000 7.055) 8.407 6.474 ( -19.132 0.000 -6.812) 20.308 6.477 ( 9.588 0.000 -5.525) 11.066 6.918 ( 5.384 0.000 5.285) 7.545 7.136 ( -5.948 0.000 -3.396) 6.849 7.409 ( 2.746 0.000 0.861) 2.878 7.657 ( -5.696 0.000 -16.759) 17.700 7.855 ( 0.231 0.000 2.258) 2.270 8.243 ( -5.199 0.000 3.090) 6.048 8.417 ( -8.819 0.000 -3.453) 9.471 8.511 ( -4.339 0.000 -2.172) 4.852 9.283 ( 2.728 0.000 1.883) 3.315 9.434 ( 4.891 0.000 4.864) 6.898 9.623 ( -0.670 0.000 7.789) 7.818 10.023 ( -5.741 0.000 1.841) 6.029 10.503 ( 9.153 0.000 -4.873) 10.370 10.554 ( 11.492 0.000 4.943) 12.510 10.960 ( 11.611 0.000 -4.996) 12.640 11.441 ( 8.310 0.000 1.842) 8.512 11.850 ( 5.755 0.000 -0.697) 5.797 12.268 ( -10.408 0.000 -0.341) 10.414 12.608 ( -7.649 0.000 6.483) 10.027 12.940 ( -7.287 0.000 0.712) 7.322 13.002 ( -4.762 0.000 0.470) 4.785 14.495 ( -8.116 0.000 0.844) 8.160 14.740 ( -8.441 0.000 1.165) 8.521 15.037 ( -8.469 0.000 3.093) 9.016 15.156 ( -8.364 0.000 -8.278) 11.768 15.458 ( -1.017 0.000 -3.318) 3.470 16.007 ( 4.190 0.000 0.514) 4.221 16.083 ( 5.887 0.000 0.987) 5.969 16.329 ( 3.946 0.000 -0.595) 3.991 20.632 ( -14.082 0.000 -0.605) 14.095 20.948 ( -5.836 0.000 0.705) 5.879 22.527 ( 0.359 0.000 -0.265) 0.446 22.928 ( 2.109 0.000 0.594) 2.191 ======================= Grid point 109 (41/170) ======================= q-point: (-0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.606 ( -18.597 0.000 32.403) 37.361 0.650 ( -31.369 0.000 14.037) 34.367 1.254 ( -57.413 0.000 34.813) 67.143 2.677 ( -4.618 0.000 -3.496) 5.792 2.794 ( 0.644 0.000 3.253) 3.317 2.933 ( 1.109 0.000 -3.478) 3.650 3.116 ( -3.793 0.000 -8.766) 9.551 3.222 ( 2.350 0.000 -2.725) 3.598 3.348 ( 13.575 0.000 -8.899) 16.231 3.405 ( 3.565 0.000 14.957) 15.376 3.657 ( 17.562 0.000 8.052) 19.320 3.684 ( 3.043 0.000 0.136) 3.046 3.951 ( -2.934 0.000 9.846) 10.274 3.962 ( 7.848 0.000 9.099) 12.016 4.196 ( 1.033 0.000 -3.955) 4.088 4.488 ( -4.001 0.000 6.718) 7.819 4.518 ( 2.424 0.000 -10.613) 10.886 4.530 ( -1.730 0.000 0.646) 1.847 4.723 ( -8.138 0.000 -0.837) 8.181 5.104 ( -2.096 0.000 2.335) 3.137 5.268 ( 14.794 0.000 -0.727) 14.812 5.461 ( -14.521 0.000 2.430) 14.723 5.800 ( -18.576 0.000 -0.776) 18.593 5.985 ( -10.738 0.000 3.137) 11.187 6.265 ( -7.016 0.000 3.008) 7.633 6.329 ( -1.914 0.000 -3.592) 4.070 6.650 ( 14.420 0.000 0.423) 14.427 6.980 ( -5.836 0.000 -1.647) 6.064 7.106 ( 6.005 0.000 15.752) 16.858 7.278 ( -13.442 0.000 -19.853) 23.976 7.430 ( -0.345 0.000 -0.864) 0.930 7.952 ( 13.598 0.000 -2.646) 13.853 8.231 ( -3.821 0.000 5.342) 6.568 8.308 ( -0.604 0.000 -2.110) 2.195 8.429 ( -5.621 0.000 5.836) 8.102 9.350 ( 2.107 0.000 2.144) 3.006 9.550 ( 2.681 0.000 1.994) 3.341 9.661 ( -0.472 0.000 -1.065) 1.165 9.879 ( -5.784 0.000 -7.109) 9.165 10.656 ( 8.636 0.000 6.668) 10.911 10.687 ( 5.674 0.000 -6.176) 8.387 11.119 ( 8.954 0.000 3.275) 9.535 11.572 ( 6.093 0.000 0.250) 6.098 11.925 ( 3.578 0.000 2.100) 4.148 12.128 ( -6.170 0.000 -1.424) 6.332 12.437 ( -18.686 0.000 -20.850) 27.998 12.818 ( -7.189 0.000 -0.768) 7.230 12.930 ( -2.811 0.000 -2.473) 3.744 14.470 ( -0.359 0.000 6.079) 6.089 14.642 ( -4.989 0.000 0.643) 5.030 14.970 ( -6.066 0.000 5.924) 8.479 14.979 ( -1.775 0.000 3.447) 3.877 15.423 ( 1.292 0.000 -3.992) 4.196 16.051 ( 1.397 0.000 -1.163) 1.818 16.157 ( 2.423 0.000 0.821) 2.558 16.362 ( 2.071 0.000 -1.853) 2.779 20.461 ( -8.276 0.000 2.399) 8.617 20.888 ( -3.008 0.000 1.035) 3.181 22.530 ( 0.387 0.000 -0.249) 0.461 22.939 ( 0.753 0.000 -2.626) 2.731 ======================= Grid point 110 (42/170) ======================= q-point: ( 0.00 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.039 ( -4.300 27.492 17.200) 32.713 1.110 ( -3.465 23.482 24.575) 34.166 1.939 ( 1.007 42.344 46.050) 62.567 2.627 ( 0.768 3.825 -10.044) 10.775 2.859 ( -1.209 -2.808 3.385) 4.561 2.909 ( 1.029 0.215 -3.303) 3.466 2.945 ( -2.523 -6.213 -14.328) 15.820 3.102 ( -0.386 1.785 -9.048) 9.231 3.370 ( 2.208 -1.575 -7.492) 7.968 3.491 ( 6.003 -10.075 6.904) 13.609 3.602 ( -3.407 -8.179 1.327) 8.959 3.855 ( -0.438 -5.611 3.932) 6.865 3.923 ( 1.708 -7.356 14.535) 16.380 4.100 ( -2.272 -1.166 7.954) 8.354 4.258 ( 5.896 1.344 1.052) 6.138 4.466 ( -1.748 6.860 5.891) 9.210 4.534 ( 3.011 -0.667 0.613) 3.144 4.640 ( -3.022 5.902 10.617) 12.518 4.912 ( -2.034 18.471 -3.194) 18.855 5.149 ( -3.436 2.136 5.311) 6.677 5.353 ( -2.607 -0.100 -3.965) 4.746 5.573 ( 3.103 14.497 -5.165) 15.699 5.727 ( 4.997 2.099 1.629) 5.659 5.969 ( -7.152 10.563 -0.269) 12.759 6.131 ( -2.892 4.427 0.672) 5.330 6.230 ( 0.311 -1.159 -0.220) 1.220 6.730 ( 4.489 -3.280 1.660) 5.802 6.978 ( 5.157 5.856 5.658) 9.638 7.077 ( -1.548 3.526 0.308) 3.863 7.434 ( -0.490 19.735 -1.230) 19.779 7.527 ( 1.024 2.101 0.520) 2.395 7.811 ( 0.509 -6.899 1.750) 7.136 8.223 ( 0.969 -1.961 4.629) 5.120 8.253 ( 0.896 -2.868 -2.624) 3.990 8.864 ( -1.471 10.875 -13.638) 17.505 9.368 ( -5.332 -2.334 -5.005) 7.677 9.474 ( -6.477 3.766 -10.558) 12.946 9.679 ( 0.865 -2.258 -6.837) 7.252 9.815 ( 11.059 -1.624 -1.563) 11.286 10.644 ( -1.969 2.363 -10.544) 10.983 10.728 ( -5.840 -7.104 5.907) 10.930 11.212 ( 4.438 -5.363 8.658) 11.109 11.615 ( 1.670 1.602 -3.930) 4.560 11.761 ( -5.611 -3.767 16.193) 17.547 11.991 ( -5.851 -2.948 1.531) 6.729 12.041 ( 5.950 -0.133 5.375) 8.019 12.739 ( -0.097 0.215 -4.024) 4.031 12.870 ( -0.127 0.372 -4.781) 4.797 14.533 ( 0.424 9.979 3.245) 10.502 14.834 ( -2.853 10.396 -5.438) 12.075 14.988 ( -2.257 0.679 8.850) 9.158 15.247 ( 4.049 4.490 -1.989) 6.365 15.349 ( 2.566 -4.105 -3.063) 5.729 16.063 ( 1.158 1.828 -4.169) 4.697 16.163 ( -0.297 -1.647 0.841) 1.873 16.344 ( 0.411 -1.769 -2.338) 2.961 20.485 ( 0.919 5.121 4.223) 6.701 20.835 ( -1.902 1.333 -0.932) 2.503 22.510 ( 0.179 -2.289 0.137) 2.300 22.881 ( -0.067 -1.821 -5.476) 5.772 ======================= Grid point 111 (43/170) ======================= q-point: ( 0.09 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 10.404 15.265 19.866) 27.128 1.442 ( 9.840 10.509 26.964) 30.567 2.477 ( 1.346 3.945 -12.843) 13.503 2.558 ( 10.947 24.443 32.124) 41.824 2.753 ( -0.207 2.837 -12.664) 12.980 2.863 ( -3.341 -7.282 0.417) 8.022 2.908 ( 1.800 1.141 -1.826) 2.806 3.068 ( 3.150 2.324 0.754) 3.987 3.228 ( -7.262 0.979 -6.264) 9.640 3.543 ( -1.347 -7.739 -1.574) 8.012 3.638 ( -3.180 -12.450 3.980) 13.452 3.799 ( 4.094 -6.591 -2.695) 8.214 3.971 ( -12.970 -4.033 11.259) 17.642 4.161 ( -4.770 2.055 6.901) 8.637 4.292 ( 3.540 1.313 -1.255) 3.978 4.417 ( -6.265 5.977 0.010) 8.659 4.645 ( -3.714 11.833 2.455) 12.643 4.830 ( 8.022 -1.053 12.022) 14.492 4.865 ( -0.871 8.935 4.743) 10.153 5.106 ( -6.982 2.573 4.478) 8.684 5.324 ( 3.384 2.092 7.399) 8.401 5.550 ( 3.693 13.603 -5.591) 15.164 5.896 ( 4.717 -3.523 1.396) 6.051 5.999 ( -2.579 4.783 -6.831) 8.729 6.076 ( 15.849 6.628 2.037) 17.300 6.410 ( 12.634 -1.559 8.360) 15.229 6.757 ( -0.275 4.803 0.418) 4.829 7.076 ( 3.202 11.276 -1.371) 11.802 7.106 ( 3.136 -0.563 0.336) 3.204 7.365 ( -0.883 11.850 -7.552) 14.079 7.552 ( -2.672 0.580 -1.078) 2.939 7.863 ( 6.735 2.054 1.145) 7.134 8.230 ( 0.390 1.355 2.038) 2.478 8.306 ( 0.638 -3.656 5.504) 6.639 8.676 ( 0.239 12.449 -8.457) 15.052 9.225 ( -2.687 -0.459 -12.939) 13.223 9.287 ( -6.664 -2.892 0.199) 7.267 9.657 ( 1.362 -2.772 -2.706) 4.106 9.931 ( 2.084 -0.428 2.071) 2.969 10.352 ( -10.994 1.296 -17.419) 20.639 10.751 ( -5.373 -7.485 10.693) 14.114 11.332 ( -1.236 -4.165 8.851) 9.859 11.458 ( -10.620 -0.893 -6.334) 12.398 11.824 ( -6.582 -2.164 -1.187) 7.029 12.114 ( 16.726 -4.587 6.832) 18.640 12.237 ( 6.993 1.923 9.835) 12.220 12.738 ( 6.487 -0.430 -5.970) 8.827 12.830 ( 3.414 1.382 -7.247) 8.129 14.598 ( 2.827 9.823 3.698) 10.870 14.759 ( -0.085 9.944 -3.816) 10.651 15.076 ( 0.237 1.435 8.560) 8.683 15.229 ( -0.472 2.248 -1.656) 2.832 15.394 ( 5.589 -2.362 0.851) 6.127 16.021 ( -0.157 1.246 -5.544) 5.684 16.142 ( -3.344 -1.453 0.557) 3.689 16.303 ( -1.842 -2.699 -3.017) 4.447 20.614 ( 7.539 4.204 6.106) 10.573 20.843 ( 4.491 0.499 -2.264) 5.054 22.513 ( -0.522 -2.683 0.787) 2.844 22.804 ( -0.837 -1.902 -7.159) 7.455 ======================= Grid point 112 (44/170) ======================= q-point: ( 0.18 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( 9.302 7.435 18.231) 21.776 1.935 ( 15.634 3.534 21.310) 26.665 2.307 ( 0.743 -1.644 -14.489) 14.601 2.617 ( 0.315 6.472 -13.377) 14.864 2.751 ( -3.184 5.989 -2.299) 7.162 2.813 ( -6.878 1.618 -7.854) 10.565 2.952 ( 5.042 -6.687 4.995) 9.752 3.059 ( -2.465 -2.355 2.161) 4.037 3.295 ( -2.625 1.100 10.765) 11.135 3.474 ( -14.004 -4.467 -0.856) 14.725 3.573 ( 1.506 -2.659 4.813) 5.701 3.831 ( -4.952 -3.756 -0.616) 6.246 3.962 ( 0.737 3.171 9.312) 9.864 4.149 ( 1.011 -1.384 5.015) 5.300 4.259 ( 0.270 0.815 -1.474) 1.706 4.421 ( 7.683 8.190 -2.413) 11.486 4.636 ( -2.257 8.389 5.774) 10.431 4.768 ( -4.531 0.843 -3.410) 5.733 5.020 ( 8.043 4.656 4.914) 10.512 5.300 ( 4.021 2.768 17.822) 18.479 5.503 ( 4.538 -2.543 5.112) 7.294 5.583 ( 6.402 7.090 -3.980) 10.348 5.816 ( -1.418 8.386 0.297) 8.510 6.060 ( 5.938 -3.401 2.454) 7.269 6.344 ( 10.198 3.290 3.597) 11.303 6.549 ( -3.830 -3.125 -3.293) 5.940 6.876 ( 7.601 3.682 7.917) 11.576 7.105 ( -2.965 -3.148 -2.980) 5.252 7.147 ( 15.519 11.753 -5.320) 20.181 7.250 ( -2.061 10.945 -6.142) 12.718 7.450 ( -5.279 2.633 -2.442) 6.384 7.975 ( 8.565 7.726 -4.429) 12.356 8.314 ( 0.872 -4.516 1.679) 4.896 8.351 ( -0.049 -1.129 2.714) 2.940 8.762 ( 13.770 4.602 7.274) 16.239 9.091 ( 2.597 -1.476 -9.098) 9.576 9.214 ( -2.895 -1.437 -0.703) 3.308 9.631 ( -1.591 2.300 -2.305) 3.624 9.895 ( -9.786 -0.047 -4.121) 10.618 10.020 ( -5.232 2.882 -8.323) 10.244 10.769 ( -6.234 -5.368 8.304) 11.689 11.184 ( -13.622 -2.424 -7.964) 15.964 11.383 ( -4.892 -3.732 9.803) 11.574 11.678 ( -5.977 -3.885 -5.698) 9.126 12.446 ( 14.244 -2.631 6.973) 16.076 12.458 ( 7.666 2.291 9.412) 12.353 12.782 ( 7.513 0.029 -8.062) 11.020 12.818 ( 6.175 1.503 -7.877) 10.121 14.686 ( 3.113 5.373 2.237) 6.600 14.766 ( 5.375 8.001 -0.808) 9.673 15.155 ( 2.306 1.093 2.122) 3.319 15.241 ( 3.983 1.953 -0.890) 4.524 15.550 ( 7.877 -0.776 6.913) 10.509 15.934 ( -3.935 -1.185 -4.093) 5.800 16.070 ( -5.421 -0.961 -0.946) 5.587 16.224 ( -3.396 -3.906 -3.560) 6.282 20.829 ( 10.574 1.527 5.386) 11.964 20.914 ( 7.360 0.244 -1.661) 7.549 22.510 ( -1.458 -3.129 1.523) 3.773 22.703 ( -1.639 -1.751 -7.265) 7.651 ======================= Grid point 113 (45/170) ======================= q-point: ( 0.27 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( 9.478 2.951 12.849) 16.237 2.199 ( 3.796 1.549 -6.531) 7.711 2.369 ( 10.486 1.976 13.503) 17.210 2.452 ( -0.016 7.627 -13.987) 15.931 2.639 ( -4.542 -1.073 -2.205) 5.162 2.710 ( -2.017 5.543 -0.674) 5.937 2.996 ( -2.877 -8.604 -1.290) 9.163 3.052 ( -1.406 -5.917 0.521) 6.104 3.165 ( -18.480 -0.854 3.591) 18.845 3.242 ( -13.016 -3.804 -5.154) 14.507 3.453 ( -9.825 -0.732 4.175) 10.701 3.697 ( -6.532 0.669 -7.585) 10.032 4.201 ( 7.544 6.241 12.620) 15.973 4.291 ( 8.919 -1.744 -1.167) 9.162 4.420 ( 7.098 -0.599 -1.623) 7.306 4.469 ( 7.115 0.828 -0.021) 7.163 4.721 ( 4.430 -2.856 2.263) 5.736 4.759 ( 10.504 3.863 4.442) 12.041 5.268 ( 7.886 7.720 1.954) 11.207 5.432 ( 3.723 -1.687 11.223) 11.944 5.573 ( 7.131 3.637 -3.733) 8.833 5.657 ( 3.461 2.633 3.257) 5.433 5.906 ( 4.153 4.817 3.340) 7.184 6.210 ( 4.697 -3.981 5.632) 8.344 6.377 ( -8.195 0.851 -6.780) 10.670 6.430 ( -0.999 3.447 1.616) 3.936 6.933 ( -5.581 -8.826 -3.997) 11.181 6.987 ( -4.175 -2.490 -0.998) 4.962 7.162 ( 1.553 11.811 -7.280) 13.961 7.265 ( -1.822 2.474 -1.198) 3.297 7.579 ( 16.363 9.762 9.102) 21.116 8.039 ( 8.221 8.401 -8.699) 14.623 8.280 ( -3.701 -5.253 0.246) 6.430 8.328 ( -2.018 -3.595 -3.278) 5.267 9.073 ( -1.207 1.602 -3.784) 4.283 9.158 ( 14.238 0.068 2.604) 14.474 9.204 ( 9.649 -0.358 7.687) 12.342 9.538 ( -5.605 7.458 -2.976) 9.792 9.739 ( 3.865 -0.381 -3.845) 5.465 9.969 ( -2.121 6.440 3.879) 7.812 10.715 ( -10.351 -3.432 4.456) 11.780 10.868 ( -14.227 -2.884 -9.228) 17.201 11.397 ( -6.989 -3.591 9.443) 12.285 11.536 ( -2.770 -4.158 -6.578) 8.261 12.646 ( 4.548 1.778 7.854) 9.249 12.718 ( 10.124 -2.331 5.038) 11.546 12.788 ( 6.688 2.982 -8.309) 11.075 12.857 ( 6.755 -0.548 -4.783) 8.295 14.756 ( 5.234 -0.355 0.104) 5.247 14.897 ( 9.002 5.396 2.013) 10.687 15.213 ( 4.793 -0.648 -1.244) 4.994 15.316 ( 6.488 2.597 -1.339) 7.115 15.739 ( 3.941 -0.591 5.145) 6.508 15.827 ( -4.428 -3.163 0.681) 5.484 15.955 ( -7.534 -1.162 -1.264) 7.727 16.126 ( -3.277 -3.652 -4.280) 6.511 20.999 ( 8.445 -2.933 -1.405) 9.050 21.068 ( 9.519 -0.411 3.712) 10.225 22.501 ( -2.114 -3.150 1.962) 4.271 22.602 ( -2.196 -1.059 -5.001) 5.564 ======================= Grid point 114 (46/170) ======================= q-point: ( 0.36 0.12 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 3.667 3.305 -0.618) 4.975 2.252 ( 1.415 3.766 3.512) 5.340 2.341 ( 4.765 3.489 -10.489) 12.037 2.532 ( -1.918 -0.553 4.091) 4.552 2.637 ( 1.404 1.286 0.912) 2.111 2.698 ( -3.893 3.257 5.413) 7.420 2.841 ( -9.242 -1.146 -1.945) 9.514 2.899 ( -11.356 2.455 0.064) 11.619 3.017 ( -0.452 -7.740 -1.706) 7.938 3.114 ( -1.795 -3.970 0.228) 4.363 3.423 ( -6.036 -2.150 8.133) 10.354 3.531 ( -3.826 0.282 -5.328) 6.566 4.294 ( 0.897 4.573 -4.720) 6.633 4.345 ( -2.742 2.117 -2.294) 4.155 4.471 ( 8.617 4.179 3.695) 10.266 4.623 ( 6.561 5.388 0.341) 8.497 4.921 ( 15.830 -12.500 1.551) 20.230 5.028 ( 14.890 -9.646 -1.024) 17.771 5.247 ( 1.910 2.142 -1.515) 3.245 5.528 ( -1.218 -1.264 -10.674) 10.817 5.707 ( 0.077 -2.459 8.638) 8.982 5.839 ( 10.869 3.797 6.084) 13.022 6.004 ( 11.929 0.610 -7.447) 14.076 6.156 ( -7.803 1.205 -9.010) 11.980 6.290 ( -5.821 -4.691 5.617) 9.351 6.383 ( 0.201 2.732 4.655) 5.401 6.800 ( -9.940 -5.861 -12.616) 17.097 6.912 ( -0.679 -0.097 12.048) 12.067 7.049 ( -3.558 7.655 -8.214) 11.778 7.293 ( -1.231 4.834 5.658) 7.543 7.884 ( 9.843 1.317 6.057) 11.632 8.009 ( 0.939 2.434 -8.886) 9.261 8.238 ( 0.427 -2.926 -5.986) 6.676 8.280 ( 1.618 1.400 -0.582) 2.217 8.963 ( -4.830 4.443 -0.354) 6.572 9.303 ( 8.786 0.969 -0.099) 8.840 9.436 ( -2.000 11.915 -3.315) 12.528 9.573 ( 12.511 0.152 11.720) 17.144 9.871 ( 6.151 2.127 6.188) 8.981 10.058 ( 8.745 3.489 3.214) 9.948 10.513 ( -12.676 -4.660 -7.391) 15.395 10.573 ( -15.452 -0.399 -0.191) 15.459 11.364 ( -7.481 -3.095 5.202) 9.624 11.457 ( 0.311 -3.183 -4.591) 5.595 12.763 ( 1.545 0.236 4.709) 4.962 12.793 ( 6.384 2.532 -5.620) 8.874 12.893 ( 5.413 -0.192 0.230) 5.422 12.933 ( 4.238 -0.923 3.647) 5.667 14.861 ( 8.045 -4.559 -0.012) 9.247 15.063 ( 8.293 2.435 1.610) 8.792 15.270 ( 4.184 -4.422 -1.503) 6.270 15.403 ( 6.154 1.544 -1.337) 6.484 15.689 ( -4.897 -4.991 -0.560) 7.014 15.790 ( -8.841 -0.789 -2.137) 9.130 15.916 ( 1.154 0.340 5.401) 5.533 16.041 ( -1.599 -1.042 -3.724) 4.185 21.103 ( 6.549 -5.709 -1.397) 8.800 21.223 ( 6.493 -3.940 0.660) 7.623 22.489 ( -1.201 -2.048 1.214) 2.667 22.537 ( -2.649 -0.285 0.335) 2.685 ======================= Grid point 115 (47/170) ======================= q-point: ( 0.45 0.12 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( -4.782 4.336 -0.932) 6.522 2.252 ( 3.597 2.690 -1.586) 4.764 2.324 ( 3.378 1.175 -6.240) 7.192 2.544 ( -4.462 4.121 8.175) 10.184 2.617 ( -2.384 0.031 5.171) 5.694 2.682 ( -0.942 -0.041 -3.436) 3.563 2.720 ( -4.091 0.734 -0.884) 4.250 2.895 ( 5.891 -1.514 1.254) 6.211 3.015 ( 0.705 -1.329 -1.874) 2.403 3.096 ( -1.946 -3.849 0.955) 4.417 3.410 ( -6.597 -2.248 7.448) 10.201 3.488 ( 1.693 -1.435 0.540) 2.284 4.241 ( -0.628 3.247 -8.993) 9.581 4.275 ( 1.937 4.188 -4.533) 6.468 4.580 ( 0.400 6.052 0.773) 6.114 4.694 ( 2.398 8.642 -1.016) 9.025 5.021 ( -0.617 -1.668 1.358) 2.238 5.229 ( 10.698 -13.073 -5.914) 17.897 5.327 ( -6.241 -10.069 -10.870) 16.078 5.444 ( 21.655 -8.209 0.237) 23.160 5.766 ( -0.842 -6.189 3.233) 7.034 5.867 ( -4.782 0.238 -8.833) 10.047 6.007 ( -6.619 -6.473 -2.570) 9.608 6.017 ( -2.625 -4.469 -1.417) 5.373 6.141 ( 8.503 3.694 -8.849) 12.816 6.437 ( -16.754 -2.624 -11.574) 20.532 6.740 ( 11.582 2.321 9.728) 15.303 6.906 ( -5.718 3.686 4.825) 8.340 7.070 ( 4.947 3.388 8.693) 10.561 7.290 ( -4.161 4.853 1.177) 6.500 7.903 ( -0.982 -3.022 -5.598) 6.437 8.057 ( 3.260 -2.934 5.177) 6.785 8.175 ( 3.121 4.575 -10.053) 11.477 8.318 ( 2.531 2.470 -1.066) 3.694 8.972 ( 0.267 5.380 8.218) 9.826 9.332 ( -3.957 4.979 0.785) 6.408 9.467 ( 7.633 7.952 -0.962) 11.064 9.776 ( -2.859 3.362 2.491) 5.068 9.999 ( 3.066 7.493 0.856) 8.141 10.188 ( 3.850 -0.488 -2.228) 4.475 10.356 ( -11.881 -2.994 4.654) 13.107 10.369 ( 3.396 -2.798 3.287) 5.492 11.273 ( -7.791 -1.879 0.407) 8.025 11.440 ( 3.469 -2.901 -3.816) 5.917 12.804 ( -2.303 0.679 3.509) 4.252 12.853 ( 6.080 0.445 -1.486) 6.275 12.958 ( 2.223 1.515 1.589) 3.125 13.011 ( -0.532 -0.989 4.271) 4.416 15.000 ( 8.739 -7.427 0.146) 11.470 15.117 ( -3.481 -1.909 0.183) 3.974 15.343 ( 6.914 -4.325 -1.234) 8.248 15.477 ( 2.980 -2.866 0.873) 4.226 15.577 ( -7.388 -6.938 -2.911) 10.544 15.688 ( -1.382 2.844 1.031) 3.326 15.959 ( 1.176 2.222 0.110) 2.517 15.986 ( -1.966 1.197 -2.195) 3.181 21.162 ( 2.764 -7.873 -1.520) 8.482 21.280 ( 1.854 -6.630 -2.345) 7.273 22.508 ( -0.267 -0.423 3.671) 3.705 22.519 ( -1.197 0.030 2.506) 2.777 ======================= Grid point 116 (48/170) ======================= q-point: (-0.45 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( -7.167 3.072 -5.056) 9.293 2.295 ( 0.333 0.307 -2.493) 2.533 2.362 ( 8.328 0.381 -0.409) 8.347 2.497 ( -9.020 -0.308 -0.517) 9.040 2.570 ( -1.543 5.786 3.416) 6.894 2.747 ( 7.697 1.735 -3.022) 8.450 2.794 ( 5.824 -0.509 11.056) 12.507 2.916 ( -0.257 0.922 0.046) 0.959 3.058 ( -1.303 -3.883 1.754) 4.456 3.097 ( 7.910 -3.223 -2.168) 8.812 3.343 ( -8.168 -1.437 3.874) 9.154 3.595 ( 7.722 -2.127 1.928) 8.238 4.062 ( -3.256 0.357 -16.581) 16.902 4.283 ( 5.341 5.328 -9.996) 12.523 4.531 ( -3.887 6.239 1.051) 7.426 4.661 ( -3.639 9.017 -2.099) 9.948 4.991 ( -13.834 -11.226 -4.278) 18.322 5.087 ( 4.043 -3.693 -6.222) 8.288 5.293 ( -9.402 -8.373 1.197) 12.647 5.499 ( -10.589 -3.322 -9.647) 14.705 5.700 ( -1.162 4.578 0.173) 4.726 5.804 ( -2.199 -5.076 -3.047) 6.316 5.909 ( 0.459 -3.175 -2.565) 4.107 6.076 ( 6.507 -10.828 0.659) 12.650 6.181 ( 1.738 0.521 -5.681) 5.963 6.276 ( 18.832 2.116 -0.915) 18.973 6.626 ( -11.272 -6.288 -5.191) 13.911 7.056 ( -0.277 -1.886 -0.926) 2.119 7.187 ( -2.238 4.544 6.205) 8.010 7.367 ( 9.543 5.941 13.901) 17.877 7.827 ( -5.170 1.937 -2.436) 6.035 8.084 ( 1.718 0.424 -9.894) 10.051 8.158 ( 2.835 1.172 1.621) 3.470 8.318 ( 1.268 -3.242 -4.117) 5.392 9.117 ( 4.170 7.198 9.421) 12.568 9.277 ( -2.734 0.267 -1.128) 2.970 9.565 ( -1.962 6.572 -2.879) 7.438 9.616 ( -6.284 4.690 5.106) 9.358 9.887 ( -11.983 7.945 -2.487) 14.591 10.198 ( -2.513 3.620 0.716) 4.464 10.383 ( 4.155 -1.775 4.501) 6.378 10.569 ( 10.985 -2.616 6.349) 12.955 11.159 ( -3.523 -1.833 -2.907) 4.921 11.482 ( 6.196 -3.193 -2.326) 7.348 12.763 ( -6.649 1.591 1.836) 7.079 12.906 ( -1.337 -3.334 0.268) 3.603 13.006 ( 0.699 2.227 3.967) 4.603 13.033 ( -1.210 1.594 4.058) 4.525 14.986 ( -8.922 -6.723 -0.427) 11.179 15.127 ( 1.444 -1.342 0.357) 2.004 15.381 ( 0.020 1.722 -2.515) 3.048 15.401 ( -4.789 -13.025 1.156) 13.926 15.610 ( 5.565 -3.394 -1.359) 6.659 15.701 ( 3.193 0.067 0.716) 3.273 15.890 ( -7.056 3.359 -0.545) 7.834 16.016 ( 7.054 2.181 -2.305) 7.735 21.158 ( -1.186 -7.427 -1.205) 7.617 21.231 ( -3.656 -7.305 -3.852) 9.032 22.508 ( -2.905 -0.166 3.654) 4.671 22.601 ( 4.242 0.026 4.607) 6.263 ======================= Grid point 117 (49/170) ======================= q-point: (-0.36 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( -16.397 4.970 -13.212) 21.636 2.144 ( -12.144 1.162 -9.062) 15.197 2.468 ( 2.840 0.700 4.337) 5.231 2.497 ( 7.660 0.967 2.824) 8.221 2.637 ( 4.214 1.402 4.832) 6.563 2.858 ( 9.947 0.670 -1.324) 10.057 2.922 ( 2.971 -1.249 6.464) 7.223 3.038 ( -1.933 -2.521 0.787) 3.273 3.112 ( 12.602 1.480 6.458) 14.238 3.197 ( 4.962 -3.729 -1.762) 6.453 3.292 ( -0.700 0.650 1.772) 2.013 3.716 ( 9.311 -0.468 -6.300) 11.252 3.802 ( -7.289 1.884 -13.626) 15.568 4.170 ( 0.975 2.188 -15.935) 16.114 4.508 ( -4.823 0.185 -0.503) 4.853 4.586 ( -8.250 -1.454 0.024) 8.377 4.692 ( -9.050 -5.955 -2.429) 11.102 4.855 ( -27.583 -1.650 -4.645) 28.020 5.085 ( -0.828 5.330 -3.115) 6.229 5.480 ( -9.888 4.057 -1.886) 10.853 5.569 ( -0.236 2.205 3.503) 4.146 5.650 ( -5.567 1.600 -2.736) 6.406 5.917 ( -1.009 4.034 0.184) 4.162 6.219 ( 9.683 -10.072 -2.302) 14.160 6.293 ( 10.863 -1.206 1.169) 10.992 6.383 ( -13.383 -7.182 -1.715) 15.285 6.656 ( 23.319 -3.726 1.916) 23.692 6.904 ( -4.712 1.641 -9.085) 10.365 7.284 ( 0.417 -2.572 8.213) 8.616 7.567 ( -10.491 9.253 -3.623) 14.450 7.667 ( -0.950 4.364 6.436) 7.834 8.019 ( 2.204 -0.366 -6.855) 7.210 8.218 ( 3.443 -2.722 -0.328) 4.401 8.271 ( 0.399 -8.932 -6.932) 11.313 9.156 ( -8.054 3.708 -2.154) 9.124 9.291 ( 0.064 3.398 5.950) 6.852 9.385 ( -7.270 7.864 0.130) 10.710 9.710 ( -8.917 8.552 3.589) 12.865 9.747 ( 5.277 -0.964 7.144) 8.934 10.175 ( -2.794 5.507 7.392) 9.632 10.463 ( 3.432 -0.968 -2.552) 4.385 10.771 ( 10.575 -0.721 -2.558) 10.903 11.146 ( 4.183 -1.944 0.932) 4.706 11.580 ( 7.941 -3.865 -0.711) 8.860 12.639 ( -10.372 1.550 0.349) 10.493 12.811 ( -9.800 -2.338 0.586) 10.092 13.038 ( -1.718 -0.431 2.576) 3.126 13.077 ( -1.108 3.017 5.411) 6.294 14.832 ( -8.836 -3.307 -1.569) 9.564 15.039 ( -9.774 1.062 1.025) 9.884 15.307 ( -6.619 2.809 -0.794) 7.234 15.436 ( 0.485 -9.745 2.276) 10.019 15.592 ( 1.046 -2.715 -6.261) 6.904 15.744 ( -2.797 0.826 -1.294) 3.191 15.868 ( 8.297 -2.057 1.553) 8.688 16.123 ( 7.431 1.643 -0.059) 7.611 21.085 ( -8.942 -5.251 -4.016) 11.120 21.110 ( -3.688 -4.429 -0.045) 5.764 22.503 ( -1.721 -0.816 2.126) 2.854 22.729 ( 4.660 -0.753 5.042) 6.907 ======================= Grid point 118 (50/170) ======================= q-point: (-0.27 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( -19.643 11.732 -13.538) 26.585 1.779 ( -20.225 5.993 -8.849) 22.875 2.579 ( 6.736 2.201 -0.739) 7.125 2.723 ( 10.016 -4.121 11.673) 15.924 2.757 ( 4.503 0.357 2.797) 5.313 2.972 ( -0.054 0.331 -2.749) 2.770 3.017 ( -4.350 2.716 -1.962) 5.491 3.056 ( 4.680 -1.940 3.971) 6.437 3.143 ( -6.215 4.966 4.401) 9.092 3.254 ( 2.088 1.923 2.438) 3.742 3.388 ( 7.495 0.940 -4.092) 8.590 3.609 ( -0.468 0.978 -4.717) 4.840 3.714 ( 9.484 1.526 -18.773) 21.087 4.071 ( 0.416 -7.240 -2.531) 7.681 4.249 ( -18.623 -9.569 -3.210) 21.182 4.399 ( -4.466 -4.639 -2.451) 6.890 4.578 ( -5.555 8.413 1.006) 10.132 4.759 ( 6.338 1.527 3.248) 7.283 4.990 ( -5.957 10.111 -4.500) 12.568 5.266 ( -15.233 3.542 3.245) 15.972 5.415 ( -7.679 6.833 -3.791) 10.956 5.758 ( 0.762 -1.325 3.228) 3.571 5.945 ( 4.483 7.114 6.102) 10.390 6.161 ( -10.612 -7.053 -1.272) 12.805 6.284 ( -2.137 -2.353 -0.596) 3.234 6.443 ( 6.253 0.173 -0.900) 6.320 6.729 ( -0.416 -3.191 -6.259) 7.038 7.027 ( 10.828 -2.503 0.230) 11.116 7.197 ( -11.751 13.840 -8.724) 20.143 7.352 ( -2.269 -1.567 3.835) 4.723 7.770 ( 0.178 0.556 4.815) 4.850 7.964 ( -2.130 1.726 -5.296) 5.963 8.174 ( -2.447 -11.032 -6.928) 13.255 8.257 ( 2.658 -2.343 -1.452) 3.829 8.919 ( -15.128 4.133 -2.119) 15.825 9.292 ( 0.279 -2.363 2.398) 3.378 9.407 ( 0.180 13.404 5.025) 14.316 9.671 ( -4.202 7.769 6.401) 10.908 9.910 ( 3.851 -4.858 8.061) 10.169 10.323 ( 7.329 3.320 10.953) 13.590 10.437 ( 2.099 -2.482 -8.018) 8.651 10.861 ( 10.296 -0.240 -8.651) 13.450 11.288 ( 8.657 -0.269 3.972) 9.528 11.700 ( 7.410 -4.546 -0.134) 8.694 12.455 ( -12.384 0.893 -0.557) 12.428 12.637 ( -13.997 -3.574 2.054) 14.591 13.013 ( -4.498 -0.593 1.672) 4.835 13.083 ( -4.394 1.991 3.415) 5.910 14.683 ( -7.235 1.959 -2.015) 7.762 14.917 ( -7.184 3.489 2.294) 8.309 15.176 ( -9.220 2.276 0.563) 9.513 15.359 ( -8.427 -0.999 -1.913) 8.699 15.499 ( -3.421 -2.311 -5.960) 7.250 15.808 ( 9.440 -5.078 0.595) 10.736 16.019 ( 7.935 -0.578 0.951) 8.012 16.230 ( 5.476 -0.230 0.558) 5.510 20.875 ( -12.296 -1.381 -2.937) 12.717 21.051 ( -4.502 -0.395 1.127) 4.658 22.501 ( -0.538 -1.714 0.686) 1.923 22.843 ( 3.611 -1.469 3.411) 5.180 ======================= Grid point 119 (51/170) ======================= q-point: (-0.18 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.999 ( -14.514 23.181 4.747) 27.758 1.359 ( -23.542 14.758 -2.294) 27.880 2.392 ( -40.516 29.020 -1.372) 49.856 2.712 ( 0.766 -3.180 -0.865) 3.383 2.843 ( -0.646 4.718 0.042) 4.762 2.927 ( 1.875 -2.853 -0.242) 3.423 3.038 ( 7.283 -8.293 11.343) 15.827 3.212 ( 3.647 -2.435 1.503) 4.635 3.229 ( 13.116 -4.519 -8.309) 16.171 3.314 ( 2.010 1.186 0.301) 2.354 3.372 ( 4.072 6.123 -6.728) 9.967 3.648 ( 3.868 1.865 0.178) 4.298 3.723 ( 7.254 -3.560 -1.032) 8.146 3.962 ( -8.988 -3.186 2.380) 9.829 4.108 ( 1.133 -7.330 -3.674) 8.277 4.396 ( 4.677 -1.979 -1.607) 5.326 4.556 ( -5.131 6.456 4.789) 9.536 4.824 ( -2.286 9.417 -6.140) 11.472 4.957 ( 11.855 -1.712 2.392) 12.215 5.062 ( -10.183 8.221 -1.516) 13.175 5.321 ( -6.331 8.481 2.476) 10.870 5.700 ( -5.658 5.884 -0.584) 8.183 5.988 ( -10.655 -1.870 2.628) 11.132 6.134 ( -4.331 -0.174 10.273) 11.150 6.228 ( 1.374 -0.720 3.137) 3.499 6.432 ( -5.766 -1.646 -5.152) 7.906 6.606 ( -5.249 7.647 -4.868) 10.475 6.973 ( 4.152 3.591 -3.388) 6.451 7.115 ( -9.120 -0.271 -1.825) 9.305 7.423 ( 7.070 4.419 1.159) 8.417 7.763 ( -1.820 2.452 -4.510) 5.447 7.808 ( -10.450 2.149 -2.791) 11.027 8.100 ( 0.773 -5.888 -1.186) 6.056 8.275 ( 1.464 -2.185 -1.150) 2.871 8.741 ( -2.257 3.412 -2.833) 4.976 9.364 ( 4.386 -6.155 2.442) 7.942 9.474 ( 2.356 15.070 3.866) 15.735 9.690 ( -3.390 4.381 7.122) 9.023 9.997 ( -4.169 -2.277 3.977) 6.195 10.383 ( 8.162 -8.051 -7.951) 13.952 10.612 ( 10.443 3.619 9.202) 14.382 10.930 ( 9.862 -2.550 -6.959) 12.337 11.468 ( 9.525 1.971 1.729) 9.880 11.798 ( 5.097 -5.065 0.086) 7.186 12.258 ( -11.590 -0.644 -0.169) 11.609 12.402 ( -20.460 -9.902 2.669) 22.886 12.935 ( -7.010 -0.628 0.768) 7.080 13.024 ( -5.312 1.363 0.339) 5.494 14.570 ( -5.075 6.621 -0.565) 8.362 14.882 ( -1.000 8.910 3.975) 9.808 15.052 ( -8.280 1.498 3.096) 8.966 15.181 ( -6.912 2.263 -7.113) 10.173 15.404 ( -1.609 -3.620 -3.717) 5.432 15.965 ( 8.743 -3.508 0.279) 9.424 16.122 ( 3.814 1.347 0.592) 4.088 16.303 ( 3.754 -1.990 -0.418) 4.270 20.658 ( -11.807 2.379 -0.997) 12.085 20.994 ( -4.826 2.588 1.495) 5.676 22.502 ( 0.234 -2.163 -0.118) 2.179 22.910 ( 2.108 -1.770 0.550) 2.807 ======================= Grid point 120 (52/170) ======================= q-point: (-0.09 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.001 ( -8.733 28.267 20.616) 36.060 1.068 ( -17.446 26.356 11.648) 33.686 1.795 ( -35.858 43.354 19.394) 59.510 2.698 ( 0.063 0.051 -4.710) 4.711 2.828 ( -1.520 2.821 3.100) 4.459 2.945 ( 2.353 -0.823 -4.897) 5.495 3.138 ( -1.336 -4.697 -10.083) 11.203 3.198 ( -1.230 0.263 -4.672) 4.838 3.307 ( 6.038 -6.330 4.544) 9.858 3.352 ( 10.798 -3.361 -7.634) 13.644 3.526 ( 9.941 -4.569 12.011) 16.246 3.651 ( -3.709 -2.612 1.798) 4.880 3.863 ( -0.511 2.014 12.463) 12.635 4.047 ( 9.820 7.115 6.231) 13.634 4.078 ( -0.012 -10.474 -1.435) 10.572 4.437 ( 1.703 2.229 -2.104) 3.506 4.553 ( -1.799 4.288 8.539) 9.723 4.688 ( -4.490 1.972 -10.640) 11.715 4.936 ( -1.801 14.618 -0.929) 14.758 5.171 ( -1.261 -1.081 2.751) 3.214 5.283 ( 8.604 4.460 0.874) 9.730 5.620 ( -1.262 13.676 -4.583) 14.479 5.800 ( -13.383 1.778 -0.568) 13.513 6.108 ( -9.412 -3.676 12.145) 15.799 6.217 ( -15.179 11.780 1.465) 19.270 6.307 ( -0.414 -1.871 -3.243) 3.766 6.602 ( 7.705 -2.703 -0.336) 8.172 6.917 ( -7.142 2.740 0.764) 7.687 7.068 ( 2.581 3.265 3.627) 5.521 7.457 ( -2.406 18.569 -2.394) 18.877 7.608 ( -7.494 3.996 -2.386) 8.822 7.748 ( 3.187 -6.332 0.728) 7.126 8.154 ( 4.101 -1.706 1.059) 4.566 8.271 ( 0.229 -3.365 -2.033) 3.938 8.812 ( 14.415 5.231 -4.102) 15.874 9.448 ( 2.082 -7.739 0.145) 8.016 9.556 ( 7.023 11.091 -3.031) 13.473 9.700 ( -1.193 3.029 0.125) 3.258 9.859 ( -6.928 -1.141 -8.177) 10.778 10.537 ( 10.556 -8.203 5.269) 14.370 10.779 ( 5.227 6.458 -3.721) 9.103 11.044 ( 7.108 -6.958 3.803) 10.649 11.588 ( 5.142 1.695 -2.777) 6.085 11.870 ( 0.127 -6.808 3.313) 7.572 12.015 ( -28.065 -9.639 6.275) 30.330 12.109 ( -8.390 -1.399 -0.730) 8.537 12.823 ( -6.177 0.001 -1.242) 6.301 12.939 ( -3.540 0.425 -2.416) 4.307 14.519 ( -2.415 8.943 1.955) 9.468 14.933 ( -4.203 5.427 4.410) 8.159 14.988 ( -5.004 1.817 -1.687) 5.584 15.092 ( 10.584 10.892 -0.136) 15.187 15.360 ( 0.836 -4.711 -3.541) 5.952 16.067 ( 4.105 -0.161 -1.416) 4.345 16.151 ( 0.272 0.003 0.044) 0.275 16.341 ( 2.578 -2.037 -1.579) 3.645 20.505 ( -7.078 4.604 1.316) 8.545 20.918 ( -6.185 2.425 -0.014) 6.644 22.505 ( 0.455 -2.200 -0.245) 2.260 22.921 ( 0.842 -1.794 -2.690) 3.341 ======================= Grid point 121 (53/170) ======================= q-point: ( 0.00 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( -2.962 23.916 10.127) 26.140 1.628 ( -6.536 25.165 5.743) 26.627 2.644 ( 1.989 -1.686 -3.259) 4.174 2.673 ( -5.656 -8.338 -5.927) 11.689 2.758 ( 1.975 12.436 9.506) 15.777 2.863 ( 2.452 3.434 4.052) 5.850 2.886 ( 0.798 0.296 -1.639) 1.847 3.210 ( -1.050 5.038 -8.226) 9.703 3.221 ( 4.823 -12.512 5.039) 14.325 3.312 ( 3.912 -2.839 -7.124) 8.610 3.448 ( -4.756 -2.818 1.564) 5.745 3.709 ( 0.368 -9.106 -5.008) 10.399 3.916 ( 3.178 4.357 6.110) 8.150 4.161 ( -2.971 4.698 20.728) 21.460 4.352 ( 0.290 6.233 1.945) 6.536 4.508 ( 8.332 7.977 8.770) 14.490 4.678 ( -8.839 9.101 8.243) 15.129 4.852 ( 2.042 13.470 3.859) 14.160 5.170 ( -3.068 5.935 -0.913) 6.743 5.327 ( -2.798 5.679 0.276) 6.337 5.437 ( -0.240 14.321 1.638) 14.416 5.748 ( 2.038 -0.009 -4.730) 5.150 5.825 ( 1.948 8.012 -0.305) 8.251 6.035 ( -2.966 1.828 2.214) 4.128 6.243 ( 4.641 3.059 0.908) 5.633 6.442 ( -12.317 16.728 -3.391) 21.049 6.653 ( 10.573 -2.413 4.860) 11.884 7.137 ( -3.121 3.500 0.060) 4.690 7.222 ( 4.871 11.850 -0.461) 12.820 7.546 ( 0.994 0.790 5.382) 5.530 7.663 ( -1.374 -5.603 -1.007) 5.856 7.946 ( 2.023 21.048 0.142) 21.145 8.125 ( 4.175 -6.367 -1.367) 7.736 8.188 ( -1.955 -3.702 1.186) 4.351 8.882 ( -0.725 -2.943 -1.413) 3.345 9.251 ( -2.126 -7.356 -1.474) 7.797 9.534 ( 2.685 -5.729 -9.065) 11.055 9.654 ( -6.706 5.247 -8.322) 11.906 9.837 ( 6.754 3.935 -0.135) 7.818 10.532 ( -4.036 -6.620 7.332) 10.671 10.693 ( -4.988 -2.295 -12.122) 13.307 11.107 ( 4.722 -2.348 5.719) 7.780 11.579 ( -1.866 -6.865 -6.734) 9.796 11.778 ( 7.800 0.807 5.533) 9.597 11.925 ( -10.028 0.875 0.827) 10.100 12.098 ( 2.162 5.390 11.388) 12.783 12.735 ( -0.221 -0.577 -4.295) 4.339 12.867 ( 0.272 -0.962 -3.838) 3.966 14.772 ( 1.700 9.189 3.053) 9.831 15.009 ( -1.267 0.995 8.154) 8.312 15.046 ( -3.949 12.043 0.081) 12.674 15.276 ( 2.839 -0.897 -1.664) 3.410 15.376 ( 1.430 7.065 -2.384) 7.592 16.068 ( 2.800 -2.325 -4.244) 5.591 16.112 ( -1.677 -2.818 0.696) 3.352 16.281 ( -0.060 -4.131 -2.428) 4.792 20.662 ( 1.634 11.167 2.619) 11.586 20.916 ( -2.186 5.588 -1.539) 6.195 22.448 ( -0.011 -3.129 -0.387) 3.153 22.809 ( -0.030 -5.232 -5.601) 7.664 ======================= Grid point 122 (54/170) ======================= q-point: ( 0.09 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( 5.096 13.998 10.633) 18.303 1.735 ( -0.021 17.094 14.116) 22.169 2.436 ( -4.377 -4.643 -14.493) 15.836 2.640 ( 0.217 -6.887 -1.930) 7.156 2.751 ( -1.230 -3.062 -1.967) 3.841 2.894 ( 2.690 -2.155 -2.073) 4.022 3.029 ( -2.171 3.137 -5.883) 7.012 3.205 ( -1.140 -2.215 -11.873) 12.131 3.269 ( 7.766 4.915 15.890) 18.356 3.352 ( 1.267 -9.884 2.544) 10.285 3.364 ( -4.782 -5.072 5.483) 8.869 3.651 ( 0.120 -0.771 -6.755) 6.800 4.041 ( 2.484 8.792 10.743) 14.102 4.268 ( -4.491 8.827 9.906) 14.007 4.432 ( -3.304 11.733 8.440) 14.826 4.606 ( -7.710 10.676 6.104) 14.515 4.776 ( 10.698 2.744 5.072) 12.153 4.911 ( -6.866 9.115 16.112) 19.744 5.007 ( -10.030 4.176 -5.275) 12.077 5.306 ( -3.010 11.906 5.302) 13.377 5.416 ( 1.681 7.960 1.848) 8.343 5.726 ( 3.278 0.325 -7.564) 8.250 5.890 ( 2.564 3.887 0.800) 4.725 6.106 ( 0.925 6.185 5.519) 8.341 6.256 ( 2.167 9.250 -2.217) 9.756 6.416 ( 7.330 2.447 2.337) 8.074 6.850 ( 6.757 -0.399 3.145) 7.464 7.041 ( -1.572 1.260 -1.595) 2.570 7.300 ( 2.225 3.045 -3.307) 5.016 7.522 ( -7.044 3.415 2.221) 8.137 7.665 ( 2.421 8.583 -2.485) 9.258 8.018 ( 5.476 11.267 1.775) 12.653 8.180 ( 3.003 -5.482 -0.649) 6.284 8.201 ( -1.096 -5.616 6.843) 8.920 8.805 ( -2.174 0.651 -3.794) 4.421 9.183 ( -0.981 -3.418 -4.527) 5.756 9.422 ( -2.128 11.869 -10.221) 15.807 9.587 ( 6.854 -0.786 -4.598) 8.291 9.931 ( -0.401 1.005 6.014) 6.111 10.364 ( -11.299 -1.566 -13.335) 17.548 10.598 ( -2.147 -4.253 6.603) 8.143 11.212 ( 0.367 -6.366 6.523) 9.122 11.401 ( -9.843 -4.918 -8.472) 13.887 11.733 ( -9.293 -7.269 -3.366) 12.269 12.088 ( 15.599 2.944 8.107) 17.825 12.297 ( 7.151 3.531 9.774) 12.615 12.724 ( 5.541 -0.781 -5.799) 8.059 12.854 ( 4.546 0.420 -6.029) 7.562 14.845 ( 1.203 10.976 4.077) 11.771 14.958 ( -3.293 9.149 -2.806) 10.121 15.126 ( 1.114 2.775 10.436) 10.856 15.268 ( -3.125 0.658 -1.109) 3.381 15.395 ( 6.800 4.554 -0.271) 8.188 16.020 ( -3.362 -1.665 -3.921) 5.427 16.088 ( -2.345 -3.987 -0.349) 4.639 16.219 ( -2.971 -4.888 -3.808) 6.871 20.755 ( 4.395 8.749 4.619) 10.826 20.899 ( 2.782 4.632 -2.420) 5.921 22.441 ( -0.619 -3.621 0.025) 3.674 22.733 ( -0.478 -4.906 -7.241) 8.759 ======================= Grid point 123 (55/170) ======================= q-point: ( 0.18 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( 5.112 10.386 10.980) 15.955 1.994 ( 11.599 1.857 16.666) 20.390 2.268 ( 0.263 -1.271 -8.746) 8.842 2.606 ( -2.347 -6.124 -0.988) 6.632 2.724 ( -1.633 -4.788 0.389) 5.074 2.855 ( -6.301 1.936 -7.775) 10.193 2.924 ( 3.262 -5.387 -5.410) 8.302 3.027 ( -3.436 1.830 -11.427) 12.072 3.260 ( -7.065 -4.419 2.441) 8.683 3.344 ( -6.124 -4.967 -1.405) 8.009 3.480 ( -0.618 -9.041 1.902) 9.260 3.668 ( 6.512 -5.468 -1.092) 8.573 4.222 ( -2.231 6.516 5.778) 8.990 4.258 ( -6.148 21.252 8.577) 23.728 4.319 ( -8.295 7.448 9.921) 14.923 4.685 ( 4.923 13.556 -0.560) 14.433 4.799 ( -5.346 7.327 2.597) 9.435 4.870 ( -3.168 9.174 4.114) 10.541 5.088 ( 5.474 -0.615 13.645) 14.715 5.379 ( 0.582 5.539 4.601) 7.224 5.518 ( 5.464 3.051 4.003) 7.429 5.687 ( 2.888 1.703 -5.836) 6.730 5.961 ( 0.597 5.562 4.990) 7.496 6.103 ( 0.966 6.500 3.411) 7.404 6.413 ( 6.966 3.035 5.041) 9.119 6.466 ( -1.380 -3.678 -1.343) 4.151 6.839 ( -7.992 -12.116 -3.488) 14.928 7.085 ( -0.910 7.551 1.790) 7.813 7.223 ( 1.836 -6.974 -6.632) 9.798 7.478 ( 0.468 13.623 -1.160) 13.680 7.686 ( 3.805 13.476 0.419) 14.009 8.122 ( 3.219 -0.128 3.937) 5.087 8.202 ( 1.695 -1.831 -3.869) 4.604 8.254 ( -1.093 -5.308 4.018) 6.746 8.850 ( 10.400 2.815 2.819) 11.137 9.139 ( 2.218 2.306 -3.578) 4.800 9.344 ( 5.051 15.174 -8.782) 18.245 9.668 ( 6.235 2.931 -1.161) 6.987 9.907 ( -11.379 0.670 0.392) 11.406 10.069 ( -4.060 2.036 -7.479) 8.750 10.664 ( -1.418 -3.241 7.624) 8.404 11.110 ( -12.917 -4.436 -10.417) 17.177 11.269 ( -3.563 -6.721 8.554) 11.448 11.548 ( -7.235 -8.527 -5.639) 12.524 12.408 ( 14.003 -0.281 6.494) 15.438 12.513 ( 7.493 2.060 7.578) 10.854 12.767 ( 7.513 -0.402 -5.433) 9.281 12.864 ( 6.149 1.862 -7.708) 10.035 14.826 ( -4.614 7.382 -0.210) 8.708 14.944 ( 0.888 7.590 1.650) 7.818 15.196 ( 1.966 2.446 -0.597) 3.194 15.295 ( 3.120 2.777 5.034) 6.542 15.555 ( 9.829 2.065 4.191) 10.883 15.880 ( -10.334 -3.805 -0.961) 11.054 16.015 ( -6.328 -5.231 -0.973) 8.268 16.128 ( -0.868 -4.154 -6.288) 7.586 20.869 ( 4.385 2.229 1.795) 5.237 20.949 ( 4.490 2.924 1.200) 5.491 22.432 ( -0.787 -3.613 0.547) 3.738 22.642 ( -0.869 -3.995 -6.988) 8.096 ======================= Grid point 124 (56/170) ======================= q-point: ( 0.27 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 6.296 3.876 8.829) 11.516 2.254 ( 5.342 2.758 -2.281) 6.430 2.352 ( 10.025 -1.344 11.674) 15.446 2.568 ( -1.123 -3.666 2.373) 4.509 2.627 ( -7.450 5.822 -5.688) 11.034 2.736 ( 0.963 -8.018 -1.769) 8.268 2.843 ( -6.493 -3.299 -5.964) 9.413 2.915 ( 1.097 -3.281 -6.468) 7.335 3.161 ( -11.908 0.102 1.865) 12.053 3.176 ( -6.148 -2.284 -4.803) 8.129 3.430 ( -6.751 -2.247 3.138) 7.776 3.673 ( -2.465 -5.239 -4.092) 7.090 4.169 ( 1.332 -0.753 0.845) 1.748 4.254 ( 3.673 -3.289 1.252) 5.087 4.522 ( 4.030 12.787 12.238) 18.152 4.619 ( -3.265 10.751 -5.932) 12.706 4.779 ( -1.674 7.155 3.779) 8.263 4.956 ( 4.204 11.482 2.047) 12.398 5.316 ( -4.506 -6.086 6.760) 10.151 5.431 ( 11.348 3.888 6.918) 13.848 5.646 ( 2.353 1.807 -2.144) 3.661 5.673 ( 2.808 -0.454 0.685) 2.926 5.937 ( -5.796 -6.499 -1.236) 8.796 6.237 ( 4.970 6.944 8.321) 11.923 6.387 ( -11.122 0.107 0.292) 11.127 6.482 ( 0.575 1.080 -8.967) 9.050 6.691 ( -4.760 -10.035 13.974) 17.851 6.940 ( -4.225 -2.949 -13.128) 14.103 7.279 ( 1.857 1.460 2.198) 3.227 7.446 ( -1.522 13.075 -3.908) 13.731 7.820 ( 7.796 10.801 3.601) 13.799 8.105 ( -5.214 -6.143 -1.973) 8.296 8.233 ( 3.260 -1.323 -6.419) 7.320 8.268 ( 5.822 3.792 1.838) 7.187 9.115 ( 11.715 0.467 3.942) 12.369 9.215 ( 5.200 1.283 4.529) 7.015 9.305 ( 4.298 13.860 -8.440) 16.787 9.706 ( 2.114 9.532 -3.305) 10.308 9.795 ( 5.025 4.935 -0.254) 7.047 10.042 ( -1.987 0.129 4.604) 5.016 10.646 ( -9.406 -2.898 -0.339) 9.848 10.816 ( -10.323 -0.653 -5.704) 11.812 11.287 ( -5.953 -6.763 8.086) 12.107 11.409 ( -1.954 -7.748 -5.231) 9.551 12.639 ( 7.732 -1.976 2.156) 8.266 12.693 ( 6.492 -0.937 6.458) 9.205 12.835 ( 6.953 2.031 -3.680) 8.124 12.883 ( 6.184 2.648 -5.134) 8.462 14.768 ( -1.464 1.603 -0.764) 2.302 14.979 ( 1.638 1.327 1.824) 2.788 15.231 ( 2.200 2.570 -1.252) 3.607 15.391 ( 4.513 4.168 1.144) 6.248 15.664 ( -6.106 -6.345 -1.814) 8.991 15.802 ( 4.017 1.093 7.604) 8.669 15.879 ( -9.211 -5.718 -0.076) 10.842 16.061 ( 1.489 -2.099 -6.755) 7.229 20.928 ( 3.435 -3.277 -1.477) 4.972 21.041 ( 2.670 -2.242 3.660) 5.056 22.432 ( -0.256 -2.809 1.019) 3.000 22.562 ( -1.183 -2.688 -4.309) 5.215 ======================= Grid point 125 (57/170) ======================= q-point: ( 0.36 0.25 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( 3.676 2.137 4.702) 6.340 2.334 ( 5.162 4.527 -0.820) 6.915 2.418 ( -1.936 2.663 -7.547) 8.234 2.533 ( 0.917 1.721 2.768) 3.386 2.636 ( 0.759 -2.394 1.081) 2.735 2.703 ( -4.684 -2.902 -2.809) 6.184 2.787 ( -5.463 -3.844 -2.204) 7.033 2.840 ( 4.363 -3.827 8.166) 10.018 2.991 ( -11.906 2.831 2.816) 12.558 3.069 ( 0.309 0.898 -5.446) 5.529 3.394 ( -5.322 -1.008 6.668) 8.591 3.543 ( -6.167 0.479 -4.003) 7.368 4.281 ( 10.284 -11.957 -3.433) 16.141 4.356 ( 7.008 -7.085 0.072) 9.966 4.550 ( 3.561 8.868 -1.729) 9.711 4.639 ( 3.757 3.795 -2.258) 5.798 4.848 ( 3.411 5.871 5.564) 8.778 5.003 ( 1.830 5.906 -2.547) 6.687 5.284 ( -4.769 -2.711 5.716) 7.923 5.425 ( -10.738 -7.576 -14.069) 19.252 5.570 ( -8.280 -8.422 6.200) 13.339 5.813 ( -1.959 -9.388 4.843) 10.743 5.904 ( 5.101 -4.539 3.715) 7.773 6.088 ( -13.026 -7.060 -6.597) 16.218 6.342 ( 5.160 11.220 -6.205) 13.821 6.559 ( 9.606 8.026 8.132) 14.928 6.684 ( -2.264 -1.506 -17.906) 18.111 6.911 ( 3.701 0.058 14.640) 15.100 7.224 ( -5.348 5.331 -8.193) 11.143 7.399 ( -3.395 6.894 4.082) 8.702 7.898 ( -2.423 1.748 1.344) 3.276 8.006 ( -3.215 -2.898 -1.836) 4.701 8.243 ( 9.461 1.632 -8.941) 13.119 8.384 ( 6.637 7.242 -0.996) 9.873 9.094 ( -3.701 6.066 -3.123) 7.762 9.304 ( 5.276 -0.645 1.711) 5.584 9.573 ( 11.460 2.762 13.003) 17.551 9.728 ( 4.522 11.737 -3.977) 13.191 9.958 ( 10.544 7.074 5.277) 13.751 10.085 ( 2.558 -2.302 2.526) 4.269 10.403 ( -11.625 -4.405 -5.870) 13.747 10.631 ( -12.177 6.531 -0.852) 13.844 11.272 ( -3.869 -5.760 3.678) 7.853 11.361 ( -0.585 -5.743 -1.706) 6.020 12.722 ( 3.895 -3.020 -1.076) 5.044 12.838 ( 2.345 -1.725 5.536) 6.255 12.893 ( 6.167 2.362 -2.933) 7.226 12.958 ( 4.251 3.071 1.649) 5.498 14.768 ( 2.404 -3.616 -0.577) 4.380 15.049 ( 5.414 -5.304 1.068) 7.654 15.189 ( -6.338 -0.948 -0.411) 6.422 15.450 ( -0.319 -0.756 0.417) 0.920 15.544 ( -3.067 -4.982 -2.940) 6.547 15.762 ( -3.939 -0.884 0.247) 4.044 15.944 ( 4.701 1.934 1.290) 5.244 16.035 ( 1.228 0.244 -1.192) 1.729 20.950 ( 1.851 -7.857 -1.901) 8.293 21.093 ( 0.548 -7.991 0.928) 8.063 22.450 ( 0.737 -1.489 1.816) 2.461 22.517 ( -1.460 -1.503 0.017) 2.096 ======================= Grid point 126 (58/170) ======================= q-point: ( 0.45 0.25 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( -3.081 1.129 -7.225) 7.935 2.319 ( 1.830 4.588 -2.028) 5.339 2.384 ( 2.124 4.429 -3.077) 5.796 2.607 ( 1.792 2.301 2.934) 4.137 2.649 ( 2.882 -0.653 -1.906) 3.517 2.656 ( 1.235 -0.684 3.841) 4.092 2.704 ( -8.975 -0.167 5.840) 10.709 2.855 ( -5.783 -0.552 3.258) 6.660 2.983 ( 0.947 -2.013 2.917) 3.669 3.053 ( 4.074 0.637 -4.872) 6.382 3.377 ( -6.344 -1.640 5.930) 8.838 3.458 ( 0.085 -0.783 -0.602) 0.991 4.314 ( 3.919 -1.436 -12.908) 13.566 4.396 ( 2.299 5.317 -6.255) 8.525 4.685 ( 9.440 -3.166 1.596) 10.084 4.732 ( 11.149 -10.524 -1.435) 15.399 4.931 ( -2.114 1.091 1.076) 2.611 4.949 ( -2.529 -14.630 -3.490) 15.251 5.087 ( -10.071 -1.380 -6.641) 12.142 5.284 ( -11.116 -19.139 5.844) 22.892 5.463 ( 0.286 -0.020 2.461) 2.477 5.794 ( -2.714 -6.794 3.622) 8.163 5.916 ( -5.558 -6.137 -1.840) 8.482 6.015 ( 3.603 2.722 -0.201) 4.520 6.318 ( 5.800 8.740 -13.518) 17.111 6.415 ( -1.594 4.126 -17.638) 18.185 6.799 ( 1.654 2.722 -2.238) 3.893 7.051 ( -3.848 7.632 4.036) 9.452 7.111 ( 5.807 -0.356 6.156) 8.470 7.398 ( -2.755 5.270 4.469) 7.438 7.848 ( -1.940 -1.159 -0.487) 2.311 7.971 ( -0.058 -3.530 -0.625) 3.585 8.284 ( 7.534 4.670 -8.933) 12.585 8.426 ( 1.783 6.005 -4.814) 7.900 9.094 ( 1.686 4.588 5.264) 7.184 9.334 ( -2.364 -2.815 -0.810) 3.763 9.689 ( 0.735 9.782 -1.373) 9.905 9.841 ( -1.110 2.501 5.043) 5.738 10.162 ( 4.181 -2.640 5.453) 7.361 10.210 ( 14.034 8.050 3.872) 16.636 10.272 ( -3.351 -0.848 2.819) 4.461 10.416 ( -11.381 9.189 -0.259) 14.630 11.220 ( -6.562 -3.295 0.672) 7.374 11.349 ( 2.589 -5.669 -2.665) 6.778 12.765 ( 2.026 -3.288 0.579) 3.905 12.892 ( -1.111 0.708 3.097) 3.365 12.957 ( 2.116 -0.782 1.522) 2.721 13.032 ( 2.020 3.158 3.194) 4.925 14.826 ( 4.335 -7.542 0.443) 8.711 15.068 ( -5.984 -3.987 -0.569) 7.214 15.175 ( 8.914 -8.195 0.423) 12.116 15.324 ( -11.600 -10.995 -0.408) 15.988 15.549 ( 3.285 3.838 -1.998) 5.432 15.742 ( -0.004 1.923 -1.035) 2.184 15.997 ( 4.683 2.187 -2.329) 5.669 16.045 ( -2.491 3.009 2.239) 4.503 20.950 ( 1.165 -11.099 -2.185) 11.372 21.080 ( -0.937 -11.505 -2.481) 11.807 22.496 ( -0.207 -0.681 4.403) 4.460 22.514 ( 0.096 -0.551 2.376) 2.441 ======================= Grid point 127 (59/170) ======================= q-point: (-0.45 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( -5.034 1.881 -5.794) 7.903 2.318 ( -1.579 0.692 -6.246) 6.480 2.380 ( 6.328 3.396 -2.315) 7.546 2.531 ( -8.173 4.448 1.865) 9.490 2.644 ( -0.977 -0.548 -1.160) 1.613 2.748 ( 0.920 0.364 4.971) 5.069 2.798 ( 5.328 0.467 7.960) 9.590 2.884 ( 3.944 -5.995 2.946) 7.757 2.986 ( 0.933 0.140 2.287) 2.474 3.072 ( 4.607 1.570 -4.665) 6.741 3.329 ( -4.169 -0.844 2.083) 4.737 3.527 ( 6.065 -3.474 2.002) 7.271 4.116 ( -0.320 1.668 -21.353) 21.421 4.372 ( 5.035 2.248 -13.228) 14.331 4.613 ( -15.473 -17.330 -5.046) 23.774 4.706 ( -11.597 3.900 -0.969) 12.274 4.818 ( -9.031 -3.285 0.089) 9.610 5.004 ( 10.992 -7.052 3.229) 13.453 5.105 ( -1.304 0.582 1.046) 1.770 5.210 ( 9.913 -18.820 2.949) 21.475 5.643 ( 8.462 -2.087 0.972) 8.769 5.774 ( -4.884 -2.738 1.916) 5.918 5.834 ( -2.582 -9.261 0.790) 9.646 5.996 ( 5.319 8.143 -10.983) 14.670 6.232 ( 0.455 4.619 -11.225) 12.147 6.328 ( 3.382 0.359 0.357) 3.419 6.627 ( -5.404 6.990 -7.932) 11.874 7.068 ( -2.796 1.261 -0.706) 3.148 7.237 ( 0.003 0.142 4.347) 4.349 7.476 ( 6.583 2.999 6.230) 9.547 7.846 ( 0.398 0.346 0.825) 0.979 7.974 ( 2.016 -3.331 -2.953) 4.887 8.289 ( 3.005 2.362 -7.376) 8.308 8.319 ( -3.685 5.331 -8.130) 10.397 9.211 ( 1.799 -0.713 4.327) 4.740 9.261 ( -0.816 0.351 -1.241) 1.526 9.691 ( -2.708 3.981 3.692) 6.067 9.740 ( -8.179 6.529 -2.093) 10.673 10.132 ( -13.364 13.526 1.795) 19.099 10.284 ( -1.667 2.910 8.212) 8.871 10.416 ( 6.866 5.560 0.353) 8.843 10.512 ( 12.497 -0.308 9.231) 15.540 11.107 ( -4.705 -3.134 -2.570) 6.210 11.383 ( 4.565 -6.133 -1.474) 7.786 12.778 ( -2.805 -1.322 1.310) 3.366 12.871 ( -5.015 0.327 1.956) 5.393 12.990 ( -0.583 -1.694 2.876) 3.389 13.095 ( 0.296 2.489 4.510) 5.160 14.850 ( -3.808 -5.771 1.301) 7.035 15.066 ( 8.218 -5.381 -0.875) 9.862 15.140 ( -10.186 -8.389 -0.710) 13.215 15.328 ( 9.086 -8.876 -0.295) 12.706 15.561 ( 0.616 1.870 -0.895) 2.163 15.705 ( -2.058 0.642 -2.449) 3.262 15.969 ( -6.735 4.106 -0.430) 7.900 16.081 ( 5.545 2.960 0.555) 6.310 20.948 ( 1.632 -11.351 -1.660) 11.587 21.017 ( -1.903 -12.007 -4.481) 12.956 22.506 ( -3.173 0.030 4.217) 5.278 22.594 ( 3.164 -0.826 4.832) 5.835 ======================= Grid point 128 (60/170) ======================= q-point: (-0.36 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -11.120 6.824 -9.806) 16.321 2.175 ( -6.649 1.639 -8.290) 10.752 2.456 ( 5.480 -1.192 -2.563) 6.166 2.498 ( -3.945 0.583 9.692) 10.481 2.637 ( 0.904 -2.261 1.786) 3.020 2.801 ( 4.691 -3.445 3.472) 6.777 2.913 ( 4.562 -1.421 3.254) 5.781 2.999 ( 1.688 -3.170 1.879) 4.053 3.110 ( 7.810 -1.727 -3.670) 8.800 3.165 ( 11.381 3.276 6.844) 13.679 3.325 ( 3.113 0.203 -0.231) 3.129 3.663 ( 8.522 -2.594 1.367) 9.013 3.901 ( 1.212 4.833 -19.207) 19.843 4.217 ( -1.146 3.099 -20.443) 20.708 4.328 ( -13.271 -11.984 -5.518) 18.713 4.414 ( -15.519 -10.875 -2.340) 19.093 4.770 ( -2.961 8.231 4.799) 9.977 5.010 ( -6.415 14.292 -1.805) 15.770 5.199 ( 2.642 3.719 7.685) 8.937 5.457 ( 4.833 -12.768 4.012) 14.229 5.545 ( -1.868 1.502 -9.559) 9.855 5.705 ( -3.729 1.735 -1.705) 4.452 5.848 ( 4.067 -16.872 -0.242) 17.357 6.081 ( 4.176 4.624 -1.478) 6.403 6.175 ( 3.475 -4.252 -2.962) 6.240 6.341 ( 3.541 -1.728 -2.150) 4.489 6.658 ( 8.358 5.886 3.865) 10.929 6.957 ( -1.298 3.494 -8.065) 8.885 7.246 ( -2.362 -2.313 1.602) 3.674 7.655 ( 6.389 -1.088 3.876) 7.552 7.803 ( -7.894 7.007 -2.634) 10.879 7.943 ( -0.212 -1.473 -3.049) 3.393 8.146 ( -0.295 -2.215 -7.861) 8.172 8.302 ( 2.923 5.181 -3.733) 7.022 9.149 ( -5.194 -1.280 -2.165) 5.771 9.298 ( -4.928 -2.260 0.946) 5.504 9.589 ( -2.546 7.072 -0.148) 7.518 9.746 ( 0.708 1.277 5.232) 5.432 9.979 ( -11.180 16.279 5.697) 20.553 10.307 ( -5.782 6.108 9.969) 13.043 10.489 ( 2.769 3.683 -2.903) 5.446 10.763 ( 10.950 0.633 0.309) 10.972 11.082 ( 3.547 -4.054 2.525) 5.949 11.459 ( 5.878 -7.473 -0.018) 9.508 12.688 ( -8.622 2.301 -0.787) 8.959 12.779 ( -9.676 0.066 2.104) 9.903 13.005 ( -2.159 -2.245 3.257) 4.507 13.130 ( -2.188 1.154 4.199) 4.873 14.790 ( -3.342 -0.486 -0.359) 3.397 15.006 ( -5.839 -4.523 0.061) 7.386 15.233 ( 10.453 -6.474 0.306) 12.299 15.374 ( -3.636 1.686 -0.665) 4.062 15.560 ( -0.506 -1.913 -2.519) 3.204 15.684 ( 6.274 -6.633 -3.133) 9.653 15.841 ( -7.394 3.680 0.483) 8.274 16.178 ( 4.677 2.051 1.613) 5.356 20.929 ( -2.857 -8.876 -4.584) 10.390 20.968 ( 1.999 -8.578 -0.095) 8.808 22.495 ( -3.258 0.274 2.988) 4.429 22.700 ( 3.151 -1.966 5.039) 6.260 ======================= Grid point 129 (61/170) ======================= q-point: (-0.27 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -10.174 15.376 -6.977) 19.713 1.923 ( -12.816 8.278 -6.307) 16.509 2.531 ( 5.482 -5.110 -0.504) 7.512 2.605 ( 2.171 -5.159 11.234) 12.551 2.716 ( 4.263 -5.208 4.085) 7.873 2.963 ( 4.754 -3.365 -1.305) 5.969 3.003 ( 4.217 0.247 8.004) 9.050 3.016 ( 4.491 -3.586 -3.064) 6.513 3.215 ( 7.097 -6.738 -2.040) 9.997 3.343 ( 3.985 4.549 6.077) 8.573 3.418 ( 2.242 3.043 -0.908) 3.887 3.711 ( -8.490 12.275 -5.471) 15.896 3.760 ( 7.859 2.022 -17.843) 19.602 3.928 ( -1.909 -4.345 -8.996) 10.171 4.145 ( -3.337 1.795 -0.689) 3.851 4.290 ( 2.949 -4.845 -4.701) 7.366 4.786 ( 1.046 8.954 0.811) 9.051 4.910 ( -5.616 13.369 2.412) 14.700 5.169 ( -9.793 6.783 -2.265) 12.126 5.327 ( -9.189 1.132 1.529) 9.384 5.520 ( -6.258 1.778 1.031) 6.587 5.751 ( 6.311 -0.613 3.142) 7.077 5.963 ( 5.823 -9.489 1.340) 11.213 6.089 ( -2.063 0.458 1.038) 2.354 6.168 ( 3.206 -6.166 -0.404) 6.961 6.446 ( 7.702 1.056 -5.817) 9.709 6.689 ( 3.033 -0.296 -8.530) 9.058 7.010 ( 4.103 3.150 3.922) 6.491 7.228 ( 4.091 -5.047 -2.945) 7.133 7.531 ( -11.727 12.310 -5.941) 18.009 7.808 ( 1.592 1.554 6.316) 6.696 7.920 ( -0.091 0.036 -2.222) 2.224 8.098 ( 1.676 -3.588 -5.311) 6.625 8.300 ( 1.368 5.554 -3.194) 6.551 8.970 ( -13.621 2.841 -1.989) 14.055 9.212 ( -3.107 -4.124 0.758) 5.219 9.623 ( 5.689 1.624 -2.450) 6.404 9.802 ( -4.210 -0.029 7.627) 8.712 9.905 ( -7.029 12.645 7.804) 16.438 10.399 ( 3.910 3.543 10.518) 11.767 10.431 ( -2.465 2.135 -6.676) 7.430 10.867 ( 8.248 1.495 -6.160) 10.402 11.259 ( 10.340 -2.684 6.120) 12.312 11.554 ( 5.520 -9.140 0.466) 10.688 12.509 ( -11.760 3.978 -1.922) 12.562 12.605 ( -15.635 1.068 2.016) 15.801 12.982 ( -4.754 -2.130 2.265) 5.680 13.113 ( -4.613 0.270 2.404) 5.208 14.747 ( -0.427 3.997 -1.918) 4.454 14.971 ( -0.105 1.181 2.262) 2.554 15.242 ( -9.016 2.121 -1.132) 9.331 15.300 ( -4.857 -2.550 0.326) 5.495 15.528 ( 0.863 4.347 -6.165) 7.592 15.709 ( 5.001 -4.190 -0.818) 6.575 15.899 ( 9.630 -8.028 2.195) 12.728 16.249 ( 2.214 0.534 1.195) 2.572 20.830 ( -4.240 -2.690 -3.232) 5.972 21.003 ( 1.119 -4.205 1.504) 4.604 22.473 ( -2.336 -0.303 1.424) 2.753 22.793 ( 2.503 -3.280 3.341) 5.309 ======================= Grid point 130 (62/170) ======================= q-point: (-0.18 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( -2.811 25.433 6.351) 26.365 1.694 ( -10.869 16.782 0.070) 19.994 2.601 ( 3.810 -5.369 -0.250) 6.589 2.756 ( 3.163 -7.183 5.274) 9.456 2.849 ( 4.126 -8.157 6.442) 11.183 2.935 ( -2.185 2.721 -1.718) 3.890 2.999 ( -1.521 -11.442 -6.235) 13.119 3.109 ( -17.999 20.189 -4.233) 27.377 3.212 ( 5.598 -5.224 -2.968) 8.212 3.286 ( 3.604 -0.450 -0.139) 3.635 3.444 ( 0.164 8.133 0.783) 8.173 3.612 ( 8.087 -2.830 -2.065) 8.813 3.762 ( 3.917 2.390 2.105) 5.049 3.924 ( 0.309 -2.098 -2.291) 3.121 4.189 ( 8.523 16.740 -0.551) 18.793 4.351 ( 7.179 -2.517 -1.435) 7.741 4.742 ( -7.419 10.051 0.081) 12.493 4.939 ( -1.138 4.646 -2.449) 5.374 5.029 ( 4.710 7.897 1.982) 9.406 5.242 ( -4.542 7.279 2.954) 9.074 5.397 ( -9.385 1.654 0.504) 9.543 5.836 ( 1.339 1.268 -1.436) 2.338 6.025 ( -4.907 5.562 6.070) 9.584 6.060 ( -1.757 -7.075 3.677) 8.165 6.220 ( 3.063 0.249 -1.494) 3.417 6.427 ( 0.211 0.821 -5.424) 5.490 6.739 ( 7.685 2.270 -0.951) 8.069 7.013 ( -0.072 5.411 -1.381) 5.585 7.219 ( -5.262 5.788 -6.486) 10.162 7.436 ( 5.054 -0.968 1.504) 5.361 7.830 ( -7.569 6.265 2.852) 10.231 7.911 ( 3.669 0.252 -2.655) 4.536 8.077 ( 1.452 -0.410 -1.861) 2.396 8.264 ( -1.336 4.315 -3.174) 5.520 8.801 ( -4.149 4.796 0.500) 6.361 9.207 ( 1.454 -7.364 0.068) 7.506 9.647 ( 0.238 -2.293 -3.247) 3.982 9.785 ( -5.930 1.958 5.734) 8.478 9.956 ( -1.023 2.949 8.865) 9.399 10.296 ( 0.814 2.014 -9.061) 9.318 10.640 ( 9.383 -3.168 10.306) 14.293 10.913 ( 6.620 3.418 -6.755) 10.057 11.487 ( 12.127 -1.030 1.505) 12.263 11.632 ( 3.351 -10.401 1.115) 10.984 12.287 ( -14.636 4.545 -1.460) 15.395 12.339 ( -19.532 2.207 2.113) 19.769 12.911 ( -6.249 -1.631 0.888) 6.519 13.040 ( -6.151 -0.275 -0.090) 6.158 14.733 ( 1.072 7.939 -1.734) 8.196 15.031 ( 0.188 5.130 4.151) 6.602 15.095 ( -7.977 1.814 2.448) 8.539 15.214 ( -0.593 -0.754 -3.086) 3.232 15.420 ( -4.506 7.929 -4.856) 10.332 15.865 ( 11.684 -5.694 -0.387) 13.003 16.068 ( 7.972 -6.227 1.530) 10.231 16.271 ( 0.367 -1.448 -0.611) 1.614 20.730 ( -4.926 4.248 -1.466) 6.668 21.021 ( -1.640 -0.028 1.861) 2.480 22.457 ( -0.845 -1.394 0.212) 1.644 22.847 ( 1.565 -4.351 0.473) 4.648 ======================= Grid point 131 (63/170) ======================= q-point: (-0.09 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( -6.123 25.193 6.775) 26.797 1.647 ( -2.201 27.282 9.841) 29.086 2.627 ( -9.474 13.128 5.744) 17.178 2.650 ( -5.209 6.196 1.541) 8.241 2.865 ( 0.883 -4.718 -1.553) 5.045 2.880 ( -2.904 -10.333 -5.902) 12.249 2.927 ( 0.385 0.171 -7.519) 7.531 3.054 ( 5.953 -8.875 8.015) 13.358 3.285 ( 9.603 -2.706 -9.437) 13.733 3.307 ( -0.033 5.672 -4.232) 7.076 3.434 ( 2.277 -0.691 0.495) 2.431 3.755 ( 0.185 -6.840 4.988) 8.468 3.849 ( -1.099 4.625 -4.035) 6.235 3.926 ( 0.354 0.774 21.915) 21.931 4.339 ( 8.116 17.310 1.573) 19.183 4.393 ( 0.323 -2.547 -4.750) 5.399 4.691 ( -4.010 8.973 8.418) 12.940 4.824 ( -1.847 11.600 -4.548) 12.596 5.182 ( 0.267 7.425 2.815) 7.945 5.281 ( 8.943 9.739 -1.685) 13.329 5.335 ( 1.256 3.432 5.256) 6.401 5.791 ( -1.965 0.470 -3.035) 3.646 5.924 ( -9.140 4.858 -0.407) 10.359 6.077 ( -4.826 3.972 3.623) 7.225 6.229 ( 1.171 -2.262 -2.638) 3.667 6.457 ( 6.255 1.271 3.403) 7.233 6.687 ( -13.424 15.294 0.507) 20.356 7.065 ( 2.463 6.739 0.270) 7.180 7.178 ( 9.116 8.160 -0.591) 12.249 7.501 ( 0.452 -7.812 -0.308) 7.831 7.714 ( -6.251 2.161 0.797) 6.661 7.930 ( 1.073 13.607 -0.650) 13.665 8.095 ( 2.487 -4.809 -1.844) 5.719 8.214 ( -1.157 2.078 -1.575) 2.853 8.838 ( 4.721 1.092 1.258) 5.006 9.248 ( 2.698 -9.329 0.170) 9.712 9.592 ( -0.828 -6.024 -4.041) 7.301 9.772 ( 0.728 1.491 -0.056) 1.660 9.875 ( -9.072 2.454 -5.932) 11.114 10.400 ( 10.488 -1.339 4.785) 11.605 10.823 ( 2.406 -12.164 -1.880) 12.541 10.957 ( 6.594 8.767 1.327) 11.050 11.609 ( 7.665 -4.096 -8.372) 12.067 11.703 ( -0.202 -5.971 5.285) 7.977 12.036 ( -13.133 6.415 4.874) 15.407 12.114 ( -13.407 3.241 2.927) 14.100 12.815 ( -5.256 -0.867 -1.327) 5.490 12.936 ( -4.580 -1.123 -2.259) 5.229 14.737 ( 0.486 9.264 0.463) 9.288 14.988 ( -6.261 1.164 5.917) 8.693 15.079 ( -1.697 6.354 1.493) 6.744 15.275 ( 5.334 1.280 -1.389) 5.658 15.324 ( 1.914 8.883 -3.570) 9.762 16.014 ( 7.601 -4.306 -1.003) 8.793 16.139 ( -0.331 -2.360 -0.321) 2.405 16.276 ( 2.685 -3.923 -1.774) 5.074 20.657 ( -2.870 9.406 0.312) 9.839 20.983 ( -4.454 3.496 0.315) 5.671 22.451 ( 0.102 -2.403 -0.395) 2.437 22.851 ( 0.664 -5.024 -2.762) 5.771 ======================= Grid point 132 (64/170) ======================= q-point: ( 0.00 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( -3.661 17.181 -0.916) 17.591 2.099 ( -5.482 19.560 -3.632) 20.636 2.460 ( -3.612 -6.878 -4.931) 9.202 2.668 ( 0.556 1.566 -4.170) 4.489 2.699 ( -1.778 -3.411 -2.772) 4.741 2.808 ( 1.335 -9.591 -6.383) 11.597 2.963 ( 3.014 -0.280 10.156) 10.597 3.006 ( 4.056 -6.555 6.365) 9.997 3.140 ( 0.156 -4.894 -7.193) 8.701 3.283 ( -1.268 -11.090 -0.460) 11.171 3.346 ( 1.429 0.478 -14.687) 14.764 3.545 ( 6.058 -7.891 -3.422) 10.520 4.188 ( -0.039 11.230 20.236) 23.143 4.253 ( -3.499 2.436 28.800) 29.114 4.616 ( -0.457 23.860 5.618) 24.516 4.773 ( 3.282 13.169 1.343) 13.638 4.877 ( -4.990 8.207 6.050) 11.352 5.131 ( 0.657 11.299 1.271) 11.390 5.282 ( -4.849 4.256 -4.315) 7.761 5.400 ( 0.311 3.266 2.505) 4.128 5.644 ( 1.468 -0.947 1.590) 2.362 5.695 ( -0.097 -6.706 -0.235) 6.711 5.930 ( 4.591 6.666 1.777) 8.286 6.135 ( -2.835 3.884 7.760) 9.129 6.382 ( 3.574 9.539 -0.287) 10.191 6.541 ( 1.419 -0.540 2.141) 2.624 6.858 ( -6.277 16.067 -3.754) 17.653 7.177 ( -3.067 0.663 -1.087) 3.320 7.331 ( -7.718 -3.310 -4.732) 9.639 7.492 ( 15.358 -6.799 -0.583) 16.805 7.723 ( 3.934 11.623 4.377) 13.028 7.955 ( 0.867 -7.666 0.467) 7.729 8.039 ( -0.481 -5.047 -0.520) 5.096 8.276 ( 1.231 3.495 -5.159) 6.352 8.870 ( -3.117 2.386 0.620) 3.974 9.101 ( -2.370 -6.493 0.010) 6.912 9.411 ( 2.775 -1.851 -0.748) 3.418 9.690 ( -3.717 -4.733 5.484) 8.142 9.975 ( 4.708 9.096 -0.002) 10.242 10.469 ( -7.659 -8.007 -3.982) 11.774 10.610 ( 3.892 6.094 -1.551) 7.395 11.139 ( 0.351 1.187 -7.642) 7.741 11.379 ( -0.504 -8.300 -1.161) 8.396 11.650 ( 1.588 -9.380 -3.211) 10.041 12.087 ( -3.223 9.677 2.671) 10.543 12.225 ( -0.275 4.949 7.576) 9.053 12.719 ( 0.020 -0.479 -3.755) 3.786 12.821 ( 0.793 -3.318 -2.550) 4.259 14.887 ( 0.945 3.066 5.066) 5.996 14.994 ( -0.534 -2.149 7.985) 8.287 15.330 ( -5.948 8.544 -0.613) 10.429 15.355 ( 4.103 10.867 -0.657) 11.634 15.539 ( 1.439 7.886 -2.987) 8.554 15.956 ( 3.454 -7.800 -3.921) 9.389 16.049 ( -2.133 -2.620 0.934) 3.505 16.175 ( -0.199 -5.684 -2.583) 6.247 20.918 ( 1.440 11.336 1.997) 11.601 21.038 ( -1.726 4.912 0.013) 5.206 22.405 ( -0.135 -0.025 -1.883) 1.888 22.657 ( -0.019 -8.731 -5.258) 10.192 ======================= Grid point 133 (65/170) ======================= q-point: ( 0.09 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( -3.538 9.770 0.567) 10.407 2.079 ( -0.900 13.659 1.804) 13.807 2.326 ( -4.184 -4.688 -5.897) 8.617 2.586 ( -0.341 0.829 -6.834) 6.893 2.668 ( -1.830 -2.109 0.055) 2.793 2.766 ( 1.157 -10.414 -4.626) 11.454 2.990 ( -1.068 -1.234 -7.031) 7.218 3.095 ( -1.599 -6.642 6.179) 9.212 3.121 ( 2.275 -8.066 -4.749) 9.633 3.206 ( -1.108 -9.655 -5.638) 11.236 3.351 ( 6.127 4.591 2.113) 7.942 3.599 ( 4.526 -5.643 -6.313) 9.601 4.406 ( -4.208 10.791 22.844) 25.613 4.436 ( -5.973 6.861 16.240) 18.614 4.733 ( 3.105 14.381 12.737) 19.460 4.830 ( -4.863 8.549 3.025) 10.290 4.910 ( 2.109 15.012 6.596) 16.532 5.102 ( -7.160 8.430 1.602) 11.176 5.130 ( -7.351 6.601 1.002) 9.930 5.443 ( 1.570 3.626 3.643) 5.375 5.620 ( -2.586 3.099 -3.220) 5.163 5.682 ( -3.742 -2.207 3.494) 5.576 5.959 ( -0.529 4.709 4.123) 6.281 6.246 ( 2.359 4.430 9.993) 11.182 6.419 ( -8.196 4.699 0.746) 9.477 6.501 ( 1.339 3.652 -1.756) 4.268 6.721 ( -6.010 -4.977 -4.891) 9.209 7.129 ( -9.484 -13.011 -5.873) 17.138 7.233 ( 10.149 13.526 0.235) 16.912 7.720 ( 12.974 -1.744 -1.745) 13.206 7.766 ( 0.105 11.757 -1.530) 11.856 7.980 ( -5.318 -8.927 6.674) 12.350 8.051 ( 3.926 -3.795 1.104) 5.571 8.257 ( 4.676 2.606 -6.508) 8.427 8.836 ( 0.619 3.128 -0.809) 3.289 9.082 ( 0.500 -6.156 0.688) 6.215 9.498 ( 6.454 2.731 1.726) 7.217 9.731 ( 3.725 3.238 2.501) 5.533 10.021 ( -3.276 8.097 1.873) 8.933 10.290 ( -6.416 -3.274 -5.566) 9.103 10.620 ( 1.698 5.668 -2.123) 6.286 11.086 ( 2.715 -6.676 -5.048) 8.799 11.273 ( -9.823 -4.574 -3.391) 11.354 11.532 ( -9.680 -10.648 -4.506) 15.079 12.202 ( 10.400 6.517 4.539) 13.085 12.359 ( 6.728 1.279 5.666) 8.889 12.720 ( 5.201 0.958 -3.871) 6.554 12.836 ( 5.348 -2.118 -4.271) 7.164 14.999 ( 3.738 4.463 6.768) 8.927 15.121 ( 2.984 -0.057 7.046) 7.652 15.189 ( -8.657 8.083 2.195) 12.046 15.312 ( -7.303 3.423 -2.071) 8.328 15.570 ( 6.885 10.190 -2.949) 12.646 15.942 ( -1.973 -6.545 -3.443) 7.654 15.985 ( -7.049 -3.574 1.245) 8.001 16.106 ( -2.156 -5.732 -4.788) 7.773 20.950 ( -1.748 8.336 3.203) 9.100 21.013 ( -0.771 5.069 -0.085) 5.128 22.387 ( 0.669 -0.568 -2.008) 2.191 22.596 ( 0.744 -7.635 -6.659) 10.158 ======================= Grid point 134 (66/170) ======================= q-point: ( 0.18 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 6.229 1.000 8.882) 10.895 2.098 ( 0.676 5.247 2.773) 5.973 2.269 ( 2.079 2.207 -0.060) 3.032 2.528 ( -1.163 -0.466 -2.022) 2.378 2.623 ( -2.102 -2.899 -2.438) 4.332 2.722 ( -0.767 -10.433 -4.382) 11.342 2.903 ( -2.077 1.541 -4.359) 5.068 3.009 ( 0.871 -2.900 -10.629) 11.052 3.147 ( -2.614 -6.016 -0.060) 6.559 3.197 ( 1.544 -9.726 5.689) 11.373 3.373 ( -3.453 1.990 -5.800) 7.038 3.558 ( 1.133 -5.319 -6.372) 8.377 4.421 ( -9.436 9.710 5.475) 14.604 4.529 ( -9.279 11.589 14.235) 20.567 4.723 ( -10.322 16.231 6.194) 20.208 4.914 ( -4.463 8.147 5.208) 10.650 4.930 ( 7.143 1.197 -2.339) 7.611 5.040 ( -9.236 4.064 11.594) 15.371 5.131 ( -1.197 13.238 7.758) 15.390 5.491 ( 0.208 2.885 0.503) 2.936 5.582 ( 1.342 2.502 0.692) 2.922 5.684 ( -0.281 -2.225 1.741) 2.839 6.010 ( -12.245 -0.848 5.314) 13.375 6.240 ( -5.928 1.096 10.505) 12.112 6.340 ( -4.085 -4.142 10.238) 11.775 6.524 ( 1.548 0.804 -2.903) 3.387 6.586 ( -4.234 -3.354 -7.598) 9.322 6.954 ( 1.702 -11.511 -11.436) 16.315 7.364 ( 2.064 12.919 2.930) 13.407 7.734 ( -0.633 6.709 -4.506) 8.106 7.859 ( 8.776 4.229 0.091) 9.742 7.999 ( -0.319 -4.600 5.201) 6.951 8.121 ( 1.954 -3.112 1.864) 4.120 8.268 ( 5.931 -0.828 -7.269) 9.418 8.922 ( 8.977 4.235 3.261) 10.448 9.131 ( 3.360 -3.053 2.431) 5.149 9.625 ( 6.191 8.678 0.949) 10.702 9.844 ( 8.327 7.747 -0.692) 11.395 9.918 ( -10.273 4.670 1.812) 11.429 10.126 ( -3.039 2.524 -9.527) 10.313 10.677 ( 3.425 5.355 2.736) 6.920 11.004 ( -7.934 -5.273 -11.244) 14.737 11.123 ( -3.931 -6.018 6.065) 9.405 11.318 ( -8.784 -12.597 -5.137) 16.193 12.432 ( 11.156 2.141 4.249) 12.128 12.525 ( 7.676 -0.982 2.705) 8.198 12.787 ( 7.237 2.211 -2.139) 7.864 12.879 ( 6.727 -0.569 -5.626) 8.788 14.989 ( -10.090 7.561 -1.363) 12.682 15.071 ( -6.144 4.469 1.720) 7.790 15.232 ( 2.602 0.833 1.918) 3.338 15.330 ( 4.253 -0.371 9.409) 10.332 15.647 ( 5.720 5.093 -3.824) 8.561 15.804 ( -9.529 -2.032 1.049) 9.799 15.872 ( -9.376 -6.116 1.539) 11.300 16.041 ( 2.793 -4.868 -7.970) 9.748 20.930 ( -3.149 3.480 1.058) 4.812 21.006 ( -2.836 1.619 2.822) 4.316 22.384 ( 1.426 -0.311 -1.509) 2.099 22.538 ( 0.873 -5.539 -6.076) 8.268 ======================= Grid point 135 (67/170) ======================= q-point: ( 0.27 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( 3.470 2.025 5.639) 6.924 2.276 ( 10.695 -1.170 8.460) 13.687 2.376 ( 6.752 3.424 6.029) 9.678 2.505 ( -0.278 -0.775 1.005) 1.299 2.565 ( -0.260 -4.682 -4.164) 6.272 2.647 ( -3.223 -6.463 -2.971) 7.809 2.809 ( -4.357 3.103 -2.788) 6.032 2.914 ( 0.733 0.353 -9.826) 9.860 3.117 ( -1.268 -3.051 -0.891) 3.422 3.184 ( -6.197 2.430 -4.964) 8.304 3.300 ( 0.830 -8.688 4.921) 10.019 3.496 ( -0.553 -9.279 -4.998) 10.554 4.308 ( -10.683 10.010 3.264) 15.000 4.347 ( -17.973 14.810 1.439) 23.333 4.789 ( -3.118 5.835 15.202) 16.579 4.862 ( -1.839 12.589 -3.253) 13.132 4.912 ( -0.384 4.528 -1.229) 4.708 5.041 ( -5.394 -8.351 -0.840) 9.978 5.186 ( -6.012 -2.044 6.883) 9.365 5.494 ( 1.458 -1.787 0.426) 2.345 5.615 ( -7.001 -5.771 4.052) 9.937 5.675 ( -1.413 0.040 -5.433) 5.613 5.729 ( -10.920 -0.668 4.271) 11.744 6.198 ( -17.516 -14.814 -5.597) 23.614 6.429 ( 5.477 8.073 13.978) 17.046 6.558 ( 5.805 3.508 9.992) 12.077 6.624 ( 7.778 2.900 -0.053) 8.301 6.863 ( 4.351 -4.092 -16.748) 17.781 7.380 ( -3.480 7.773 3.166) 9.086 7.644 ( -4.924 3.206 -2.884) 6.545 8.005 ( -1.591 -0.908 -1.513) 2.376 8.021 ( 3.945 8.250 2.450) 9.467 8.142 ( 5.357 -4.255 -3.972) 7.911 8.335 ( 10.222 -1.343 -1.795) 10.465 9.145 ( 9.847 2.220 5.814) 11.649 9.231 ( 2.804 -0.279 4.830) 5.592 9.585 ( -3.290 11.475 -8.006) 14.373 9.885 ( -1.514 1.958 8.737) 9.081 9.947 ( 5.949 7.687 -1.692) 9.866 10.039 ( 5.545 3.520 -8.988) 11.132 10.613 ( -10.672 2.055 -5.028) 11.975 10.870 ( -0.803 5.305 0.644) 5.404 11.100 ( -5.157 -11.286 2.553) 12.668 11.218 ( 0.357 -9.614 -0.783) 9.652 12.609 ( 6.226 -0.628 1.309) 6.393 12.653 ( 5.416 -2.258 3.067) 6.621 12.891 ( 7.056 2.605 -0.503) 7.538 12.927 ( 6.588 1.148 -3.947) 7.766 14.826 ( -7.553 3.776 -1.755) 8.624 14.971 ( -5.838 -1.406 0.343) 6.015 15.283 ( -2.651 1.611 1.654) 3.516 15.414 ( -5.002 -4.752 2.563) 7.360 15.583 ( -1.316 2.217 -2.142) 3.352 15.758 ( -5.598 -4.822 2.574) 7.824 15.852 ( 7.062 3.303 3.516) 8.552 16.013 ( 4.310 -2.900 -7.043) 8.752 20.881 ( -3.703 -0.780 -0.310) 3.797 20.975 ( -5.194 -3.762 2.961) 7.063 22.399 ( 1.699 -0.050 -0.272) 1.721 22.495 ( 0.396 -3.418 -3.420) 4.852 ======================= Grid point 136 (68/170) ======================= q-point: ( 0.36 0.38 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( 5.741 2.525 4.644) 7.804 2.420 ( 3.587 3.211 -1.656) 5.091 2.460 ( -2.373 0.005 -6.882) 7.280 2.557 ( 3.538 -0.839 3.477) 5.031 2.575 ( 2.403 -2.178 1.850) 3.734 2.657 ( 6.048 0.281 2.781) 6.663 2.744 ( -3.142 0.840 2.932) 4.379 2.829 ( 1.809 2.235 -3.858) 4.811 3.051 ( -0.536 2.358 -5.953) 6.426 3.106 ( -5.257 2.795 3.776) 7.050 3.343 ( -2.389 -4.804 3.936) 6.654 3.457 ( -0.010 -10.403 -2.055) 10.604 4.118 ( -7.688 2.432 -1.440) 8.191 4.191 ( -6.155 -1.239 1.269) 6.406 4.755 ( -9.462 1.413 1.952) 9.764 4.781 ( -11.071 -4.899 -8.729) 14.925 4.852 ( -9.482 -12.655 -4.195) 16.360 4.982 ( 0.300 5.746 9.183) 10.837 5.061 ( -10.891 -6.867 3.715) 13.401 5.406 ( -2.868 6.205 -9.114) 11.392 5.545 ( -2.368 3.748 3.168) 5.449 5.606 ( -0.861 -7.504 1.002) 7.619 5.856 ( 3.533 -1.594 10.090) 10.808 5.937 ( -5.290 -6.568 -5.655) 10.154 6.575 ( 7.414 8.297 -14.515) 18.289 6.643 ( 3.369 3.040 -7.390) 8.672 6.743 ( 6.741 3.045 0.157) 7.399 6.892 ( 4.495 -2.318 13.820) 14.716 7.319 ( -5.173 6.062 -2.662) 8.402 7.535 ( -5.674 2.842 -0.580) 6.372 7.931 ( -3.879 -1.528 -3.753) 5.609 7.957 ( -5.503 1.212 -0.344) 5.645 8.296 ( 13.802 4.143 -4.556) 15.114 8.486 ( 8.372 0.941 -0.969) 8.481 9.185 ( -5.349 3.165 -2.474) 6.689 9.287 ( -0.043 -1.085 2.448) 2.678 9.662 ( 10.670 5.457 8.806) 14.872 9.923 ( -0.329 5.259 -0.693) 5.314 9.962 ( -1.022 -5.413 3.119) 6.331 10.107 ( 5.518 0.922 -2.166) 5.999 10.451 ( -0.773 12.020 -1.662) 12.159 10.811 ( -6.899 8.869 -0.683) 11.257 11.105 ( 2.118 -9.897 1.146) 10.185 11.221 ( -1.629 -7.346 1.175) 7.616 12.672 ( 2.382 -1.189 -0.020) 2.662 12.756 ( 1.095 -4.316 5.433) 7.024 12.970 ( 5.789 3.376 -2.434) 7.130 13.012 ( 4.703 1.582 1.279) 5.124 14.728 ( -2.876 0.231 -0.764) 2.985 14.911 ( -1.923 -6.465 -0.147) 6.747 15.184 ( -8.736 -0.419 0.636) 8.769 15.281 ( -10.579 -8.210 0.361) 13.396 15.610 ( 4.669 5.422 -2.250) 7.501 15.751 ( 1.303 -0.751 0.168) 1.514 15.985 ( 5.763 1.836 -0.396) 6.062 16.037 ( 3.806 -0.296 0.542) 3.855 20.810 ( -3.625 -4.449 -1.716) 5.990 20.912 ( -4.940 -8.121 0.367) 9.513 22.432 ( 1.478 -0.132 1.770) 2.310 22.479 ( -0.174 -1.897 0.363) 1.939 ======================= Grid point 137 (69/170) ======================= q-point: ( 0.45 0.38 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( -3.003 1.470 -9.827) 10.380 2.371 ( 1.150 0.040 -6.062) 6.170 2.496 ( 5.459 3.766 3.244) 7.382 2.598 ( -0.208 -3.274 0.660) 3.346 2.643 ( 3.541 4.403 -3.024) 6.409 2.719 ( 3.019 7.267 2.245) 8.183 2.758 ( 0.949 4.297 5.073) 6.716 2.919 ( -3.252 -0.449 5.754) 6.624 2.960 ( -4.789 6.354 1.168) 8.042 3.082 ( 2.647 1.673 -2.612) 4.078 3.321 ( -4.799 -3.980 2.115) 6.584 3.426 ( -0.769 -4.352 -0.307) 4.430 4.096 ( 6.738 -12.105 -5.977) 15.088 4.218 ( 9.254 -15.055 -0.228) 17.673 4.408 ( -14.786 -19.605 -7.164) 25.580 4.510 ( -21.988 -21.311 1.650) 30.665 4.783 ( 4.525 6.010 -4.669) 8.854 4.906 ( -6.864 -3.699 -4.604) 9.056 5.086 ( -2.878 11.097 6.017) 12.947 5.324 ( 3.349 11.266 -5.976) 13.185 5.569 ( 2.469 3.656 2.322) 4.985 5.625 ( -1.274 -8.536 4.489) 9.728 5.831 ( -3.179 -0.024 -0.509) 3.220 6.031 ( 2.289 -1.868 9.045) 9.515 6.435 ( 3.512 4.430 -22.433) 23.135 6.553 ( 3.332 3.799 -16.036) 16.814 6.858 ( 1.252 3.685 -0.487) 3.923 7.044 ( 0.019 -3.939 5.498) 6.763 7.217 ( -0.534 7.095 -1.294) 7.232 7.466 ( -3.344 -0.701 0.043) 3.417 7.846 ( -0.269 1.191 -1.396) 1.854 7.931 ( -0.338 -0.577 2.320) 2.415 8.392 ( 7.385 5.577 -9.164) 13.023 8.520 ( 0.569 2.324 -6.322) 6.760 9.141 ( 0.217 0.540 2.096) 2.176 9.252 ( -2.622 -4.419 -1.298) 5.300 9.852 ( -4.485 6.025 -0.754) 7.549 9.901 ( 2.358 3.178 4.199) 5.770 10.085 ( 5.033 -3.393 10.569) 12.188 10.134 ( 0.023 -5.279 10.067) 11.367 10.551 ( 10.735 15.954 -0.383) 19.233 10.674 ( -8.637 12.820 -0.976) 15.488 11.121 ( -3.527 -6.306 0.259) 7.230 11.199 ( 1.184 -8.431 -1.843) 8.711 12.708 ( 1.055 -1.470 2.097) 2.769 12.809 ( -2.368 -5.359 6.473) 8.731 13.018 ( 2.442 3.585 -1.409) 4.561 13.080 ( 1.960 0.995 1.677) 2.765 14.716 ( 0.635 -2.241 1.188) 2.615 14.900 ( 0.337 -9.409 -0.249) 9.419 15.091 ( -2.419 -1.404 0.140) 2.800 15.135 ( -7.166 -5.538 -0.013) 9.057 15.647 ( 2.643 4.745 -2.039) 5.802 15.762 ( 0.809 -0.147 -2.092) 2.248 16.050 ( 4.022 2.507 -0.359) 4.753 16.091 ( -0.218 1.169 2.013) 2.338 20.743 ( -1.028 -7.096 -3.019) 7.780 20.834 ( -2.823 -10.425 -3.050) 11.223 22.483 ( -0.043 -0.431 4.444) 4.465 22.497 ( 0.505 -0.904 3.071) 3.241 ======================= Grid point 138 (70/170) ======================= q-point: (-0.45 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( -1.443 1.648 -7.543) 7.855 2.295 ( -0.126 -2.215 -9.097) 9.364 2.484 ( -3.326 2.241 -3.288) 5.186 2.578 ( 1.380 -3.870 -5.048) 6.509 2.704 ( -9.050 10.021 6.447) 14.963 2.784 ( 1.794 3.777 2.797) 5.031 2.801 ( -3.828 1.847 3.938) 5.795 2.840 ( 1.634 3.884 4.291) 6.014 3.026 ( 6.054 2.979 2.817) 7.312 3.126 ( 5.356 3.049 -1.591) 6.365 3.246 ( -2.813 -7.777 -3.436) 8.955 3.468 ( 4.436 -3.316 2.735) 6.177 4.027 ( 1.259 -7.657 -12.140) 14.409 4.219 ( -13.642 -16.516 1.469) 21.472 4.262 ( 5.398 -12.876 -10.047) 17.201 4.502 ( 18.129 -20.011 -1.983) 27.074 4.688 ( -2.944 -1.931 -10.880) 11.435 4.885 ( 10.381 -6.470 -1.471) 12.320 5.075 ( -4.708 13.119 5.968) 15.162 5.357 ( 3.332 12.535 0.444) 12.978 5.634 ( -3.448 -9.329 4.953) 11.111 5.670 ( 3.112 -1.603 2.475) 4.288 5.770 ( -5.273 6.615 0.007) 8.459 6.137 ( 3.043 1.836 2.662) 4.440 6.244 ( -3.318 -1.307 -10.300) 10.900 6.354 ( -2.247 1.119 -19.028) 19.193 6.833 ( 1.481 10.213 -2.171) 10.545 7.059 ( 0.051 -1.554 -1.815) 2.390 7.239 ( -0.558 0.711 1.104) 1.427 7.443 ( 4.643 -5.675 -3.438) 8.098 7.893 ( 3.924 4.309 1.993) 6.159 7.971 ( 1.715 1.509 1.462) 2.712 8.346 ( -1.455 2.752 -9.800) 10.283 8.393 ( -1.908 1.381 -8.639) 8.955 9.168 ( 0.035 -1.579 -0.583) 1.683 9.239 ( 1.814 -2.921 -0.283) 3.450 9.776 ( -6.211 3.964 2.467) 7.770 9.835 ( -6.217 2.369 -1.611) 6.846 10.274 ( -1.456 1.969 15.751) 15.940 10.373 ( 9.660 -1.998 10.649) 14.516 10.530 ( -9.391 14.045 2.209) 17.039 10.707 ( 8.427 12.673 -0.051) 15.219 11.017 ( -5.426 -5.505 -2.871) 8.246 11.222 ( 2.984 -9.071 -1.025) 9.604 12.743 ( -1.195 -1.020 3.401) 3.746 12.828 ( -4.441 -4.105 6.361) 8.777 13.012 ( -0.953 3.083 -1.199) 3.443 13.113 ( -0.386 -0.697 2.169) 2.310 14.752 ( 0.717 -2.794 2.531) 3.837 14.903 ( 0.019 -7.808 -0.374) 7.817 15.075 ( 1.767 -0.669 -0.378) 1.926 15.138 ( 6.881 -6.114 -0.008) 9.205 15.636 ( -1.678 3.878 -1.787) 4.587 15.718 ( -3.055 0.175 -2.933) 4.238 16.053 ( -4.603 3.543 0.341) 5.819 16.122 ( 2.935 0.764 1.499) 3.383 20.726 ( 3.332 -8.332 -3.046) 9.476 20.769 ( 0.574 -10.067 -5.033) 11.270 22.512 ( -2.185 0.615 4.865) 5.369 22.567 ( 1.579 -1.584 5.136) 5.602 ======================= Grid point 139 (71/170) ======================= q-point: (-0.36 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -5.235 4.574 -6.597) 9.584 2.205 ( 1.101 0.199 -5.334) 5.450 2.433 ( 0.005 -0.725 -1.977) 2.106 2.526 ( -2.436 -3.762 -1.275) 4.659 2.579 ( -9.399 2.606 2.681) 10.115 2.744 ( 0.024 -2.554 2.625) 3.663 2.884 ( 3.349 -3.523 1.985) 5.250 2.946 ( 2.509 5.664 3.635) 7.183 3.101 ( -1.135 -3.016 -2.589) 4.134 3.227 ( 8.741 -0.419 3.020) 9.257 3.280 ( 9.996 1.272 2.131) 10.299 3.605 ( 7.270 -5.763 3.955) 10.086 3.955 ( 6.493 0.979 -18.206) 19.354 4.071 ( -6.101 -9.688 -3.790) 12.060 4.231 ( 7.015 -1.253 -6.655) 9.751 4.418 ( 1.906 12.973 -16.517) 21.089 4.933 ( 23.423 -25.542 1.619) 34.693 5.010 ( -1.974 9.069 4.916) 10.503 5.116 ( 5.237 -6.296 2.761) 8.643 5.413 ( -0.988 11.355 3.202) 11.839 5.582 ( -5.871 -8.093 0.278) 10.002 5.630 ( -4.531 7.163 -8.616) 12.086 5.691 ( -1.392 -1.821 0.114) 2.295 6.104 ( -3.636 -4.520 -6.061) 8.390 6.171 ( 1.383 2.696 -4.534) 5.453 6.284 ( 6.007 -2.574 7.125) 9.668 6.840 ( -1.158 8.878 -1.800) 9.132 7.038 ( 4.917 2.942 -6.188) 8.434 7.198 ( -1.903 -0.035 -2.407) 3.069 7.545 ( 9.799 -8.375 -0.747) 12.912 7.961 ( 1.813 5.286 0.425) 5.605 7.985 ( -1.598 6.580 -0.774) 6.816 8.143 ( -6.011 0.905 -8.549) 10.489 8.343 ( 2.659 -1.798 -5.464) 6.337 9.132 ( -1.954 -0.110 -2.692) 3.328 9.224 ( -3.885 -4.028 -1.450) 5.781 9.694 ( -5.424 3.917 0.276) 6.696 9.781 ( -2.323 1.010 3.821) 4.584 10.310 ( -9.188 11.553 5.578) 15.780 10.453 ( -8.173 7.383 7.967) 13.594 10.567 ( 5.152 4.528 1.519) 7.025 10.836 ( 6.742 6.632 1.235) 9.538 10.973 ( 2.872 -6.432 3.464) 7.850 11.264 ( 3.011 -10.692 0.031) 11.108 12.720 ( -6.437 1.252 2.497) 7.017 12.794 ( -7.775 -0.377 4.205) 8.847 12.981 ( -2.359 1.065 0.724) 2.688 13.116 ( -2.329 -2.378 2.105) 3.938 14.798 ( 2.437 0.816 1.542) 2.997 14.898 ( 1.408 -3.878 -0.694) 4.184 15.171 ( 8.571 -0.861 -0.012) 8.614 15.281 ( 9.325 -8.031 0.483) 12.316 15.553 ( -5.459 1.889 -2.238) 6.195 15.615 ( -3.813 -1.126 -3.773) 5.481 15.961 ( -6.714 6.818 0.354) 9.575 16.182 ( 1.795 -1.855 2.056) 3.300 20.750 ( 3.806 -6.835 -4.653) 9.102 20.782 ( 6.860 -7.817 -1.636) 10.528 22.520 ( -3.093 2.087 3.986) 5.460 22.646 ( 1.128 -3.055 5.013) 5.979 ======================= Grid point 140 (72/170) ======================= q-point: (-0.27 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( -3.193 11.349 -0.158) 11.791 2.159 ( -2.449 11.601 -2.339) 12.085 2.427 ( -0.919 -4.003 3.191) 5.202 2.517 ( 3.444 -4.058 2.427) 5.849 2.568 ( 1.799 -5.943 2.147) 6.570 2.833 ( 5.833 -8.078 0.845) 10.000 2.912 ( -3.732 -5.197 -3.162) 7.137 2.952 ( 4.724 -6.431 -1.290) 8.083 3.155 ( 1.333 5.204 10.550) 11.839 3.398 ( 7.831 1.225 4.174) 8.958 3.457 ( 3.799 2.277 3.213) 5.472 3.729 ( 5.709 -5.933 -12.170) 14.694 3.804 ( 2.330 -3.877 -7.941) 9.139 3.884 ( -1.181 -4.086 -15.255) 15.836 4.374 ( 14.089 14.410 -0.438) 20.158 4.418 ( 11.026 23.023 -4.813) 25.977 4.987 ( -2.402 9.835 1.519) 10.237 5.137 ( -7.629 -0.746 4.279) 8.779 5.231 ( 1.670 -9.233 5.115) 10.687 5.297 ( -4.112 1.932 -6.506) 7.935 5.510 ( 3.601 1.155 -4.392) 5.796 5.675 ( 4.368 -4.779 -0.496) 6.493 5.708 ( 10.234 -7.465 4.059) 13.302 5.982 ( -1.260 -8.190 -6.978) 10.833 6.221 ( 1.357 6.879 5.754) 9.070 6.444 ( 5.806 -2.305 -0.873) 6.307 6.745 ( -2.644 5.675 -5.528) 8.352 7.067 ( 4.169 -6.066 -1.395) 7.491 7.203 ( 5.351 10.023 -1.303) 11.437 7.686 ( 5.785 -5.020 0.083) 7.660 7.852 ( -6.448 9.020 -5.348) 12.310 7.960 ( -1.069 2.126 -0.568) 2.447 8.068 ( -0.404 1.563 -0.525) 1.697 8.330 ( 2.857 -3.800 -5.377) 7.177 9.036 ( -6.816 2.682 -2.004) 7.594 9.132 ( -5.287 -3.357 1.236) 6.384 9.621 ( -3.869 2.027 -0.679) 4.420 9.793 ( -3.243 -1.546 3.822) 5.246 10.195 ( -8.729 10.726 1.790) 13.945 10.401 ( -6.295 -2.182 3.594) 7.570 10.597 ( 1.766 13.188 -2.822) 13.602 10.941 ( 6.374 5.166 1.244) 8.298 11.171 ( 11.175 -5.604 6.757) 14.211 11.313 ( 2.533 -13.375 0.771) 13.634 12.597 ( -10.995 4.039 0.856) 11.744 12.667 ( -13.280 3.218 2.627) 13.915 12.944 ( -4.262 -0.566 1.333) 4.501 13.083 ( -4.364 -3.161 1.186) 5.517 14.849 ( 4.373 5.259 -1.902) 7.099 14.976 ( 7.884 -0.443 1.559) 8.049 15.223 ( -3.953 -0.625 -1.051) 4.138 15.308 ( -8.285 -0.031 -0.120) 8.286 15.549 ( 11.225 -3.007 -1.494) 11.717 15.603 ( 7.762 -6.358 -3.297) 10.562 15.877 ( -4.309 7.786 1.758) 9.071 16.214 ( -0.209 -4.121 1.326) 4.334 20.780 ( 4.956 -1.359 -2.899) 5.900 20.891 ( 7.354 -5.656 0.208) 9.280 22.503 ( -3.414 3.074 2.293) 5.135 22.705 ( 0.390 -4.919 3.223) 5.893 ======================= Grid point 141 (73/170) ======================= q-point: (-0.18 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.974 ( 2.590 16.189 7.524) 18.039 2.117 ( -0.222 20.976 -0.064) 20.977 2.482 ( 2.089 -4.850 3.955) 6.598 2.629 ( 2.248 -8.568 2.741) 9.272 2.645 ( 5.957 -6.794 4.372) 10.038 2.811 ( -0.476 -2.685 -6.373) 6.932 2.905 ( 1.009 -7.434 1.717) 7.696 3.004 ( 3.072 -8.887 -4.926) 10.615 3.253 ( -1.205 1.056 1.704) 2.339 3.359 ( -9.773 0.093 -6.391) 11.678 3.540 ( 1.544 0.112 5.015) 5.249 3.622 ( 7.742 3.482 -8.767) 12.204 3.788 ( 2.671 -3.734 -3.418) 5.724 3.901 ( 3.446 -3.705 4.059) 6.487 4.529 ( 5.404 23.826 0.252) 24.432 4.614 ( 13.064 20.829 0.136) 24.588 4.939 ( -5.090 7.934 -0.611) 9.446 5.085 ( -0.325 6.170 4.676) 7.749 5.197 ( -2.777 5.242 3.087) 6.687 5.318 ( 5.011 0.564 0.925) 5.127 5.476 ( -1.667 4.753 -2.912) 5.818 5.757 ( 4.598 -6.604 2.102) 8.317 5.834 ( -1.073 -11.379 -3.626) 11.991 6.019 ( 9.649 -8.797 -1.558) 13.149 6.292 ( 3.824 5.182 2.762) 7.008 6.420 ( -0.674 -1.335 -7.279) 7.431 6.773 ( 10.301 4.892 3.147) 11.829 7.161 ( 4.845 -8.314 2.428) 9.924 7.269 ( 2.772 15.495 -0.774) 15.760 7.585 ( -7.480 11.205 -6.669) 15.032 7.843 ( 2.509 -4.451 -2.096) 5.523 7.907 ( -4.392 -3.625 0.617) 5.728 8.056 ( -1.362 3.706 0.724) 4.014 8.320 ( 3.517 -3.366 -5.171) 7.102 8.932 ( -5.334 5.722 2.051) 8.087 9.094 ( -2.723 -3.653 3.044) 5.480 9.547 ( -5.212 -1.808 -0.431) 5.534 9.745 ( -6.278 -3.078 2.593) 7.457 10.090 ( -5.997 5.544 -1.291) 8.268 10.362 ( 0.401 -3.966 0.969) 4.103 10.613 ( 3.426 9.931 -2.037) 10.701 11.063 ( 7.277 9.093 0.989) 11.688 11.346 ( 4.456 -15.220 -2.944) 16.130 11.421 ( 9.803 -6.334 5.306) 12.821 12.412 ( -12.823 5.785 0.311) 14.071 12.444 ( -17.403 6.274 2.130) 18.621 12.875 ( -5.491 -1.114 0.393) 5.616 12.999 ( -6.614 -3.625 -0.612) 7.567 14.891 ( 2.472 6.669 -2.115) 7.420 15.073 ( -6.318 -1.994 -0.181) 6.628 15.149 ( 0.518 4.493 3.186) 5.532 15.213 ( 4.766 1.516 -0.308) 5.011 15.637 ( -0.746 7.150 -3.497) 7.994 15.750 ( 13.715 -3.665 -1.368) 14.262 15.927 ( 6.809 -3.821 2.825) 8.304 16.202 ( -1.697 -5.489 -0.514) 5.769 20.829 ( 3.850 4.897 -1.119) 6.329 20.997 ( 4.527 -2.261 1.201) 5.200 22.468 ( -2.711 2.828 0.470) 3.946 22.726 ( -0.308 -6.849 0.447) 6.870 ======================= Grid point 142 (74/170) ======================= q-point: (-0.09 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.063 ( 0.912 19.884 0.973) 19.929 2.176 ( 1.565 21.903 3.831) 22.290 2.528 ( -0.068 -5.264 -0.924) 5.345 2.671 ( 0.554 -6.064 0.897) 6.154 2.747 ( 1.078 -3.505 -3.990) 5.420 2.794 ( 3.969 -4.538 4.086) 7.283 2.883 ( -5.367 -1.208 -3.110) 6.320 2.936 ( 1.238 -6.286 1.100) 6.500 3.210 ( 2.284 -7.040 -10.275) 12.663 3.256 ( 1.933 -6.697 0.898) 7.028 3.521 ( -0.628 0.817 -12.100) 12.144 3.567 ( -1.861 -5.944 -5.995) 8.645 3.964 ( 0.526 1.460 25.455) 25.502 4.008 ( 0.636 4.793 11.426) 12.407 4.583 ( 0.003 25.148 2.621) 25.285 4.735 ( 2.927 15.963 -0.147) 16.230 4.898 ( -5.494 8.641 5.831) 11.784 5.089 ( 2.744 11.577 -1.546) 11.998 5.315 ( 7.524 2.032 3.108) 8.391 5.351 ( -1.731 4.598 -1.142) 5.044 5.531 ( 7.906 6.162 3.283) 10.548 5.727 ( -2.442 -7.030 -2.935) 8.000 5.872 ( 4.228 -4.955 -1.639) 6.717 6.062 ( 0.132 -2.796 4.827) 5.580 6.348 ( 2.560 5.695 -3.169) 7.002 6.452 ( 6.823 1.278 1.920) 7.202 6.981 ( 0.281 7.124 4.361) 8.357 7.201 ( 0.676 9.189 -3.788) 9.962 7.277 ( 3.261 -3.735 4.202) 6.499 7.478 ( 2.812 9.860 -7.336) 12.607 7.708 ( -8.936 -1.798 -0.944) 9.164 7.936 ( 2.240 -8.178 0.271) 8.484 8.044 ( -0.224 2.048 -0.229) 2.073 8.312 ( 1.720 -1.008 -4.589) 5.003 8.900 ( -3.509 4.542 3.185) 6.564 9.108 ( -0.338 -3.931 2.570) 4.709 9.449 ( -4.984 -3.940 -1.463) 6.519 9.698 ( -4.751 -7.161 5.238) 10.064 9.975 ( -2.708 7.235 -4.124) 8.758 10.459 ( 7.740 -7.887 1.657) 11.174 10.620 ( -0.190 7.566 -2.886) 8.100 11.166 ( 4.974 9.941 -2.250) 11.341 11.366 ( 2.984 -15.239 -2.890) 15.795 11.591 ( 7.652 -7.291 -0.495) 10.581 12.207 ( -12.045 8.346 0.237) 14.656 12.243 ( -11.859 7.049 5.696) 14.926 12.789 ( -4.385 -1.229 -1.491) 4.791 12.882 ( -5.227 -3.855 -2.056) 6.812 14.869 ( -2.737 3.707 1.464) 4.835 14.979 ( -5.960 -1.929 4.100) 7.487 15.227 ( 7.898 7.726 0.465) 11.058 15.363 ( 6.264 5.685 0.725) 8.490 15.560 ( -2.133 11.187 -3.016) 11.781 15.910 ( 8.318 -4.948 -2.400) 9.972 16.041 ( 2.260 -5.467 1.479) 6.098 16.176 ( 1.370 -5.783 -1.995) 6.269 20.874 ( 2.520 9.868 0.285) 10.189 21.047 ( 0.353 1.843 0.977) 2.116 22.433 ( -1.324 1.432 -1.040) 2.210 22.706 ( -0.524 -8.343 -2.608) 8.757 ======================= Grid point 143 (75/170) ======================= q-point: ( 0.00 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.316 ( -5.636 -6.288 -9.382) 12.622 2.316 ( -5.636 6.288 -9.382) 12.622 2.503 ( -1.570 -16.037 -7.605) 17.818 2.503 ( -1.570 16.037 -7.605) 17.818 2.673 ( 0.199 -4.027 5.205) 6.584 2.673 ( 0.199 4.027 5.205) 6.584 2.981 ( 0.810 -9.431 0.917) 9.510 2.981 ( 0.810 9.431 0.917) 9.510 3.072 ( 3.702 -4.031 -2.051) 5.845 3.072 ( 3.702 4.031 -2.051) 5.845 3.411 ( 3.356 -4.444 -7.005) 8.949 3.411 ( 3.356 4.444 -7.005) 8.949 4.275 ( -1.882 -0.373 25.761) 25.833 4.275 ( -1.882 0.373 25.761) 25.833 4.917 ( -2.601 -3.304 2.252) 4.770 4.917 ( -2.601 3.304 2.252) 4.770 5.208 ( -0.869 -14.753 2.611) 15.007 5.208 ( -0.869 14.753 2.611) 15.007 5.351 ( -1.284 -8.402 0.891) 8.546 5.351 ( -1.284 8.402 0.891) 8.546 5.566 ( 2.096 -4.446 -0.508) 4.942 5.566 ( 2.096 4.446 -0.508) 4.942 6.089 ( 5.450 -6.530 8.265) 11.860 6.089 ( 5.450 6.530 8.265) 11.860 6.545 ( -3.135 -2.968 1.069) 4.447 6.545 ( -3.135 2.968 1.069) 4.447 7.133 ( -13.521 -7.577 -2.768) 15.745 7.133 ( -13.521 7.577 -2.768) 15.745 7.315 ( 12.859 -7.677 -4.377) 15.603 7.315 ( 12.859 7.677 -4.377) 15.603 7.842 ( 1.237 -2.223 2.199) 3.363 7.842 ( 1.237 2.223 2.199) 3.363 8.150 ( 4.115 -12.069 -5.356) 13.830 8.150 ( 4.115 12.069 -5.356) 13.830 8.967 ( -4.014 -6.012 0.184) 7.231 8.967 ( -4.014 6.012 0.184) 7.231 9.510 ( -0.758 -9.325 7.884) 12.234 9.510 ( -0.758 9.325 7.884) 12.234 10.211 ( 1.181 -12.654 0.067) 12.709 10.211 ( 1.181 12.654 0.067) 12.709 10.918 ( -0.111 -17.047 -8.052) 18.853 10.918 ( -0.111 17.047 -8.052) 18.853 11.441 ( -0.033 -9.347 -2.306) 9.627 11.441 ( -0.033 9.347 -2.306) 9.627 12.244 ( -1.882 -3.827 2.798) 5.100 12.244 ( -1.882 3.827 2.798) 5.100 12.744 ( 0.854 -3.046 -2.143) 3.821 12.744 ( 0.854 3.046 -2.143) 3.821 14.942 ( 0.213 -2.466 6.726) 7.167 14.942 ( 0.213 2.466 6.726) 7.167 15.461 ( -1.798 -3.056 -0.548) 3.588 15.461 ( -1.798 3.056 -0.548) 3.588 15.746 ( 2.788 -11.314 -3.506) 12.168 15.746 ( 2.788 11.314 -3.506) 12.168 16.060 ( -0.744 -4.061 -0.918) 4.230 16.060 ( -0.744 4.061 -0.918) 4.230 21.075 ( -0.122 -2.531 1.552) 2.971 21.075 ( -0.122 2.531 1.552) 2.971 22.478 ( -0.092 -6.872 -3.991) 7.947 22.478 ( -0.092 6.872 -3.991) 7.947 ======================= Grid point 145 (76/170) ======================= q-point: ( 0.09 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -5.286 -7.313 -6.302) 11.006 2.117 ( -5.286 7.313 -6.302) 11.006 2.439 ( 0.168 -13.152 -3.349) 13.573 2.439 ( 0.168 13.152 -3.349) 13.573 2.676 ( -2.543 -0.751 -0.351) 2.675 2.676 ( -2.543 0.751 -0.351) 2.675 2.988 ( 2.961 -3.342 -5.402) 7.008 2.988 ( 2.961 3.342 -5.402) 7.008 3.052 ( -1.302 -0.781 -1.053) 1.848 3.052 ( -1.302 0.781 -1.053) 1.848 3.473 ( 5.754 -6.095 -1.762) 8.565 3.473 ( 5.754 6.095 -1.762) 8.565 4.489 ( -4.611 -1.368 21.175) 21.714 4.489 ( -4.611 1.368 21.175) 21.714 4.903 ( -2.151 -1.852 1.793) 3.358 4.903 ( -2.151 1.852 1.793) 3.358 5.175 ( -6.037 -3.159 0.553) 6.836 5.175 ( -6.037 3.159 0.553) 6.836 5.418 ( 1.604 -15.099 13.687) 20.442 5.418 ( 1.604 15.099 13.687) 20.442 5.575 ( -0.213 -2.316 -1.977) 3.052 5.575 ( -0.213 2.316 -1.977) 3.052 6.166 ( -11.716 -11.157 7.119) 17.676 6.166 ( -11.716 11.157 7.119) 17.676 6.476 ( -1.197 -2.356 2.531) 3.659 6.476 ( -1.197 2.356 2.531) 3.659 6.846 ( -10.857 -12.353 -8.849) 18.676 6.846 ( -10.857 12.353 -8.849) 18.676 7.548 ( 14.687 -14.165 -1.670) 20.473 7.548 ( 14.687 14.165 -1.670) 20.473 7.859 ( 0.029 -2.106 1.420) 2.540 7.859 ( 0.029 2.106 1.420) 2.540 8.163 ( 4.105 -9.632 -4.525) 11.406 8.163 ( 4.105 9.632 -4.525) 11.406 8.940 ( 0.911 -6.416 1.070) 6.568 8.940 ( 0.911 6.416 1.070) 6.568 9.637 ( 4.244 -8.510 8.401) 12.689 9.637 ( 4.244 8.510 8.401) 12.689 10.196 ( -2.804 -6.848 -1.041) 7.473 10.196 ( -2.804 6.848 -1.041) 7.473 10.847 ( 4.070 -13.993 -8.157) 16.701 10.847 ( 4.070 13.993 -8.157) 16.701 11.323 ( -10.521 -7.922 -3.510) 13.630 11.323 ( -10.521 7.922 -3.510) 13.630 12.325 ( 7.324 -4.314 2.536) 8.870 12.325 ( 7.324 4.314 2.536) 8.870 12.772 ( 5.517 -3.441 -2.696) 7.039 12.772 ( 5.517 3.441 -2.696) 7.039 15.073 ( 4.587 -2.954 9.014) 10.536 15.073 ( 4.587 2.954 9.014) 10.536 15.332 ( -10.472 -3.146 -1.954) 11.107 15.332 ( -10.472 3.146 -1.954) 11.107 15.772 ( 2.812 -8.609 -2.849) 9.494 15.772 ( 2.812 8.609 -2.849) 9.494 15.990 ( -5.194 -4.069 -2.066) 6.915 15.990 ( -5.194 4.069 -2.066) 6.915 21.061 ( -4.095 -1.449 2.148) 4.846 21.061 ( -4.095 1.449 2.148) 4.846 22.443 ( 1.850 -5.725 -4.829) 7.715 22.443 ( 1.850 5.725 -4.829) 7.715 ======================= Grid point 147 (77/170) ======================= q-point: ( 0.18 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( 2.448 -4.117 2.369) 5.344 2.070 ( 2.448 4.117 2.369) 5.344 2.430 ( 1.184 -10.277 -0.046) 10.345 2.430 ( 1.184 10.277 -0.046) 10.345 2.607 ( -2.870 -0.724 -3.547) 4.619 2.607 ( -2.870 0.724 -3.547) 4.619 2.944 ( 2.942 -3.163 -9.231) 10.192 2.944 ( 2.942 3.163 -9.231) 10.192 3.070 ( -1.403 -1.567 6.199) 6.546 3.070 ( -1.403 1.567 6.199) 6.546 3.454 ( -2.095 -4.603 -7.010) 8.644 3.454 ( -2.095 4.603 -7.010) 8.644 4.595 ( -5.578 -5.682 13.265) 15.471 4.595 ( -5.578 5.682 13.265) 15.471 4.898 ( -2.482 -3.253 3.111) 5.140 4.898 ( -2.482 3.253 3.111) 5.140 5.075 ( -7.773 -4.845 1.015) 9.215 5.075 ( -7.773 4.845 1.015) 9.215 5.448 ( -11.904 -10.690 0.018) 15.999 5.448 ( -11.904 10.690 0.018) 15.999 5.607 ( -1.160 -2.671 9.804) 10.228 5.607 ( -1.160 2.671 9.804) 10.228 6.047 ( -9.972 -7.402 7.191) 14.351 6.047 ( -9.972 7.402 7.191) 14.351 6.420 ( -8.813 -5.070 4.542) 11.136 6.420 ( -8.813 5.070 4.542) 11.136 6.735 ( 9.173 -9.210 -10.076) 16.447 6.735 ( 9.173 9.210 -10.076) 16.447 7.635 ( -2.132 -11.383 0.194) 11.582 7.635 ( -2.132 11.383 0.194) 11.582 7.949 ( 10.514 -2.634 -0.348) 10.845 7.949 ( 10.514 2.634 -0.348) 10.845 8.170 ( 2.211 -6.660 -3.626) 7.899 8.170 ( 2.211 6.660 -3.626) 7.899 9.029 ( 6.520 -5.593 3.951) 9.456 9.029 ( 6.520 5.593 3.951) 9.456 9.787 ( 1.401 -6.542 8.312) 10.670 9.787 ( 1.401 6.542 8.312) 10.670 10.110 ( -0.424 -5.340 -8.119) 9.727 10.110 ( -0.424 5.340 -8.119) 9.727 10.866 ( 5.466 -9.244 -5.051) 11.868 10.866 ( 5.466 9.244 -5.051) 11.868 11.090 ( -12.414 -5.308 -1.425) 13.576 11.090 ( -12.414 5.308 -1.425) 13.576 12.484 ( 8.637 -2.489 1.926) 9.192 12.484 ( 8.637 2.489 1.926) 9.192 12.843 ( 7.147 -2.574 -2.896) 8.129 12.843 ( 7.147 2.574 -2.896) 8.129 15.107 ( -11.826 -2.299 -0.838) 12.077 15.107 ( -11.826 2.299 -0.838) 12.077 15.272 ( 4.340 -3.775 6.580) 8.739 15.272 ( 4.340 3.775 6.580) 8.739 15.724 ( -6.831 -4.003 0.395) 7.927 15.724 ( -6.831 4.003 0.395) 7.927 15.913 ( 1.895 -6.647 -4.872) 8.457 15.913 ( 1.895 6.647 -4.872) 8.457 20.998 ( -6.917 -2.274 2.358) 7.654 20.998 ( -6.917 2.274 2.358) 7.654 22.428 ( 2.462 -4.188 -4.125) 6.373 22.428 ( 2.462 4.188 -4.125) 6.373 ======================= Grid point 149 (78/170) ======================= q-point: ( 0.27 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( 7.792 -2.912 7.912) 11.480 2.221 ( 7.792 2.912 7.912) 11.480 2.479 ( 3.036 -5.907 1.800) 6.881 2.479 ( 3.036 5.907 1.800) 6.881 2.529 ( -0.956 -0.682 -2.974) 3.198 2.529 ( -0.956 0.682 -2.974) 3.198 2.881 ( 1.139 -3.533 -8.202) 9.003 2.881 ( 1.139 3.533 -8.202) 9.003 3.122 ( -0.734 -4.650 5.839) 7.500 3.122 ( -0.734 4.650 5.839) 7.500 3.314 ( -3.540 -7.414 -6.923) 10.743 3.314 ( -3.540 7.414 -6.923) 10.743 4.587 ( -11.522 -11.708 7.211) 17.940 4.587 ( -11.522 11.708 7.211) 17.940 4.763 ( -20.858 -15.490 1.838) 26.046 4.763 ( -20.858 15.490 1.838) 26.046 4.996 ( -2.367 -2.321 -0.548) 3.360 4.996 ( -2.367 2.321 -0.548) 3.360 5.278 ( -6.077 -12.918 1.398) 14.344 5.278 ( -6.077 12.918 1.398) 14.344 5.635 ( -2.565 -3.012 3.173) 5.071 5.635 ( -2.565 3.012 3.173) 5.071 5.900 ( -8.456 -12.212 -2.848) 15.124 5.900 ( -8.456 12.212 -2.848) 15.124 6.542 ( 4.490 -3.144 17.475) 18.314 6.542 ( 4.490 3.144 17.475) 18.314 6.756 ( 8.555 -6.287 -13.797) 17.409 6.756 ( 8.555 6.287 -13.797) 17.409 7.566 ( -6.364 -8.254 1.393) 10.515 7.566 ( -6.364 8.254 1.393) 10.515 8.047 ( 0.564 -3.773 -5.004) 6.292 8.047 ( 0.564 3.773 -5.004) 6.292 8.220 ( 10.656 -8.408 0.349) 13.578 8.220 ( 10.656 8.408 0.349) 13.578 9.198 ( 5.991 -2.465 5.902) 8.763 9.198 ( 5.991 2.465 5.902) 8.763 9.795 ( -6.303 -8.067 1.579) 10.359 9.795 ( -6.303 8.067 1.579) 10.359 10.067 ( 5.609 -3.769 -7.362) 9.993 10.067 ( 5.609 3.769 -7.362) 9.993 10.809 ( -3.887 -14.168 -3.419) 15.084 10.809 ( -3.887 14.168 -3.419) 15.084 11.025 ( 0.702 -8.290 2.726) 8.755 11.025 ( 0.702 8.290 2.726) 8.755 12.615 ( 5.021 -1.151 1.790) 5.454 12.615 ( 5.021 1.151 1.790) 5.454 12.929 ( 7.039 -0.895 -1.770) 7.313 12.929 ( 7.039 0.895 -1.770) 7.313 14.915 ( -9.882 -3.983 -1.298) 10.733 14.915 ( -9.882 3.983 -1.298) 10.733 15.315 ( -6.731 -2.600 2.091) 7.513 15.315 ( -6.731 2.600 2.091) 7.513 15.667 ( -0.285 -4.145 2.222) 4.712 15.667 ( -0.285 4.145 2.222) 4.712 15.935 ( 6.206 -4.152 -3.251) 8.144 15.935 ( 6.206 4.152 -3.251) 8.144 20.901 ( -7.921 -2.598 1.509) 8.471 20.901 ( -7.921 2.598 1.509) 8.471 22.428 ( 1.813 -2.546 -1.955) 3.687 22.428 ( 1.813 2.546 -1.955) 3.687 ======================= Grid point 151 (79/170) ======================= q-point: ( 0.36 -0.50 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( 3.783 -4.760 -0.666) 6.117 2.391 ( 3.783 4.760 -0.666) 6.117 2.487 ( 2.677 -3.416 0.903) 4.433 2.487 ( 2.676 3.416 0.903) 4.433 2.621 ( 6.050 -2.897 5.652) 8.771 2.621 ( 6.050 2.897 5.652) 8.771 2.823 ( 2.842 -4.266 -5.801) 7.742 2.823 ( 2.842 4.266 -5.801) 7.742 3.165 ( 1.399 -7.926 0.753) 8.084 3.165 ( 1.399 7.926 0.753) 8.084 3.230 ( -2.451 -5.531 0.093) 6.050 3.230 ( -2.451 5.531 0.093) 6.050 4.352 ( -21.828 -10.971 -0.144) 24.430 4.352 ( -21.828 10.971 -0.144) 24.430 4.407 ( -22.893 -12.100 1.661) 25.948 4.407 ( -22.893 12.100 1.661) 25.948 4.946 ( -0.604 -4.844 -3.547) 6.034 4.946 ( -0.604 4.844 -3.547) 6.034 5.291 ( 1.244 -13.505 3.934) 14.121 5.291 ( 1.244 13.505 3.934) 14.121 5.601 ( -1.072 -1.545 -4.308) 4.701 5.601 ( -1.072 1.545 -4.308) 4.701 5.841 ( 0.205 -1.394 4.222) 4.451 5.841 ( 0.205 1.394 4.222) 4.451 6.670 ( 6.288 -2.235 -17.723) 18.938 6.670 ( 6.288 2.235 -17.723) 18.938 6.818 ( 4.014 -4.383 12.661) 13.987 6.818 ( 4.014 4.383 12.661) 13.987 7.475 ( -6.103 -7.037 -0.459) 9.325 7.475 ( -6.103 7.037 -0.459) 9.325 7.945 ( -3.517 -2.034 -4.744) 6.246 7.945 ( -3.517 2.034 -4.744) 6.246 8.420 ( 11.639 -6.108 -0.432) 13.151 8.420 ( 11.639 6.108 -0.432) 13.151 9.248 ( -4.644 -2.607 -0.094) 5.326 9.248 ( -4.644 2.607 -0.094) 5.326 9.796 ( 4.827 -7.183 5.903) 10.476 9.796 ( 4.827 7.183 5.903) 10.476 10.050 ( -1.713 -4.555 -2.535) 5.488 10.050 ( -1.713 4.555 -2.535) 5.488 10.778 ( 2.531 -14.622 -0.557) 14.850 10.778 ( 2.531 14.622 -0.557) 14.850 11.053 ( -0.795 -7.723 1.096) 7.841 11.053 ( -0.795 7.723 1.096) 7.841 12.683 ( 0.808 -2.196 2.836) 3.676 12.683 ( 0.808 2.196 2.836) 3.676 13.018 ( 5.305 -1.022 -0.390) 5.417 13.018 ( 5.305 1.022 -0.390) 5.417 14.785 ( -5.134 -4.922 -0.503) 7.130 14.785 ( -5.134 4.922 -0.503) 7.130 15.183 ( -9.203 -1.313 0.506) 9.310 15.183 ( -9.203 1.313 0.506) 9.310 15.709 ( 3.301 -3.429 -1.212) 4.912 15.709 ( 3.301 3.429 -1.212) 4.912 16.020 ( 5.548 -1.310 0.363) 5.712 16.020 ( 5.548 1.310 0.363) 5.712 20.789 ( -6.623 -2.710 -0.763) 7.196 20.789 ( -6.623 2.710 -0.763) 7.196 22.444 ( 0.912 -1.235 1.130) 1.906 22.444 ( 0.912 1.235 1.130) 1.906 ======================= Grid point 153 (80/170) ======================= q-point: ( 0.45 -0.50 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( -0.246 -1.953 -8.906) 9.121 2.343 ( -0.246 1.953 -8.906) 9.121 2.543 ( 0.973 -2.040 -0.233) 2.272 2.543 ( 0.973 2.040 -0.233) 2.272 2.766 ( 4.443 -4.277 3.982) 7.340 2.766 ( 4.443 4.277 3.982) 7.340 2.870 ( 5.278 -4.754 1.123) 7.192 2.870 ( 5.278 4.754 1.123) 7.192 3.184 ( -6.658 -8.321 1.893) 10.823 3.184 ( -6.658 8.321 1.893) 10.823 3.205 ( 4.228 -14.195 -1.227) 14.862 3.205 ( 4.228 14.195 -1.227) 14.862 4.050 ( -11.655 -7.246 -1.463) 13.801 4.050 ( -11.655 7.246 -1.463) 13.801 4.137 ( -10.749 -7.428 1.059) 13.108 4.137 ( -10.749 7.428 1.059) 13.108 4.878 ( 0.301 -2.366 -9.670) 9.960 4.878 ( 0.301 2.366 -9.670) 9.960 5.354 ( -0.683 -11.970 5.754) 13.299 5.354 ( -0.683 11.970 5.754) 13.299 5.548 ( 1.973 -5.308 -4.655) 7.331 5.548 ( 1.973 5.308 -4.655) 7.331 5.931 ( -0.071 -6.789 8.926) 11.215 5.931 ( -0.071 6.789 8.926) 11.215 6.531 ( 3.488 -4.175 -21.247) 21.932 6.531 ( 3.488 4.175 -21.247) 21.932 6.955 ( 1.044 -4.587 4.730) 6.671 6.955 ( 1.044 4.587 4.730) 6.671 7.368 ( -3.518 -6.941 -3.933) 8.719 7.368 ( -3.518 6.941 -3.933) 8.719 7.900 ( 1.141 -2.683 0.998) 3.081 7.900 ( 1.141 2.683 0.998) 3.081 8.503 ( 3.331 -3.861 -7.566) 9.124 8.503 ( 3.331 3.861 -7.566) 9.124 9.169 ( -2.021 -2.819 -0.126) 3.471 9.169 ( -2.021 2.819 -0.126) 3.471 9.942 ( -3.087 -1.025 -1.494) 3.580 9.942 ( -3.087 1.025 -1.494) 3.580 10.048 ( 4.715 -1.390 14.629) 15.433 10.048 ( 4.715 1.390 14.629) 15.433 10.829 ( 2.315 -5.744 0.282) 6.199 10.829 ( 2.315 5.744 0.282) 6.199 11.024 ( -1.744 -4.334 -1.581) 4.932 11.024 ( -1.744 4.334 -1.581) 4.932 12.719 ( -1.049 -2.601 4.691) 5.465 12.719 ( -1.049 2.601 4.691) 5.465 13.073 ( 1.939 -1.515 -0.226) 2.470 13.073 ( 1.939 1.515 -0.226) 2.470 14.742 ( -0.932 -4.677 0.840) 4.842 14.742 ( -0.932 4.677 0.840) 4.842 15.080 ( -3.736 -0.533 0.120) 3.776 15.080 ( -3.736 0.533 0.120) 3.776 15.731 ( 1.686 -2.839 -2.234) 3.986 15.731 ( 1.686 2.839 -2.234) 3.986 16.091 ( 2.113 -1.110 1.124) 2.638 16.091 ( 2.113 1.110 1.124) 2.638 20.689 ( -2.780 -2.392 -3.418) 5.013 20.689 ( -2.780 2.392 -3.418) 5.013 22.482 ( 0.267 -0.399 3.929) 3.958 22.482 ( 0.267 0.399 3.929) 3.958 ======================= Grid point 155 (81/170) ======================= q-point: (-0.45 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( -0.106 -3.512 -9.702) 10.319 2.230 ( -0.106 3.512 -9.702) 10.319 2.510 ( -1.116 -1.894 -4.473) 4.984 2.510 ( -1.116 1.894 -4.473) 4.984 2.794 ( -9.367 -1.371 5.738) 11.070 2.794 ( -9.367 1.371 5.738) 11.070 2.971 ( 3.567 -5.823 0.783) 6.874 2.971 ( 3.567 5.823 0.783) 6.874 3.066 ( -3.177 -1.917 -1.097) 3.869 3.066 ( -3.177 1.917 -1.097) 3.869 3.277 ( 4.629 -13.000 1.337) 13.864 3.277 ( 4.629 13.000 1.337) 13.864 3.984 ( 4.698 -5.802 -4.044) 8.491 3.984 ( 4.698 5.802 -4.044) 8.491 4.148 ( 9.723 -7.171 1.453) 12.168 4.148 ( 9.723 7.171 1.453) 12.168 4.762 ( 3.593 -5.037 -13.910) 15.224 4.762 ( 3.593 5.037 -13.910) 15.224 5.380 ( -5.087 -13.739 6.658) 16.092 5.380 ( -5.087 13.739 6.658) 16.092 5.573 ( 3.063 -7.040 0.715) 7.711 5.573 ( 3.063 7.040 0.715) 7.711 5.993 ( -3.658 -11.140 5.784) 13.074 5.993 ( -3.658 11.140 5.784) 13.074 6.313 ( -1.054 -4.215 -18.518) 19.021 6.313 ( -1.054 4.215 -18.518) 19.021 7.002 ( 2.300 -5.025 0.112) 5.527 7.002 ( 2.300 5.025 0.112) 5.527 7.302 ( 1.529 -5.846 -4.699) 7.654 7.302 ( 1.529 5.846 -4.699) 7.654 7.974 ( 4.241 -2.072 2.588) 5.383 7.974 ( 4.241 2.072 2.588) 5.383 8.390 ( -3.390 -1.333 -9.714) 10.375 8.390 ( -3.390 1.333 -9.714) 10.375 9.174 ( 1.369 -2.223 -0.898) 2.761 9.174 ( 1.369 2.223 -0.898) 2.761 9.841 ( -5.911 -1.717 -0.421) 6.170 9.841 ( -5.911 1.717 -0.421) 6.170 10.318 ( 4.529 -2.383 16.665) 17.433 10.318 ( 4.529 2.383 16.665) 17.433 10.807 ( -4.565 -9.502 -0.428) 10.550 10.807 ( -4.565 9.502 -0.428) 10.550 11.007 ( 2.213 -10.083 -1.868) 10.491 11.007 ( 2.213 10.083 -1.868) 10.491 12.754 ( -2.108 -2.176 5.644) 6.406 12.754 ( -2.108 2.176 5.644) 6.406 13.076 ( -0.991 -2.594 -0.362) 2.800 13.076 ( -0.991 2.594 -0.362) 2.800 14.764 ( 1.913 -4.153 1.487) 4.808 14.764 ( 1.913 4.153 1.487) 4.808 15.077 ( 3.217 -0.854 0.067) 3.329 15.077 ( 3.217 0.854 0.067) 3.329 15.701 ( -2.604 -1.952 -2.507) 4.108 15.701 ( -2.604 1.952 -2.507) 4.108 16.111 ( -0.889 -1.736 1.196) 2.288 16.111 ( -0.889 1.736 1.196) 2.288 20.642 ( 2.813 -1.091 -4.577) 5.482 20.642 ( 2.813 1.091 -4.577) 5.482 22.533 ( -0.347 -1.386 5.222) 5.413 22.533 ( -0.347 1.386 5.222) 5.413 ======================= Grid point 157 (82/170) ======================= q-point: (-0.36 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 0.959 -4.505 -4.609) 6.515 2.154 ( 0.959 4.505 -4.609) 6.515 2.444 ( -0.744 -2.272 -3.387) 4.146 2.444 ( -0.744 2.272 -3.387) 4.146 2.666 ( -8.772 -4.437 2.227) 10.079 2.666 ( -8.772 4.437 2.227) 10.079 2.920 ( -2.044 -6.111 -3.904) 7.534 2.920 ( -2.044 6.111 -3.904) 7.534 3.170 ( 5.035 -6.339 7.792) 11.236 3.170 ( 5.035 6.339 7.792) 11.236 3.395 ( 6.989 -9.596 3.745) 12.448 3.395 ( 6.989 9.596 3.745) 12.448 3.967 ( 5.164 -2.160 -17.431) 18.307 3.967 ( 5.164 2.160 -17.431) 18.307 4.419 ( 20.873 -17.875 1.410) 27.517 4.419 ( 20.873 17.875 1.410) 27.517 4.764 ( 11.881 -16.680 -6.665) 21.536 4.764 ( 11.881 16.680 -6.665) 21.536 5.326 ( -9.539 -12.564 4.021) 16.280 5.326 ( -9.539 12.564 4.021) 16.280 5.618 ( 0.120 -4.801 1.683) 5.089 5.618 ( 0.120 4.801 1.683) 5.089 5.893 ( -5.179 -13.586 -8.048) 16.618 5.893 ( -5.179 13.586 -8.048) 16.618 6.235 ( 3.005 -2.619 2.457) 4.682 6.235 ( 3.005 2.619 2.457) 4.682 6.994 ( -1.388 -5.585 -4.386) 7.235 6.994 ( -1.388 5.585 -4.386) 7.235 7.335 ( 8.286 -10.346 -2.896) 13.568 7.335 ( 8.286 10.346 -2.896) 13.568 8.045 ( 1.481 -2.670 0.080) 3.054 8.045 ( 1.481 2.670 0.080) 3.054 8.236 ( -3.159 -7.290 -6.848) 10.489 8.236 ( -3.159 7.290 -6.848) 10.489 9.153 ( -1.845 -2.248 -2.447) 3.801 9.153 ( -1.845 2.248 -2.447) 3.801 9.766 ( -4.416 -2.416 1.318) 5.204 9.766 ( -4.416 2.416 1.318) 5.204 10.460 ( -6.458 -4.175 6.742) 10.227 10.460 ( -6.458 4.175 6.742) 10.227 10.790 ( 4.180 -11.281 4.040) 12.690 10.790 ( 4.180 11.281 4.040) 12.690 11.026 ( 1.152 -10.830 0.044) 10.891 11.026 ( 1.152 10.830 0.044) 10.891 12.757 ( -5.626 -2.220 4.987) 7.839 12.757 ( -5.626 2.220 4.987) 7.839 13.044 ( -2.559 -3.868 -0.038) 4.638 13.044 ( -2.559 3.868 -0.038) 4.638 14.833 ( 5.136 -2.711 1.006) 5.894 14.833 ( 5.136 2.711 1.006) 5.894 15.173 ( 8.118 -1.724 0.145) 8.301 15.173 ( 8.118 1.724 0.145) 8.301 15.592 ( -6.565 -1.427 -3.194) 7.439 15.592 ( -6.565 1.427 -3.194) 7.439 16.100 ( -2.215 -5.613 1.475) 6.212 16.100 ( -2.215 5.613 1.475) 6.212 20.681 ( 7.768 -0.913 -3.597) 8.609 20.681 ( 7.768 0.913 -3.597) 8.609 22.578 ( -1.203 -3.173 4.715) 5.810 22.578 ( -1.203 3.173 4.715) 5.810 ======================= Grid point 159 (83/170) ======================= q-point: (-0.27 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( 1.448 -9.981 3.911) 10.817 2.167 ( 1.448 9.981 3.911) 10.817 2.430 ( 2.804 -4.266 -2.292) 5.596 2.430 ( 2.804 4.266 -2.292) 5.596 2.619 ( -1.507 -10.139 3.677) 10.890 2.619 ( -1.507 10.139 3.677) 10.890 2.866 ( 0.988 -0.973 -4.131) 4.358 2.866 ( 0.988 0.973 -4.131) 4.358 3.327 ( -0.013 -8.295 11.365) 14.070 3.327 ( -0.013 8.295 11.365) 14.070 3.552 ( 5.970 -7.320 3.437) 10.052 3.552 ( 5.970 7.320 3.437) 10.052 3.793 ( 5.709 -3.190 -24.245) 25.112 3.793 ( 5.709 3.190 -24.245) 25.112 4.777 ( 19.929 -21.354 1.820) 29.265 4.777 ( 19.929 21.354 1.820) 29.265 4.924 ( 11.055 -21.095 -0.231) 23.817 4.924 ( 11.055 21.095 -0.231) 23.817 5.196 ( -7.143 -7.659 -0.407) 10.481 5.196 ( -7.143 7.659 -0.407) 10.481 5.626 ( 0.082 -0.799 1.188) 1.434 5.626 ( 0.082 0.799 1.188) 1.434 5.757 ( -1.372 -12.082 -6.252) 13.673 5.757 ( -1.372 12.082 -6.252) 13.673 6.359 ( 4.068 -5.419 4.590) 8.184 6.359 ( 4.068 5.419 4.590) 8.184 6.901 ( -1.645 -8.309 -3.717) 9.250 6.901 ( -1.645 8.309 -3.717) 9.250 7.466 ( 10.331 -12.814 -1.815) 16.560 7.466 ( 10.331 12.814 -1.815) 16.560 7.989 ( -5.336 -1.868 -3.676) 6.743 7.989 ( -5.336 1.868 -3.676) 6.743 8.177 ( 0.982 -8.811 -2.179) 9.129 8.177 ( 0.982 8.811 -2.179) 9.129 9.077 ( -4.928 -1.768 -0.401) 5.251 9.077 ( -4.928 1.768 -0.401) 5.251 9.716 ( -4.674 -5.346 1.672) 7.295 9.716 ( -4.674 5.346 1.672) 7.295 10.336 ( -9.564 -3.953 -0.819) 10.381 10.336 ( -9.564 3.953 -0.819) 10.381 10.938 ( 5.804 -16.023 0.180) 17.043 10.938 ( 5.804 16.023 0.180) 17.043 11.079 ( 4.482 -6.533 5.646) 9.729 11.079 ( 4.482 6.533 5.646) 9.729 12.673 ( -10.870 -2.547 3.399) 11.670 12.673 ( -10.870 2.547 3.399) 11.670 12.992 ( -4.297 -4.538 0.048) 6.250 12.992 ( -4.297 4.538 0.048) 6.250 14.944 ( 8.254 -3.065 -0.580) 8.823 14.944 ( 8.254 3.065 -0.580) 8.823 15.256 ( -2.482 -3.494 0.395) 4.304 15.256 ( -2.482 3.494 0.395) 4.304 15.516 ( 6.179 -1.430 -2.372) 6.771 15.516 ( 6.179 1.430 -2.372) 6.771 16.074 ( -2.930 -8.787 1.165) 9.336 16.074 ( -2.930 8.787 1.165) 9.336 20.794 ( 9.614 -2.860 -1.611) 10.159 20.794 ( 9.614 2.860 -1.611) 10.159 22.594 ( -2.144 -5.159 2.916) 6.302 22.594 ( -2.144 5.159 2.916) 6.302 ======================= Grid point 161 (84/170) ======================= q-point: (-0.18 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( 5.791 -11.678 7.038) 14.814 2.288 ( 5.791 11.678 7.038) 14.814 2.461 ( 3.431 -4.551 -1.675) 5.940 2.461 ( 3.431 4.551 -1.675) 5.940 2.660 ( -1.027 -11.329 4.695) 12.306 2.660 ( -1.027 11.329 4.695) 12.306 2.868 ( 4.176 -5.131 -2.759) 7.168 2.868 ( 4.176 5.131 -2.759) 7.168 3.293 ( -9.418 -3.545 -5.093) 11.279 3.293 ( -9.418 3.545 -5.093) 11.279 3.609 ( 4.710 -5.960 -7.366) 10.582 3.609 ( 4.710 5.960 -7.366) 10.582 3.783 ( 5.819 -6.292 5.804) 10.351 3.783 ( 5.819 6.292 5.804) 10.351 4.951 ( -0.034 -5.891 2.845) 6.542 4.951 ( -0.034 5.891 2.845) 6.542 5.114 ( 9.522 -18.648 1.599) 20.999 5.114 ( 9.522 18.648 1.599) 20.999 5.170 ( 3.247 -4.374 1.797) 5.737 5.170 ( 3.247 4.374 1.797) 5.737 5.611 ( -0.997 -9.422 -4.284) 10.398 5.611 ( -0.997 9.422 -4.284) 10.398 5.789 ( 11.599 -9.482 -0.712) 14.998 5.789 ( 11.599 9.482 -0.712) 14.998 6.376 ( -0.613 -2.970 -3.222) 4.425 6.376 ( -0.613 2.970 -3.222) 4.425 6.951 ( 6.210 -10.407 4.747) 13.016 6.951 ( 6.210 10.407 4.747) 13.016 7.592 ( 6.854 -13.301 -1.181) 15.009 7.592 ( 6.854 13.301 -1.181) 15.009 7.826 ( -8.250 -5.712 -5.665) 11.523 7.826 ( -8.250 5.712 -5.665) 11.523 8.177 ( 0.745 -7.304 -1.344) 7.464 8.177 ( 0.745 7.304 -1.344) 7.464 9.017 ( -4.204 -3.405 3.400) 6.390 9.017 ( -4.204 3.405 3.400) 6.390 9.635 ( -8.394 -7.109 1.820) 11.150 9.635 ( -8.394 7.109 1.820) 11.150 10.208 ( -3.341 -6.757 -2.376) 7.904 10.208 ( -3.341 6.757 -2.376) 7.904 10.971 ( 2.253 -19.125 -2.173) 19.380 10.971 ( 2.253 19.125 -2.173) 19.380 11.259 ( 9.032 -8.810 3.518) 13.098 11.259 ( 9.032 8.810 3.518) 13.098 12.504 ( -13.868 -1.642 2.224) 14.141 12.504 ( -13.868 1.642 2.224) 14.141 12.905 ( -6.158 -4.097 -0.835) 7.443 12.905 ( -6.158 4.097 -0.835) 7.443 15.006 ( -2.494 -4.156 -1.381) 5.040 15.006 ( -2.494 4.156 -1.381) 5.040 15.227 ( 4.756 -1.690 1.538) 5.277 15.227 ( 4.756 1.690 1.538) 5.277 15.677 ( 11.948 -2.872 -1.341) 12.361 15.677 ( 11.948 2.872 -1.341) 12.361 16.038 ( -2.262 -9.442 0.288) 9.714 16.038 ( -2.262 9.442 0.288) 9.714 20.927 ( 7.929 -4.130 -0.004) 8.940 20.927 ( 7.929 4.130 -0.004) 8.940 22.575 ( -2.613 -6.729 0.494) 7.236 22.575 ( -2.613 6.729 0.494) 7.236 ======================= Grid point 163 (85/170) ======================= q-point: (-0.09 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.411 ( 4.112 -9.595 -5.224) 11.673 2.411 ( 4.112 9.595 -5.224) 11.673 2.543 ( 4.197 -6.034 7.999) 10.863 2.543 ( 4.197 6.034 7.999) 10.863 2.643 ( -2.991 -10.782 -3.720) 11.791 2.643 ( -2.991 10.782 -3.720) 11.791 2.920 ( 3.018 -2.975 1.679) 4.558 2.920 ( 3.018 2.975 1.679) 4.558 3.093 ( -4.509 -2.599 -4.981) 7.204 3.093 ( -4.509 2.599 -4.981) 7.204 3.521 ( 0.067 -0.637 -13.016) 13.032 3.521 ( 0.067 0.637 -13.016) 13.032 4.010 ( 1.199 -2.398 22.313) 22.473 4.010 ( 1.199 2.398 22.313) 22.473 4.943 ( -3.892 -3.172 2.866) 5.781 4.943 ( -3.892 3.172 2.866) 5.781 5.196 ( -0.021 -18.077 1.976) 18.185 5.196 ( -0.021 18.077 1.976) 18.185 5.292 ( 7.541 -1.955 1.241) 7.889 5.292 ( 7.541 1.955 1.241) 7.889 5.560 ( 0.223 -7.101 -2.654) 7.584 5.560 ( 0.223 7.101 -2.654) 7.584 5.952 ( 6.156 -7.935 1.182) 10.113 5.952 ( 6.156 7.935 1.182) 10.113 6.435 ( 10.517 -4.021 1.245) 11.328 6.435 ( 10.517 4.021 1.245) 11.328 7.102 ( 5.838 -7.140 3.472) 9.854 7.102 ( 5.838 7.140 3.472) 9.854 7.499 ( -14.232 -10.505 -5.700) 18.585 7.499 ( -14.232 10.505 -5.700) 18.585 7.765 ( 6.143 -7.106 -0.915) 9.438 7.765 ( 6.143 7.106 -0.915) 9.438 8.161 ( 0.934 -9.145 -3.438) 9.815 8.161 ( 0.934 9.145 -3.438) 9.815 9.009 ( -3.181 -5.496 3.627) 7.313 9.009 ( -3.181 5.496 3.627) 7.313 9.519 ( -8.446 -8.457 3.960) 12.591 9.519 ( -8.446 8.457 3.960) 12.591 10.184 ( 2.267 -12.378 -1.592) 12.684 10.184 ( 2.267 12.378 -1.592) 12.684 10.975 ( 1.705 -19.118 -3.894) 19.585 10.975 ( 1.705 19.118 -3.894) 19.585 11.400 ( 6.549 -10.134 -0.720) 12.088 11.400 ( 6.549 10.134 -0.720) 12.088 12.323 ( -11.044 -1.104 2.400) 11.356 12.323 ( -11.044 1.104 2.400) 11.356 12.799 ( -4.649 -2.819 -1.765) 5.717 12.799 ( -4.649 2.819 -1.765) 5.717 14.929 ( -5.080 -2.459 2.782) 6.293 14.929 ( -5.080 2.459 2.782) 6.293 15.381 ( 9.624 -4.932 0.694) 10.837 15.381 ( 9.624 4.932 0.694) 10.837 15.769 ( 1.798 -8.778 -2.813) 9.392 15.769 ( 1.798 8.778 -2.813) 9.392 16.040 ( 2.578 -5.682 -0.154) 6.241 16.040 ( 2.578 5.682 -0.154) 6.241 21.029 ( 4.181 -4.099 0.902) 5.925 21.029 ( 4.181 4.099 0.902) 5.925 22.529 ( -1.962 -7.335 -1.998) 7.851 22.529 ( -1.962 7.335 -1.998) 7.851 ======================= Grid point 198 (86/170) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( -1.325 0.000 29.161) 29.191 1.424 ( 4.866 0.000 31.761) 32.131 2.286 ( -0.045 0.000 -18.620) 18.620 2.503 ( -4.620 0.000 -13.329) 14.107 2.690 ( -7.801 0.000 43.187) 43.886 2.836 ( 2.401 0.000 -2.597) 3.537 2.917 ( 1.801 0.000 -4.158) 4.531 3.108 ( 0.671 0.000 9.243) 9.267 3.280 ( -1.439 0.000 -2.439) 2.832 3.608 ( 0.904 0.000 -2.315) 2.486 3.812 ( -1.085 0.000 -8.317) 8.388 3.931 ( 2.241 0.000 10.205) 10.448 4.135 ( 9.412 0.000 -7.330) 11.929 4.164 ( -2.506 0.000 -1.684) 3.020 4.296 ( -4.595 0.000 -9.818) 10.840 4.303 ( 2.881 0.000 -3.034) 4.184 4.612 ( 2.211 0.000 13.306) 13.488 4.736 ( 6.822 0.000 4.502) 8.173 5.074 ( -11.825 0.000 16.933) 20.653 5.206 ( -7.867 0.000 -8.281) 11.422 5.238 ( 1.852 0.000 1.988) 2.717 5.435 ( -1.309 0.000 18.511) 18.558 5.694 ( 2.204 0.000 -7.760) 8.067 5.890 ( 7.227 0.000 15.334) 16.952 5.957 ( -4.504 0.000 -9.227) 10.268 6.445 ( -0.872 0.000 10.315) 10.351 6.671 ( 2.680 0.000 -4.698) 5.409 6.859 ( 3.758 0.000 -14.557) 15.034 6.938 ( 2.019 0.000 -1.860) 2.745 7.175 ( -3.175 0.000 -9.752) 10.256 7.523 ( 2.734 0.000 8.203) 8.647 7.860 ( -1.954 0.000 -7.433) 7.685 8.247 ( -3.357 0.000 4.948) 5.979 8.394 ( -6.413 0.000 -2.130) 6.758 8.485 ( 4.081 0.000 7.449) 8.493 9.114 ( -4.991 0.000 -19.256) 19.892 9.450 ( -2.857 0.000 4.441) 5.281 9.649 ( 4.327 0.000 -2.595) 5.045 9.817 ( 11.719 0.000 2.647) 12.015 10.305 ( -4.791 0.000 -15.804) 16.514 11.025 ( -2.396 0.000 10.741) 11.005 11.351 ( 5.861 0.000 -1.859) 6.148 11.618 ( -4.258 0.000 4.980) 6.552 11.930 ( -2.108 0.000 -6.615) 6.943 12.099 ( -2.079 0.000 11.982) 12.161 12.248 ( 2.261 0.000 12.591) 12.792 12.603 ( 0.745 0.000 -9.541) 9.570 12.723 ( -1.194 0.000 -8.704) 8.785 14.493 ( 0.020 0.000 2.226) 2.226 14.584 ( -1.188 0.000 -1.655) 2.037 15.170 ( 1.826 0.000 -0.694) 1.953 15.182 ( -4.458 0.000 5.330) 6.949 15.365 ( 3.828 0.000 5.936) 7.063 15.903 ( 1.474 0.000 -9.760) 9.870 16.205 ( -1.005 0.000 1.553) 1.850 16.300 ( 1.232 0.000 -3.152) 3.384 20.572 ( 0.541 0.000 7.309) 7.329 20.804 ( -1.259 0.000 -3.312) 3.543 22.555 ( 0.390 0.000 2.052) 2.089 22.763 ( -0.169 0.000 -7.349) 7.351 ======================= Grid point 199 (87/170) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 7.526 0.000 23.984) 25.137 1.892 ( 11.495 0.000 27.204) 29.533 2.120 ( 5.759 0.000 -19.908) 20.724 2.241 ( 1.090 0.000 -23.639) 23.664 2.753 ( -4.898 0.000 -0.971) 4.993 2.811 ( -3.258 0.000 -3.272) 4.617 3.098 ( -2.506 0.000 15.783) 15.980 3.194 ( -4.877 0.000 1.756) 5.184 3.379 ( 6.482 0.000 27.059) 27.825 3.608 ( 2.206 0.000 3.128) 3.827 3.672 ( -4.153 0.000 -9.692) 10.545 4.002 ( -8.232 0.000 -9.942) 12.908 4.094 ( 3.722 0.000 9.639) 10.333 4.141 ( 3.407 0.000 -7.802) 8.513 4.170 ( 2.896 0.000 -6.913) 7.495 4.272 ( -6.580 0.000 -6.169) 9.020 4.560 ( -11.421 0.000 7.838) 13.852 4.768 ( -5.283 0.000 -2.397) 5.802 5.058 ( -3.622 0.000 2.115) 4.195 5.138 ( 8.556 0.000 -0.174) 8.558 5.452 ( 8.123 0.000 14.309) 16.454 5.631 ( -1.574 0.000 -14.141) 14.228 5.687 ( 6.970 0.000 20.739) 21.879 6.003 ( 20.378 0.000 -2.342) 20.512 6.160 ( 0.625 0.000 12.897) 12.912 6.617 ( -1.911 0.000 -18.420) 18.518 6.697 ( 18.371 0.000 12.749) 22.361 6.724 ( 5.937 0.000 -10.667) 12.208 6.946 ( 0.916 0.000 1.128) 1.453 7.011 ( -2.813 0.000 -10.729) 11.092 7.607 ( -6.107 0.000 5.927) 8.510 7.749 ( 0.902 0.000 -7.432) 7.487 8.321 ( -1.961 0.000 -1.408) 2.414 8.339 ( 6.089 0.000 7.434) 9.609 8.688 ( 8.541 0.000 14.440) 16.777 8.900 ( 3.508 0.000 -16.984) 17.343 9.424 ( -6.484 0.000 4.140) 7.693 9.631 ( -1.203 0.000 -4.098) 4.271 9.980 ( 1.211 0.000 6.233) 6.350 9.984 ( -11.356 0.000 -17.046) 20.482 11.041 ( -8.281 0.000 9.156) 12.345 11.292 ( -6.059 0.000 -9.019) 10.865 11.615 ( -5.766 0.000 10.581) 12.050 11.778 ( -7.514 0.000 -5.276) 9.181 12.332 ( 11.979 0.000 10.551) 15.963 12.449 ( 4.982 0.000 12.373) 13.338 12.570 ( 7.705 0.000 -10.745) 13.222 12.628 ( 3.834 0.000 -10.525) 11.202 14.561 ( 4.601 0.000 3.221) 5.617 14.574 ( 2.756 0.000 -2.098) 3.464 15.163 ( -1.474 0.000 0.568) 1.579 15.171 ( 0.255 0.000 -0.487) 0.550 15.543 ( 5.150 0.000 11.834) 12.906 15.820 ( 3.750 0.000 -12.604) 13.150 16.183 ( -4.110 0.000 1.801) 4.487 16.269 ( -1.069 0.000 -2.885) 3.076 20.717 ( 7.344 0.000 6.810) 10.015 20.789 ( 4.678 0.000 -4.143) 6.249 22.586 ( -0.497 0.000 3.646) 3.680 22.676 ( -0.944 0.000 -6.733) 6.799 ======================= Grid point 200 (88/170) ======================= q-point: ( 0.18 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 5.969 0.000 3.053) 6.705 2.013 ( 6.814 0.000 -17.173) 18.476 2.073 ( 6.535 0.000 -7.723) 10.118 2.341 ( 10.252 0.000 21.615) 23.923 2.693 ( -3.320 0.000 2.126) 3.942 2.705 ( -4.811 0.000 -0.201) 4.816 3.124 ( -2.579 0.000 -1.577) 3.023 3.195 ( -1.006 0.000 3.574) 3.713 3.467 ( -9.670 0.000 -7.385) 12.168 3.518 ( -9.994 0.000 7.399) 12.435 3.690 ( -14.600 0.000 1.950) 14.729 3.743 ( -13.004 0.000 -5.796) 14.237 4.128 ( 5.932 0.000 10.866) 12.379 4.152 ( 4.353 0.000 -4.822) 6.496 4.197 ( 19.896 0.000 -16.490) 25.841 4.312 ( 8.757 0.000 4.312) 9.761 4.608 ( 4.589 0.000 8.217) 9.411 4.631 ( -1.699 0.000 -9.740) 9.887 5.166 ( 5.741 0.000 14.101) 15.225 5.234 ( 8.748 0.000 -8.252) 12.026 5.449 ( -2.518 0.000 -8.235) 8.611 5.699 ( 3.386 0.000 14.338) 14.733 6.017 ( -2.146 0.000 18.363) 18.488 6.259 ( 2.912 0.000 -15.679) 15.947 6.273 ( 8.861 0.000 6.778) 11.156 6.303 ( 5.748 0.000 -18.477) 19.351 6.726 ( 7.665 0.000 -11.233) 13.599 6.922 ( 3.500 0.000 -1.566) 3.835 6.969 ( 7.877 0.000 0.909) 7.929 7.257 ( 18.573 0.000 14.736) 23.709 7.458 ( -14.297 0.000 3.288) 14.670 7.706 ( 5.277 0.000 -11.165) 12.350 8.287 ( -1.007 0.000 -0.632) 1.189 8.482 ( 0.650 0.000 5.138) 5.179 8.847 ( 10.856 0.000 -13.570) 17.378 9.116 ( 17.740 0.000 21.277) 27.702 9.313 ( -12.451 0.000 1.681) 12.563 9.534 ( -5.299 0.000 -3.456) 6.326 9.689 ( -2.334 0.000 -9.252) 9.542 10.002 ( -7.256 0.000 7.869) 10.703 10.979 ( -10.323 0.000 5.869) 11.875 11.025 ( -12.591 0.000 -10.785) 16.578 11.598 ( -7.016 0.000 -5.895) 9.164 11.639 ( -6.546 0.000 9.813) 11.796 12.548 ( 6.554 0.000 -11.030) 12.830 12.630 ( 9.204 0.000 9.615) 13.310 12.659 ( 11.016 0.000 -7.978) 13.601 12.663 ( 7.148 0.000 10.395) 12.615 14.628 ( 6.657 0.000 -1.622) 6.851 14.702 ( 8.480 0.000 3.319) 9.106 15.161 ( 1.965 0.000 -1.213) 2.309 15.189 ( 2.582 0.000 0.217) 2.591 15.749 ( 5.188 0.000 -13.024) 14.019 15.749 ( 4.292 0.000 10.341) 11.197 16.119 ( -6.962 0.000 2.917) 7.548 16.200 ( -3.580 0.000 -2.953) 4.641 20.858 ( 9.546 0.000 -3.958) 10.334 20.924 ( 10.331 0.000 4.226) 11.162 22.590 ( -1.540 0.000 -4.990) 5.223 22.617 ( -1.891 0.000 5.301) 5.628 ======================= Grid point 201 (89/170) ======================= q-point: ( 0.27 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( 11.734 0.000 -15.811) 19.689 1.987 ( 10.815 0.000 -12.215) 16.314 2.264 ( 4.485 0.000 10.533) 11.448 2.622 ( -1.602 0.000 9.681) 9.813 2.685 ( -3.043 0.000 5.363) 6.166 2.697 ( 0.259 0.000 8.661) 8.665 3.019 ( -7.121 0.000 -4.079) 8.206 3.143 ( -12.244 0.000 -0.465) 12.253 3.172 ( -18.662 0.000 -7.590) 20.147 3.274 ( -6.806 0.000 3.547) 7.675 3.499 ( -7.194 0.000 -7.576) 10.448 3.662 ( -5.379 0.000 12.802) 13.886 4.133 ( 6.044 0.000 -12.994) 14.331 4.286 ( 1.625 0.000 -4.673) 4.947 4.404 ( 3.396 0.000 6.273) 7.133 4.442 ( 25.956 0.000 -9.359) 27.592 4.564 ( 9.632 0.000 -9.528) 13.549 4.934 ( 17.713 0.000 8.618) 19.698 5.224 ( 7.766 0.000 -16.833) 18.538 5.248 ( -3.913 0.000 0.253) 3.921 5.617 ( 14.677 0.000 10.507) 18.050 5.880 ( -0.584 0.000 12.556) 12.569 5.891 ( 1.609 0.000 -34.182) 34.220 5.998 ( -9.213 0.000 5.926) 10.954 6.302 ( 1.191 0.000 2.279) 2.571 6.572 ( 11.248 0.000 7.339) 13.430 6.766 ( 4.730 0.000 -4.942) 6.841 6.918 ( -6.154 0.000 -1.155) 6.261 7.170 ( 8.959 0.000 3.980) 9.803 7.170 ( -10.498 0.000 0.977) 10.543 7.661 ( 8.713 0.000 -15.246) 17.560 7.737 ( 15.126 0.000 9.978) 18.120 8.272 ( -0.347 0.000 -0.330) 0.479 8.449 ( -8.040 0.000 0.011) 8.040 8.930 ( 15.448 0.000 -10.310) 18.572 9.121 ( -11.083 0.000 4.875) 12.108 9.417 ( -5.326 0.000 -0.867) 5.396 9.559 ( 7.853 0.000 13.601) 15.705 9.805 ( 17.326 0.000 7.611) 18.923 9.961 ( -8.028 0.000 8.088) 11.396 10.684 ( -14.271 0.000 -11.977) 18.631 10.838 ( -13.468 0.000 2.392) 13.679 11.450 ( -3.321 0.000 -5.543) 6.461 11.604 ( -9.470 0.000 6.218) 11.329 12.571 ( 9.400 0.000 -7.121) 11.792 12.763 ( 10.011 0.000 -3.672) 10.664 12.802 ( 1.990 0.000 8.353) 8.587 12.897 ( 7.728 0.000 7.404) 10.702 14.744 ( 9.835 0.000 -1.244) 9.914 14.888 ( 10.565 0.000 2.768) 10.921 15.202 ( 5.488 0.000 -2.039) 5.855 15.261 ( 5.826 0.000 0.854) 5.888 15.697 ( 5.166 0.000 -11.409) 12.524 15.856 ( -2.445 0.000 4.075) 4.752 16.056 ( -6.154 0.000 6.211) 8.744 16.092 ( -5.605 0.000 -3.446) 6.580 20.990 ( 11.626 0.000 -3.145) 12.044 21.111 ( 9.836 0.000 0.374) 9.843 22.525 ( -1.367 0.000 -2.325) 2.697 22.641 ( -3.550 0.000 6.601) 7.495 ======================= Grid point 202 (90/170) ======================= q-point: ( 0.36 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( 13.214 0.000 -8.186) 15.544 2.063 ( 12.872 0.000 -8.886) 15.641 2.341 ( -6.580 0.000 3.697) 7.548 2.616 ( -5.167 0.000 3.183) 6.068 2.722 ( -2.501 0.000 7.115) 7.542 2.724 ( -6.028 0.000 2.034) 6.362 2.825 ( -3.057 0.000 -1.081) 3.242 2.925 ( -17.669 0.000 7.293) 19.115 2.999 ( -0.082 0.000 -4.775) 4.776 3.247 ( -4.622 0.000 2.592) 5.299 3.408 ( 4.209 0.000 -3.108) 5.232 3.683 ( -9.346 0.000 9.106) 13.049 4.080 ( 6.042 0.000 -13.020) 14.354 4.168 ( -2.087 0.000 -10.496) 10.701 4.542 ( 2.729 0.000 4.624) 5.370 4.562 ( 1.930 0.000 0.860) 2.113 4.889 ( 35.790 0.000 -15.013) 38.812 5.079 ( -2.663 0.000 1.211) 2.925 5.151 ( 11.327 0.000 -16.606) 20.101 5.296 ( 7.491 0.000 -9.821) 12.352 5.606 ( 9.311 0.000 -13.099) 16.071 5.830 ( -10.670 0.000 3.434) 11.209 5.876 ( 7.680 0.000 -2.331) 8.026 6.057 ( 2.109 0.000 6.441) 6.777 6.593 ( -19.682 0.000 2.326) 19.819 6.600 ( 19.110 0.000 18.878) 26.862 6.665 ( -13.669 0.000 -2.483) 13.893 6.775 ( 7.245 0.000 -11.134) 13.283 7.187 ( -2.175 0.000 12.376) 12.565 7.228 ( -0.965 0.000 -4.376) 4.481 7.694 ( 13.471 0.000 -11.523) 17.727 7.971 ( 5.248 0.000 2.879) 5.986 8.270 ( 1.146 0.000 -0.947) 1.487 8.292 ( -8.702 0.000 -0.991) 8.759 9.061 ( 11.849 0.000 -6.524) 13.526 9.082 ( -6.007 0.000 11.004) 12.537 9.394 ( 1.701 0.000 3.144) 3.574 9.765 ( 3.949 0.000 6.136) 7.297 9.945 ( -4.172 0.000 5.686) 7.052 10.131 ( 7.264 0.000 4.467) 8.528 10.373 ( -4.685 0.000 -7.486) 8.831 10.634 ( -13.774 0.000 1.889) 13.903 11.374 ( 1.068 0.000 -5.187) 5.296 11.478 ( -12.101 0.000 2.223) 12.304 12.686 ( 11.166 0.000 -1.853) 11.318 12.880 ( 7.189 0.000 -0.089) 7.190 12.886 ( -1.607 0.000 6.253) 6.456 13.045 ( 2.170 0.000 4.910) 5.369 14.900 ( 11.785 0.000 -1.503) 11.881 15.074 ( 9.056 0.000 1.873) 9.248 15.280 ( 5.802 0.000 -0.735) 5.849 15.389 ( 8.424 0.000 1.380) 8.536 15.654 ( 3.172 0.000 -8.280) 8.866 15.782 ( -8.561 0.000 1.642) 8.717 15.960 ( -4.974 0.000 -4.521) 6.721 16.040 ( -5.689 0.000 4.751) 7.411 21.133 ( 9.578 0.000 -2.253) 9.840 21.236 ( 7.427 0.000 -2.380) 7.799 22.507 ( 0.572 0.000 0.652) 0.868 22.645 ( -5.216 0.000 6.576) 8.393 ======================= Grid point 203 (91/170) ======================= q-point: ( 0.45 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 3.729 0.000 0.758) 3.805 2.198 ( 12.762 0.000 -3.406) 13.208 2.213 ( -4.300 0.000 -1.701) 4.624 2.540 ( -0.075 0.000 -7.434) 7.434 2.618 ( -9.994 0.000 0.184) 9.996 2.770 ( -13.840 0.000 12.589) 18.709 2.781 ( 3.364 0.000 4.832) 5.887 2.900 ( 5.192 0.000 1.330) 5.359 2.992 ( 3.750 0.000 -0.573) 3.793 3.188 ( -4.637 0.000 1.359) 4.832 3.474 ( 6.205 0.000 -4.868) 7.886 3.527 ( -11.456 0.000 -5.202) 12.582 4.038 ( 5.078 0.000 -10.373) 11.549 4.041 ( -1.658 0.000 -7.934) 8.106 4.539 ( -4.212 0.000 -0.080) 4.213 4.564 ( -1.501 0.000 -0.918) 1.759 4.984 ( 7.522 0.000 -14.197) 16.067 5.144 ( 4.013 0.000 9.594) 10.400 5.165 ( 0.248 0.000 -15.291) 15.293 5.508 ( 35.713 0.000 -3.810) 35.915 5.707 ( -6.654 0.000 -0.689) 6.690 5.737 ( 3.853 0.000 1.260) 4.054 5.979 ( 8.115 0.000 -0.614) 8.138 6.103 ( -1.850 0.000 1.283) 2.251 6.272 ( -19.293 0.000 -0.907) 19.314 6.325 ( -20.205 0.000 -3.124) 20.445 6.777 ( 4.737 0.000 -6.542) 8.077 7.070 ( 0.333 0.000 -3.074) 3.092 7.163 ( 15.035 0.000 11.305) 18.811 7.291 ( -3.292 0.000 14.029) 14.410 7.774 ( 10.219 0.000 -8.867) 13.530 7.931 ( -9.579 0.000 -3.562) 10.219 8.217 ( -1.067 0.000 0.819) 1.345 8.287 ( 3.532 0.000 -2.761) 4.483 9.141 ( -2.729 0.000 10.295) 10.651 9.168 ( 8.053 0.000 -1.373) 8.170 9.517 ( 6.808 0.000 5.000) 8.447 9.690 ( -13.646 0.000 -3.307) 14.041 9.905 ( -6.661 0.000 0.652) 6.693 10.123 ( 2.860 0.000 -4.827) 5.611 10.489 ( 9.874 0.000 4.074) 10.681 10.508 ( -6.629 0.000 5.662) 8.718 11.296 ( -11.948 0.000 0.617) 11.964 11.366 ( 5.550 0.000 -5.559) 7.855 12.861 ( 10.503 0.000 1.467) 10.605 12.891 ( -5.495 0.000 4.939) 7.388 12.978 ( 4.400 0.000 1.174) 4.554 13.071 ( -3.761 0.000 2.205) 4.360 15.067 ( 10.382 0.000 -0.993) 10.429 15.175 ( 0.045 0.000 0.538) 0.540 15.338 ( 0.329 0.000 1.017) 1.069 15.507 ( 6.467 0.000 -3.314) 7.267 15.655 ( 3.714 0.000 0.647) 3.770 15.681 ( -5.583 0.000 2.418) 6.084 15.865 ( 1.603 0.000 -5.818) 6.035 15.954 ( -8.738 0.000 0.389) 8.747 21.221 ( 3.813 0.000 -1.298) 4.028 21.287 ( 2.687 0.000 -3.161) 4.149 22.562 ( 4.032 0.000 2.665) 4.833 22.620 ( -5.899 0.000 4.942) 7.696 ======================= Grid point 204 (92/170) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( -19.433 0.000 -1.164) 19.468 2.253 ( -6.746 0.000 -5.601) 8.768 2.315 ( 8.151 0.000 0.270) 8.156 2.481 ( -0.728 0.000 -0.903) 1.160 2.566 ( 11.995 0.000 -1.426) 12.080 2.756 ( -6.561 0.000 12.394) 14.023 2.856 ( 7.369 0.000 -5.231) 9.037 3.044 ( 7.087 0.000 9.188) 11.604 3.086 ( 7.057 0.000 -0.324) 7.064 3.139 ( -3.801 0.000 1.544) 4.103 3.344 ( -1.086 0.000 -6.417) 6.509 3.438 ( 5.098 0.000 -17.228) 17.966 3.896 ( -9.121 0.000 -3.785) 9.875 4.032 ( 4.607 0.000 -3.760) 5.946 4.515 ( 1.230 0.000 1.870) 2.238 4.528 ( -1.414 0.000 -0.201) 1.428 4.951 ( -9.500 0.000 -8.886) 13.008 4.956 ( 1.517 0.000 -4.483) 4.733 5.393 ( 1.016 0.000 9.157) 9.213 5.467 ( -25.626 0.000 1.635) 25.678 5.556 ( -7.546 0.000 -4.998) 9.051 5.820 ( -5.644 0.000 -2.490) 6.168 6.014 ( -10.944 0.000 -0.607) 10.960 6.135 ( 10.912 0.000 1.751) 11.052 6.209 ( 5.301 0.000 -1.876) 5.623 6.220 ( 26.271 0.000 0.157) 26.271 6.764 ( -4.159 0.000 2.252) 4.730 6.877 ( -7.250 0.000 -9.113) 11.646 7.401 ( -0.438 0.000 10.917) 10.926 7.578 ( 11.626 0.000 11.692) 16.489 7.645 ( -17.691 0.000 -8.282) 19.533 7.822 ( 8.899 0.000 -8.305) 12.172 8.223 ( 1.147 0.000 -0.701) 1.345 8.323 ( 6.229 0.000 -4.302) 7.570 9.142 ( -8.785 0.000 2.254) 9.069 9.279 ( 5.322 0.000 1.165) 5.448 9.471 ( -10.112 0.000 2.543) 10.427 9.678 ( 7.224 0.000 0.145) 7.226 9.803 ( -6.593 0.000 7.396) 9.908 10.110 ( 2.770 0.000 -4.630) 5.395 10.497 ( -3.884 0.000 3.587) 5.287 10.643 ( 5.854 0.000 -0.366) 5.865 11.170 ( -4.376 0.000 2.421) 5.001 11.433 ( 10.283 0.000 -4.882) 11.383 12.821 ( -9.661 0.000 3.845) 10.398 12.988 ( -7.792 0.000 0.546) 7.811 13.012 ( 5.639 0.000 0.108) 5.640 13.052 ( 3.174 0.000 2.982) 4.355 15.066 ( -11.408 0.000 -1.404) 11.494 15.150 ( -2.284 0.000 1.573) 2.773 15.325 ( -1.633 0.000 1.093) 1.965 15.556 ( 4.324 0.000 -6.662) 7.942 15.690 ( 2.320 0.000 3.348) 4.073 15.693 ( 0.472 0.000 2.863) 2.902 15.789 ( -9.396 0.000 -3.189) 9.923 15.942 ( 11.861 0.000 -1.756) 11.991 21.223 ( -2.311 0.000 -0.174) 2.318 21.242 ( -4.574 0.000 -2.663) 5.293 22.577 ( -4.548 0.000 2.539) 5.209 22.678 ( 6.365 0.000 2.633) 6.888 ======================= Grid point 205 (93/170) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -28.352 0.000 1.520) 28.393 1.968 ( -18.471 0.000 -5.456) 19.260 2.450 ( 6.461 0.000 3.232) 7.225 2.551 ( 11.132 0.000 -3.042) 11.540 2.751 ( 7.067 0.000 2.224) 7.409 2.850 ( 3.104 0.000 8.365) 8.922 2.942 ( 9.853 0.000 -7.250) 12.233 3.076 ( -4.618 0.000 -3.037) 5.527 3.185 ( 6.801 0.000 1.394) 6.943 3.263 ( 5.311 0.000 6.634) 8.498 3.324 ( 2.783 0.000 -2.012) 3.434 3.382 ( 11.461 0.000 -7.669) 13.790 3.682 ( -15.422 0.000 0.048) 15.422 4.083 ( 4.324 0.000 -1.255) 4.503 4.527 ( -0.647 0.000 3.033) 3.102 4.602 ( 4.135 0.000 1.866) 4.537 4.676 ( -12.635 0.000 -5.588) 13.815 4.843 ( -34.734 0.000 0.071) 34.734 4.901 ( -5.596 0.000 -1.131) 5.709 5.359 ( -7.062 0.000 -8.469) 11.027 5.564 ( -19.615 0.000 0.201) 19.616 5.737 ( 13.162 0.000 11.446) 17.443 5.875 ( -6.352 0.000 -1.572) 6.544 6.270 ( 5.886 0.000 -2.046) 6.232 6.300 ( 3.020 0.000 1.701) 3.466 6.626 ( 4.791 0.000 2.502) 5.404 6.727 ( 0.582 0.000 -4.118) 4.159 6.749 ( 8.587 0.000 8.659) 12.195 7.207 ( -22.743 0.000 -11.884) 25.661 7.486 ( -1.522 0.000 4.875) 5.107 7.686 ( 1.826 0.000 -7.953) 8.160 7.918 ( 3.790 0.000 3.149) 4.928 8.237 ( 2.095 0.000 -1.272) 2.450 8.390 ( 8.646 0.000 -5.296) 10.139 8.947 ( -15.651 0.000 0.012) 15.651 9.336 ( 1.768 0.000 -0.293) 1.792 9.368 ( -8.904 0.000 3.179) 9.455 9.711 ( -2.499 0.000 6.696) 7.147 9.950 ( 8.744 0.000 8.171) 11.968 10.173 ( 9.827 0.000 -0.872) 9.865 10.423 ( -5.741 0.000 -3.363) 6.653 10.683 ( 4.473 0.000 -3.516) 5.689 11.214 ( 4.210 0.000 3.401) 5.412 11.569 ( 11.826 0.000 -3.153) 12.239 12.667 ( -13.274 0.000 1.286) 13.336 12.869 ( -8.429 0.000 1.805) 8.620 13.042 ( 0.366 0.000 -1.086) 1.145 13.120 ( 0.154 0.000 1.980) 1.986 14.848 ( -13.394 0.000 -0.824) 13.419 15.057 ( -10.297 0.000 2.361) 10.564 15.302 ( -5.711 0.000 3.796) 6.858 15.446 ( -6.552 0.000 -6.942) 9.545 15.594 ( -7.841 0.000 -4.933) 9.263 15.799 ( 7.768 0.000 1.319) 7.879 15.825 ( 8.400 0.000 2.594) 8.791 16.114 ( 10.083 0.000 -0.189) 10.084 21.089 ( -11.663 0.000 -1.254) 11.731 21.157 ( -6.071 0.000 0.733) 6.116 22.540 ( -2.088 0.000 0.467) 2.139 22.799 ( 6.045 0.000 0.748) 6.091 ======================= Grid point 206 (94/170) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( -25.518 0.000 18.924) 31.769 1.587 ( -25.075 0.000 -0.414) 25.078 2.568 ( -1.674 0.000 8.195) 8.365 2.675 ( 8.982 0.000 -7.477) 11.687 2.917 ( -9.068 0.000 -1.678) 9.221 2.923 ( 4.742 0.000 -1.262) 4.907 2.948 ( 6.982 0.000 0.010) 6.982 2.989 ( 9.339 0.000 -2.332) 9.626 3.222 ( -7.304 0.000 -0.734) 7.341 3.300 ( -1.953 0.000 -2.192) 2.936 3.378 ( -5.455 0.000 9.890) 11.295 3.487 ( 5.588 0.000 -6.975) 8.937 3.653 ( 12.905 0.000 15.921) 20.494 4.114 ( 3.275 0.000 -4.783) 5.797 4.354 ( -17.280 0.000 -1.354) 17.333 4.485 ( -11.153 0.000 0.098) 11.153 4.567 ( -0.760 0.000 5.360) 5.413 4.755 ( -10.753 0.000 0.563) 10.768 4.787 ( 12.263 0.000 1.687) 12.379 5.157 ( -10.606 0.000 -6.490) 12.434 5.284 ( -14.669 0.000 3.096) 14.992 5.771 ( -5.318 0.000 -1.231) 5.459 6.056 ( 13.750 0.000 7.014) 15.435 6.280 ( -2.987 0.000 -1.521) 3.352 6.334 ( 1.578 0.000 3.934) 4.238 6.519 ( -19.321 0.000 9.974) 21.743 6.712 ( -21.343 0.000 -11.153) 24.081 6.830 ( 10.958 0.000 3.056) 11.376 7.067 ( 12.948 0.000 2.676) 13.222 7.440 ( -6.151 0.000 -0.740) 6.195 7.552 ( -2.114 0.000 -15.317) 15.462 7.923 ( -5.209 0.000 0.363) 5.222 8.259 ( 1.806 0.000 -0.473) 1.867 8.454 ( 5.697 0.000 -4.213) 7.086 8.673 ( -19.667 0.000 2.398) 19.812 9.302 ( -2.624 0.000 3.100) 4.061 9.374 ( 4.858 0.000 -0.983) 4.956 9.744 ( -3.972 0.000 6.376) 7.512 10.152 ( -3.880 0.000 6.742) 7.779 10.303 ( 7.569 0.000 -6.352) 9.881 10.346 ( 13.990 0.000 -5.094) 14.888 10.775 ( 9.533 0.000 1.473) 9.646 11.333 ( 6.827 0.000 1.678) 7.031 11.715 ( 9.917 0.000 -1.673) 10.058 12.457 ( -13.430 0.000 0.034) 13.430 12.759 ( -8.330 0.000 0.832) 8.372 13.011 ( -2.296 0.000 -1.667) 2.838 13.086 ( -5.150 0.000 -0.845) 5.219 14.658 ( -10.778 0.000 1.886) 10.941 14.908 ( -10.908 0.000 1.495) 11.010 15.237 ( -9.672 0.000 7.303) 12.119 15.239 ( -9.575 0.000 -6.241) 11.429 15.445 ( -3.473 0.000 -5.655) 6.636 15.926 ( 6.672 0.000 0.366) 6.682 15.985 ( 8.039 0.000 2.039) 8.294 16.236 ( 6.517 0.000 -1.504) 6.688 20.871 ( -15.048 0.000 0.970) 15.079 21.061 ( -7.115 0.000 1.279) 7.229 22.522 ( -0.273 0.000 -0.524) 0.591 22.873 ( 4.120 0.000 -2.101) 4.625 ======================= Grid point 207 (95/170) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.175 ( -18.469 0.000 26.955) 32.675 1.226 ( -26.142 0.000 11.931) 28.736 2.390 ( -43.322 0.000 30.676) 53.083 2.657 ( 1.632 0.000 -10.611) 10.736 2.822 ( 0.054 0.000 3.795) 3.795 2.874 ( 0.009 0.000 -4.454) 4.454 3.062 ( 12.196 0.000 -3.262) 12.625 3.085 ( -4.174 0.000 -8.879) 9.811 3.187 ( -3.932 0.000 -5.460) 6.728 3.361 ( 24.746 0.000 5.360) 25.320 3.439 ( 4.563 0.000 6.515) 7.954 3.621 ( 8.072 0.000 3.723) 8.889 4.001 ( 3.800 0.000 15.146) 15.615 4.086 ( 4.961 0.000 -8.050) 9.456 4.146 ( -10.393 0.000 6.104) 12.053 4.378 ( 0.386 0.000 -7.389) 7.399 4.530 ( -3.689 0.000 -5.634) 6.734 4.734 ( -6.157 0.000 22.197) 23.035 4.887 ( -13.872 0.000 -2.392) 14.077 5.031 ( 14.613 0.000 2.767) 14.872 5.195 ( -4.664 0.000 4.901) 6.765 5.643 ( -9.615 0.000 -2.927) 10.051 6.154 ( -6.258 0.000 -2.557) 6.760 6.189 ( -25.500 0.000 0.602) 25.507 6.346 ( 1.401 0.000 2.459) 2.831 6.390 ( 11.330 0.000 -1.879) 11.485 6.436 ( -11.054 0.000 4.141) 11.804 7.091 ( -8.914 0.000 -1.387) 9.021 7.103 ( 12.383 0.000 10.768) 16.410 7.283 ( -8.737 0.000 -16.423) 18.602 7.402 ( 2.706 0.000 -0.025) 2.706 7.814 ( -2.299 0.000 -5.583) 6.037 8.281 ( 1.351 0.000 0.026) 1.351 8.438 ( -14.469 0.000 5.769) 15.577 8.492 ( 1.899 0.000 1.908) 2.692 9.344 ( 1.852 0.000 4.041) 4.445 9.456 ( 7.353 0.000 -3.487) 8.138 9.699 ( -4.553 0.000 -2.268) 5.087 9.933 ( -12.237 0.000 -11.306) 16.660 10.464 ( 11.867 0.000 -10.915) 16.123 10.554 ( 13.237 0.000 9.318) 16.188 10.991 ( 11.694 0.000 4.953) 12.700 11.461 ( 7.760 0.000 0.644) 7.787 11.843 ( 7.817 0.000 -0.258) 7.821 12.267 ( -11.104 0.000 1.067) 11.155 12.572 ( -13.769 0.000 -6.017) 15.026 12.930 ( -6.508 0.000 -1.998) 6.807 12.957 ( -5.614 0.000 -4.762) 7.361 14.562 ( -5.779 0.000 3.333) 6.671 14.759 ( -9.008 0.000 0.467) 9.020 15.062 ( -6.162 0.000 0.505) 6.183 15.178 ( -9.813 0.000 10.700) 14.518 15.358 ( 0.333 0.000 -6.099) 6.108 16.001 ( 3.263 0.000 -1.771) 3.713 16.109 ( 5.065 0.000 1.649) 5.326 16.288 ( 4.027 0.000 -3.505) 5.338 20.666 ( -13.394 0.000 3.665) 13.886 20.970 ( -6.070 0.000 1.085) 6.166 22.519 ( 0.544 0.000 -0.348) 0.646 22.882 ( 2.090 0.000 -4.921) 5.347 ======================= Grid point 208 (96/170) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( -12.338 0.000 28.253) 30.829 1.168 ( -18.413 0.000 25.801) 31.697 2.278 ( -25.597 0.000 53.975) 59.737 2.503 ( -3.043 0.000 -14.343) 14.662 2.830 ( -4.231 0.000 -16.708) 17.235 2.838 ( 1.659 0.000 -4.237) 4.550 2.900 ( 1.089 0.000 1.399) 1.773 3.104 ( -2.990 0.000 -1.555) 3.370 3.228 ( 11.045 0.000 -2.954) 11.434 3.583 ( 5.391 0.000 -0.224) 5.396 3.786 ( 16.648 0.000 4.443) 17.231 3.794 ( 1.711 0.000 11.218) 11.348 4.002 ( 5.301 0.000 -6.461) 8.357 4.179 ( 1.935 0.000 0.827) 2.104 4.254 ( 6.635 0.000 16.666) 17.939 4.330 ( 6.573 0.000 -7.115) 9.686 4.421 ( -1.746 0.000 -6.335) 6.572 4.705 ( -4.529 0.000 -1.563) 4.791 4.965 ( -9.084 0.000 32.975) 34.203 5.216 ( -2.470 0.000 9.395) 9.714 5.250 ( 10.241 0.000 -2.190) 10.473 5.429 ( -8.544 0.000 -5.082) 9.941 5.853 ( -18.358 0.000 5.779) 19.246 5.937 ( -15.554 0.000 -6.599) 16.896 6.174 ( -9.660 0.000 -8.936) 13.159 6.392 ( -4.838 0.000 8.871) 10.104 6.614 ( 13.978 0.000 -4.916) 14.818 6.952 ( -3.277 0.000 -1.997) 3.838 6.980 ( -6.215 0.000 -10.645) 12.327 7.294 ( -2.563 0.000 1.427) 2.934 7.439 ( 0.058 0.000 3.332) 3.332 7.839 ( 13.107 0.000 -6.784) 14.758 8.280 ( -3.320 0.000 1.068) 3.487 8.379 ( -1.865 0.000 7.455) 7.684 8.530 ( -4.343 0.000 1.963) 4.766 9.417 ( 0.728 0.000 4.449) 4.508 9.436 ( -6.637 0.000 -12.827) 14.443 9.575 ( 0.858 0.000 -5.762) 5.826 9.696 ( 4.011 0.000 -6.573) 7.700 10.465 ( 4.841 0.000 -13.589) 14.426 10.851 ( 8.616 0.000 11.279) 14.194 11.211 ( 9.949 0.000 3.122) 10.427 11.578 ( 4.934 0.000 1.366) 5.120 11.946 ( 6.139 0.000 -3.125) 6.889 12.151 ( -7.414 0.000 6.287) 9.721 12.235 ( -20.188 0.000 2.018) 20.288 12.753 ( -7.568 0.000 -6.385) 9.902 12.840 ( -3.169 0.000 -5.978) 6.766 14.509 ( -3.766 0.000 0.888) 3.870 14.646 ( -5.232 0.000 -0.517) 5.258 15.098 ( 4.496 0.000 3.827) 5.904 15.171 ( -7.782 0.000 12.841) 15.015 15.317 ( 2.562 0.000 -5.014) 5.631 15.981 ( 0.082 0.000 -5.852) 5.853 16.181 ( 1.901 0.000 1.538) 2.445 16.302 ( 3.001 0.000 -3.621) 4.703 20.552 ( -7.453 0.000 6.064) 9.608 20.885 ( -4.849 0.000 -1.355) 5.035 22.531 ( 0.713 0.000 0.642) 0.959 22.838 ( 0.729 0.000 -6.767) 6.806 ======================= Grid point 209 (97/170) ======================= q-point: ( 0.00 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( -1.678 13.650 22.344) 26.237 1.644 ( -1.046 14.143 26.738) 30.266 2.320 ( -1.486 3.442 -18.357) 18.736 2.598 ( -0.056 3.467 -18.187) 18.515 2.785 ( -0.592 3.335 8.590) 9.233 2.885 ( -3.134 4.048 0.452) 5.139 2.987 ( -5.031 2.569 13.801) 14.912 3.022 ( 10.262 3.240 17.515) 20.557 3.244 ( -1.192 -3.138 -3.529) 4.870 3.534 ( 0.478 -5.760 0.565) 5.807 3.706 ( 2.086 -13.349 4.136) 14.130 3.730 ( -3.724 -8.750 -7.107) 11.872 4.134 ( -0.772 -10.298 -2.749) 10.686 4.213 ( 3.098 7.178 0.401) 7.828 4.252 ( 2.329 8.454 6.942) 11.184 4.448 ( 1.287 11.674 -3.379) 12.221 4.657 ( 5.451 -0.129 9.005) 10.527 4.834 ( -3.203 12.017 -2.492) 12.684 5.142 ( -12.917 4.286 13.678) 19.295 5.230 ( -3.254 2.501 5.865) 7.158 5.375 ( 0.663 -0.510 11.840) 11.869 5.402 ( 6.123 9.747 -9.890) 15.176 5.840 ( 6.656 4.492 5.990) 10.017 5.953 ( -4.909 7.262 0.742) 8.797 5.987 ( -3.777 7.117 -5.723) 9.883 6.382 ( 1.415 -2.642 8.194) 8.725 6.684 ( 6.948 0.812 -5.414) 8.846 6.959 ( -1.218 6.208 -9.137) 11.113 7.088 ( 2.461 9.052 3.760) 10.106 7.352 ( -3.388 17.691 -7.022) 19.333 7.585 ( 1.331 4.711 5.053) 7.035 7.797 ( 1.941 -4.341 -3.054) 5.652 8.229 ( 0.435 -2.666 1.511) 3.095 8.367 ( 0.245 -1.567 6.113) 6.315 8.646 ( -4.620 11.144 -5.408) 13.220 9.133 ( -4.346 1.318 -17.036) 17.631 9.408 ( -6.262 -2.451 2.293) 7.104 9.570 ( 5.579 -7.023 -4.254) 9.927 9.830 ( 11.960 1.594 4.589) 12.909 10.337 ( -6.532 2.734 -16.433) 17.894 10.942 ( -3.204 -7.419 11.614) 14.149 11.305 ( 6.232 -4.523 -1.915) 7.935 11.580 ( -3.244 -3.305 3.477) 5.791 11.890 ( 0.269 -4.287 -7.232) 8.411 12.066 ( -3.747 -1.349 14.455) 14.993 12.274 ( 1.472 2.401 12.806) 13.112 12.601 ( 0.843 -0.138 -9.654) 9.692 12.737 ( -0.909 1.157 -8.249) 8.379 14.601 ( 0.779 10.070 3.294) 10.623 14.737 ( -1.758 11.224 -3.943) 12.025 15.180 ( -2.252 1.522 3.247) 4.235 15.222 ( 0.154 3.166 -0.474) 3.205 15.341 ( 3.033 -1.903 8.773) 9.476 15.918 ( 1.831 0.916 -10.451) 10.649 16.188 ( -0.548 -1.595 1.637) 2.351 16.285 ( 0.618 -1.580 -3.105) 3.538 20.601 ( 1.452 3.324 6.493) 7.437 20.801 ( -2.192 0.992 -2.590) 3.535 22.528 ( 0.254 -2.488 2.028) 3.220 22.742 ( -0.102 -2.110 -7.564) 7.854 ======================= Grid point 210 (98/170) ======================= q-point: ( 0.09 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( 6.599 7.611 21.219) 23.489 1.971 ( 6.439 4.482 23.274) 24.560 2.126 ( 2.941 2.419 -16.603) 17.034 2.414 ( 3.926 10.240 -20.304) 23.077 2.783 ( -3.330 3.463 -1.820) 5.137 2.817 ( -1.605 0.216 -3.700) 4.039 3.016 ( -3.840 -8.237 6.998) 11.470 3.142 ( -5.167 -4.854 -1.218) 7.193 3.459 ( -0.967 5.554 19.743) 20.532 3.534 ( 1.656 -5.605 1.074) 5.942 3.597 ( -0.892 -5.397 -1.006) 5.562 3.793 ( 4.193 -13.960 -0.830) 14.600 4.094 ( -1.960 1.160 1.496) 2.725 4.180 ( -2.165 4.821 -0.315) 5.294 4.297 ( 1.981 12.587 -3.507) 13.216 4.388 ( -9.604 8.214 -1.245) 12.699 4.668 ( -1.954 9.348 0.997) 9.602 4.823 ( -5.541 2.719 -0.734) 6.215 5.039 ( -1.332 2.708 6.860) 7.495 5.256 ( 3.447 7.892 -4.001) 9.496 5.498 ( 4.925 1.164 5.160) 7.227 5.541 ( 2.814 -2.431 5.022) 6.249 5.845 ( 2.727 9.997 3.522) 10.944 6.027 ( 5.181 1.810 5.790) 7.977 6.152 ( 11.877 2.402 6.271) 13.644 6.484 ( 4.754 -4.426 -7.743) 10.107 6.803 ( 9.803 4.451 4.130) 11.531 6.834 ( 6.953 5.605 -13.353) 16.065 7.139 ( -1.868 12.460 1.510) 12.690 7.227 ( -1.702 18.009 -4.058) 18.539 7.580 ( -7.554 -1.306 2.456) 8.050 7.811 ( 5.155 5.112 -5.223) 8.944 8.298 ( 2.839 -1.542 3.568) 4.813 8.360 ( -0.001 0.827 -1.890) 2.063 8.706 ( 5.967 2.200 13.025) 14.495 8.935 ( 2.296 3.327 -13.983) 14.555 9.328 ( -7.872 -6.660 3.134) 10.777 9.599 ( 2.918 -2.981 -3.307) 5.323 9.980 ( -11.281 1.077 -12.876) 17.152 10.035 ( 1.747 3.235 3.537) 5.101 10.966 ( -7.866 -6.656 10.052) 14.395 11.250 ( -5.487 -3.936 -10.269) 12.290 11.567 ( -5.816 -4.418 10.234) 12.573 11.744 ( -7.463 -3.523 -6.135) 10.283 12.308 ( 11.564 -1.601 11.835) 16.624 12.461 ( 5.228 0.890 9.856) 11.192 12.574 ( 7.876 0.544 -8.594) 11.670 12.653 ( 3.601 2.165 -10.013) 10.859 14.667 ( 2.035 9.102 2.129) 9.567 14.697 ( 2.186 10.149 -1.473) 10.485 15.163 ( -1.565 0.817 0.129) 1.770 15.210 ( 0.056 3.044 -0.593) 3.102 15.530 ( 5.025 -1.139 12.697) 13.702 15.834 ( 3.834 0.960 -12.882) 13.474 16.166 ( -4.710 -1.738 1.585) 5.265 16.242 ( -1.964 -2.522 -2.537) 4.081 20.740 ( 6.453 2.396 4.847) 8.418 20.790 ( 5.278 1.105 -2.348) 5.882 22.553 ( -1.057 -2.979 3.394) 4.638 22.656 ( -0.617 -1.992 -6.567) 6.890 ======================= Grid point 211 (99/170) ======================= q-point: ( 0.18 0.12 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 6.947 3.714 -13.671) 15.778 2.059 ( 3.901 3.978 17.048) 17.935 2.259 ( 4.377 13.868 -20.305) 24.976 2.364 ( 9.155 0.065 19.057) 21.142 2.700 ( -5.367 -0.579 -1.661) 5.648 2.751 ( -1.015 4.589 3.091) 5.625 3.019 ( -3.992 -8.592 -1.134) 9.541 3.092 ( -0.542 -8.638 2.438) 8.992 3.380 ( -9.070 -6.840 -7.113) 13.403 3.451 ( -10.269 -5.025 5.652) 12.753 3.657 ( -10.304 -3.478 2.389) 11.135 3.746 ( -4.938 -2.069 -6.774) 8.635 4.152 ( 3.433 1.394 5.652) 6.758 4.173 ( 5.469 1.792 -2.861) 6.427 4.298 ( 4.875 6.310 -0.195) 7.976 4.335 ( 6.640 10.690 -3.416) 13.040 4.644 ( -0.357 4.903 -8.075) 9.454 4.759 ( -0.705 7.961 5.683) 9.807 5.214 ( 7.527 5.093 13.442) 16.226 5.296 ( 9.982 6.244 -9.325) 15.019 5.456 ( -1.691 -0.470 -4.120) 4.478 5.684 ( 4.141 -1.599 8.521) 9.608 6.020 ( -5.728 0.878 5.614) 8.068 6.128 ( 10.327 -2.802 3.677) 11.315 6.339 ( -1.485 3.035 -16.391) 16.736 6.390 ( 8.803 3.218 1.154) 9.444 6.788 ( 10.616 4.866 -9.751) 15.214 7.000 ( 1.239 5.391 -1.028) 5.626 7.140 ( -1.553 5.823 1.179) 6.141 7.307 ( 5.700 8.214 8.290) 12.988 7.495 ( -1.003 5.591 5.071) 7.614 7.814 ( 6.354 8.827 -9.679) 14.559 8.283 ( -0.368 -0.533 -3.597) 3.655 8.368 ( -3.451 -8.283 -0.522) 8.988 8.895 ( 10.341 3.821 -6.268) 12.682 9.110 ( 15.344 -0.481 20.618) 25.706 9.223 ( -9.125 -5.193 1.001) 10.547 9.590 ( -0.407 3.697 -2.014) 4.229 9.659 ( -5.218 -0.512 -9.514) 10.863 10.099 ( -4.870 6.305 8.440) 11.606 10.922 ( -10.202 -4.812 5.560) 12.575 10.979 ( -11.394 -3.903 -10.332) 15.868 11.552 ( -7.035 -4.354 -6.375) 10.444 11.595 ( -6.210 -4.085 9.839) 12.331 12.569 ( 8.878 -0.738 -6.705) 11.150 12.606 ( 8.061 0.449 -3.080) 8.641 12.641 ( 9.700 0.023 7.018) 11.972 12.706 ( 7.187 2.348 3.783) 8.455 14.688 ( 3.038 4.713 -1.159) 5.726 14.798 ( 6.507 8.545 2.933) 11.134 15.155 ( 1.110 -0.363 -0.271) 1.199 15.222 ( 3.181 3.206 -1.607) 4.794 15.740 ( 5.225 -0.408 6.567) 8.402 15.760 ( 3.682 0.308 -8.892) 9.629 16.084 ( -7.385 -3.181 2.061) 8.301 16.167 ( -4.724 -3.150 -1.792) 5.955 20.839 ( 8.553 -0.991 -3.403) 9.258 20.951 ( 9.458 2.209 3.719) 10.401 22.545 ( -2.052 -3.614 -1.527) 4.427 22.608 ( -1.310 -1.381 1.951) 2.726 ======================= Grid point 212 (100/170) ======================= q-point: ( 0.27 0.12 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( 10.576 6.419 -9.618) 15.670 2.132 ( 6.276 10.375 -16.003) 20.078 2.274 ( 3.293 1.284 10.995) 11.549 2.610 ( 0.670 -0.387 9.361) 9.393 2.656 ( -2.622 -1.474 4.089) 5.076 2.798 ( -3.547 3.831 4.445) 6.856 2.942 ( 1.598 -6.752 0.359) 6.948 3.044 ( -14.727 -5.918 -2.920) 16.138 3.148 ( -6.487 -5.230 -2.521) 8.706 3.237 ( -15.298 -0.512 2.852) 15.570 3.535 ( -7.678 2.263 -4.997) 9.436 3.630 ( -5.766 -2.655 9.394) 11.337 4.188 ( 3.697 5.864 -11.654) 13.560 4.300 ( 7.473 -0.128 -5.576) 9.324 4.354 ( 9.835 -5.404 1.781) 11.362 4.499 ( 12.450 6.772 -0.249) 14.175 4.572 ( 9.234 0.575 -11.163) 14.498 4.871 ( 5.386 -0.752 3.454) 6.443 5.290 ( -3.072 3.532 -0.590) 4.718 5.323 ( 7.530 6.799 -11.440) 15.291 5.648 ( 14.291 0.441 3.978) 14.841 5.809 ( 1.869 -1.697 -16.900) 17.088 5.855 ( -0.701 -1.161 10.103) 10.193 6.152 ( -5.994 8.934 -6.053) 12.344 6.324 ( 6.726 2.856 6.847) 10.014 6.471 ( -0.157 -7.408 2.211) 7.732 6.835 ( -1.284 -0.028 -2.925) 3.195 6.981 ( -11.044 -1.599 -5.699) 12.530 7.060 ( 4.724 5.107 4.187) 8.119 7.366 ( -1.231 8.558 4.749) 9.865 7.701 ( 11.963 5.244 -3.969) 13.652 7.856 ( 10.140 8.993 -1.434) 13.629 8.228 ( -5.107 -10.626 -6.469) 13.448 8.258 ( -0.881 -3.269 -2.048) 3.957 9.049 ( 13.541 5.848 -1.461) 14.823 9.091 ( -6.299 -1.009 1.498) 6.553 9.490 ( -0.520 3.806 2.017) 4.339 9.551 ( 4.718 2.214 12.534) 13.574 9.751 ( 14.372 -1.517 6.800) 15.971 10.093 ( -5.434 7.507 6.860) 11.530 10.638 ( -13.675 -3.776 -10.491) 17.644 10.808 ( -12.809 -2.087 2.079) 13.144 11.404 ( -3.066 -4.135 -4.995) 7.173 11.572 ( -8.632 -3.032 6.406) 11.169 12.604 ( 9.047 2.439 -7.555) 12.036 12.713 ( 9.035 -2.862 -2.317) 9.756 12.843 ( 3.424 3.061 6.857) 8.253 12.891 ( 7.721 -1.065 7.209) 10.617 14.749 ( 5.884 0.106 -0.730) 5.930 14.944 ( 8.220 4.819 2.313) 9.805 15.194 ( 3.997 -0.795 -0.207) 4.081 15.278 ( 6.385 2.305 -1.822) 7.029 15.696 ( 3.317 -0.491 -10.025) 10.571 15.830 ( -2.850 -2.614 1.132) 4.029 16.024 ( -6.676 -3.101 5.578) 9.236 16.065 ( -3.855 -1.793 -0.477) 4.279 20.951 ( 9.785 -3.126 -3.079) 10.723 21.114 ( 7.759 -0.225 0.628) 7.787 22.497 ( -0.859 -2.334 -1.589) 2.951 22.623 ( -3.165 -1.653 6.141) 7.104 ======================= Grid point 213 (101/170) ======================= q-point: ( 0.36 0.12 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( 10.240 5.629 -8.092) 14.214 2.121 ( 9.608 4.816 -8.230) 13.537 2.357 ( -5.177 1.370 3.931) 6.643 2.627 ( -3.846 -0.415 -0.998) 3.995 2.671 ( -2.872 -3.072 3.500) 5.472 2.732 ( -5.218 -0.124 3.871) 6.499 2.821 ( -1.722 -0.856 0.440) 1.973 2.972 ( -16.356 4.079 5.042) 17.594 3.020 ( -0.923 2.026 1.553) 2.715 3.156 ( -3.027 -8.003 2.670) 8.963 3.419 ( 0.911 1.356 -2.237) 2.770 3.640 ( -8.422 -3.762 8.573) 12.593 4.105 ( 4.794 2.962 -13.639) 14.757 4.215 ( -2.977 3.965 -11.432) 12.461 4.537 ( 7.454 0.396 0.563) 7.485 4.634 ( 5.111 3.758 2.547) 6.837 4.825 ( 30.187 -6.241 -10.527) 32.573 4.933 ( 6.973 -8.714 -6.486) 12.908 5.222 ( 2.164 -0.484 -7.328) 7.657 5.292 ( -0.732 4.814 -5.170) 7.101 5.623 ( 9.338 4.137 -12.854) 16.417 5.861 ( 2.100 -0.606 3.215) 3.888 5.939 ( -1.539 3.680 -2.415) 4.663 6.055 ( -0.375 2.395 2.726) 3.648 6.327 ( -18.597 -16.127 1.128) 24.641 6.615 ( 4.750 -2.819 4.951) 7.418 6.648 ( -7.795 -3.686 -1.832) 8.815 6.871 ( 6.339 5.258 -0.827) 8.277 7.149 ( -2.426 2.005 4.169) 5.224 7.373 ( -2.413 7.364 3.170) 8.372 7.775 ( 9.790 6.030 -9.248) 14.756 8.019 ( 6.139 3.746 2.185) 7.516 8.076 ( -2.775 -12.100 -5.824) 13.712 8.261 ( 2.126 -0.192 -1.776) 2.776 9.073 ( -2.673 0.329 8.341) 8.765 9.272 ( 14.756 10.374 -1.945) 18.142 9.416 ( -4.912 4.903 0.228) 6.944 9.788 ( 5.610 3.662 7.767) 10.257 10.017 ( 2.297 1.283 8.734) 9.122 10.108 ( 2.130 0.283 -0.706) 2.262 10.374 ( -4.765 1.273 -3.232) 5.897 10.604 ( -13.858 -2.347 1.774) 14.167 11.341 ( 0.725 -2.888 -3.908) 4.914 11.462 ( -10.995 -1.781 2.013) 11.319 12.701 ( 10.310 1.028 -2.826) 10.739 12.828 ( 5.282 -2.345 1.600) 5.997 12.939 ( 1.437 3.436 4.395) 5.761 13.045 ( 2.524 -0.712 5.685) 6.261 14.853 ( 8.524 -4.122 -1.031) 9.524 15.092 ( 7.245 1.445 1.072) 7.465 15.259 ( 3.252 -3.307 0.624) 4.680 15.377 ( 7.374 0.521 -0.401) 7.403 15.633 ( -0.554 -2.818 -5.746) 6.424 15.750 ( -4.556 -2.230 -1.449) 5.275 15.919 ( -4.803 -2.873 -2.424) 6.100 16.067 ( -3.609 2.087 4.059) 5.818 21.062 ( 7.611 -6.168 -2.335) 10.070 21.203 ( 4.727 -3.592 -2.211) 6.335 22.497 ( 1.501 -0.729 1.028) 1.960 22.633 ( -4.612 -1.125 6.539) 8.081 ======================= Grid point 214 (102/170) ======================= q-point: ( 0.45 0.12 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( 2.709 1.089 -0.782) 3.023 2.223 ( 8.905 2.210 -2.345) 9.470 2.242 ( -4.617 2.649 -0.136) 5.325 2.540 ( 3.029 -1.715 -10.468) 11.031 2.634 ( -6.973 2.876 1.028) 7.612 2.786 ( -4.167 0.415 10.207) 11.033 2.802 ( -5.447 2.665 8.276) 10.260 2.900 ( 5.154 -0.627 -0.115) 5.193 2.981 ( -0.895 0.028 -1.021) 1.359 3.126 ( -3.385 -5.643 1.227) 6.694 3.474 ( 5.964 -0.222 -2.944) 6.655 3.513 ( -11.300 -1.713 -2.449) 11.688 3.967 ( -2.372 -2.846 -13.646) 14.140 4.085 ( 4.369 2.384 -13.610) 14.492 4.574 ( 0.064 5.297 -0.402) 5.312 4.687 ( -1.712 7.912 0.533) 8.112 4.943 ( 9.042 -3.643 -6.381) 11.651 5.123 ( -1.737 -4.240 -9.272) 10.342 5.190 ( 10.109 -2.959 3.735) 11.176 5.441 ( 25.327 -0.839 0.989) 25.361 5.660 ( -1.519 -4.229 -5.751) 7.299 5.789 ( -3.809 3.513 -1.142) 5.306 6.004 ( -8.763 -8.278 -0.207) 12.056 6.008 ( -0.388 -7.913 2.493) 8.305 6.086 ( -1.390 -1.521 -0.355) 2.091 6.325 ( -16.862 -2.719 -2.141) 17.214 6.659 ( -0.493 -6.405 -6.193) 8.923 7.050 ( -4.598 0.002 -7.996) 9.224 7.215 ( 14.604 3.497 14.211) 20.675 7.401 ( -2.151 6.386 9.566) 11.701 7.818 ( 5.541 3.058 -4.978) 8.052 7.975 ( -1.368 -2.497 -6.753) 7.329 8.117 ( 3.270 -1.073 0.468) 3.473 8.252 ( 0.818 -2.142 -4.785) 5.305 9.160 ( 1.187 2.010 8.069) 8.400 9.314 ( -3.040 7.296 -1.431) 8.032 9.487 ( 8.558 1.932 1.604) 8.919 9.774 ( -8.497 5.588 -2.607) 10.499 10.018 ( -7.897 9.344 2.665) 12.521 10.134 ( 5.828 1.833 -2.911) 6.768 10.455 ( 3.438 -2.106 5.107) 6.507 10.503 ( -0.875 -0.654 6.822) 6.909 11.276 ( -10.627 -1.694 0.629) 10.780 11.351 ( 4.028 -1.686 -4.804) 6.492 12.842 ( 8.249 -1.006 0.124) 8.311 12.877 ( -2.864 -1.366 3.230) 4.528 13.012 ( 2.970 3.583 3.199) 5.648 13.095 ( -2.163 0.828 3.442) 4.149 14.992 ( 10.199 -6.610 -0.861) 12.184 15.124 ( -5.343 -3.345 0.375) 6.315 15.328 ( 5.263 -3.179 0.155) 6.150 15.486 ( 5.392 -0.953 -1.386) 5.649 15.531 ( -6.344 -8.238 0.245) 10.401 15.702 ( -0.797 -0.784 -0.371) 1.178 15.876 ( 4.659 2.627 -3.710) 6.510 16.006 ( -7.144 3.650 0.582) 8.043 21.129 ( 3.395 -8.238 -1.338) 9.010 21.217 ( 0.909 -6.738 -3.311) 7.563 22.566 ( 4.309 0.327 2.801) 5.149 22.618 ( -5.374 -0.212 5.078) 7.397 ======================= Grid point 215 (103/170) ======================= q-point: (-0.45 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( -18.245 3.045 -0.264) 18.500 2.234 ( -5.540 -0.741 -2.350) 6.064 2.343 ( 6.928 0.249 -2.027) 7.223 2.538 ( -3.350 4.355 2.964) 6.243 2.580 ( 15.406 1.346 -6.232) 16.673 2.762 ( -5.073 1.452 9.106) 10.524 2.875 ( 4.808 0.856 -4.757) 6.818 3.027 ( 5.730 -3.132 9.393) 11.440 3.044 ( 7.502 -1.754 0.181) 7.707 3.093 ( -1.797 -3.848 1.537) 4.517 3.331 ( -3.013 -0.915 -6.343) 7.082 3.470 ( 6.220 2.187 -14.917) 16.309 3.825 ( -4.867 -4.593 -3.038) 7.349 4.004 ( 3.720 -1.864 -10.272) 11.083 4.583 ( -3.641 6.136 2.256) 7.483 4.644 ( -0.097 8.673 0.840) 8.714 4.875 ( -13.822 -5.547 -3.277) 15.249 5.047 ( 3.891 5.926 -2.734) 7.598 5.306 ( -29.192 -12.003 -2.364) 31.652 5.433 ( 9.781 -0.153 6.592) 11.796 5.668 ( -8.337 6.747 -3.810) 11.381 5.747 ( -1.726 -4.239 -1.804) 4.920 5.952 ( 4.067 -6.662 4.886) 9.209 6.069 ( 10.694 -9.001 -4.109) 14.570 6.086 ( 1.117 -6.492 0.318) 6.595 6.299 ( 14.267 6.621 -1.737) 15.824 6.588 ( -4.455 -8.534 4.885) 10.795 6.873 ( -2.872 -0.360 -11.304) 11.669 7.395 ( -4.343 -0.272 9.843) 10.762 7.604 ( 7.595 1.162 7.653) 10.845 7.772 ( -11.083 7.240 -4.918) 14.122 7.885 ( 6.870 2.663 -7.117) 10.244 8.158 ( 3.067 -3.365 -1.100) 4.684 8.199 ( 0.495 -7.508 -5.852) 9.532 9.223 ( -2.550 3.993 1.942) 5.121 9.299 ( 2.563 0.913 1.913) 3.326 9.526 ( -8.930 6.054 -0.127) 10.790 9.690 ( 5.098 1.625 -0.290) 5.358 9.912 ( -8.931 9.531 6.074) 14.405 10.188 ( 5.095 6.840 -2.135) 8.793 10.485 ( -4.280 -0.683 4.501) 6.248 10.638 ( 6.007 -0.264 0.360) 6.024 11.157 ( -4.359 -1.225 2.825) 5.337 11.410 ( 9.509 -2.242 -4.391) 10.711 12.810 ( -8.822 -0.301 2.347) 9.134 12.919 ( -1.048 -2.964 0.701) 3.221 13.069 ( -1.376 1.891 1.694) 2.888 13.105 ( 2.203 3.716 2.773) 5.133 14.977 ( -10.480 -5.955 -0.424) 12.061 15.130 ( 3.715 -2.751 -0.046) 4.623 15.342 ( -3.034 -2.050 -0.482) 3.693 15.435 ( -0.272 -9.025 0.894) 9.073 15.580 ( -0.408 -1.377 -0.797) 1.642 15.693 ( 4.041 -4.116 -1.753) 6.029 15.878 ( -6.711 3.866 -0.918) 7.799 15.981 ( 9.486 4.676 -0.432) 10.585 21.142 ( -0.793 -7.524 -0.177) 7.568 21.158 ( -3.783 -7.667 -2.792) 8.994 22.579 ( -4.823 0.239 2.746) 5.555 22.680 ( 5.834 0.103 2.613) 6.394 ======================= Grid point 216 (104/170) ======================= q-point: (-0.36 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -25.090 7.249 2.614) 26.247 2.006 ( -15.892 2.527 -4.047) 16.592 2.451 ( 8.365 -0.665 -0.098) 8.392 2.581 ( 8.426 2.340 -2.950) 9.229 2.754 ( 6.052 -0.575 2.914) 6.742 2.885 ( 4.891 3.071 7.084) 9.140 2.952 ( 10.291 0.720 -3.687) 10.955 3.028 ( -3.267 -3.674 -2.133) 5.359 3.156 ( 4.926 -3.928 1.105) 6.396 3.246 ( 7.951 -0.195 2.629) 8.377 3.305 ( 6.789 -1.127 0.129) 6.883 3.441 ( 8.602 4.412 -6.856) 11.852 3.683 ( -12.332 1.317 -0.497) 12.412 4.003 ( 4.159 -6.567 -2.877) 8.289 4.498 ( -8.478 -2.421 -0.411) 8.826 4.565 ( -18.154 -6.379 0.577) 19.250 4.726 ( 0.895 5.793 2.645) 6.431 4.791 ( -23.548 -1.183 -1.287) 23.613 5.033 ( -4.804 9.533 -3.483) 11.229 5.482 ( -6.422 9.507 -6.514) 13.193 5.504 ( -10.667 -3.393 1.612) 11.309 5.750 ( 5.548 -0.415 6.867) 8.838 5.954 ( -2.360 6.320 1.654) 6.946 6.193 ( 7.363 -9.391 2.674) 12.229 6.239 ( 5.109 -2.829 -3.400) 6.758 6.399 ( 5.794 -13.189 -0.296) 14.409 6.709 ( -4.419 -5.013 0.128) 6.684 6.813 ( 15.851 5.230 4.788) 17.364 7.322 ( -14.068 -0.400 -9.340) 16.891 7.470 ( -9.000 6.420 2.242) 11.280 7.734 ( 3.288 3.473 -4.186) 6.356 7.952 ( 2.375 -0.310 1.108) 2.639 8.137 ( -0.670 -9.737 -4.962) 10.949 8.201 ( 3.140 -2.739 -0.253) 4.174 9.150 ( -10.988 4.938 1.130) 12.100 9.345 ( -6.966 1.468 -2.038) 7.405 9.374 ( 3.242 4.653 1.630) 5.900 9.800 ( 2.845 5.923 4.065) 7.727 9.909 ( -0.199 0.344 7.902) 7.912 10.289 ( 8.708 8.243 1.918) 12.143 10.406 ( -6.756 -0.819 -2.835) 7.372 10.682 ( 4.194 0.096 -4.028) 5.816 11.210 ( 4.705 -0.580 3.783) 6.065 11.538 ( 11.060 -2.951 -2.690) 11.759 12.657 ( -12.506 -0.212 0.882) 12.539 12.839 ( -9.250 -1.790 1.588) 9.555 13.061 ( -0.948 0.895 -0.448) 1.378 13.149 ( -0.770 2.061 1.512) 2.669 14.807 ( -9.769 -2.712 -0.434) 10.148 15.069 ( -8.885 0.114 1.667) 9.041 15.321 ( -4.252 1.040 2.384) 4.985 15.448 ( 0.554 -4.491 -5.517) 7.135 15.472 ( -7.161 -3.742 -0.967) 8.137 15.722 ( 1.873 -2.430 -0.638) 3.134 15.889 ( 8.135 -1.382 0.549) 8.270 16.126 ( 8.048 2.564 0.385) 8.456 21.027 ( -9.105 -5.738 -1.527) 10.870 21.120 ( -2.990 -3.921 1.045) 5.040 22.534 ( -3.018 -0.340 0.636) 3.103 22.790 ( 5.426 -0.823 0.665) 5.528 ======================= Grid point 217 (105/170) ======================= q-point: (-0.27 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( -20.056 13.286 17.656) 29.841 1.702 ( -19.684 8.571 1.504) 21.522 2.579 ( 5.505 -0.807 2.242) 5.999 2.683 ( 9.796 0.426 -7.398) 12.283 2.901 ( 2.802 -1.184 1.255) 3.290 2.933 ( -2.173 -0.654 -1.991) 3.019 2.966 ( 8.607 0.167 -1.921) 8.820 3.036 ( 3.563 5.536 -3.470) 7.442 3.237 ( 3.878 -2.952 -1.560) 5.118 3.312 ( -1.432 2.203 -3.788) 4.611 3.366 ( -22.096 2.982 10.204) 24.520 3.513 ( 10.470 2.414 -1.936) 10.917 3.661 ( 11.297 0.960 17.929) 21.213 4.026 ( 2.337 -7.178 -3.839) 8.469 4.246 ( -18.660 -8.059 2.856) 20.525 4.358 ( -5.663 -5.562 -1.973) 8.179 4.661 ( -0.274 4.667 7.444) 8.791 4.807 ( 3.304 3.066 -5.533) 7.136 4.854 ( -7.030 7.524 -0.220) 10.299 5.246 ( -13.488 5.293 -3.761) 14.970 5.418 ( -4.852 12.009 0.899) 12.983 5.775 ( -4.585 0.059 -0.547) 4.618 6.088 ( 11.821 0.896 3.473) 12.353 6.176 ( -6.861 -3.266 0.853) 7.647 6.322 ( 1.080 -0.824 7.399) 7.523 6.486 ( -5.767 -8.358 5.002) 11.319 6.663 ( 2.047 -5.099 -0.325) 5.504 6.919 ( -9.357 6.844 -8.019) 14.096 7.149 ( 8.974 5.624 2.478) 10.877 7.378 ( -5.442 -1.207 -1.193) 5.700 7.688 ( 0.247 9.274 -8.573) 12.632 7.938 ( -5.595 -1.375 0.584) 5.791 8.088 ( 0.334 -11.206 -1.801) 11.355 8.235 ( 1.723 -2.041 -0.597) 2.737 8.908 ( -17.284 5.939 1.439) 18.332 9.307 ( 2.830 -5.077 -1.490) 6.000 9.445 ( 3.227 10.904 0.908) 11.408 9.827 ( -4.713 6.997 4.327) 9.482 10.074 ( 6.309 -6.114 8.154) 11.986 10.223 ( -4.464 -3.235 -10.595) 11.943 10.483 ( 11.985 8.707 0.606) 14.826 10.746 ( 8.377 -2.646 -0.266) 8.789 11.339 ( 7.610 0.198 0.928) 7.669 11.680 ( 9.297 -3.525 -1.134) 10.007 12.457 ( -13.257 0.327 0.604) 13.275 12.679 ( -13.293 -4.562 1.129) 14.099 13.019 ( -3.350 0.192 -1.104) 3.533 13.103 ( -5.041 1.094 -1.494) 5.371 14.675 ( -7.455 1.543 1.337) 7.730 14.963 ( -6.116 4.008 1.938) 7.564 15.253 ( -9.878 1.652 6.774) 12.091 15.264 ( -9.487 2.199 -5.544) 11.206 15.392 ( -2.718 -3.767 -4.801) 6.681 15.827 ( 8.949 -5.883 1.041) 10.760 16.032 ( 8.067 -0.585 0.298) 8.094 16.225 ( 5.015 0.028 -1.352) 5.194 20.850 ( -12.136 -1.888 0.477) 12.291 21.076 ( -4.244 0.277 1.310) 4.450 22.503 ( -0.968 -1.413 -0.475) 1.777 22.856 ( 3.851 -1.585 -2.203) 4.711 ======================= Grid point 218 (106/170) ======================= q-point: (-0.18 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.384 ( -13.062 17.533 22.767) 31.566 1.469 ( -17.742 17.278 12.168) 27.593 2.589 ( -27.965 16.606 18.920) 37.627 2.653 ( -0.548 -0.735 -7.472) 7.528 2.789 ( 2.990 -1.610 -4.106) 5.329 2.891 ( 0.385 0.147 -1.405) 1.464 3.044 ( 0.698 -2.427 -6.007) 6.516 3.121 ( 5.319 -0.727 -4.352) 6.911 3.190 ( -3.408 0.884 -7.891) 8.640 3.262 ( 8.346 -7.274 7.439) 13.338 3.424 ( 11.482 -0.979 6.566) 13.263 3.674 ( 5.513 4.893 4.677) 8.729 3.979 ( -2.713 -5.797 -2.150) 6.752 4.027 ( 4.447 -0.153 8.891) 9.942 4.092 ( -3.595 -0.227 13.463) 13.937 4.341 ( 5.203 -0.406 -3.546) 6.310 4.615 ( -4.174 3.546 -10.504) 11.846 4.777 ( -4.045 3.225 19.441) 20.118 4.975 ( 2.872 5.555 -3.114) 6.986 5.049 ( 0.052 5.186 3.725) 6.386 5.345 ( -5.470 10.022 1.150) 11.475 5.661 ( -7.104 2.799 -3.522) 8.409 6.020 ( -12.138 -1.588 -2.512) 12.496 6.277 ( 3.431 -1.734 0.026) 3.844 6.357 ( -10.484 -6.854 1.338) 12.597 6.394 ( 2.300 0.177 5.080) 5.580 6.560 ( -11.889 16.665 3.030) 20.694 7.009 ( 12.058 -4.561 6.512) 14.443 7.052 ( -11.662 -0.350 -4.159) 12.386 7.431 ( 4.892 9.521 0.023) 10.704 7.588 ( 1.179 12.269 -6.048) 13.729 7.797 ( -9.346 -0.635 -2.860) 9.794 8.128 ( 2.760 -8.883 4.122) 10.174 8.247 ( 0.841 -3.555 -1.182) 3.840 8.738 ( -5.504 6.818 2.677) 9.162 9.363 ( 6.433 -7.887 -2.797) 10.555 9.493 ( 1.990 9.861 0.786) 10.090 9.745 ( -5.728 4.333 -4.507) 8.480 9.908 ( -11.742 -1.659 -12.594) 17.299 10.381 ( 14.523 -7.161 4.212) 16.731 10.629 ( 9.015 6.675 -3.169) 11.656 10.942 ( 10.975 -4.599 5.782) 13.230 11.455 ( 7.611 -0.724 -1.969) 7.894 11.806 ( 7.493 -3.768 0.085) 8.388 12.274 ( -11.667 0.600 2.358) 11.918 12.432 ( -19.244 -7.281 0.883) 20.594 12.924 ( -7.192 -0.719 -2.144) 7.539 12.977 ( -5.384 1.309 -4.744) 7.294 14.602 ( -5.016 4.771 2.951) 7.525 14.929 ( -0.443 11.545 -1.753) 11.685 15.082 ( -6.585 1.869 0.648) 6.875 15.192 ( -9.563 1.186 10.512) 14.261 15.309 ( -0.338 -3.470 -5.321) 6.362 15.965 ( 7.144 -3.487 -0.704) 7.980 16.126 ( 3.336 0.789 -0.122) 3.430 16.263 ( 4.070 -2.242 -3.559) 5.853 20.676 ( -11.457 1.304 2.706) 11.844 21.009 ( -5.612 2.509 0.141) 6.149 22.494 ( 0.405 -2.122 -0.419) 2.200 22.862 ( 2.119 -1.895 -5.030) 5.777 ======================= Grid point 219 (107/170) ======================= q-point: (-0.09 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( -13.547 18.856 17.406) 29.018 1.451 ( -10.982 20.315 23.615) 33.030 2.481 ( -10.207 14.804 19.047) 26.195 2.569 ( -7.126 8.602 7.269) 13.327 2.811 ( 4.466 -2.020 -3.800) 6.202 2.850 ( -4.585 -3.597 -12.916) 14.169 2.912 ( 0.487 1.432 -0.185) 1.524 3.061 ( -3.545 -0.952 -4.856) 6.087 3.218 ( 7.774 -1.696 -2.524) 8.347 3.452 ( 5.927 -9.058 5.163) 11.993 3.658 ( 2.324 -9.720 2.363) 10.269 3.834 ( 3.909 -8.648 0.528) 9.505 3.911 ( 6.436 5.065 7.818) 11.322 4.146 ( 4.777 -0.456 3.171) 5.752 4.225 ( -1.140 3.060 4.801) 5.806 4.424 ( 7.402 5.919 0.170) 9.479 4.501 ( 0.633 4.210 -2.528) 4.951 4.892 ( -1.133 13.851 -1.437) 13.971 4.994 ( -7.529 2.292 31.888) 32.845 5.234 ( 9.032 0.109 1.336) 9.131 5.285 ( -4.365 3.410 2.357) 6.020 5.502 ( -3.224 9.057 -8.547) 12.864 5.797 ( -10.358 1.702 0.872) 10.533 6.151 ( -8.273 -1.723 -7.601) 11.366 6.208 ( -14.606 8.050 -1.937) 16.789 6.350 ( -11.445 5.671 8.348) 15.259 6.583 ( 12.115 -2.502 -3.226) 12.785 6.959 ( 1.299 5.749 2.370) 6.352 7.128 ( -4.378 2.627 -0.482) 5.128 7.418 ( 0.374 18.379 -0.826) 18.401 7.583 ( -5.773 7.770 -0.602) 9.698 7.737 ( 8.828 -6.565 -1.862) 11.158 8.224 ( 0.797 -6.428 0.366) 6.488 8.255 ( 1.491 -3.083 6.903) 7.706 8.758 ( 2.249 9.429 -2.347) 9.974 9.384 ( -2.810 -5.003 -7.679) 9.586 9.488 ( -3.422 4.177 -3.680) 6.534 9.591 ( -2.239 0.316 -10.298) 10.543 9.651 ( 4.393 -0.428 -4.364) 6.207 10.515 ( 4.933 3.323 -11.643) 13.074 10.787 ( 6.621 -5.108 9.959) 13.005 11.163 ( 9.393 -4.436 3.988) 11.127 11.539 ( 5.109 -3.105 -0.604) 6.009 11.896 ( 4.568 -5.099 -3.008) 7.478 12.138 ( -14.543 -2.731 6.644) 16.221 12.194 ( -10.942 1.548 9.794) 14.767 12.750 ( -7.248 -0.326 -6.552) 9.776 12.851 ( -3.507 0.794 -5.865) 6.879 14.578 ( -2.299 7.801 3.134) 8.716 14.832 ( -3.737 11.811 -5.460) 13.538 15.132 ( 2.889 3.273 5.211) 6.798 15.195 ( -4.976 2.341 10.716) 12.044 15.271 ( 2.395 -3.599 -3.750) 5.722 15.995 ( 1.225 0.509 -6.192) 6.333 16.159 ( 1.738 -1.757 0.862) 2.618 16.288 ( 3.458 -1.663 -3.313) 5.069 20.574 ( -6.296 2.774 5.070) 8.546 20.901 ( -6.640 1.983 -1.515) 7.093 22.505 ( 0.782 -2.349 0.543) 2.534 22.818 ( 0.791 -1.983 -6.951) 7.272 ======================= Grid point 220 (108/170) ======================= q-point: ( 0.00 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( -4.575 14.914 10.347) 18.720 1.915 ( -3.716 11.741 16.846) 20.868 2.371 ( -5.301 0.606 -14.933) 15.858 2.561 ( 3.314 -5.043 -8.523) 10.443 2.750 ( 0.765 -3.716 0.007) 3.794 2.866 ( -0.772 -5.416 -0.155) 5.473 2.972 ( 0.264 -0.018 -8.912) 8.916 3.061 ( 5.376 -5.444 -8.978) 11.796 3.309 ( 5.620 -2.190 9.939) 11.626 3.369 ( 0.666 -10.661 7.377) 12.982 3.484 ( -5.004 -7.503 0.557) 9.036 3.590 ( 0.287 -4.160 -5.663) 7.032 4.132 ( 0.988 21.253 18.970) 28.505 4.431 ( -4.268 11.012 9.772) 15.329 4.536 ( 3.256 15.630 9.874) 18.772 4.651 ( 8.288 1.375 6.250) 10.471 4.743 ( -3.118 14.641 -1.971) 15.098 5.058 ( -6.102 6.463 -7.716) 11.770 5.238 ( -8.609 2.410 20.951) 22.779 5.388 ( -0.623 11.320 1.334) 11.415 5.402 ( 2.007 7.654 0.629) 7.938 5.574 ( 3.446 5.520 -11.132) 12.895 5.892 ( 1.421 1.714 8.881) 9.155 6.084 ( 1.894 8.857 2.598) 9.422 6.253 ( 1.652 8.579 -1.395) 8.848 6.421 ( -8.994 8.238 0.810) 12.224 6.705 ( 11.403 0.955 0.769) 11.469 7.033 ( -5.280 2.141 -9.234) 10.850 7.279 ( 3.287 6.806 5.378) 9.276 7.579 ( 2.107 -2.686 -5.321) 6.322 7.674 ( -7.485 3.099 4.177) 9.114 7.880 ( 7.541 13.016 -5.794) 16.120 8.153 ( 2.744 -3.286 4.658) 6.327 8.289 ( 0.565 -6.379 6.208) 8.919 8.824 ( -5.436 4.305 -3.067) 7.582 9.140 ( -2.362 -1.199 -10.098) 10.440 9.398 ( 4.901 -3.399 -2.863) 6.616 9.476 ( -5.802 7.428 -6.806) 11.626 9.891 ( 10.556 4.414 6.201) 13.014 10.401 ( -8.546 2.576 -15.667) 18.031 10.744 ( -3.929 -10.031 12.148) 16.237 11.161 ( 6.149 -8.711 -3.053) 11.091 11.483 ( -1.978 -5.815 0.450) 6.159 11.748 ( 1.767 -8.535 -6.551) 10.903 12.090 ( -3.671 3.525 12.451) 13.451 12.337 ( -0.157 2.960 10.951) 11.345 12.601 ( 1.047 0.274 -8.443) 8.512 12.758 ( -0.278 0.445 -6.884) 6.904 14.850 ( 2.165 10.984 4.144) 11.937 14.987 ( -3.309 12.320 -2.767) 13.053 15.239 ( 0.012 3.738 0.963) 3.860 15.293 ( 2.650 0.229 9.131) 9.510 15.324 ( -2.172 4.273 2.072) 5.222 15.917 ( 2.934 -1.569 -10.843) 11.342 16.136 ( -0.213 -3.235 1.581) 3.607 16.225 ( -0.487 -4.125 -2.786) 5.001 20.737 ( 2.827 9.553 4.443) 10.909 20.881 ( -3.333 6.419 -2.032) 7.512 22.454 ( -0.011 -4.180 1.521) 4.448 22.666 ( -0.002 -5.188 -7.797) 9.366 ======================= Grid point 221 (109/170) ======================= q-point: ( 0.09 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( 4.739 6.935 13.816) 16.169 2.068 ( 1.205 5.563 14.956) 16.002 2.181 ( -0.868 2.259 -8.426) 8.767 2.539 ( 6.198 0.056 -9.218) 11.108 2.746 ( -2.501 -6.207 -0.167) 6.694 2.825 ( -1.115 -2.372 -2.880) 3.894 2.890 ( -2.233 -2.380 -4.346) 5.435 2.989 ( -0.823 -7.311 -7.150) 10.259 3.368 ( -5.333 -6.612 -0.211) 8.497 3.424 ( -4.514 -7.757 0.446) 8.986 3.473 ( 2.896 -10.621 1.959) 11.182 3.568 ( 4.910 -5.640 -0.498) 7.494 4.335 ( -4.472 18.342 11.003) 21.852 4.435 ( -5.497 20.394 5.570) 21.844 4.571 ( -12.117 9.203 4.702) 15.925 4.631 ( 0.207 16.014 -0.609) 16.027 4.853 ( 4.061 3.983 6.007) 8.273 4.915 ( -0.621 11.150 -3.912) 11.833 5.200 ( -6.071 8.498 7.100) 12.629 5.400 ( 1.590 6.449 -0.438) 6.657 5.471 ( 1.265 0.487 0.122) 1.361 5.564 ( 5.426 2.034 -3.290) 6.664 6.048 ( 1.226 6.609 12.663) 14.336 6.149 ( -5.693 11.255 1.110) 12.661 6.238 ( 10.363 4.790 -0.741) 11.441 6.464 ( 6.417 1.538 0.069) 6.599 6.808 ( 1.372 -4.551 -7.879) 9.202 6.989 ( 12.665 9.485 -0.515) 15.831 7.248 ( -10.881 -4.648 -1.328) 11.906 7.549 ( -0.900 9.876 1.041) 9.971 7.623 ( -0.959 5.146 -0.253) 5.241 7.953 ( 9.110 7.321 -5.955) 13.116 8.231 ( -1.197 -4.511 3.384) 5.764 8.312 ( -1.275 -7.289 -0.847) 7.448 8.795 ( 2.077 5.159 7.813) 9.590 9.042 ( 3.339 5.127 -7.953) 10.034 9.290 ( -4.643 6.784 -2.963) 8.738 9.545 ( 8.865 -0.213 -0.141) 8.869 10.035 ( -13.546 4.176 -14.546) 20.311 10.102 ( 2.873 2.998 8.659) 9.603 10.792 ( -4.887 -8.735 10.789) 14.717 11.126 ( -2.609 -7.724 -11.786) 14.330 11.437 ( -6.574 -7.380 8.600) 13.101 11.619 ( -7.180 -8.176 -7.017) 12.948 12.297 ( 9.647 0.826 11.654) 15.151 12.464 ( 6.030 -0.813 2.053) 6.421 12.607 ( 6.516 2.550 -1.382) 7.132 12.702 ( 4.228 2.058 -8.553) 9.760 14.893 ( -4.263 11.165 -1.483) 12.043 14.940 ( 2.453 11.457 3.052) 12.108 15.202 ( -3.442 2.697 -1.468) 4.613 15.303 ( 0.695 5.783 -0.078) 5.825 15.498 ( 5.274 -1.797 13.199) 14.327 15.843 ( 4.050 -0.509 -12.844) 13.477 16.106 ( -6.133 -3.904 1.037) 7.343 16.160 ( -3.978 -5.082 -1.385) 6.601 20.824 ( 1.413 5.794 -0.707) 6.006 20.878 ( 6.025 7.067 2.520) 9.623 22.467 ( -1.598 -4.814 2.680) 5.737 22.586 ( 0.182 -4.590 -6.156) 7.681 ======================= Grid point 222 (110/170) ======================= q-point: ( 0.18 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 5.275 5.352 1.593) 7.682 2.164 ( 2.312 4.776 5.314) 7.509 2.314 ( 7.871 -1.934 11.245) 13.861 2.540 ( 4.929 8.071 -7.133) 11.846 2.663 ( -4.554 -3.303 -7.109) 9.066 2.738 ( -3.802 -7.169 3.407) 8.801 2.868 ( 0.277 -4.803 1.674) 5.094 2.901 ( -4.202 -6.088 -2.196) 7.717 3.238 ( -7.518 -5.724 -5.627) 10.998 3.339 ( -6.793 -5.465 2.797) 9.156 3.517 ( -0.401 -9.355 1.966) 9.568 3.620 ( 2.750 -8.774 -3.392) 9.801 4.259 ( -5.995 8.163 0.736) 10.154 4.281 ( -9.813 12.947 -0.899) 16.270 4.576 ( -0.898 13.806 3.196) 14.199 4.590 ( -1.259 13.525 -5.877) 14.801 4.834 ( -2.362 11.473 -2.423) 11.962 4.960 ( -0.934 11.400 4.158) 12.171 5.330 ( 7.821 1.241 8.970) 11.966 5.410 ( -2.442 0.968 0.738) 2.728 5.466 ( 8.488 7.540 -8.988) 14.480 5.647 ( 4.807 -1.448 4.234) 6.568 6.054 ( -8.427 2.288 -1.777) 8.911 6.216 ( 7.445 9.740 6.529) 13.890 6.324 ( 5.717 -1.706 -5.375) 8.031 6.493 ( -0.632 3.097 -10.465) 10.932 6.814 ( 2.987 -2.692 7.637) 8.631 6.983 ( -14.883 -12.048 -5.845) 20.020 7.195 ( 8.074 8.107 0.233) 11.445 7.528 ( -5.804 7.711 5.440) 11.079 7.687 ( 9.321 10.243 -0.279) 13.852 8.021 ( 8.306 8.380 -7.718) 14.099 8.176 ( -3.263 -7.360 -2.010) 8.299 8.256 ( -2.621 -4.946 -4.404) 7.123 8.995 ( 8.274 4.680 5.055) 10.767 9.143 ( 11.106 3.951 10.316) 15.665 9.223 ( -0.855 7.873 -4.172) 8.951 9.678 ( 5.272 4.971 1.618) 7.424 9.707 ( -5.317 5.334 -9.219) 11.904 10.191 ( -5.124 1.502 9.893) 11.242 10.808 ( -9.545 -5.221 2.894) 11.258 10.886 ( -6.173 -4.018 -6.847) 10.056 11.411 ( -6.871 -8.808 -7.094) 13.233 11.468 ( -5.055 -7.721 9.627) 13.336 12.524 ( 8.541 -1.524 -1.655) 8.832 12.616 ( 10.581 -1.562 6.305) 12.415 12.677 ( 6.707 3.674 -7.197) 10.501 12.764 ( 6.847 2.591 4.060) 8.371 14.806 ( -4.002 6.313 -1.248) 7.578 14.995 ( -0.285 7.798 2.709) 8.260 15.176 ( 2.296 3.337 -0.452) 4.075 15.319 ( 3.050 5.679 -2.261) 6.831 15.707 ( 2.192 -3.393 8.338) 9.265 15.764 ( 4.303 0.120 -10.954) 11.769 15.997 ( -7.061 -4.593 1.447) 8.547 16.071 ( -6.633 -5.616 0.207) 8.693 20.845 ( 4.144 1.943 -2.779) 5.354 21.010 ( 5.149 3.101 2.949) 6.695 22.455 ( -1.503 -4.420 -0.072) 4.669 22.555 ( -0.448 -3.527 0.806) 3.645 ======================= Grid point 223 (111/170) ======================= q-point: ( 0.27 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( 7.781 7.791 -4.880) 12.044 2.270 ( 1.385 2.206 3.420) 4.299 2.375 ( -0.189 7.210 -6.866) 9.958 2.569 ( 1.419 -4.704 2.356) 5.449 2.606 ( 0.753 -2.044 1.044) 2.416 2.734 ( -3.844 -5.247 2.168) 6.856 2.879 ( -3.128 -3.734 4.605) 6.704 2.894 ( -0.161 -5.487 7.732) 9.482 3.034 ( -6.055 -4.297 -6.540) 9.894 3.246 ( -10.215 0.312 4.116) 11.018 3.524 ( -2.906 -4.492 5.073) 7.372 3.589 ( -2.871 -2.858 -3.044) 5.067 4.171 ( -1.104 -1.750 -0.613) 2.158 4.253 ( 3.327 -1.889 -2.663) 4.661 4.458 ( 2.056 12.850 -10.198) 16.534 4.608 ( -1.345 8.216 -2.358) 8.653 4.776 ( 4.920 13.533 -5.792) 15.521 4.979 ( -0.384 8.895 1.148) 8.977 5.330 ( -2.271 -2.638 -13.794) 14.227 5.392 ( -1.569 -0.967 3.677) 4.113 5.648 ( 14.019 2.115 0.411) 14.184 5.820 ( 6.689 -0.947 4.217) 7.964 5.864 ( -7.186 2.063 -1.505) 7.626 6.235 ( -12.281 -10.251 -8.162) 17.959 6.316 ( -0.236 4.846 -4.757) 6.794 6.471 ( 9.247 6.256 5.389) 12.397 6.629 ( -12.672 -13.365 -8.063) 20.105 6.983 ( -0.533 0.717 7.245) 7.300 7.219 ( -0.127 6.618 -3.225) 7.363 7.498 ( -3.763 5.289 3.120) 7.202 7.862 ( 11.199 8.616 -1.562) 14.216 8.011 ( 0.349 2.068 -4.556) 5.015 8.078 ( -4.568 -3.340 -5.575) 7.944 8.241 ( 7.444 1.986 -4.026) 8.693 9.129 ( -3.340 5.383 -2.462) 6.796 9.173 ( 11.388 5.639 0.544) 12.720 9.517 ( 13.102 1.235 15.937) 20.668 9.657 ( 2.842 6.265 0.745) 6.920 9.817 ( 8.530 7.102 3.302) 11.580 10.174 ( -6.488 -0.570 4.313) 7.812 10.554 ( -12.307 -3.581 -3.792) 13.367 10.799 ( -9.386 2.355 0.560) 9.693 11.276 ( -1.601 -8.107 -3.725) 9.064 11.474 ( -6.540 -6.287 6.417) 11.112 12.612 ( 7.818 -1.063 -4.092) 8.888 12.731 ( 8.906 4.129 -4.234) 10.691 12.844 ( 6.834 -2.994 7.959) 10.909 12.910 ( 4.765 2.539 4.713) 7.167 14.753 ( -1.131 0.780 -0.725) 1.553 15.012 ( 0.602 -0.128 1.433) 1.560 15.227 ( 1.651 4.806 1.007) 5.181 15.356 ( 6.123 4.700 -3.697) 8.558 15.631 ( -6.442 -6.417 -2.727) 9.493 15.776 ( 2.489 -1.736 -7.605) 8.188 15.931 ( -7.017 -4.459 2.467) 8.672 16.041 ( 1.134 -0.875 5.717) 5.894 20.881 ( 3.981 -2.939 -2.924) 5.747 21.083 ( 1.640 -2.869 0.335) 3.322 22.444 ( 0.758 -2.205 0.006) 2.332 22.573 ( -1.993 -2.937 5.358) 6.427 ======================= Grid point 224 (112/170) ======================= q-point: ( 0.36 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 2.277 4.442 -9.671) 10.883 2.255 ( 4.746 6.446 -3.993) 8.946 2.384 ( -1.665 0.915 3.717) 4.175 2.536 ( 2.033 -4.397 -8.450) 9.740 2.667 ( -1.892 1.044 8.306) 8.583 2.707 ( -4.544 -3.524 2.393) 6.229 2.791 ( -1.183 -1.629 1.238) 2.363 2.970 ( 1.947 -5.717 -0.970) 6.117 3.032 ( -1.459 -0.407 6.203) 6.385 3.108 ( -14.789 5.568 6.559) 17.110 3.466 ( -3.307 2.113 -2.767) 4.802 3.541 ( -6.577 -5.142 6.562) 10.619 4.136 ( 2.224 -3.407 -11.369) 12.076 4.275 ( 3.166 -2.318 -9.746) 10.507 4.512 ( 12.971 1.429 -3.522) 13.516 4.526 ( 7.408 -7.245 -8.193) 13.210 4.870 ( 7.358 8.836 -0.376) 11.505 4.936 ( -2.184 8.780 -6.763) 11.296 5.137 ( -1.833 -5.155 -7.028) 8.906 5.417 ( -4.490 0.629 7.521) 8.782 5.728 ( -10.492 -6.245 4.978) 13.185 5.804 ( 8.812 4.859 -9.214) 13.644 5.904 ( -11.460 -12.655 -0.085) 17.073 5.970 ( -1.195 -0.861 0.105) 1.476 6.239 ( 0.225 1.231 -16.678) 16.724 6.328 ( -8.247 -9.608 2.854) 12.979 6.715 ( 5.631 4.070 -2.071) 7.250 6.998 ( 4.741 5.951 1.055) 7.682 7.188 ( -3.497 0.440 1.195) 3.721 7.490 ( -2.388 4.388 4.384) 6.647 7.906 ( -3.968 4.110 0.422) 5.728 7.925 ( 1.620 -1.502 -9.894) 10.137 8.074 ( 7.487 0.947 -2.253) 7.876 8.310 ( 6.102 4.729 -5.379) 9.409 9.116 ( 1.117 2.907 3.041) 4.353 9.328 ( 4.972 -0.792 0.077) 5.035 9.645 ( 1.785 11.778 -3.207) 12.336 9.882 ( 5.423 1.009 13.382) 14.474 10.025 ( 11.620 5.246 3.564) 13.238 10.117 ( 0.951 0.569 -1.676) 2.010 10.428 ( -6.531 -0.051 8.628) 10.822 10.604 ( -12.454 5.625 -1.828) 13.787 11.254 ( 1.484 -5.556 -1.988) 6.085 11.395 ( -9.125 -4.642 1.900) 10.413 12.697 ( 6.990 -0.940 -1.113) 7.140 12.844 ( 7.091 3.602 -0.049) 7.953 12.996 ( 1.194 -3.087 7.370) 8.079 13.011 ( 3.627 2.051 2.847) 5.046 14.761 ( 2.949 -3.545 -0.194) 4.615 15.062 ( 4.748 -6.414 0.136) 7.982 15.192 ( -7.235 -0.209 0.536) 7.258 15.434 ( 6.267 3.624 -1.344) 7.363 15.499 ( -7.813 -8.634 -1.300) 11.716 15.717 ( 0.694 -1.039 -4.799) 4.959 15.895 ( 2.690 1.324 -1.988) 3.597 16.108 ( -1.449 1.399 4.492) 4.923 20.899 ( 2.352 -8.365 -2.802) 9.130 21.073 ( -1.079 -8.389 -2.414) 8.796 22.485 ( 2.897 -0.276 2.095) 3.586 22.600 ( -3.081 -1.933 6.405) 7.365 ======================= Grid point 225 (113/170) ======================= q-point: ( 0.45 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( 0.471 -2.104 -3.747) 4.323 2.274 ( 0.694 1.362 -1.096) 1.881 2.347 ( -3.505 7.237 0.392) 8.050 2.490 ( 6.062 -1.760 -10.650) 12.380 2.705 ( -0.703 0.711 0.295) 1.043 2.750 ( 4.773 -2.243 6.200) 8.140 2.836 ( -0.090 0.115 4.266) 4.268 2.915 ( -10.468 1.318 4.502) 11.470 3.000 ( -0.716 0.787 1.480) 1.823 3.027 ( -3.290 0.298 0.143) 3.307 3.426 ( -4.776 -4.517 -2.230) 6.941 3.477 ( -1.259 -1.399 0.123) 1.886 3.939 ( -3.066 -0.654 -19.854) 20.100 4.136 ( 3.499 1.224 -18.228) 18.601 4.658 ( 14.893 -8.753 -3.232) 17.575 4.731 ( 4.108 -6.402 1.308) 7.718 4.906 ( 1.302 -11.664 -0.566) 11.750 4.919 ( 5.900 7.353 2.480) 9.748 5.060 ( -5.769 -2.815 0.514) 6.440 5.370 ( -13.914 -17.202 2.148) 22.229 5.586 ( -3.730 1.561 7.989) 8.954 5.767 ( 6.446 7.444 -10.955) 14.729 5.875 ( -3.803 -9.887 -2.711) 10.935 5.924 ( -3.602 -2.113 6.073) 7.370 6.071 ( 2.811 3.931 -13.963) 14.775 6.363 ( 0.359 3.954 11.068) 11.758 6.606 ( -3.439 2.139 -12.639) 13.272 7.092 ( -4.881 0.919 -6.615) 8.272 7.213 ( 10.768 -1.655 6.864) 12.877 7.499 ( -3.981 1.496 4.879) 6.472 7.849 ( 2.173 -4.324 -3.241) 5.825 7.904 ( 0.941 5.288 -0.787) 5.428 8.148 ( 5.769 0.650 -4.015) 7.059 8.275 ( -0.760 3.806 -9.070) 9.866 9.202 ( 4.101 0.789 3.776) 5.631 9.300 ( -4.643 -4.381 -1.590) 6.579 9.677 ( 3.837 10.335 -0.064) 11.024 9.879 ( -7.461 3.280 -1.950) 8.381 10.215 ( 3.884 7.874 1.834) 8.970 10.250 ( 9.207 9.184 1.803) 13.128 10.439 ( -6.119 0.671 7.223) 9.491 10.515 ( 1.215 3.969 9.706) 10.557 11.223 ( -8.560 -3.606 0.341) 9.295 11.287 ( 2.020 -4.372 -3.364) 5.874 12.797 ( 4.102 -1.939 2.130) 5.012 12.908 ( 0.581 3.260 -0.031) 3.312 13.054 ( -1.541 -2.197 5.405) 6.035 13.098 ( 2.802 1.080 2.839) 4.132 14.843 ( 6.361 -6.117 1.145) 8.899 15.050 ( -7.877 -4.557 -1.072) 9.163 15.173 ( 8.887 -8.212 -0.579) 12.114 15.317 ( -12.128 -10.702 -0.137) 16.175 15.525 ( 4.033 3.715 0.301) 5.492 15.696 ( 0.863 0.400 -3.402) 3.532 15.959 ( 6.930 4.478 -0.987) 8.310 16.082 ( -5.451 3.133 1.046) 6.374 20.903 ( 1.870 -12.040 -1.896) 12.331 21.010 ( -2.191 -12.072 -3.811) 12.847 22.573 ( 4.168 0.251 3.295) 5.319 22.610 ( -4.016 -0.603 5.338) 6.707 ======================= Grid point 226 (114/170) ======================= q-point: (-0.45 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( -11.172 1.480 0.193) 11.271 2.207 ( -5.779 -2.598 -4.415) 7.723 2.333 ( 4.247 0.912 -2.359) 4.943 2.563 ( 10.469 -2.330 -1.138) 10.785 2.660 ( -4.314 5.404 1.027) 6.990 2.828 ( -4.157 3.932 5.742) 8.106 2.863 ( 4.932 -1.905 -3.416) 6.295 2.929 ( 5.033 -3.769 2.450) 6.749 3.016 ( -0.801 -1.204 -0.186) 1.458 3.057 ( 8.420 1.582 5.583) 10.226 3.284 ( -2.614 -4.333 -6.095) 7.922 3.495 ( 7.349 -0.362 -9.988) 12.405 3.770 ( 0.069 -0.096 -4.769) 4.771 3.987 ( 2.892 0.532 -16.548) 16.807 4.583 ( -17.527 -13.089 0.458) 21.880 4.740 ( -19.089 -3.880 3.209) 19.742 4.829 ( 3.245 1.362 0.187) 3.524 5.094 ( -10.072 -1.137 -1.380) 10.229 5.097 ( 15.847 -4.126 2.972) 16.643 5.291 ( 14.264 -11.666 2.627) 18.614 5.558 ( -6.413 -4.879 -2.237) 8.362 5.766 ( -5.005 -4.637 -2.963) 7.438 5.870 ( 0.895 0.146 0.854) 1.246 5.940 ( 13.014 4.396 -2.148) 13.903 6.046 ( 0.175 1.027 3.918) 4.054 6.395 ( -6.459 -1.262 -8.836) 11.017 6.569 ( 8.039 8.620 11.217) 16.271 6.910 ( -3.873 2.362 -11.566) 12.424 7.333 ( -6.043 -5.254 2.864) 8.504 7.545 ( 9.725 -7.261 0.448) 12.145 7.875 ( -2.129 3.008 0.846) 3.781 7.919 ( 2.262 3.591 -0.433) 4.266 8.090 ( -3.825 -0.280 -8.263) 9.110 8.200 ( 4.191 3.059 -5.133) 7.299 9.214 ( -4.787 -3.116 0.111) 5.713 9.299 ( 3.825 -2.208 0.830) 4.494 9.697 ( -8.358 7.947 -1.406) 11.619 9.759 ( 1.897 4.268 2.151) 5.142 10.165 ( -8.012 13.513 2.527) 15.912 10.373 ( 7.260 9.753 -1.969) 12.317 10.498 ( -4.508 2.665 8.002) 9.563 10.650 ( 5.372 1.901 2.735) 6.321 11.113 ( -4.390 -3.104 3.355) 6.337 11.333 ( 7.400 -5.160 -3.294) 9.604 12.816 ( -6.092 0.421 1.791) 6.364 12.893 ( -1.748 0.892 0.612) 2.056 13.068 ( -2.818 -2.103 3.676) 5.087 13.160 ( 1.742 0.799 1.553) 2.466 14.871 ( -6.682 -3.549 0.551) 7.586 15.041 ( 10.999 -6.428 -1.224) 12.799 15.137 ( -10.209 -8.385 0.467) 13.220 15.323 ( 9.468 -8.674 -0.177) 12.842 15.563 ( -0.505 1.384 1.317) 1.976 15.643 ( -2.506 0.303 -3.617) 4.410 15.964 ( -7.863 4.456 -0.273) 9.042 16.084 ( 7.548 4.066 0.039) 8.573 20.922 ( 0.956 -12.339 -1.196) 12.434 20.936 ( -0.706 -12.502 -2.524) 12.774 22.588 ( -4.637 0.572 3.157) 5.638 22.677 ( 4.408 -0.538 2.723) 5.209 ======================= Grid point 227 (115/170) ======================= q-point: (-0.36 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( -16.343 9.514 3.775) 19.283 2.052 ( -9.228 2.328 -2.818) 9.925 2.403 ( 7.960 -3.431 -2.267) 8.959 2.618 ( 1.558 0.717 -1.843) 2.518 2.689 ( 5.331 -6.016 1.525) 8.181 2.904 ( 1.817 -3.549 0.904) 4.089 2.960 ( 2.024 1.080 0.672) 2.391 3.006 ( 3.822 -1.320 3.647) 5.445 3.063 ( 10.115 0.481 1.308) 10.211 3.245 ( 8.927 -2.323 -0.108) 9.225 3.275 ( 8.019 0.025 -0.374) 8.028 3.509 ( 9.478 1.208 -6.862) 11.763 3.800 ( 0.927 5.239 4.569) 7.013 3.873 ( -0.499 0.478 -9.290) 9.315 4.320 ( -15.467 -9.276 1.515) 18.099 4.400 ( -21.321 -12.691 0.589) 24.819 4.839 ( -5.565 9.277 1.320) 10.898 4.962 ( -0.586 12.359 -2.240) 12.574 5.238 ( -4.204 8.587 -6.817) 11.742 5.449 ( 0.271 -2.161 3.786) 4.368 5.588 ( 6.007 -13.023 6.846) 15.892 5.694 ( 2.284 -0.206 1.124) 2.554 5.866 ( 0.992 -9.781 1.088) 9.892 6.034 ( 6.387 -7.408 -3.634) 10.435 6.229 ( 2.049 0.963 8.286) 8.589 6.238 ( 4.224 4.051 -7.617) 9.605 6.639 ( -5.108 -0.019 -6.942) 8.619 6.932 ( 11.744 4.848 7.341) 14.674 7.203 ( -6.275 -5.689 -4.779) 9.725 7.656 ( -5.994 5.550 -0.833) 8.211 7.767 ( 3.277 0.160 -4.248) 5.367 7.939 ( -0.952 1.368 1.405) 2.180 8.035 ( 0.592 -1.184 -0.549) 1.433 8.217 ( 3.988 2.269 -4.099) 6.153 9.131 ( -7.234 -2.203 0.308) 7.568 9.304 ( -4.614 -3.996 0.198) 6.108 9.573 ( -2.608 8.819 -0.158) 9.198 9.854 ( 3.299 1.307 4.510) 5.739 10.076 ( -7.222 11.995 3.356) 14.398 10.405 ( -2.105 3.367 -6.075) 7.257 10.477 ( -1.066 6.163 6.078) 8.722 10.715 ( 4.364 4.017 -3.576) 6.926 11.178 ( 5.245 -2.642 4.524) 7.413 11.436 ( 8.748 -6.787 -1.664) 11.197 12.683 ( -10.907 2.773 0.024) 11.254 12.827 ( -9.239 0.868 2.087) 9.511 13.054 ( -2.618 -1.617 1.269) 3.329 13.173 ( -1.397 -0.461 -0.130) 1.477 14.772 ( -4.457 -0.129 -1.025) 4.575 15.025 ( -4.897 -5.146 1.527) 7.265 15.221 ( 10.360 -5.535 -0.931) 11.783 15.404 ( -2.529 0.188 3.023) 3.945 15.496 ( -5.931 1.513 -3.495) 7.048 15.624 ( 4.819 -6.561 -2.188) 8.430 15.860 ( -3.036 1.835 1.017) 3.690 16.193 ( 5.480 2.346 -0.023) 5.961 20.860 ( -2.795 -9.215 -1.883) 9.812 20.979 ( 2.998 -9.067 1.246) 9.630 22.538 ( -4.286 0.906 0.946) 4.481 22.762 ( 3.803 -1.944 0.580) 4.310 ======================= Grid point 228 (116/170) ======================= q-point: (-0.27 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( -9.492 17.337 14.648) 24.602 1.887 ( -10.913 9.159 3.390) 14.645 2.507 ( 6.842 -4.677 -1.531) 8.428 2.665 ( 7.640 -2.387 -4.583) 9.223 2.812 ( 7.159 -7.173 3.576) 10.747 2.874 ( 0.793 -5.372 -5.590) 7.793 2.951 ( 1.005 -1.238 -4.122) 4.420 3.073 ( 3.673 -6.326 -6.090) 9.519 3.162 ( 5.700 -0.691 -2.754) 6.368 3.362 ( 0.927 2.743 -2.494) 3.822 3.503 ( 4.217 -0.513 4.161) 5.947 3.636 ( -11.212 12.427 10.643) 19.834 3.708 ( 7.623 5.628 13.925) 16.843 3.874 ( 1.445 -4.486 -0.926) 4.803 4.183 ( -4.747 4.189 4.307) 7.657 4.236 ( 1.809 -5.900 -1.361) 6.319 4.797 ( -0.549 8.421 0.750) 8.472 4.942 ( -1.613 10.409 -3.416) 11.073 5.032 ( -6.952 8.379 -2.481) 11.167 5.376 ( -9.409 6.935 0.971) 11.729 5.599 ( -9.634 0.476 2.475) 9.958 5.786 ( 2.357 0.886 0.958) 2.694 6.015 ( 10.438 -9.325 3.958) 14.545 6.156 ( 1.959 -13.071 0.367) 13.222 6.168 ( 3.414 -3.092 -1.846) 4.962 6.369 ( 0.688 2.174 4.748) 5.267 6.548 ( 7.583 -1.770 -2.326) 8.126 7.045 ( -4.834 5.899 -2.663) 8.078 7.198 ( 8.223 -1.601 1.756) 8.560 7.466 ( -9.761 9.226 -1.213) 13.486 7.812 ( 3.739 1.089 -3.992) 5.577 7.952 ( -1.748 4.915 4.066) 6.614 8.034 ( 0.752 -1.257 -1.205) 1.897 8.215 ( 1.484 0.861 -4.371) 4.696 8.977 ( -12.971 2.627 2.839) 13.535 9.220 ( -3.912 -1.810 -0.034) 4.311 9.601 ( 3.032 2.432 0.129) 3.889 9.913 ( -3.837 -3.227 3.105) 5.897 10.036 ( -0.401 7.126 4.666) 8.527 10.229 ( -5.576 5.014 -11.846) 14.020 10.603 ( 6.218 -2.893 7.756) 10.353 10.746 ( 6.803 7.939 -5.688) 11.902 11.318 ( 8.657 -2.725 -0.710) 9.103 11.558 ( 7.418 -7.997 0.420) 10.916 12.495 ( -12.839 3.712 0.449) 13.372 12.650 ( -15.787 1.950 1.953) 16.027 13.003 ( -4.757 -1.798 -0.272) 5.093 13.113 ( -4.319 -0.549 -2.422) 4.982 14.722 ( -0.939 3.006 -0.216) 3.157 15.021 ( 1.879 0.660 2.123) 2.911 15.255 ( -5.184 -2.168 1.027) 5.712 15.300 ( -10.656 1.520 0.522) 10.776 15.423 ( -1.500 7.127 -2.852) 7.821 15.694 ( 8.408 -6.649 -0.405) 10.727 15.938 ( 8.815 -6.007 1.425) 10.762 16.242 ( 1.969 0.370 -1.937) 2.787 20.797 ( -4.149 -2.812 -0.018) 5.012 21.035 ( 1.532 -4.326 1.586) 4.855 22.483 ( -2.708 0.034 -0.515) 2.757 22.804 ( 2.758 -3.337 -2.340) 4.921 ======================= Grid point 229 (117/170) ======================= q-point: (-0.18 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -8.980 16.689 11.456) 22.145 1.826 ( -5.328 18.693 14.911) 24.498 2.563 ( 3.276 -4.675 -3.168) 6.529 2.724 ( 8.329 -3.348 -8.602) 12.433 2.830 ( -0.523 -7.078 -6.817) 9.841 2.883 ( -0.920 -0.287 -4.890) 4.984 2.950 ( -1.512 -5.311 0.899) 5.595 3.039 ( 6.071 -6.707 -1.685) 9.202 3.194 ( -7.050 -0.303 7.095) 10.007 3.231 ( -1.094 4.205 -5.676) 7.148 3.436 ( -1.183 5.287 3.418) 6.406 3.780 ( -0.474 -10.533 -4.420) 11.433 3.812 ( 3.076 9.416 6.625) 11.917 4.136 ( 4.458 4.999 28.802) 29.571 4.239 ( 5.464 15.088 3.163) 16.356 4.329 ( 6.378 1.218 0.755) 6.537 4.730 ( -1.129 9.585 -4.235) 10.540 4.906 ( -3.618 9.235 8.262) 12.909 5.086 ( 9.460 5.979 0.981) 11.234 5.248 ( -6.136 10.745 1.196) 12.431 5.457 ( -9.138 0.554 1.984) 9.368 5.772 ( -1.253 4.145 -4.264) 6.077 6.043 ( -5.930 -1.994 -5.860) 8.572 6.177 ( -1.968 -3.951 4.358) 6.203 6.202 ( 2.243 -5.257 3.045) 6.476 6.407 ( 0.906 0.140 2.247) 2.427 6.860 ( 14.551 -0.405 10.198) 17.773 6.950 ( -1.423 10.795 -3.272) 11.370 7.136 ( -8.620 6.458 -1.803) 10.921 7.458 ( 4.074 -2.748 1.084) 5.032 7.811 ( -0.316 3.879 -2.070) 4.408 7.911 ( -4.972 9.375 0.256) 10.615 8.059 ( 1.687 -2.837 0.465) 3.333 8.186 ( 1.684 1.485 -3.530) 4.184 8.867 ( -5.565 6.939 5.685) 10.556 9.196 ( 1.675 -5.196 -1.155) 5.580 9.599 ( -1.989 -0.901 -2.123) 3.045 9.793 ( -7.529 -0.616 -5.715) 9.473 9.950 ( -8.674 5.182 -10.021) 14.231 10.257 ( 13.140 -1.188 6.353) 14.643 10.732 ( 4.769 -4.919 -4.642) 8.276 10.865 ( 9.330 4.884 5.528) 11.894 11.409 ( 7.946 -4.464 -6.578) 11.240 11.676 ( 6.096 -8.207 0.954) 10.268 12.302 ( -13.991 3.323 2.984) 14.686 12.407 ( -17.424 3.801 4.487) 18.390 12.897 ( -6.799 -1.817 -2.533) 7.480 12.992 ( -5.827 -0.300 -4.311) 7.255 14.734 ( 1.174 6.853 1.574) 7.129 15.118 ( 6.597 3.441 0.834) 7.487 15.140 ( -7.041 2.663 -0.324) 7.535 15.202 ( -5.873 0.441 6.387) 8.688 15.334 ( -5.240 8.906 -1.618) 10.459 15.858 ( 10.790 -6.341 -0.535) 12.527 16.088 ( 7.201 -4.891 0.342) 8.711 16.217 ( 0.402 -1.888 -4.653) 5.038 20.731 ( -4.953 3.836 1.456) 6.432 21.044 ( -2.301 0.487 0.484) 2.401 22.448 ( -0.695 -1.632 -0.880) 1.980 22.797 ( 1.620 -4.372 -5.142) 6.941 ======================= Grid point 230 (118/170) ======================= q-point: (-0.09 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -6.432 17.612 11.250) 21.866 1.843 ( -10.954 18.094 11.918) 24.278 2.551 ( 1.870 -1.404 -7.136) 7.509 2.661 ( -3.023 -9.151 -11.335) 14.878 2.751 ( 3.131 -1.836 -6.227) 7.208 2.882 ( -2.141 -2.266 -0.115) 3.120 2.910 ( 4.357 1.388 5.701) 7.308 3.128 ( 0.136 4.543 -10.915) 11.823 3.175 ( 4.971 -3.408 1.330) 6.173 3.249 ( 0.887 -8.489 11.170) 14.058 3.504 ( 0.722 -3.745 4.110) 5.607 3.659 ( -1.227 -8.890 -8.074) 12.072 3.965 ( -0.309 9.284 13.036) 16.007 4.336 ( 1.019 12.506 7.488) 14.612 4.385 ( 5.345 14.052 5.506) 16.010 4.480 ( 0.988 3.645 14.235) 14.728 4.746 ( 4.800 14.917 -3.087) 15.971 5.027 ( -5.321 3.109 26.418) 27.128 5.171 ( 2.640 8.335 -4.413) 9.793 5.293 ( 5.028 4.796 4.410) 8.230 5.407 ( 1.235 9.532 0.027) 9.612 5.675 ( -1.304 4.873 -8.574) 9.948 5.888 ( -6.803 2.213 -1.296) 7.270 6.142 ( -6.836 5.151 2.406) 8.891 6.206 ( -1.068 -0.450 -0.301) 1.197 6.508 ( 10.125 -4.192 0.630) 10.976 6.697 ( -20.086 17.751 0.284) 26.807 7.110 ( 8.895 3.232 3.090) 9.955 7.179 ( 0.972 6.290 -1.200) 6.477 7.521 ( 3.974 -7.481 2.849) 8.938 7.750 ( -6.308 3.507 2.716) 7.712 7.866 ( 3.041 13.811 -6.292) 15.478 8.083 ( 1.148 -5.329 1.850) 5.757 8.213 ( 2.093 -0.174 2.297) 3.112 8.887 ( -1.019 4.386 2.646) 5.223 9.231 ( 3.018 -7.161 -1.777) 7.971 9.450 ( -5.813 -4.245 -11.444) 13.519 9.707 ( -7.885 8.675 -8.254) 14.338 9.710 ( 5.157 4.172 -2.612) 7.129 10.521 ( 9.802 -3.180 1.225) 10.377 10.697 ( -2.713 -3.723 -1.908) 4.986 11.054 ( 7.163 -3.707 3.384) 8.747 11.453 ( 7.012 -5.744 -5.341) 10.521 11.743 ( 3.411 -8.530 -2.343) 9.481 12.136 ( -13.011 3.162 7.059) 15.137 12.276 ( -8.903 5.290 10.605) 14.822 12.737 ( -6.250 -0.995 -6.755) 9.257 12.859 ( -4.105 -0.467 -5.029) 6.509 14.782 ( 1.338 9.576 3.309) 10.219 15.057 ( -2.901 9.296 -1.415) 9.840 15.177 ( -0.159 -2.948 5.508) 6.249 15.255 ( -5.337 5.973 3.643) 8.800 15.284 ( 6.247 6.839 0.711) 9.290 15.965 ( 4.749 -3.819 -5.005) 7.886 16.117 ( 0.400 -2.283 -1.282) 2.649 16.223 ( 4.417 -4.382 -2.896) 6.862 20.692 ( -2.326 8.311 2.969) 9.127 20.975 ( -5.497 4.638 -0.947) 7.254 22.442 ( 0.443 -3.191 -0.104) 3.223 22.745 ( 0.593 -4.988 -7.120) 8.713 ======================= Grid point 231 (119/170) ======================= q-point: ( 0.00 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.025 ( -7.033 7.813 0.268) 10.516 2.145 ( -2.041 9.234 6.492) 11.471 2.343 ( -5.974 -3.792 -8.481) 11.045 2.473 ( 3.318 -1.937 -9.445) 10.197 2.699 ( -0.858 -0.316 1.272) 1.567 2.726 ( 0.252 -6.704 -2.419) 7.132 2.904 ( 2.932 -2.212 -7.861) 8.677 2.953 ( 2.660 -6.772 -13.366) 15.218 3.167 ( 0.714 -7.047 5.882) 9.207 3.246 ( -1.408 -7.912 4.476) 9.199 3.303 ( 2.925 -0.496 2.057) 3.610 3.481 ( 3.978 -5.233 -3.797) 7.591 4.593 ( -0.168 5.243 12.250) 13.326 4.684 ( 0.454 1.280 9.278) 9.377 4.789 ( -5.545 22.664 14.516) 27.480 4.878 ( 7.444 21.054 9.932) 24.440 4.999 ( -4.484 7.955 2.465) 9.459 5.192 ( -4.239 6.975 -2.299) 8.479 5.289 ( -4.355 3.834 13.114) 14.340 5.450 ( 1.454 2.367 2.117) 3.492 5.561 ( 1.411 -0.668 -5.426) 5.646 5.831 ( -3.194 3.693 9.729) 10.886 5.931 ( 6.266 11.952 -1.428) 13.570 6.278 ( 0.562 5.837 5.542) 8.069 6.373 ( 5.924 6.032 -0.069) 8.455 6.563 ( 0.079 1.731 -1.350) 2.197 6.812 ( -9.839 10.847 0.280) 14.647 7.083 ( 1.174 2.950 -8.962) 9.508 7.283 ( -9.304 -6.473 1.130) 11.390 7.445 ( 14.747 -8.456 -3.799) 17.419 7.793 ( -2.294 7.816 2.155) 8.426 7.946 ( 5.973 -3.610 -2.874) 7.548 8.056 ( 1.714 -8.649 2.479) 9.159 8.171 ( 0.373 -4.239 -3.619) 5.587 8.884 ( -5.904 2.989 1.535) 6.793 9.071 ( -1.223 -4.762 -3.628) 6.111 9.448 ( 3.192 8.948 4.362) 10.454 9.708 ( -2.738 8.314 -4.048) 9.644 10.029 ( 7.787 8.696 6.008) 13.128 10.390 ( -8.422 -4.473 -5.825) 11.174 10.598 ( -1.012 -1.344 3.082) 3.511 10.958 ( 3.233 -10.236 -9.821) 14.550 11.362 ( -0.785 -3.928 0.584) 4.048 11.551 ( 0.867 -9.412 -6.154) 11.278 12.196 ( -2.495 5.821 7.293) 9.659 12.370 ( -1.822 -0.475 5.216) 5.546 12.625 ( 1.525 2.299 -4.206) 5.030 12.746 ( 0.472 -1.690 -4.780) 5.092 15.022 ( 1.702 5.792 7.580) 9.690 15.170 ( -0.781 0.534 5.892) 5.967 15.330 ( -0.271 8.866 0.317) 8.876 15.369 ( -3.882 5.936 5.205) 8.798 15.456 ( 1.475 7.012 -4.774) 8.610 15.832 ( 4.647 -6.659 -8.934) 12.073 16.062 ( -0.700 -3.189 0.625) 3.325 16.120 ( -1.048 -5.246 -2.371) 5.852 20.970 ( 2.704 10.730 2.889) 11.436 21.039 ( -2.971 7.116 -0.093) 7.712 22.373 ( -0.169 -2.629 -0.576) 2.697 22.524 ( 0.012 -7.648 -7.050) 10.402 ======================= Grid point 232 (120/170) ======================= q-point: ( 0.09 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( 1.639 2.529 8.944) 9.438 2.168 ( -3.487 -1.419 3.938) 5.448 2.231 ( 2.087 6.465 -0.980) 6.864 2.465 ( 4.701 -3.812 -5.143) 7.942 2.654 ( -4.444 -2.396 -2.047) 5.448 2.708 ( -0.705 -6.817 -0.209) 6.857 2.846 ( 1.961 -2.246 -9.750) 10.196 2.881 ( 2.015 -2.457 -4.634) 5.619 3.212 ( -3.154 -7.718 1.377) 8.450 3.241 ( 0.174 -6.917 4.732) 8.382 3.368 ( -0.957 -0.276 -1.704) 1.974 3.466 ( 2.559 -3.646 -5.962) 7.442 4.595 ( -7.698 7.449 3.407) 11.241 4.764 ( -2.696 2.781 6.021) 7.159 4.844 ( -1.729 10.876 5.060) 12.119 4.892 ( -7.499 11.389 -1.067) 13.677 5.049 ( -3.610 12.717 6.217) 14.608 5.167 ( -0.763 7.790 2.587) 8.244 5.330 ( -6.685 12.765 13.393) 19.672 5.485 ( 0.619 0.518 0.057) 0.809 5.552 ( 3.088 3.894 1.823) 5.294 5.739 ( -5.119 15.089 -5.051) 16.715 6.124 ( 5.487 1.236 10.696) 12.085 6.350 ( 1.961 5.605 -5.122) 7.842 6.424 ( -7.855 11.592 0.645) 14.018 6.498 ( 5.220 0.543 6.643) 8.466 6.620 ( -8.309 -11.654 -4.820) 15.102 7.009 ( -17.811 -14.134 -4.308) 23.142 7.233 ( 14.515 12.056 -0.325) 18.871 7.653 ( 14.329 -2.223 -4.250) 15.110 7.729 ( -4.092 6.749 -0.335) 7.900 8.021 ( 7.150 -1.330 -3.957) 8.280 8.070 ( -2.340 -11.165 0.006) 11.408 8.162 ( 1.859 -3.328 -1.700) 4.174 8.888 ( 1.798 3.977 6.755) 8.042 9.067 ( 4.876 -2.590 -1.975) 5.864 9.555 ( 2.852 13.458 1.476) 13.836 9.681 ( 7.032 11.844 -3.128) 14.125 10.129 ( -12.753 3.369 -7.748) 15.298 10.161 ( -2.918 2.193 7.201) 8.073 10.645 ( 2.844 -3.371 5.847) 7.323 10.926 ( 3.321 -10.823 -10.233) 15.261 11.289 ( -8.734 -5.281 4.488) 11.150 11.420 ( -8.305 -9.578 -5.720) 13.908 12.336 ( 7.671 2.437 7.988) 11.340 12.434 ( 5.888 -1.840 0.165) 6.171 12.667 ( 5.722 2.702 0.139) 6.329 12.728 ( 4.842 0.260 -6.024) 7.733 15.115 ( -6.917 9.028 -2.181) 11.580 15.148 ( 1.994 8.182 7.069) 10.995 15.257 ( -6.636 1.857 -2.656) 7.385 15.411 ( -2.252 -0.217 11.432) 11.654 15.498 ( 8.117 5.814 -1.961) 10.175 15.799 ( 4.603 -3.899 -10.917) 12.473 16.011 ( -7.347 -4.330 0.699) 8.556 16.042 ( -5.522 -5.416 -0.386) 7.744 20.980 ( -3.128 7.937 -0.558) 8.549 21.042 ( 1.341 6.747 2.540) 7.333 22.372 ( -0.326 -3.361 0.774) 3.464 22.467 ( 1.501 -6.142 -4.907) 8.004 ======================= Grid point 233 (121/170) ======================= q-point: ( 0.18 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.195 ( 2.368 0.705 6.769) 7.205 2.235 ( 5.415 1.244 8.044) 9.776 2.318 ( 5.574 3.334 5.190) 8.314 2.494 ( 3.031 -6.400 -1.564) 7.252 2.562 ( -2.825 -1.849 -1.056) 3.538 2.692 ( -3.094 -8.643 2.184) 9.436 2.765 ( 1.316 2.553 -9.428) 9.855 2.864 ( -1.716 -0.336 -0.267) 1.769 3.145 ( -5.285 -2.440 -5.180) 7.792 3.243 ( -3.117 -2.587 0.157) 4.054 3.330 ( 0.357 -6.948 4.392) 8.228 3.432 ( 1.256 -8.169 -6.575) 10.562 4.486 ( -8.748 11.631 1.567) 14.638 4.642 ( -15.967 17.626 0.587) 23.790 4.811 ( 0.912 5.846 -8.165) 10.083 4.865 ( -0.559 13.118 3.884) 13.692 5.036 ( -6.839 5.821 6.964) 11.364 5.125 ( -5.015 0.965 0.530) 5.134 5.309 ( -5.641 3.056 2.672) 6.950 5.491 ( -0.070 -1.477 0.212) 1.494 5.607 ( -1.302 8.885 -7.443) 11.663 5.680 ( 2.420 5.975 6.207) 8.949 6.064 ( -18.290 -2.422 1.615) 18.521 6.296 ( 5.337 -1.115 -13.742) 14.784 6.433 ( 0.092 1.028 -1.802) 2.076 6.493 ( 1.340 4.613 0.050) 4.804 6.638 ( -11.415 -16.230 -11.707) 23.038 6.750 ( 1.518 -2.499 20.601) 20.808 7.403 ( 4.409 10.646 -0.172) 11.524 7.672 ( -2.492 5.572 -1.457) 6.275 7.818 ( 14.000 1.906 -4.045) 14.696 8.006 ( -1.625 -8.211 -3.277) 8.989 8.132 ( 9.178 1.240 -4.146) 10.147 8.140 ( -0.637 -3.585 -0.563) 3.684 9.072 ( 8.274 2.975 9.169) 12.703 9.180 ( 8.248 -0.556 3.081) 8.822 9.547 ( 0.534 17.804 -6.952) 19.120 9.825 ( 7.316 8.103 3.521) 11.471 9.871 ( -3.660 8.810 -8.597) 12.842 10.146 ( -8.998 -5.577 8.677) 13.688 10.723 ( -7.537 -1.820 -2.955) 8.297 10.839 ( 4.718 -0.717 0.481) 4.796 11.198 ( -8.827 -9.874 -5.834) 14.473 11.281 ( -4.152 -9.333 8.476) 13.274 12.516 ( 7.405 0.609 -0.004) 7.430 12.579 ( 8.964 -1.785 5.923) 10.891 12.747 ( 7.314 2.797 -5.221) 9.411 12.800 ( 7.389 0.672 1.854) 7.647 14.951 ( -9.793 7.063 -1.857) 12.216 15.088 ( -8.082 1.852 -0.098) 8.292 15.293 ( 3.418 5.884 3.580) 7.689 15.444 ( 1.354 4.644 -1.507) 5.067 15.604 ( -1.635 -4.468 1.843) 5.102 15.752 ( 5.286 -1.930 -8.628) 10.301 15.905 ( -6.318 -3.519 3.414) 7.997 15.953 ( -4.632 -4.753 1.176) 6.740 20.922 ( -2.837 4.938 -1.588) 5.912 21.058 ( -2.480 0.740 1.458) 2.970 22.381 ( 0.901 -1.925 0.536) 2.192 22.467 ( 1.180 -4.419 0.537) 4.605 ======================= Grid point 234 (122/170) ======================= q-point: ( 0.27 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.297 ( 2.109 2.892 5.711) 6.740 2.338 ( 3.554 3.812 -2.457) 5.762 2.443 ( -2.626 -3.819 -5.254) 7.007 2.485 ( 7.715 1.396 2.549) 8.244 2.610 ( -3.453 -2.452 -0.272) 4.244 2.643 ( -0.562 -0.240 4.950) 4.988 2.756 ( 4.504 -3.415 2.254) 6.085 2.843 ( -3.124 -2.955 5.666) 7.113 2.980 ( -2.337 0.904 -8.209) 8.583 3.242 ( -3.036 -0.293 5.947) 6.684 3.385 ( 1.383 -9.876 -3.839) 10.686 3.404 ( 1.915 -9.449 3.116) 10.132 4.324 ( -14.383 11.895 -1.713) 18.743 4.368 ( -15.657 14.465 0.038) 21.316 4.704 ( 0.798 8.397 -10.654) 13.589 4.810 ( -7.608 7.402 -9.907) 14.520 5.029 ( -2.393 6.605 2.627) 7.500 5.070 ( -3.198 -1.918 8.070) 8.889 5.231 ( -5.589 -4.892 -1.517) 7.581 5.373 ( -7.270 1.960 -9.707) 12.285 5.606 ( 3.697 -7.723 1.914) 8.774 5.756 ( -10.120 -4.130 6.640) 12.789 5.880 ( -0.964 0.888 7.170) 7.289 6.053 ( -13.837 -8.678 -8.453) 18.391 6.312 ( 1.777 -2.783 -17.620) 17.927 6.393 ( 7.365 -0.789 -20.258) 21.570 6.708 ( 5.672 9.206 10.413) 15.012 6.965 ( 1.158 -2.614 11.957) 12.294 7.365 ( -4.396 8.334 -4.355) 10.381 7.610 ( -3.726 3.770 -0.292) 5.309 7.939 ( -1.293 -5.612 -5.845) 8.206 7.977 ( 8.413 -2.669 -6.769) 11.123 8.079 ( 0.533 7.529 2.456) 7.937 8.300 ( 12.036 0.910 -2.766) 12.383 9.241 ( -3.606 3.691 -3.048) 5.993 9.266 ( 5.749 2.624 2.128) 6.668 9.592 ( 9.304 6.224 9.988) 15.002 9.836 ( 6.665 7.726 -6.003) 11.838 9.946 ( 2.670 2.374 1.531) 3.887 10.133 ( -2.485 -0.448 9.921) 10.237 10.523 ( -8.874 2.946 -2.653) 9.719 10.913 ( -4.564 7.761 2.105) 9.247 11.053 ( 0.438 -12.889 -2.188) 13.081 11.309 ( -3.965 -9.054 5.630) 11.375 12.617 ( 5.781 1.780 0.025) 6.049 12.768 ( 5.259 -4.041 7.017) 9.655 12.827 ( 8.799 4.443 -3.152) 10.349 12.938 ( 6.324 -0.072 2.479) 6.793 14.799 ( -6.987 3.661 -0.821) 7.931 14.975 ( -6.140 -2.633 0.206) 6.684 15.319 ( -5.174 2.405 1.592) 5.923 15.440 ( -4.122 -2.987 -0.528) 5.118 15.500 ( -0.416 1.685 -4.288) 4.626 15.717 ( 1.038 -4.202 -7.153) 8.360 15.894 ( 1.950 1.288 0.894) 2.503 16.011 ( 3.595 -2.095 6.392) 7.627 20.848 ( -3.747 0.226 -2.689) 4.617 20.996 ( -5.580 -4.990 -0.892) 7.539 22.419 ( 2.259 0.011 1.833) 2.909 22.505 ( -0.074 -3.249 4.494) 5.546 ======================= Grid point 235 (123/170) ======================= q-point: ( 0.36 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( -3.411 1.323 -8.764) 9.497 2.329 ( -1.414 -0.115 -2.887) 3.216 2.430 ( 4.159 4.262 4.341) 7.370 2.520 ( 5.227 3.629 -8.964) 10.993 2.603 ( -0.904 -4.259 0.630) 4.400 2.702 ( 1.166 0.107 2.747) 2.986 2.772 ( 0.975 1.505 3.639) 4.057 2.935 ( 3.692 2.593 -3.778) 5.885 2.982 ( 1.445 -4.075 11.181) 11.988 3.218 ( -8.977 4.245 5.057) 11.144 3.390 ( 2.971 -10.648 -2.628) 11.363 3.428 ( -4.402 -6.247 2.738) 8.117 4.085 ( -9.928 3.668 -1.899) 10.753 4.178 ( -5.300 1.137 -2.361) 5.913 4.470 ( -9.959 -4.447 -21.196) 23.838 4.622 ( 3.256 4.940 -12.010) 13.388 4.882 ( -18.863 -10.360 3.733) 21.843 5.089 ( -11.450 -12.429 0.419) 16.905 5.182 ( -2.264 9.998 -4.435) 11.170 5.212 ( 2.757 5.656 7.703) 9.946 5.602 ( -7.228 -5.615 -0.023) 9.153 5.683 ( -0.400 -9.785 4.636) 10.835 5.902 ( -2.150 3.032 4.200) 5.609 6.000 ( 5.844 5.043 -5.097) 9.250 6.170 ( 7.259 0.432 -14.273) 16.019 6.324 ( 4.692 -2.092 -11.953) 13.010 6.820 ( 1.432 6.269 -2.300) 6.829 7.051 ( 0.811 -2.002 1.717) 2.760 7.244 ( -3.704 6.481 -2.200) 7.782 7.552 ( -5.639 -0.930 1.384) 5.881 7.833 ( -1.336 -1.586 -5.201) 5.599 7.973 ( -1.411 -2.455 2.073) 3.509 8.177 ( 8.761 9.201 -5.793) 13.963 8.399 ( 6.238 2.103 -6.870) 9.514 9.163 ( -1.098 1.670 -0.359) 2.031 9.284 ( -2.587 -3.177 -2.630) 4.869 9.838 ( 4.780 4.372 -0.559) 6.502 9.888 ( 5.178 1.984 2.976) 6.293 10.046 ( 6.642 0.893 9.138) 11.332 10.278 ( 2.915 0.757 11.509) 11.897 10.433 ( 0.083 10.937 1.165) 10.999 10.800 ( -7.934 9.892 0.478) 12.689 11.096 ( 3.225 -9.126 -0.388) 9.687 11.262 ( -6.749 -7.796 1.353) 10.400 12.703 ( 3.502 1.893 2.665) 4.790 12.893 ( 0.865 -5.281 7.092) 8.885 12.936 ( 6.567 3.963 -0.737) 7.706 13.039 ( 4.176 -0.049 0.964) 4.286 14.730 ( -1.642 0.828 0.923) 2.058 14.908 ( -2.317 -6.664 -0.139) 7.056 15.193 ( -9.340 -0.442 0.132) 9.351 15.291 ( -11.285 -8.027 0.546) 13.860 15.546 ( 7.031 5.082 -3.048) 9.195 15.692 ( 4.122 -1.594 -4.975) 6.655 15.963 ( 5.515 4.458 -0.169) 7.093 16.113 ( 0.994 -1.169 4.120) 4.397 20.751 ( -3.770 -4.554 -3.605) 6.925 20.877 ( -6.142 -9.045 -3.246) 11.405 22.489 ( 2.744 0.707 3.590) 4.574 22.555 ( -1.095 -2.129 5.967) 6.429 ======================= Grid point 236 (124/170) ======================= q-point: ( 0.45 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( -2.857 -0.170 -6.644) 7.234 2.245 ( -3.005 -3.617 -5.888) 7.536 2.459 ( 4.641 -1.502 -8.970) 10.210 2.498 ( -4.047 1.785 -4.941) 6.632 2.657 ( 10.302 4.047 3.521) 11.615 2.800 ( 5.690 2.603 4.081) 7.470 2.857 ( 2.266 3.028 3.552) 5.189 2.960 ( -0.215 5.769 -0.741) 5.820 3.033 ( -5.869 -0.738 3.642) 6.947 3.091 ( -8.674 5.109 4.102) 10.870 3.320 ( -8.384 -5.373 -2.512) 10.270 3.404 ( 3.101 -6.718 -3.271) 8.090 3.917 ( -4.674 0.076 -10.570) 11.557 4.113 ( 1.130 -2.429 -11.745) 12.047 4.278 ( 8.790 -17.699 -1.242) 19.801 4.508 ( -12.272 -16.557 -2.275) 20.734 4.661 ( 1.246 -7.314 -4.801) 8.837 4.843 ( -17.831 -17.304 -1.173) 24.874 5.180 ( 0.287 14.702 4.500) 15.378 5.309 ( 2.147 11.154 2.700) 11.675 5.599 ( 5.306 -3.127 0.891) 6.223 5.748 ( -0.778 -6.932 6.598) 9.602 5.864 ( -5.982 6.525 -5.367) 10.352 6.004 ( 5.809 8.605 -1.436) 10.481 6.150 ( 5.184 1.519 -16.262) 17.136 6.314 ( -1.240 -7.483 6.136) 9.756 6.759 ( 1.564 9.542 -7.146) 12.023 7.030 ( -1.362 -4.251 -5.108) 6.783 7.234 ( 2.909 2.041 0.645) 3.612 7.426 ( -7.505 -6.822 -3.460) 10.716 7.854 ( 4.551 3.843 2.569) 6.487 7.985 ( -1.185 0.784 3.129) 3.437 8.206 ( 5.366 5.313 -8.194) 11.143 8.342 ( -0.872 1.715 -10.037) 10.219 9.175 ( 0.263 -2.502 0.464) 2.558 9.212 ( -0.690 -3.412 -2.147) 4.090 9.836 ( -0.409 4.546 -0.706) 4.619 9.907 ( -3.721 -0.052 -1.687) 4.086 10.309 ( 9.630 3.434 10.126) 14.389 10.433 ( 0.034 -0.990 11.966) 12.007 10.544 ( 8.296 15.660 0.965) 17.748 10.708 ( -6.275 11.655 4.838) 14.093 11.107 ( -4.331 -7.569 -0.856) 8.762 11.163 ( -0.969 -7.315 -1.700) 7.572 12.785 ( 1.380 0.965 4.755) 5.045 12.955 ( -3.360 -5.434 6.945) 9.436 12.987 ( 2.341 3.251 -1.755) 4.374 13.102 ( 3.048 -1.201 0.099) 3.277 14.759 ( 1.840 -1.804 2.825) 3.824 14.891 ( 0.153 -8.183 -0.700) 8.214 15.088 ( -2.428 -1.278 -0.418) 2.776 15.136 ( -7.908 -5.288 0.015) 9.513 15.614 ( 3.447 4.087 -0.742) 5.398 15.704 ( 1.971 -0.002 -3.089) 3.665 16.050 ( 5.322 3.856 0.134) 6.574 16.126 ( -2.731 0.817 1.154) 3.075 20.673 ( -0.649 -8.229 -3.203) 8.854 20.750 ( -3.947 -10.976 -4.412) 12.471 22.577 ( 2.700 0.139 4.141) 4.945 22.595 ( -2.052 -0.739 5.388) 5.813 ======================= Grid point 237 (125/170) ======================= q-point: (-0.45 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( -1.096 -1.359 -2.455) 3.013 2.132 ( -0.790 -3.870 -6.419) 7.537 2.372 ( -1.933 0.558 -6.592) 6.893 2.458 ( 5.919 -5.869 -5.695) 10.095 2.787 ( -9.518 3.750 0.058) 10.231 2.845 ( 1.701 4.352 3.584) 5.889 2.893 ( -6.329 -0.100 4.629) 7.842 2.937 ( 2.433 6.839 5.944) 9.382 3.065 ( 5.917 3.866 -3.123) 7.728 3.094 ( 10.302 0.897 1.944) 10.522 3.158 ( -4.810 -5.395 -3.128) 7.876 3.440 ( 8.941 -5.091 -7.910) 12.978 3.800 ( -1.416 2.805 -4.774) 5.715 4.030 ( 6.897 2.531 -10.587) 12.886 4.271 ( -12.578 -13.418 3.006) 18.636 4.425 ( -10.078 -14.595 -2.415) 17.900 4.601 ( 11.895 -19.479 -0.069) 22.824 4.856 ( 18.143 -17.415 -0.875) 25.163 5.207 ( -6.354 13.771 5.849) 16.255 5.394 ( 5.869 13.695 1.840) 15.013 5.627 ( -6.054 5.557 -6.897) 10.728 5.691 ( -2.052 -0.119 -2.709) 3.400 5.776 ( -5.441 -8.259 5.515) 11.324 6.028 ( 1.072 -1.541 -11.688) 11.838 6.133 ( 4.773 6.683 8.737) 11.991 6.327 ( -3.024 -3.924 2.376) 5.495 6.784 ( 5.155 8.946 -1.096) 10.383 6.919 ( -0.287 -1.103 -9.223) 9.293 7.242 ( -5.651 -2.390 -1.594) 6.339 7.374 ( 9.357 -7.241 -2.036) 12.005 7.966 ( 2.424 4.909 4.956) 7.385 7.995 ( -0.859 3.182 1.824) 3.767 8.135 ( -3.711 3.144 -9.628) 10.786 8.235 ( 2.824 0.036 -7.176) 7.712 9.149 ( -2.057 -2.315 -0.413) 3.124 9.217 ( 1.428 -4.580 -1.947) 5.178 9.808 ( -6.418 2.812 0.339) 7.015 9.835 ( -0.577 2.131 1.941) 2.939 10.446 ( -3.914 10.996 0.921) 11.708 10.527 ( 3.401 4.189 2.480) 5.939 10.622 ( -3.683 8.074 7.126) 11.381 10.754 ( 4.501 8.868 2.546) 10.265 11.015 ( -3.827 -6.451 3.534) 8.291 11.189 ( 4.711 -8.406 -2.268) 9.900 12.830 ( -3.081 1.288 4.511) 5.613 12.929 ( -4.424 0.513 1.465) 4.688 13.007 ( -0.665 -1.636 2.232) 2.846 13.131 ( 1.121 -3.179 -0.716) 3.446 14.806 ( -0.614 -3.022 2.418) 3.919 14.885 ( 0.410 -5.965 -1.385) 6.137 15.072 ( 1.672 -0.283 0.074) 1.698 15.137 ( 7.684 -5.991 -0.091) 9.744 15.620 ( -2.781 2.906 0.367) 4.039 15.663 ( -3.652 0.915 -2.390) 4.459 16.057 ( -5.395 4.034 -0.053) 6.737 16.138 ( 4.609 0.932 0.234) 4.708 20.670 ( 1.924 -9.876 -2.689) 10.415 20.679 ( 2.698 -10.190 -2.374) 10.805 22.604 ( -3.009 0.967 3.438) 4.670 22.657 ( 2.253 -1.245 3.055) 3.995 ======================= Grid point 238 (126/170) ======================= q-point: (-0.36 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( -4.138 5.891 3.816) 8.148 2.122 ( 2.269 2.855 -1.715) 4.030 2.336 ( 5.566 -2.020 -4.493) 7.433 2.513 ( 4.873 -9.253 0.169) 10.459 2.641 ( -6.472 2.226 0.995) 6.916 2.807 ( -4.496 -4.261 0.203) 6.198 2.878 ( 1.763 -4.507 -0.886) 4.920 3.005 ( -5.761 -1.481 3.899) 7.112 3.175 ( 10.436 2.053 -6.674) 12.557 3.215 ( 9.496 7.363 10.123) 15.712 3.304 ( 12.139 1.692 -0.449) 12.265 3.487 ( 8.875 -3.257 -8.131) 12.470 3.723 ( -0.470 -3.646 -2.125) 4.246 4.054 ( -12.255 -16.571 1.450) 20.661 4.199 ( 6.798 18.720 0.074) 19.917 4.237 ( 2.940 3.269 -0.845) 4.477 4.943 ( 21.019 -18.541 0.339) 28.030 5.122 ( -5.394 9.180 1.669) 10.777 5.148 ( 15.086 -16.306 2.617) 22.367 5.376 ( -10.064 7.836 -6.599) 14.361 5.496 ( -1.540 6.886 3.760) 7.995 5.655 ( -0.633 -0.860 1.094) 1.529 5.727 ( -6.261 -6.427 3.362) 9.582 5.935 ( -0.413 -4.278 -6.883) 8.114 6.267 ( 0.277 3.570 3.795) 5.218 6.350 ( 5.035 2.657 0.943) 5.771 6.708 ( -3.034 5.737 -9.343) 11.375 6.967 ( 7.129 -2.689 1.060) 7.693 7.167 ( -0.774 3.432 0.366) 3.538 7.546 ( 11.747 -10.412 0.621) 15.709 7.907 ( -7.501 8.881 -7.601) 13.890 7.985 ( -2.516 2.840 2.170) 4.371 8.078 ( 0.982 3.081 3.223) 4.566 8.222 ( 3.442 -2.025 -5.780) 7.026 9.105 ( -3.702 -0.348 0.275) 3.729 9.198 ( -1.441 -5.049 -0.400) 5.266 9.721 ( -6.604 5.300 2.343) 8.786 9.862 ( -0.647 -0.992 3.597) 3.787 10.325 ( -8.431 9.602 -2.396) 13.001 10.519 ( -4.555 1.819 -1.968) 5.285 10.580 ( -3.808 10.149 -0.418) 10.848 10.861 ( 5.724 8.561 1.521) 10.410 11.089 ( 5.030 -6.152 4.268) 9.020 11.253 ( 5.542 -10.115 -0.539) 11.547 12.765 ( -8.746 4.508 1.289) 9.923 12.866 ( -7.444 2.214 2.836) 8.268 13.003 ( -2.537 -2.390 1.284) 3.714 13.122 ( -0.721 -4.172 -1.644) 4.542 14.800 ( -0.095 2.245 -1.352) 2.622 14.896 ( 3.157 -4.834 0.506) 5.796 15.174 ( 8.391 -0.544 0.398) 8.418 15.294 ( 10.720 -8.157 0.609) 13.485 15.526 ( -8.323 1.642 -0.834) 8.524 15.562 ( -5.056 -0.332 -0.801) 5.129 15.965 ( -5.570 6.978 0.051) 8.928 16.199 ( 2.626 -1.921 -0.186) 3.259 20.682 ( 4.205 -6.300 -1.598) 7.742 20.771 ( 7.745 -9.334 0.635) 12.145 22.576 ( -3.678 2.535 1.068) 4.593 22.708 ( 1.478 -3.002 0.686) 3.416 ======================= Grid point 239 (127/170) ======================= q-point: (-0.27 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( -1.321 11.836 9.845) 15.452 2.128 ( -0.929 11.906 2.888) 12.286 2.412 ( 6.917 -4.070 -1.804) 8.225 2.621 ( 2.197 -1.132 -0.359) 2.497 2.626 ( 4.698 -8.953 5.923) 11.718 2.746 ( 0.671 -3.768 -4.736) 6.089 2.891 ( 2.027 -7.938 -4.495) 9.345 2.949 ( -3.567 -1.409 0.489) 3.866 3.150 ( 2.942 0.508 -12.310) 12.667 3.403 ( 0.054 -0.260 0.360) 0.448 3.454 ( 7.280 -3.099 -7.300) 10.766 3.580 ( 2.872 -6.810 1.090) 7.471 3.785 ( 4.131 -0.244 19.684) 20.114 3.937 ( -2.444 -3.003 8.529) 9.367 4.368 ( 14.447 20.616 -1.032) 25.195 4.423 ( 12.245 19.360 4.717) 23.388 4.999 ( -4.285 9.140 0.983) 10.143 5.157 ( -0.463 1.298 -2.186) 2.584 5.211 ( -1.262 10.749 -1.194) 10.889 5.395 ( -1.005 -15.108 6.214) 16.367 5.491 ( -0.747 -2.645 4.672) 5.420 5.661 ( 4.832 -8.688 -0.093) 9.942 5.796 ( 9.597 -6.026 4.520) 12.200 5.850 ( -0.854 -9.175 -5.661) 10.814 6.266 ( 2.758 5.184 -6.656) 8.876 6.370 ( -2.269 -1.117 -3.905) 4.652 6.661 ( 5.202 9.743 2.878) 11.414 7.095 ( 6.788 -7.382 2.405) 10.313 7.212 ( 3.037 9.629 1.816) 10.258 7.692 ( -7.995 8.065 -1.593) 11.467 7.727 ( 7.017 -7.157 -3.370) 10.574 7.964 ( -2.442 -0.784 0.260) 2.578 8.111 ( -2.040 5.432 3.698) 6.881 8.206 ( 2.541 -1.932 -5.240) 6.136 9.044 ( -5.314 3.337 2.880) 6.904 9.183 ( -2.936 -3.250 3.693) 5.729 9.649 ( -6.287 4.536 2.879) 8.271 9.854 ( -4.775 -2.536 1.378) 5.579 10.164 ( -6.642 4.578 -4.452) 9.214 10.399 ( -5.422 0.148 -2.995) 6.196 10.540 ( 1.836 8.583 -2.599) 9.154 10.962 ( 6.460 10.416 -0.114) 12.257 11.195 ( 6.886 -9.905 -3.592) 12.587 11.359 ( 6.238 -9.610 2.919) 11.823 12.610 ( -11.551 6.532 0.437) 13.277 12.729 ( -14.195 4.148 2.950) 15.080 12.951 ( -4.415 -2.414 -0.755) 5.088 13.067 ( -3.533 -3.817 -2.613) 5.820 14.809 ( 3.932 5.182 -1.549) 6.687 14.997 ( 8.421 -2.405 0.130) 8.758 15.240 ( -3.709 0.988 2.740) 4.716 15.327 ( -10.158 0.429 1.990) 10.360 15.514 ( 10.333 -1.360 -2.135) 10.638 15.556 ( 7.096 -5.279 -0.846) 8.885 15.906 ( -1.527 5.114 1.036) 5.437 16.207 ( -0.265 -3.964 -1.974) 4.437 20.754 ( 5.092 -0.597 0.363) 5.139 20.910 ( 7.640 -6.605 1.693) 10.240 22.517 ( -3.614 3.152 -0.949) 4.889 22.716 ( 0.546 -4.836 -2.195) 5.338 ======================= Grid point 240 (128/170) ======================= q-point: (-0.18 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( -2.158 12.871 4.293) 13.738 2.212 ( 0.464 15.164 8.709) 17.493 2.480 ( 3.745 -4.160 -2.760) 6.241 2.633 ( 1.960 -2.816 -4.983) 6.050 2.714 ( 1.480 -2.493 -1.729) 3.376 2.789 ( 4.020 -4.422 5.505) 8.125 2.825 ( 1.138 -8.182 -9.502) 12.590 2.920 ( 2.006 -1.572 -1.560) 2.988 3.096 ( 1.403 -6.025 -3.737) 7.227 3.296 ( -5.425 -6.672 -0.541) 8.617 3.381 ( 0.382 -2.110 -14.199) 14.361 3.574 ( -1.764 -7.766 -4.340) 9.070 4.100 ( 3.614 8.581 15.786) 18.327 4.187 ( 4.990 0.220 30.344) 30.752 4.565 ( 8.256 24.743 2.751) 26.229 4.667 ( 9.099 21.526 4.757) 23.849 4.986 ( 1.041 12.380 4.350) 13.163 5.135 ( -7.831 9.915 2.363) 12.854 5.208 ( 6.844 4.674 0.380) 8.296 5.370 ( -2.076 -5.063 -1.213) 5.605 5.475 ( -0.904 6.166 4.498) 7.686 5.758 ( -3.351 -9.123 -1.681) 9.863 5.807 ( 4.007 -10.239 2.475) 11.270 6.032 ( 9.351 -10.144 2.562) 14.032 6.246 ( 4.432 3.074 -7.013) 8.847 6.363 ( 7.838 -3.862 2.666) 9.136 6.854 ( 11.900 5.632 2.383) 13.379 7.178 ( 0.443 -1.898 -1.865) 2.697 7.289 ( 4.385 13.681 3.366) 14.756 7.494 ( -10.872 7.664 -1.322) 13.367 7.800 ( -0.005 -4.277 -1.757) 4.624 7.910 ( -1.647 -9.250 0.141) 9.396 8.078 ( -4.879 6.094 0.886) 7.857 8.209 ( 4.227 -2.035 -4.717) 6.653 9.018 ( -5.034 6.038 6.222) 10.026 9.174 ( -3.768 0.015 3.991) 5.489 9.565 ( -8.357 1.898 1.259) 8.662 9.768 ( -3.285 -1.814 -1.684) 4.113 10.015 ( -6.110 2.506 -4.637) 8.070 10.353 ( 4.537 0.027 -2.010) 4.962 10.573 ( 3.383 1.817 -0.825) 3.927 11.061 ( 6.175 10.359 -1.406) 12.142 11.229 ( 6.325 -12.834 -7.592) 16.197 11.484 ( 6.342 -9.285 0.316) 11.248 12.424 ( -13.135 7.169 1.483) 15.037 12.519 ( -15.677 5.336 4.538) 17.171 12.851 ( -5.647 -2.042 -3.039) 6.730 12.952 ( -6.264 -3.554 -3.674) 8.085 14.882 ( 4.473 6.903 1.011) 8.288 15.090 ( 0.686 -2.932 0.333) 3.029 15.212 ( -5.974 3.410 4.258) 8.091 15.255 ( 4.047 3.235 4.617) 6.940 15.560 ( -0.294 8.268 -3.543) 9.000 15.722 ( 12.233 -5.266 -1.452) 13.397 15.970 ( 6.784 -3.852 1.252) 7.901 16.152 ( -1.746 -4.767 -4.377) 6.703 20.833 ( 3.570 5.532 1.396) 6.730 21.025 ( 4.124 -2.268 1.631) 4.981 22.449 ( -2.614 2.127 -2.114) 3.978 22.679 ( -0.269 -6.509 -4.804) 8.094 ======================= Grid point 241 (129/170) ======================= q-point: (-0.09 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( -2.103 12.071 4.964) 13.220 2.190 ( -8.186 13.151 -2.424) 15.679 2.455 ( -0.469 -7.168 -4.435) 8.442 2.595 ( -0.527 3.191 -7.586) 8.247 2.700 ( -0.276 -2.164 -2.492) 3.312 2.749 ( 1.209 -8.060 -4.429) 9.276 2.889 ( 6.906 -1.083 -3.790) 7.952 2.989 ( 3.845 -7.375 1.313) 8.420 3.107 ( 3.086 -6.216 -1.247) 7.051 3.225 ( -2.459 -1.593 -5.488) 6.221 3.279 ( 1.130 -9.107 1.095) 9.242 3.484 ( -0.929 -7.078 -4.511) 8.444 4.357 ( 3.325 11.905 20.175) 23.660 4.520 ( 1.711 0.646 19.536) 19.622 4.689 ( 1.552 27.623 7.770) 28.737 4.772 ( -2.006 17.053 6.695) 18.430 5.035 ( -2.072 9.385 -0.203) 9.613 5.141 ( -1.332 7.510 15.716) 17.469 5.267 ( 1.723 2.173 -4.006) 4.873 5.387 ( 3.536 3.709 2.390) 5.654 5.567 ( 5.602 1.171 -2.809) 6.375 5.749 ( -0.598 -5.475 6.778) 8.734 5.840 ( 3.763 5.038 -0.478) 6.306 6.178 ( 4.901 -4.501 4.477) 8.020 6.312 ( 7.896 5.196 0.091) 9.453 6.493 ( 1.792 5.252 1.217) 5.681 7.013 ( -8.902 9.093 -1.469) 12.810 7.081 ( 13.631 -0.634 -6.612) 15.163 7.327 ( -5.811 1.037 -6.026) 8.436 7.420 ( -0.879 1.973 6.836) 7.169 7.729 ( -1.633 -3.067 2.784) 4.453 7.951 ( 0.789 -6.097 1.241) 6.272 8.013 ( 0.229 2.159 -2.554) 3.353 8.205 ( 1.794 -4.319 -4.808) 6.708 8.977 ( -7.629 4.171 3.469) 9.361 9.145 ( -3.722 -2.676 0.305) 4.594 9.434 ( -5.496 5.126 -0.402) 7.527 9.773 ( 0.282 -1.039 1.954) 2.231 9.899 ( 0.376 10.176 -2.802) 10.561 10.450 ( 7.272 -8.426 -2.723) 11.458 10.591 ( -1.997 2.307 1.762) 3.524 11.053 ( 0.262 -0.338 -9.037) 9.047 11.294 ( 8.537 -6.272 -2.370) 10.855 11.551 ( 4.991 -9.411 -3.974) 11.370 12.253 ( -11.433 6.951 4.180) 14.018 12.385 ( -9.560 3.768 7.526) 12.737 12.714 ( -4.672 -0.597 -5.799) 7.471 12.822 ( -4.250 -3.041 -3.688) 6.396 14.943 ( -0.279 5.592 5.241) 7.669 15.107 ( -2.043 -3.205 6.723) 7.723 15.246 ( 5.112 8.731 2.263) 10.368 15.388 ( 3.022 5.403 2.295) 6.603 15.486 ( -1.649 10.326 -3.777) 11.118 15.842 ( 5.911 -7.194 -4.832) 10.490 16.052 ( 1.341 -3.589 -0.697) 3.895 16.114 ( 4.303 -5.369 -3.271) 7.618 20.899 ( 2.711 10.035 2.065) 10.598 21.067 ( -0.572 3.067 0.941) 3.259 22.396 ( -1.061 -0.300 -2.031) 2.311 22.607 ( -0.629 -7.651 -6.573) 10.106 ======================= Grid point 242 (130/170) ======================= q-point: ( 0.00 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( -7.046 -6.069 -4.624) 10.386 2.165 ( -7.046 6.069 -4.624) 10.386 2.378 ( 2.528 -7.080 -5.169) 9.123 2.378 ( 2.528 7.080 -5.169) 9.123 2.696 ( -1.856 -2.428 -2.884) 4.202 2.696 ( -1.856 2.428 -2.884) 4.202 2.867 ( 2.481 -2.525 -6.703) 7.580 2.867 ( 2.481 2.525 -6.703) 7.580 3.107 ( -0.853 -2.458 4.777) 5.439 3.107 ( -0.853 2.458 4.777) 5.439 3.375 ( 4.983 -4.683 -0.124) 6.840 3.375 ( 4.983 4.683 -0.124) 6.840 4.668 ( -0.105 -2.311 9.784) 10.054 4.668 ( -0.105 2.311 9.784) 10.054 5.008 ( -4.546 -4.790 5.303) 8.469 5.008 ( -4.546 4.790 5.303) 8.469 5.244 ( -1.410 -4.130 0.513) 4.394 5.244 ( -1.410 4.130 0.513) 4.394 5.493 ( 1.110 -2.085 5.242) 5.749 5.493 ( 1.110 2.085 5.242) 5.749 5.604 ( 0.342 -16.766 14.284) 22.029 5.604 ( 0.342 16.766 14.284) 22.029 6.224 ( 9.219 -8.907 2.395) 13.041 6.224 ( 9.219 8.907 2.395) 13.041 6.540 ( -6.086 -6.142 -2.384) 8.969 6.540 ( -6.086 6.142 -2.384) 8.969 7.058 ( -17.167 -10.749 -3.542) 20.562 7.058 ( -17.167 10.749 -3.542) 20.562 7.233 ( 16.529 -9.453 -3.091) 19.290 7.233 ( 16.529 9.453 -3.091) 19.290 7.896 ( -0.162 -1.250 2.702) 2.981 7.896 ( -0.162 1.250 2.702) 2.981 8.018 ( 4.605 -8.129 -6.502) 11.383 8.018 ( 4.605 8.129 -6.502) 11.383 8.967 ( -3.699 -4.638 -0.364) 5.944 8.967 ( -3.699 4.638 -0.364) 5.944 9.678 ( 0.103 -9.568 7.451) 12.127 9.678 ( 0.103 9.568 7.451) 12.127 10.237 ( 0.707 -9.566 2.650) 9.951 10.237 ( 0.707 9.566 2.650) 9.951 10.719 ( -0.112 -11.156 -10.145) 15.079 10.719 ( -0.112 11.156 -10.145) 15.079 11.380 ( -0.083 -5.593 -3.123) 6.407 11.380 ( -0.083 5.593 -3.123) 6.407 12.312 ( -2.264 -4.598 3.371) 6.134 12.312 ( -2.264 4.598 3.371) 6.134 12.690 ( 1.208 -3.287 -2.798) 4.483 12.690 ( 1.208 3.287 -2.798) 4.483 15.120 ( 1.124 -3.680 9.819) 10.546 15.120 ( 1.124 3.680 9.819) 10.546 15.450 ( -5.733 -0.695 -0.373) 5.787 15.450 ( -5.733 0.695 -0.373) 5.787 15.644 ( 6.054 -10.300 -6.331) 13.521 15.644 ( 6.054 10.300 -6.331) 13.521 16.037 ( -0.958 -1.590 -1.143) 2.180 16.037 ( -0.958 1.590 -1.143) 2.180 21.114 ( -0.104 -1.500 1.960) 2.470 21.114 ( -0.104 1.500 1.960) 2.470 22.384 ( -0.106 -4.211 -4.362) 6.064 22.384 ( -0.106 4.211 -4.362) 6.064 ======================= Grid point 244 (131/170) ======================= q-point: ( 0.09 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( -0.782 -3.690 3.478) 5.130 2.087 ( -0.782 3.690 3.478) 5.130 2.383 ( 3.690 -5.946 -3.116) 7.660 2.383 ( 3.690 5.946 -3.116) 7.660 2.619 ( -3.215 -1.473 -2.743) 4.476 2.619 ( -3.215 1.473 -2.743) 4.476 2.843 ( 1.707 -2.262 -4.076) 4.964 2.843 ( 1.707 2.262 -4.076) 4.964 3.140 ( -0.741 -1.428 4.698) 4.966 3.140 ( -0.741 1.428 4.698) 4.966 3.402 ( 0.526 -2.618 -5.375) 6.002 3.402 ( 0.526 2.618 -5.375) 6.002 4.719 ( -1.737 -4.554 3.497) 5.999 4.719 ( -1.737 4.554 3.497) 5.999 4.993 ( -4.171 -1.624 4.980) 6.696 4.993 ( -4.171 1.624 4.980) 6.696 5.201 ( -5.284 -2.415 1.965) 6.133 5.201 ( -5.284 2.415 1.965) 6.133 5.495 ( -1.565 -0.223 -3.021) 3.410 5.495 ( -1.565 0.223 -3.021) 3.410 5.815 ( -3.654 -13.676 17.853) 22.784 5.815 ( -3.654 13.676 17.853) 22.784 6.257 ( -4.177 -14.527 -1.236) 15.166 6.257 ( -4.177 14.527 -1.236) 15.166 6.467 ( 4.843 -4.436 -4.332) 7.867 6.467 ( 4.843 4.436 -4.332) 7.867 6.712 ( -20.701 -12.336 -0.057) 24.098 6.712 ( -20.701 12.336 -0.057) 24.098 7.501 ( 17.533 -11.633 -3.023) 21.258 7.501 ( 17.533 11.633 -3.023) 21.258 7.855 ( -2.024 -6.613 -1.518) 7.080 7.855 ( -2.024 6.613 -1.518) 7.080 8.071 ( 6.116 -4.647 -3.555) 8.464 8.071 ( 6.116 4.647 -3.555) 8.464 8.979 ( 3.910 -4.664 2.717) 6.665 8.979 ( 3.910 4.664 2.717) 6.665 9.785 ( 4.764 -5.416 4.287) 8.391 9.785 ( 4.764 5.416 4.287) 8.391 10.170 ( -10.042 -1.511 -0.989) 10.203 10.170 ( -10.042 1.511 -0.989) 10.203 10.705 ( 8.156 -8.364 -4.485) 12.513 10.705 ( 8.156 8.364 -4.485) 12.513 11.265 ( -10.027 -3.655 -1.435) 10.769 11.265 ( -10.027 3.655 -1.435) 10.769 12.389 ( 6.331 -2.400 3.265) 7.517 12.389 ( 6.331 2.400 3.265) 7.517 12.713 ( 5.265 -1.571 -2.607) 6.082 12.713 ( 5.265 1.571 -2.607) 6.082 15.237 ( -2.079 -2.469 1.600) 3.602 15.237 ( -2.079 2.469 1.600) 3.602 15.326 ( -5.318 -6.168 6.050) 10.146 15.326 ( -5.318 6.168 6.050) 10.146 15.670 ( 5.387 -7.988 -7.045) 11.935 15.670 ( 5.387 7.988 -7.045) 11.935 15.966 ( -6.592 -0.911 0.079) 6.655 15.966 ( -6.592 0.911 0.079) 6.655 21.101 ( -3.817 -1.997 1.268) 4.490 21.101 ( -3.817 1.997 1.268) 4.490 22.361 ( 1.878 -2.774 -2.337) 4.085 22.361 ( 1.878 2.774 -2.337) 4.085 ======================= Grid point 246 (132/170) ======================= q-point: ( 0.18 -0.50 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 4.998 -1.628 9.742) 11.070 2.206 ( 4.998 1.628 9.742) 11.070 2.419 ( 4.459 -3.601 -3.239) 6.584 2.419 ( 4.459 3.601 -3.240) 6.584 2.553 ( -3.441 -2.557 2.224) 4.830 2.553 ( -3.441 2.557 2.224) 4.830 2.820 ( -0.117 -3.542 -3.294) 4.838 2.820 ( -0.117 3.542 -3.294) 4.838 3.177 ( -0.813 -4.314 1.551) 4.656 3.177 ( -0.813 4.314 1.551) 4.656 3.295 ( -2.628 -4.020 -5.834) 7.556 3.295 ( -2.628 4.020 -5.834) 7.556 4.708 ( -2.255 -8.112 -0.550) 8.437 4.708 ( -2.255 8.112 -0.550) 8.437 4.996 ( -3.708 -4.694 4.998) 7.795 4.996 ( -3.708 4.694 4.998) 7.795 5.105 ( -10.372 -2.652 1.519) 10.813 5.105 ( -10.372 2.652 1.519) 10.813 5.386 ( -7.204 -5.275 -2.636) 9.310 5.386 ( -7.204 5.275 -2.636) 9.310 5.768 ( -10.247 -3.235 2.202) 10.968 5.768 ( -10.247 3.235 2.202) 10.968 6.114 ( -17.572 -12.217 -1.198) 21.435 6.114 ( -17.572 12.217 -1.198) 21.435 6.419 ( 9.351 -4.360 -18.143) 20.871 6.419 ( 9.351 4.360 -18.143) 20.871 6.673 ( 1.101 -5.802 16.278) 17.316 6.673 ( 1.101 5.802 16.278) 17.316 7.632 ( 0.400 -9.643 -0.685) 9.676 7.632 ( 0.400 9.643 -0.685) 9.676 7.868 ( 9.650 -4.468 -6.966) 12.713 7.868 ( 9.650 4.468 -6.966) 12.713 8.122 ( 4.283 -1.022 -0.251) 4.410 8.122 ( 4.283 1.022 -0.251) 4.410 9.135 ( 8.672 -2.963 5.710) 10.798 9.135 ( 8.672 2.963 5.710) 10.798 9.861 ( 0.868 -9.222 -6.910) 11.556 9.861 ( 0.868 9.222 -6.910) 11.556 10.013 ( -5.488 -4.977 4.841) 8.850 10.013 ( -5.488 4.977 4.841) 8.850 10.775 ( 3.122 -5.710 -3.457) 7.369 10.775 ( 3.122 5.710 -3.457) 7.369 11.118 ( -7.577 -4.037 3.915) 9.436 11.118 ( -7.577 4.037 3.915) 9.436 12.542 ( 7.627 -1.651 3.218) 8.441 12.542 ( 7.627 1.651 3.218) 8.441 12.792 ( 7.588 -1.337 -1.656) 7.881 12.792 ( 7.588 1.337 -1.656) 7.881 15.076 ( -11.150 -3.563 -1.756) 11.836 15.076 ( -11.150 3.563 -1.756) 11.836 15.404 ( -0.913 -5.153 4.941) 7.198 15.404 ( -0.913 5.153 4.941) 7.198 15.656 ( 2.004 -6.271 -6.680) 9.379 15.656 ( 2.004 6.271 -6.680) 9.379 15.885 ( -2.832 -1.535 2.500) 4.078 15.885 ( -2.832 1.535 2.500) 4.078 21.024 ( -6.612 -3.818 -0.126) 7.636 21.024 ( -6.612 3.818 -0.126) 7.636 22.388 ( 2.429 -2.455 0.605) 3.506 22.388 ( 2.429 2.455 0.605) 3.506 ======================= Grid point 248 (133/170) ======================= q-point: ( 0.27 -0.50 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.370 ( 0.709 -2.863 1.508) 3.313 2.370 ( 0.709 2.863 1.508) 3.313 2.421 ( 4.352 -5.703 0.214) 7.177 2.421 ( 4.352 5.703 0.214) 7.177 2.617 ( 2.440 -3.311 7.296) 8.375 2.617 ( 2.440 3.311 7.296) 8.375 2.764 ( -0.946 -3.451 -2.600) 4.423 2.764 ( -0.946 3.451 -2.600) 4.423 3.116 ( 0.662 -10.433 -6.398) 12.257 3.116 ( 0.662 10.433 -6.398) 12.257 3.288 ( -0.933 -3.092 4.937) 5.899 3.288 ( -0.933 3.092 4.937) 5.899 4.587 ( -9.417 -9.399 -7.519) 15.283 4.587 ( -9.417 9.399 -7.519) 15.283 4.801 ( -23.278 -12.998 1.085) 26.683 4.801 ( -23.278 12.998 1.085) 26.683 4.992 ( -7.981 -5.390 0.995) 9.682 4.992 ( -7.981 5.390 0.995) 9.682 5.314 ( -0.269 -10.669 3.088) 11.110 5.314 ( -0.269 10.669 3.088) 11.110 5.611 ( -7.180 -8.347 -6.405) 12.738 5.611 ( -7.180 8.347 -6.405) 12.738 5.919 ( -4.425 -2.832 4.601) 6.984 5.919 ( -4.425 2.832 4.601) 6.984 6.348 ( 8.987 -3.219 -21.647) 23.659 6.348 ( 8.987 3.219 -21.647) 23.659 6.872 ( 2.433 -6.058 10.792) 12.613 6.872 ( 2.433 6.058 10.792) 12.613 7.561 ( -5.948 -8.359 -1.923) 10.438 7.561 ( -5.948 8.359 -1.923) 10.438 7.900 ( 3.536 -2.645 -6.962) 8.244 7.900 ( 3.536 2.645 -6.962) 8.244 8.242 ( 9.437 -6.044 0.816) 11.236 8.242 ( 9.437 6.044 0.816) 11.236 9.284 ( 1.479 -0.859 0.369) 1.750 9.284 ( 1.479 0.859 0.369) 1.750 9.767 ( 1.773 -8.980 -0.602) 9.173 9.767 ( 1.773 8.980 -0.602) 9.173 10.073 ( 0.925 -6.631 5.135) 8.438 10.073 ( 0.925 6.631 5.135) 8.438 10.743 ( -0.320 -15.165 -1.829) 15.279 10.743 ( -0.320 15.165 -1.829) 15.279 11.104 ( -2.749 -9.765 4.265) 11.004 11.104 ( -2.749 9.765 4.265) 11.004 12.681 ( 4.604 -3.907 4.171) 7.339 12.681 ( 4.604 3.907 4.171) 7.339 12.906 ( 7.882 -2.801 -0.396) 8.374 12.906 ( 7.882 2.801 -0.396) 8.374 14.896 ( -9.365 -4.779 -0.439) 10.523 14.896 ( -9.365 4.779 -0.439) 10.523 15.351 ( -9.508 -2.107 1.204) 9.813 15.351 ( -9.508 2.107 1.204) 9.813 15.613 ( 3.773 -5.492 -6.312) 9.179 15.613 ( 3.773 5.492 -6.312) 9.179 15.952 ( 4.571 -3.286 3.855) 6.823 15.952 ( 4.571 3.286 3.855) 6.823 20.895 ( -8.126 -3.938 -2.072) 9.264 20.895 ( -8.126 3.938 -2.072) 9.264 22.444 ( 1.838 -2.252 3.373) 4.453 22.444 ( 1.838 2.252 3.373) 4.453 ======================= Grid point 250 (134/170) ======================= q-point: ( 0.36 -0.50 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -2.764 -1.417 -6.073) 6.821 2.298 ( -2.764 1.417 -6.073) 6.821 2.520 ( 0.497 -3.573 0.624) 3.661 2.520 ( 0.497 3.573 0.624) 3.661 2.648 ( 6.522 -4.781 -4.523) 9.266 2.648 ( 6.522 4.781 -4.523) 9.266 2.859 ( 3.743 -6.277 9.532) 12.011 2.859 ( 3.743 6.277 9.532) 12.011 3.105 ( 4.623 -12.399 -3.681) 13.735 3.105 ( 4.623 12.399 -3.681) 13.735 3.307 ( -4.231 -4.552 4.344) 7.582 3.307 ( -4.231 4.552 4.344) 7.582 4.259 ( -16.397 -10.883 -9.718) 21.948 4.259 ( -16.397 10.883 -9.718) 21.948 4.434 ( -22.644 -17.891 0.910) 28.874 4.434 ( -22.644 17.891 0.910) 28.874 4.836 ( -7.927 -7.508 -6.287) 12.599 4.836 ( -7.927 7.508 -6.287) 12.599 5.384 ( 2.828 -4.200 2.647) 5.713 5.384 ( 2.828 4.200 2.647) 5.713 5.497 ( 0.120 -4.380 -1.047) 4.505 5.497 ( 0.120 4.380 -1.047) 4.505 6.007 ( 2.428 -4.409 9.240) 10.522 6.007 ( 2.428 4.409 9.240) 10.522 6.235 ( 6.732 -4.877 -21.127) 22.704 6.235 ( 6.732 4.877 -21.127) 22.704 6.958 ( 0.691 -5.989 0.334) 6.038 6.958 ( 0.691 5.989 0.334) 6.038 7.422 ( -7.122 -9.027 -3.661) 12.067 7.422 ( -7.122 9.027 -3.661) 12.067 7.887 ( 1.513 -4.702 -0.353) 4.952 7.887 ( 1.513 4.702 -0.353) 4.952 8.356 ( 6.437 -6.143 -5.316) 10.365 8.356 ( 6.437 6.143 -5.316) 10.365 9.211 ( -4.045 -3.144 -2.840) 5.857 9.211 ( -4.045 3.144 -2.840) 5.857 9.886 ( 6.020 -1.836 0.333) 6.302 9.886 ( 6.020 1.836 0.333) 6.302 10.159 ( 1.404 -7.500 11.956) 14.183 10.159 ( 1.404 7.500 11.956) 14.183 10.768 ( 3.848 -14.614 0.726) 15.129 10.768 ( 3.848 14.614 0.726) 15.129 11.076 ( -4.659 -8.842 0.880) 10.033 11.076 ( -4.659 8.842 0.880) 10.033 12.778 ( 0.869 -4.904 5.888) 7.712 12.778 ( 0.869 4.904 5.888) 7.712 13.010 ( 5.436 -2.595 -0.708) 6.065 13.010 ( 5.436 2.595 -0.708) 6.065 14.790 ( -4.367 -4.447 0.910) 6.299 14.790 ( -4.367 4.447 0.910) 6.299 15.192 ( -9.876 -1.386 0.236) 9.975 15.192 ( -9.876 1.386 0.236) 9.975 15.640 ( 6.141 -3.477 -4.316) 8.272 15.640 ( 6.141 3.477 -4.316) 8.272 16.057 ( 3.694 -3.882 2.437) 5.886 16.057 ( 3.694 3.882 2.437) 5.886 20.736 ( -7.352 -3.365 -3.883) 8.970 20.736 ( -7.352 3.365 -3.883) 8.970 22.514 ( 1.056 -1.629 5.013) 5.376 22.514 ( 1.056 1.629 5.013) 5.376 ======================= Grid point 252 (135/170) ======================= q-point: ( 0.45 -0.50 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( -3.237 -3.054 -8.262) 9.384 2.164 ( -3.237 3.054 -8.262) 9.384 2.454 ( -0.584 -1.659 -7.690) 7.888 2.454 ( -0.584 1.659 -7.690) 7.888 2.799 ( 12.152 -3.293 0.733) 12.611 2.799 ( 12.152 3.293 0.733) 12.611 2.964 ( -2.850 -6.014 5.701) 8.764 2.964 ( -2.850 6.014 5.701) 8.764 3.165 ( 6.410 -10.713 -2.596) 12.752 3.165 ( 6.410 10.713 -2.596) 12.752 3.211 ( -10.651 -7.026 0.021) 12.760 3.211 ( -10.651 7.026 0.021) 12.760 4.002 ( -4.811 -7.424 -3.043) 9.355 4.002 ( -4.811 7.424 -3.043) 9.355 4.172 ( -11.230 -10.438 2.711) 15.570 4.173 ( -11.230 10.438 2.711) 15.570 4.620 ( -4.416 -3.327 -12.932) 14.064 4.620 ( -4.416 3.327 -12.932) 14.064 5.464 ( 4.206 -9.657 2.601) 10.849 5.464 ( 4.206 9.657 2.601) 10.849 5.551 ( 0.259 -9.926 6.283) 11.751 5.551 ( 0.259 9.926 6.283) 11.751 6.060 ( -0.947 -9.732 -12.499) 15.870 6.060 ( -0.947 9.732 -12.499) 15.870 6.161 ( 3.113 -5.867 2.562) 7.119 6.161 ( 3.113 5.867 2.562) 7.119 6.929 ( 1.344 -6.082 -5.983) 8.637 6.929 ( 1.344 6.082 -5.983) 8.637 7.295 ( -3.858 -4.517 -2.501) 6.445 7.295 ( -3.858 4.517 -2.501) 6.445 7.946 ( 3.131 -3.767 3.379) 5.950 7.946 ( 3.131 3.767 3.379) 5.950 8.320 ( 0.276 -3.931 -9.267) 10.070 8.320 ( 0.276 3.931 -9.267) 10.070 9.157 ( -0.401 -1.294 -1.417) 1.960 9.157 ( -0.401 1.294 -1.417) 1.960 9.892 ( -1.629 -1.370 -1.840) 2.813 9.892 ( -1.629 1.370 -1.840) 2.813 10.385 ( 5.818 -3.283 14.018) 15.528 10.385 ( 5.818 3.283 14.018) 15.528 10.844 ( 2.330 -9.037 1.744) 9.494 10.844 ( 2.330 9.037 1.744) 9.494 10.991 ( -4.365 -6.277 -1.359) 7.766 10.991 ( -4.365 6.277 -1.359) 7.766 12.842 ( -1.405 -4.355 6.639) 8.063 12.842 ( -1.405 4.355 6.639) 8.063 13.055 ( 2.286 -2.879 -1.805) 4.096 13.055 ( 2.286 2.879 -1.805) 4.096 14.768 ( -0.678 -2.999 1.497) 3.419 14.768 ( -0.678 2.999 1.497) 3.419 15.082 ( -3.707 -0.829 0.078) 3.799 15.082 ( -3.707 0.829 0.078) 3.799 15.683 ( 2.870 -2.174 -1.958) 4.098 15.683 ( 2.870 2.174 -1.958) 4.098 16.114 ( 1.296 -1.939 0.803) 2.466 16.114 ( 1.296 1.939 0.803) 2.466 20.601 ( -3.207 -2.072 -4.337) 5.778 20.601 ( -3.207 2.072 -4.337) 5.778 22.582 ( 0.351 -0.418 4.970) 5.000 22.582 ( 0.351 0.418 4.970) 5.000 ======================= Grid point 254 (136/170) ======================= q-point: (-0.45 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.064 ( 1.831 -1.963 -5.803) 6.394 2.064 ( 1.831 1.963 -5.803) 6.394 2.373 ( 1.660 -1.484 -7.534) 7.856 2.373 ( 1.660 1.484 -7.534) 7.856 2.866 ( -11.470 -2.777 0.731) 11.824 2.866 ( -11.470 2.777 0.731) 11.824 2.968 ( -0.681 -7.388 1.206) 7.516 2.968 ( -0.681 7.388 1.206) 7.516 3.081 ( 4.492 -2.884 1.208) 5.473 3.081 ( 4.492 2.884 1.208) 5.473 3.270 ( 9.195 -10.290 -2.246) 13.981 3.270 ( 9.195 10.290 -2.246) 13.981 3.925 ( -7.860 -9.552 -0.955) 12.407 3.925 ( -7.860 9.552 -0.955) 12.407 4.193 ( 8.881 -7.841 3.051) 12.234 4.193 ( 8.881 7.841 3.051) 12.234 4.513 ( 9.500 -11.695 -8.690) 17.394 4.513 ( 9.500 11.695 -8.690) 17.394 5.515 ( -7.110 -13.106 5.482) 15.886 5.515 ( -7.110 13.106 5.482) 15.886 5.613 ( 2.671 -5.785 1.909) 6.652 5.613 ( 2.671 5.785 1.909) 6.652 5.871 ( -2.938 -11.324 -11.569) 16.453 5.871 ( -2.938 11.324 -11.569) 16.453 6.249 ( 0.966 -3.930 7.025) 8.107 6.249 ( 0.966 3.930 7.025) 8.107 6.895 ( 3.714 -1.892 -8.401) 9.378 6.895 ( 3.714 1.892 -8.401) 9.378 7.254 ( 0.970 -3.757 -0.377) 3.898 7.254 ( 0.970 3.757 -0.377) 3.898 8.033 ( 2.112 -0.471 3.687) 4.275 8.033 ( 2.112 0.471 3.687) 4.275 8.201 ( -1.814 -2.919 -8.566) 9.230 8.201 ( -1.814 2.919 -8.566) 9.230 9.141 ( 0.148 -1.861 -1.789) 2.585 9.141 ( 0.148 1.861 -1.789) 2.585 9.845 ( -3.196 -0.839 0.930) 3.433 9.845 ( -3.196 0.839 0.930) 3.433 10.563 ( 0.240 -1.186 4.888) 5.035 10.563 ( 0.240 1.186 4.888) 5.035 10.833 ( -3.862 -10.443 3.755) 11.750 10.833 ( -3.862 10.443 3.755) 11.750 10.981 ( 3.464 -10.916 -0.690) 11.473 10.981 ( 3.464 10.916 -0.690) 11.473 12.877 ( -3.109 -3.131 5.921) 7.384 12.877 ( -3.109 3.131 5.921) 7.384 13.051 ( 0.214 -3.841 -2.264) 4.463 13.051 ( 0.214 3.841 -2.264) 4.463 14.790 ( 1.738 -2.287 0.819) 2.987 14.790 ( 1.738 2.287 0.819) 2.987 15.080 ( 3.117 -0.887 0.180) 3.246 15.080 ( 3.117 0.887 0.180) 3.246 15.664 ( -3.629 -1.025 -0.980) 3.896 15.664 ( -3.629 1.025 -0.980) 3.896 16.125 ( -0.274 -2.117 0.158) 2.141 16.125 ( -0.274 2.117 0.158) 2.141 20.559 ( 3.223 -0.242 -2.902) 4.344 20.559 ( 3.223 0.242 -2.902) 4.344 22.629 ( -0.412 -1.329 3.387) 3.662 22.629 ( -0.412 1.329 3.387) 3.662 ======================= Grid point 256 (137/170) ======================= q-point: (-0.36 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( 6.880 -3.467 1.012) 7.770 2.113 ( 6.880 3.467 1.012) 7.770 2.354 ( 3.246 -4.381 -2.741) 6.103 2.354 ( 3.246 4.381 -2.741) 6.103 2.717 ( -6.442 -4.225 0.837) 7.749 2.717 ( -6.442 4.225 0.837) 7.749 2.894 ( -6.548 -5.297 2.488) 8.782 2.894 ( -6.548 5.297 2.488) 8.782 3.273 ( 13.380 -3.817 -1.224) 13.968 3.273 ( 13.380 3.817 -1.224) 13.968 3.394 ( 8.797 -5.296 -4.052) 11.039 3.394 ( 8.797 5.296 -4.052) 11.039 3.748 ( -10.106 -8.574 1.881) 13.386 3.748 ( -10.106 8.574 1.881) 13.386 4.446 ( 19.806 -14.722 0.909) 24.695 4.446 ( 19.806 14.722 0.909) 24.695 4.709 ( 17.324 -20.034 0.416) 26.489 4.709 ( 17.324 20.034 0.416) 26.489 5.361 ( -12.179 -9.038 -0.729) 15.184 5.361 ( -12.179 9.038 -0.729) 15.184 5.658 ( -1.852 -1.234 3.000) 3.736 5.658 ( -1.852 1.234 3.000) 3.736 5.747 ( -2.211 -12.745 -4.510) 13.699 5.747 ( -2.211 12.745 -4.510) 13.699 6.344 ( 2.796 -2.619 2.881) 4.793 6.344 ( 2.796 2.619 2.881) 4.793 6.849 ( 1.558 -6.979 -5.577) 9.068 6.849 ( 1.558 6.979 -5.577) 9.068 7.322 ( 6.766 -9.846 0.920) 11.982 7.322 ( 6.766 9.846 0.920) 11.982 8.026 ( -4.080 -0.668 -3.760) 5.589 8.026 ( -4.080 0.667 -3.760) 5.589 8.146 ( 1.605 -4.184 0.497) 4.509 8.146 ( 1.605 4.184 0.497) 4.509 9.119 ( -1.207 -2.086 -0.312) 2.430 9.119 ( -1.207 2.086 -0.312) 2.430 9.812 ( -3.877 -3.450 2.863) 5.927 9.812 ( -3.877 3.450 2.863) 5.927 10.471 ( -9.436 -4.690 -3.313) 11.046 10.471 ( -9.436 4.690 -3.313) 11.046 10.875 ( 2.180 -13.560 1.276) 13.794 10.875 ( 2.180 13.560 1.276) 13.794 11.048 ( 4.708 -8.534 2.084) 9.967 11.048 ( 4.708 8.534 2.084) 9.967 12.856 ( -7.373 -3.494 4.251) 9.200 12.856 ( -7.373 3.494 4.251) 9.200 13.021 ( -0.713 -4.258 -2.211) 4.851 13.021 ( -0.713 4.258 -2.211) 4.851 14.839 ( 4.368 -1.413 -0.491) 4.617 14.839 ( 4.368 1.413 -0.491) 4.617 15.180 ( 8.758 -2.031 0.533) 9.006 15.180 ( 8.758 2.031 0.533) 9.006 15.553 ( -8.356 -0.777 -0.556) 8.410 15.553 ( -8.356 0.777 -0.556) 8.410 16.112 ( -1.387 -6.034 -0.155) 6.193 16.112 ( -1.387 6.034 -0.155) 6.193 20.636 ( 8.468 -2.388 -0.558) 8.816 20.636 ( 8.468 2.388 -0.558) 8.816 22.640 ( -1.301 -3.309 0.923) 3.674 22.640 ( -1.301 3.309 0.923) 3.674 ======================= Grid point 258 (138/170) ======================= q-point: (-0.27 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( 5.379 -3.349 2.339) 6.754 2.242 ( 5.379 3.349 2.339) 6.754 2.415 ( 3.530 -7.469 4.166) 9.253 2.415 ( 3.530 7.469 4.166) 9.253 2.683 ( 1.939 -4.468 -2.773) 5.605 2.683 ( 1.939 4.468 -2.773) 5.605 2.848 ( -3.937 -4.963 4.786) 7.940 2.848 ( -3.937 4.963 4.786) 7.940 3.264 ( -0.109 -9.195 -19.179) 21.269 3.264 ( -0.109 9.195 -19.179) 21.269 3.465 ( 4.454 -3.501 -0.154) 5.667 3.465 ( 4.454 3.501 -0.154) 5.667 3.839 ( 4.529 -4.747 19.554) 20.625 3.839 ( 4.529 4.747 19.554) 20.625 4.794 ( 20.865 -16.825 0.173) 26.804 4.794 ( 20.865 16.825 0.173) 26.804 4.980 ( 12.811 -20.026 4.176) 24.137 4.980 ( 12.811 20.026 4.176) 24.137 5.218 ( -5.531 -6.000 3.497) 8.878 5.218 ( -5.531 6.000 3.497) 8.878 5.577 ( -4.574 -8.949 -5.472) 11.443 5.577 ( -4.574 8.949 -5.472) 11.443 5.730 ( 0.145 -1.191 3.306) 3.517 5.730 ( 0.145 1.191 3.306) 3.517 6.340 ( 0.121 -1.983 -7.190) 7.460 6.340 ( 0.121 1.983 -7.190) 7.460 6.891 ( 5.314 -11.026 3.838) 12.827 6.891 ( 5.314 11.026 3.838) 12.827 7.459 ( 8.344 -12.997 1.105) 15.484 7.459 ( 8.344 12.997 1.105) 15.484 7.893 ( -6.253 -6.749 -5.119) 10.528 7.893 ( -6.253 6.749 -5.119) 10.528 8.178 ( -0.510 -1.037 2.144) 2.436 8.178 ( -0.510 1.037 2.144) 2.436 9.107 ( -2.291 -3.040 3.580) 5.226 9.107 ( -2.291 3.040 3.580) 5.226 9.772 ( -5.809 -5.521 2.955) 8.542 9.772 ( -5.809 5.521 2.955) 8.542 10.273 ( -8.656 -6.323 -4.567) 11.652 10.273 ( -8.656 6.323 -4.567) 11.652 10.889 ( 2.839 -17.541 -4.657) 18.369 10.889 ( 2.839 17.541 -4.657) 18.369 11.169 ( 6.585 -8.925 2.350) 11.338 11.169 ( 6.585 8.925 2.350) 11.338 12.737 ( -12.043 -4.215 2.419) 12.987 12.737 ( -12.043 4.215 2.419) 12.987 12.968 ( -3.425 -4.417 -2.327) 6.054 12.968 ( -3.425 4.417 -2.327) 6.054 14.923 ( 7.484 -4.770 -1.316) 8.972 14.923 ( 7.484 4.770 -1.316) 8.972 15.291 ( -2.249 -3.317 2.811) 4.895 15.291 ( -2.249 3.317 2.811) 4.895 15.484 ( 6.153 -1.455 -0.787) 6.371 15.484 ( 6.153 1.455 -0.787) 6.371 16.074 ( -2.554 -8.207 -1.114) 8.667 16.074 ( -2.554 8.207 -1.114) 8.667 20.790 ( 9.818 -4.060 1.208) 10.693 20.790 ( 9.818 4.060 1.208) 10.693 22.608 ( -2.159 -5.044 -1.651) 5.730 22.608 ( -2.159 5.044 -1.651) 5.730 ======================= Grid point 260 (139/170) ======================= q-point: (-0.18 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( 3.173 -6.638 -1.176) 7.451 2.315 ( 3.173 6.638 -1.176) 7.451 2.534 ( 3.442 -10.426 3.469) 11.514 2.534 ( 3.442 10.426 3.469) 11.514 2.660 ( -0.938 -4.263 -2.200) 4.888 2.660 ( -0.938 4.263 -2.200) 4.888 2.884 ( 2.744 -5.079 2.981) 6.497 2.884 ( 2.744 5.079 2.981) 6.497 3.054 ( -1.784 -6.664 -12.665) 14.422 3.054 ( -1.784 6.664 -12.665) 14.422 3.448 ( -1.431 -4.610 -6.120) 7.794 3.448 ( -1.431 4.610 -6.120) 7.794 4.180 ( 5.484 -1.146 24.155) 24.796 4.180 ( 5.484 1.146 24.155) 24.796 5.023 ( 4.400 -14.338 3.982) 15.518 5.023 ( 4.400 14.338 3.982) 15.518 5.147 ( 5.798 -13.105 0.931) 14.361 5.147 ( 5.798 13.105 0.931) 14.361 5.277 ( -1.184 -13.324 9.073) 16.163 5.277 ( -1.184 13.324 9.073) 16.163 5.491 ( 3.793 -5.146 -5.250) 8.273 5.491 ( 3.793 5.146 -5.250) 8.273 5.830 ( 8.425 -7.488 3.716) 11.869 5.830 ( 8.425 7.488 3.716) 11.869 6.293 ( 5.777 -2.441 -4.248) 7.575 6.293 ( 5.777 2.441 -4.248) 7.575 7.034 ( 6.387 -9.195 1.857) 11.349 7.034 ( 6.387 9.195 1.857) 11.349 7.582 ( 3.618 -11.897 0.114) 12.435 7.582 ( 3.618 11.897 0.114) 12.435 7.718 ( -7.614 -8.302 -3.261) 11.727 7.718 ( -7.614 8.302 -3.261) 11.727 8.161 ( -2.856 -2.203 -0.520) 3.644 8.161 ( -2.856 2.203 -0.520) 3.644 9.118 ( -4.150 -4.015 5.849) 8.219 9.118 ( -4.150 4.015 5.849) 8.219 9.688 ( -7.821 -6.241 2.361) 10.281 9.688 ( -7.821 6.241 2.361) 10.281 10.147 ( -1.272 -10.554 -2.729) 10.975 10.147 ( -1.272 10.554 -2.729) 10.975 10.882 ( 3.694 -18.306 -6.096) 19.645 10.882 ( 3.694 18.306 -6.096) 19.645 11.282 ( 6.662 -9.946 -1.330) 12.045 11.282 ( 6.662 9.946 -1.330) 12.045 12.552 ( -13.833 -3.334 2.301) 14.414 12.552 ( -13.833 3.334 2.301) 14.414 12.862 ( -5.715 -3.645 -3.168) 7.483 12.862 ( -5.715 3.645 -3.168) 7.483 15.011 ( 1.898 -4.871 1.354) 5.400 15.011 ( 1.898 4.871 1.354) 5.400 15.277 ( 1.296 -1.980 3.926) 4.584 15.277 ( 1.296 1.980 3.926) 4.584 15.642 ( 10.487 -3.159 -2.233) 11.177 15.642 ( 10.487 3.159 -2.233) 11.177 16.019 ( -1.240 -6.769 -2.036) 7.177 16.019 ( -1.240 6.769 -2.036) 7.177 20.948 ( 7.621 -4.851 1.919) 9.235 20.948 ( 7.621 4.851 1.919) 9.235 22.539 ( -2.590 -5.998 -3.707) 7.512 22.539 ( -2.590 5.998 -3.707) 7.512 ======================= Grid point 262 (140/170) ======================= q-point: (-0.09 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 166 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( -1.678 -6.680 -3.612) 7.778 2.309 ( -1.678 6.680 -3.612) 7.778 2.455 ( -3.098 -12.272 -9.828) 16.024 2.455 ( -3.098 12.272 -9.828) 16.024 2.705 ( 0.934 -2.585 3.446) 4.408 2.705 ( 0.934 2.585 3.446) 4.408 2.923 ( 2.329 -9.085 -9.679) 13.477 2.923 ( 2.329 9.085 -9.679) 13.477 3.014 ( 4.324 -4.930 5.753) 8.723 3.014 ( 4.324 4.930 5.753) 8.723 3.352 ( -1.308 -5.485 -3.648) 6.716 3.352 ( -1.308 5.485 -3.648) 6.716 4.489 ( 2.364 -3.343 19.530) 19.955 4.489 ( 2.364 3.343 19.530) 19.955 5.030 ( -5.492 -8.060 4.486) 10.735 5.030 ( -5.492 8.060 4.486) 10.735 5.229 ( 2.252 -9.287 0.317) 9.561 5.229 ( 2.252 9.287 0.317) 9.561 5.372 ( 1.453 -13.435 10.383) 17.042 5.372 ( 1.453 13.435 10.383) 17.042 5.525 ( 2.132 -2.810 0.574) 3.574 5.525 ( 2.132 2.810 0.574) 3.574 6.026 ( 9.444 -8.115 4.597) 13.273 6.026 ( 9.444 8.115 4.597) 13.273 6.469 ( 14.095 -8.291 1.706) 16.441 6.469 ( 14.095 8.291 1.706) 16.441 7.094 ( 5.634 -4.654 -6.439) 9.740 7.094 ( 5.634 4.654 -6.439) 9.740 7.393 ( -17.733 -6.478 -1.866) 18.971 7.393 ( -17.733 6.478 -1.866) 18.971 7.780 ( 8.320 -7.736 2.011) 11.537 7.780 ( 8.320 7.736 2.011) 11.537 8.086 ( -3.224 -4.701 -3.707) 6.799 8.086 ( -3.224 4.701 -3.707) 6.799 9.065 ( -7.346 -4.263 1.189) 8.576 9.065 ( -7.346 4.263 1.189) 8.576 9.632 ( -4.491 -10.434 6.425) 13.051 9.632 ( -4.491 10.434 6.425) 13.051 10.165 ( 4.252 -14.402 0.160) 15.017 10.165 ( 4.252 14.402 0.160) 15.017 10.842 ( 0.098 -15.460 -8.264) 17.530 10.842 ( 0.098 15.460 -8.264) 17.530 11.355 ( 6.297 -8.446 -3.473) 11.093 11.355 ( 6.297 8.446 -3.473) 11.093 12.384 ( -10.633 -4.082 3.179) 11.825 12.384 ( -10.633 4.082 3.179) 11.825 12.744 ( -3.805 -3.443 -3.237) 6.067 12.744 ( -3.805 3.443 -3.237) 6.067 15.036 ( -2.353 -3.592 7.026) 8.234 15.036 ( -2.353 3.592 7.026) 8.234 15.407 ( 7.505 -4.696 2.353) 9.161 15.407 ( 7.505 4.696 2.353) 9.161 15.681 ( 0.649 -8.060 -5.867) 9.990 15.681 ( 0.649 8.060 -5.867) 9.990 16.023 ( 3.459 -2.121 -1.432) 4.303 16.023 ( 3.459 2.121 -1.432) 4.303 21.062 ( 3.898 -4.207 2.079) 6.101 21.062 ( 3.898 4.207 2.079) 6.101 22.454 ( -1.995 -5.726 -4.768) 7.714 22.454 ( -1.995 5.726 -4.768) 7.714 ======================= Grid point 297 (141/170) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 85 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 1.147 0.000 -23.617) 23.645 1.843 ( -1.147 0.000 23.617) 23.645 2.025 ( -4.038 0.000 -26.244) 26.553 2.025 ( 4.038 0.000 26.244) 26.553 2.808 ( -2.492 0.000 -0.725) 2.595 2.808 ( 2.492 0.000 0.725) 2.595 3.245 ( -0.245 0.000 -3.093) 3.103 3.245 ( 0.245 0.000 3.093) 3.103 3.602 ( -3.415 0.000 -20.131) 20.419 3.602 ( 3.415 0.000 20.131) 20.419 3.679 ( 7.291 0.000 -23.047) 24.172 3.679 ( -7.291 0.000 23.047) 24.172 4.117 ( -2.871 0.000 -8.127) 8.619 4.117 ( 2.871 0.000 8.127) 8.619 4.232 ( 3.646 0.000 -3.694) 5.190 4.232 ( -3.646 0.000 3.694) 5.190 4.800 ( 5.070 0.000 -2.340) 5.584 4.800 ( -5.070 0.000 2.340) 5.584 5.089 ( 0.148 0.000 -0.204) 0.252 5.089 ( -0.148 0.000 0.204) 0.252 5.467 ( -0.730 0.000 -13.500) 13.520 5.467 ( 0.730 0.000 13.500) 13.520 5.770 ( 1.272 0.000 -10.862) 10.936 5.770 ( -1.272 0.000 10.862) 10.936 6.364 ( 1.054 0.000 -26.546) 26.567 6.364 ( -1.054 0.000 26.546) 26.567 6.628 ( -2.241 0.000 -7.040) 7.388 6.628 ( 2.241 0.000 7.040) 7.388 6.979 ( -1.491 0.000 -7.179) 7.332 6.979 ( 1.491 0.000 7.179) 7.332 7.700 ( -2.236 0.000 -8.532) 8.820 7.700 ( 2.236 0.000 8.532) 8.820 8.332 ( -1.879 0.000 -3.344) 3.836 8.332 ( 1.879 0.000 3.344) 3.836 8.733 ( -3.257 0.000 -16.819) 17.131 8.733 ( 3.257 0.000 16.819) 17.131 9.555 ( 4.048 0.000 -5.584) 6.897 9.555 ( -4.048 0.000 5.584) 6.897 9.998 ( -7.947 0.000 -13.444) 15.617 9.998 ( 7.947 0.000 13.444) 15.617 11.228 ( 3.527 0.000 -8.837) 9.514 11.228 ( -3.527 0.000 8.837) 9.514 11.771 ( 1.395 0.000 -8.507) 8.620 11.771 ( -1.395 0.000 8.507) 8.620 12.365 ( 1.988 0.000 -13.225) 13.373 12.365 ( -1.988 0.000 13.225) 13.373 12.508 ( -1.829 0.000 -12.311) 12.446 12.508 ( 1.829 0.000 12.311) 12.446 14.541 ( -1.077 0.000 -2.380) 2.612 14.541 ( 1.077 0.000 2.380) 2.612 15.176 ( -0.518 0.000 -1.360) 1.455 15.176 ( 0.518 0.000 1.360) 1.455 15.640 ( 0.960 0.000 -15.477) 15.506 15.640 ( -0.960 0.000 15.477) 15.506 16.244 ( 1.260 0.000 -2.313) 2.634 16.244 ( -1.260 0.000 2.313) 2.634 20.711 ( -1.023 0.000 -5.949) 6.036 20.711 ( 1.023 0.000 5.949) 6.036 22.629 ( -0.305 0.000 -5.351) 5.360 22.629 ( 0.305 0.000 5.351) 5.360 ======================= Grid point 299 (142/170) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 11.162 0.000 -23.816) 26.302 1.704 ( 4.092 0.000 -27.504) 27.807 2.138 ( 3.652 0.000 20.435) 20.759 2.403 ( 7.995 0.000 22.878) 24.234 2.767 ( -3.058 0.000 2.682) 4.067 2.803 ( -6.265 0.000 2.329) 6.684 3.172 ( 3.434 0.000 -8.247) 8.933 3.204 ( -7.307 0.000 0.510) 7.325 3.328 ( 9.212 0.000 -31.885) 33.189 3.611 ( 2.828 0.000 -9.040) 9.472 3.711 ( -3.663 0.000 9.827) 10.488 3.897 ( -6.143 0.000 10.832) 12.453 4.006 ( -0.403 0.000 -9.040) 9.049 4.167 ( -3.699 0.000 -1.834) 4.129 4.192 ( -7.733 0.000 5.838) 9.690 4.273 ( 3.896 0.000 8.209) 9.086 4.583 ( -9.120 0.000 -14.143) 16.828 4.650 ( -3.077 0.000 3.064) 4.342 5.179 ( -1.015 0.000 4.060) 4.185 5.201 ( 4.015 0.000 10.019) 10.794 5.364 ( 2.534 0.000 -12.225) 12.485 5.734 ( 10.431 0.000 12.842) 16.544 5.819 ( 19.144 0.000 -27.123) 33.199 5.990 ( 13.571 0.000 10.134) 16.937 6.032 ( 3.412 0.000 -18.544) 18.855 6.439 ( -12.624 0.000 12.322) 17.641 6.584 ( 3.361 0.000 -8.794) 9.414 6.829 ( 8.607 0.000 4.492) 9.709 6.914 ( 0.322 0.000 0.171) 0.365 7.166 ( 9.406 0.000 13.355) 16.335 7.574 ( 0.021 0.000 -8.859) 8.859 7.716 ( -11.661 0.000 5.238) 12.783 8.301 ( -0.629 0.000 -0.820) 1.033 8.472 ( 7.127 0.000 6.090) 9.375 8.585 ( 5.309 0.000 -13.223) 14.249 9.066 ( 12.774 0.000 20.812) 24.420 9.511 ( -9.046 0.000 3.577) 9.728 9.524 ( 0.088 0.000 -5.808) 5.808 9.700 ( -9.484 0.000 -8.831) 12.958 10.186 ( -2.709 0.000 13.007) 13.287 11.084 ( -7.347 0.000 -11.236) 13.425 11.191 ( -9.744 0.000 4.919) 10.915 11.656 ( -5.513 0.000 -5.875) 8.056 11.814 ( -4.667 0.000 8.718) 9.888 12.341 ( 7.932 0.000 -11.064) 13.613 12.396 ( 8.457 0.000 -11.437) 14.224 12.566 ( 8.445 0.000 11.309) 14.114 12.682 ( 4.126 0.000 9.927) 10.750 14.535 ( 3.214 0.000 -1.658) 3.616 14.617 ( 5.266 0.000 2.235) 5.720 15.145 ( -1.436 0.000 -1.510) 2.084 15.198 ( -0.558 0.000 3.269) 3.316 15.511 ( 5.590 0.000 -16.730) 17.639 15.803 ( 1.854 0.000 11.725) 11.871 16.218 ( -1.477 0.000 -2.125) 2.588 16.232 ( -3.870 0.000 3.034) 4.918 20.682 ( 6.097 0.000 -6.238) 8.722 20.830 ( 6.375 0.000 4.161) 7.613 22.570 ( -0.930 0.000 -3.490) 3.612 22.693 ( -0.694 0.000 6.730) 6.765 ======================= Grid point 300 (143/170) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( 14.684 0.000 -21.202) 25.790 1.638 ( 14.240 0.000 -19.989) 24.543 2.369 ( -0.551 0.000 16.439) 16.448 2.723 ( 3.576 0.000 12.674) 13.169 2.770 ( 0.307 0.000 6.034) 6.042 2.778 ( -1.342 0.000 5.159) 5.331 3.064 ( -7.581 0.000 -2.633) 8.025 3.155 ( 2.121 0.000 -12.252) 12.435 3.229 ( 16.673 0.000 -15.322) 22.644 3.489 ( -25.522 0.000 -6.730) 26.394 3.545 ( 0.541 0.000 -8.534) 8.551 3.817 ( -7.383 0.000 -14.230) 16.031 3.854 ( -3.907 0.000 12.093) 12.708 4.166 ( 0.971 0.000 3.550) 3.680 4.207 ( 2.697 0.000 -3.407) 4.345 4.405 ( 3.329 0.000 5.877) 6.754 4.411 ( 5.756 0.000 -10.244) 11.750 4.782 ( 10.743 0.000 6.974) 12.808 5.110 ( -6.080 0.000 -4.618) 7.635 5.260 ( -0.720 0.000 -8.596) 8.626 5.466 ( 12.965 0.000 -14.515) 19.462 5.519 ( 4.434 0.000 -12.687) 13.439 5.974 ( 3.016 0.000 12.413) 12.774 6.208 ( 14.332 0.000 -2.698) 14.584 6.279 ( -11.453 0.000 8.131) 14.046 6.373 ( 12.179 0.000 2.366) 12.407 6.565 ( 9.693 0.000 -6.857) 11.874 6.994 ( 4.127 0.000 8.635) 9.570 7.038 ( 10.601 0.000 4.031) 11.342 7.319 ( -8.310 0.000 -5.909) 10.197 7.486 ( 0.030 0.000 -8.824) 8.824 7.643 ( 4.223 0.000 11.111) 11.886 8.282 ( -1.085 0.000 -0.153) 1.096 8.543 ( -3.645 0.000 -0.658) 3.704 8.603 ( 13.114 0.000 -10.168) 16.594 9.331 ( -8.173 0.000 5.934) 10.100 9.441 ( -2.233 0.000 -5.217) 5.675 9.588 ( 8.691 0.000 18.345) 20.299 9.636 ( 9.252 0.000 4.341) 10.220 10.215 ( -10.468 0.000 12.373) 16.207 10.788 ( -12.927 0.000 -12.258) 17.815 11.049 ( -11.836 0.000 0.333) 11.840 11.497 ( -7.242 0.000 -3.490) 8.039 11.796 ( -7.987 0.000 5.155) 9.506 12.351 ( 9.451 0.000 -7.500) 12.066 12.534 ( 15.015 0.000 -3.037) 15.319 12.819 ( 7.598 0.000 8.515) 11.412 12.844 ( 5.567 0.000 6.787) 8.778 14.601 ( 6.759 0.000 -1.188) 6.863 14.751 ( 8.962 0.000 1.417) 9.073 15.115 ( 2.050 0.000 -3.081) 3.700 15.240 ( 0.548 0.000 4.686) 4.718 15.450 ( 8.844 0.000 -15.213) 17.597 15.923 ( -0.245 0.000 6.176) 6.181 16.149 ( -4.389 0.000 -2.212) 4.915 16.199 ( -5.197 0.000 4.717) 7.019 20.762 ( 11.714 0.000 -5.228) 12.828 20.975 ( 7.903 0.000 0.921) 7.957 22.526 ( -1.056 0.000 -1.433) 1.780 22.750 ( -2.048 0.000 7.287) 7.569 ======================= Grid point 301 (144/170) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 17.924 0.000 -19.107) 26.198 1.688 ( 19.707 0.000 -10.028) 22.112 2.482 ( -4.295 0.000 10.613) 11.450 2.748 ( -6.587 0.000 -3.078) 7.271 2.820 ( -2.162 0.000 6.929) 7.258 2.828 ( -2.411 0.000 6.041) 6.504 2.956 ( -1.652 0.000 -2.123) 2.690 3.032 ( -21.293 0.000 -4.984) 21.869 3.169 ( 1.295 0.000 4.907) 5.075 3.307 ( 1.235 0.000 -1.535) 1.970 3.404 ( -8.831 0.000 -0.838) 8.871 3.681 ( 19.808 0.000 -23.199) 30.505 3.902 ( -8.443 0.000 7.629) 11.380 4.093 ( -1.945 0.000 -12.684) 12.832 4.335 ( 18.330 0.000 0.005) 18.330 4.484 ( 9.879 0.000 -1.476) 9.989 4.536 ( 3.979 0.000 5.933) 7.144 4.931 ( -3.532 0.000 -11.662) 12.185 5.042 ( 9.373 0.000 -14.138) 16.962 5.064 ( 4.220 0.000 -6.302) 7.584 5.349 ( 9.708 0.000 -6.260) 11.552 5.750 ( 7.797 0.000 1.640) 7.967 6.079 ( -15.881 0.000 3.823) 16.335 6.124 ( 0.190 0.000 9.097) 9.099 6.460 ( 17.098 0.000 11.185) 20.431 6.546 ( 9.268 0.000 -8.541) 12.603 6.693 ( 9.410 0.000 -4.360) 10.371 6.904 ( -19.166 0.000 -2.977) 19.396 7.178 ( -0.017 0.000 -5.423) 5.423 7.268 ( 4.395 0.000 10.538) 11.418 7.433 ( 7.637 0.000 -3.582) 8.435 7.880 ( 9.504 0.000 4.517) 10.523 8.262 ( -1.002 0.000 -0.571) 1.153 8.423 ( -7.862 0.000 -0.939) 7.918 8.762 ( 17.656 0.000 -6.253) 18.731 9.281 ( -7.640 0.000 7.983) 11.050 9.371 ( 0.527 0.000 -3.336) 3.377 9.740 ( 5.513 0.000 5.576) 7.841 10.039 ( 14.044 0.000 11.838) 18.368 10.160 ( -12.056 0.000 10.861) 16.227 10.433 ( -14.028 0.000 -12.254) 18.626 10.838 ( -12.509 0.000 -2.430) 12.742 11.369 ( -4.848 0.000 -2.447) 5.430 11.683 ( -10.839 0.000 2.041) 11.030 12.475 ( 12.588 0.000 -2.348) 12.806 12.738 ( 11.023 0.000 1.102) 11.078 12.942 ( 1.347 0.000 5.214) 5.386 13.027 ( 6.149 0.000 4.883) 7.852 14.711 ( 9.661 0.000 -2.332) 9.939 14.921 ( 11.022 0.000 0.410) 11.029 15.172 ( 7.332 0.000 0.144) 7.334 15.323 ( 3.427 0.000 4.750) 5.857 15.447 ( 9.466 0.000 -11.913) 15.216 15.913 ( -5.941 0.000 1.708) 6.182 16.032 ( -7.004 0.000 -2.575) 7.462 16.174 ( -5.427 0.000 4.720) 7.192 20.919 ( 13.668 0.000 -3.408) 14.087 21.094 ( 7.820 0.000 -1.636) 7.989 22.509 ( -0.245 0.000 0.368) 0.442 22.781 ( -3.950 0.000 6.443) 7.558 ======================= Grid point 302 (145/170) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 23.233 0.000 -15.943) 28.177 1.928 ( 17.612 0.000 -1.648) 17.689 2.439 ( -12.511 0.000 5.981) 13.868 2.567 ( -7.380 0.000 -6.684) 9.957 2.787 ( -4.583 0.000 -1.598) 4.854 2.804 ( -9.493 0.000 5.719) 11.082 2.874 ( 0.512 0.000 5.669) 5.692 2.967 ( 2.253 0.000 2.052) 3.048 3.121 ( -14.823 0.000 10.005) 17.883 3.255 ( -3.135 0.000 -0.497) 3.174 3.373 ( 1.065 0.000 -2.192) 2.437 3.614 ( -13.806 0.000 -18.424) 23.023 3.794 ( 15.371 0.000 -11.454) 19.170 4.037 ( -1.793 0.000 1.720) 2.484 4.584 ( -1.909 0.000 -1.113) 2.210 4.594 ( -0.473 0.000 2.345) 2.392 4.674 ( 18.894 0.000 -5.605) 19.708 4.909 ( 26.765 0.000 -7.464) 27.786 4.961 ( 8.599 0.000 -8.913) 12.384 5.190 ( 2.574 0.000 6.350) 6.852 5.561 ( 16.638 0.000 0.843) 16.660 5.854 ( 6.840 0.000 0.136) 6.842 5.866 ( -12.860 0.000 -0.967) 12.897 6.189 ( -3.538 0.000 5.741) 6.743 6.456 ( -5.771 0.000 -12.462) 13.733 6.644 ( -15.669 0.000 -0.377) 15.673 6.681 ( -3.618 0.000 0.901) 3.728 6.942 ( 22.208 0.000 14.507) 26.526 7.013 ( 1.102 0.000 -14.474) 14.515 7.446 ( 0.207 0.000 13.129) 13.130 7.558 ( 8.443 0.000 -3.261) 9.051 7.983 ( 0.125 0.000 -1.626) 1.630 8.239 ( -0.319 0.000 -1.388) 1.425 8.306 ( -7.697 0.000 2.518) 8.099 8.975 ( 14.459 0.000 -2.557) 14.684 9.272 ( -3.692 0.000 6.460) 7.441 9.413 ( 7.768 0.000 -1.057) 7.839 9.813 ( -2.251 0.000 -1.892) 2.940 10.079 ( -11.009 0.000 6.997) 13.045 10.096 ( -9.072 0.000 -6.241) 11.012 10.349 ( 11.883 0.000 3.378) 12.354 10.655 ( -7.743 0.000 0.379) 7.752 11.285 ( -1.471 0.000 -3.742) 4.021 11.514 ( -13.037 0.000 1.989) 13.188 12.674 ( 13.560 0.000 0.130) 13.560 12.889 ( 7.463 0.000 0.151) 7.464 12.990 ( -1.596 0.000 3.943) 4.253 13.119 ( 0.537 0.000 2.048) 2.117 14.862 ( 12.599 0.000 -1.877) 12.738 15.089 ( 9.717 0.000 -0.548) 9.732 15.316 ( 6.107 0.000 4.587) 7.638 15.409 ( 3.799 0.000 -3.509) 5.172 15.517 ( 10.204 0.000 -0.472) 10.215 15.808 ( -7.954 0.000 0.605) 7.977 15.883 ( -7.238 0.000 -3.219) 7.921 16.102 ( -8.501 0.000 1.464) 8.626 21.092 ( 10.893 0.000 -1.378) 10.980 21.186 ( 6.413 0.000 -2.142) 6.762 22.531 ( 2.028 0.000 1.212) 2.362 22.762 ( -6.007 0.000 4.229) 7.346 ======================= Grid point 303 (146/170) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( 24.044 0.000 -8.324) 25.445 2.167 ( 10.681 0.000 1.907) 10.850 2.303 ( -13.559 0.000 8.928) 16.234 2.386 ( -6.445 0.000 -6.481) 9.140 2.695 ( -10.767 0.000 7.689) 13.231 2.721 ( -0.322 0.000 -8.432) 8.438 2.941 ( 5.664 0.000 -2.840) 6.336 3.013 ( -11.262 0.000 8.004) 13.816 3.082 ( 4.030 0.000 10.475) 11.223 3.213 ( -3.586 0.000 2.763) 4.527 3.277 ( -3.956 0.000 -10.967) 11.659 3.284 ( -2.497 0.000 -11.302) 11.575 3.901 ( 8.901 0.000 -3.080) 9.419 3.997 ( -5.395 0.000 0.930) 5.474 4.532 ( -1.582 0.000 -0.436) 1.641 4.544 ( -2.373 0.000 -1.096) 2.614 4.854 ( 9.458 0.000 0.154) 9.459 4.965 ( -0.476 0.000 -4.812) 4.836 5.374 ( 7.654 0.000 11.760) 14.032 5.450 ( 38.060 0.000 -1.663) 38.096 5.637 ( -10.407 0.000 -7.648) 12.915 5.780 ( 3.201 0.000 2.140) 3.850 5.986 ( 9.174 0.000 1.282) 9.263 6.146 ( -6.004 0.000 2.330) 6.440 6.205 ( -12.797 0.000 -3.752) 13.335 6.262 ( -22.309 0.000 -3.134) 22.528 6.742 ( 6.042 0.000 3.236) 6.854 6.883 ( -1.983 0.000 -9.183) 9.395 7.442 ( 20.112 0.000 11.997) 23.418 7.556 ( -3.397 0.000 11.565) 12.054 7.602 ( 6.361 0.000 -8.846) 10.896 7.826 ( -13.462 0.000 -6.655) 15.017 8.230 ( 1.561 0.000 -1.825) 2.401 8.247 ( -3.759 0.000 2.562) 4.549 9.156 ( 10.723 0.000 -0.176) 10.724 9.274 ( -4.605 0.000 2.667) 5.322 9.538 ( 8.631 0.000 -2.424) 8.965 9.653 ( -10.671 0.000 0.261) 10.674 9.986 ( -8.397 0.000 6.538) 10.642 9.989 ( 2.816 0.000 -8.542) 8.994 10.535 ( 8.223 0.000 0.164) 8.225 10.602 ( -3.784 0.000 3.431) 5.108 11.255 ( 4.780 0.000 -5.255) 7.104 11.340 ( -12.040 0.000 3.770) 12.617 12.873 ( 11.055 0.000 -0.827) 11.086 12.977 ( -5.389 0.000 3.241) 6.288 12.992 ( 6.143 0.000 0.183) 6.146 13.090 ( -4.803 0.000 -0.466) 4.826 15.051 ( 11.893 0.000 -0.139) 11.894 15.173 ( -0.598 0.000 -0.656) 0.888 15.402 ( 4.445 0.000 -5.735) 7.256 15.415 ( -2.411 0.000 6.171) 6.626 15.710 ( 7.609 0.000 3.945) 8.571 15.717 ( -2.878 0.000 0.668) 2.955 15.766 ( 0.903 0.000 -4.031) 4.131 15.941 ( -11.779 0.000 -1.133) 11.833 21.210 ( 4.436 0.000 0.412) 4.455 21.237 ( 2.249 0.000 -1.618) 2.771 22.598 ( 5.118 0.000 0.515) 5.144 22.690 ( -6.787 0.000 1.568) 6.965 ======================= Grid point 309 (147/170) ======================= q-point: ( 0.00 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( -0.710 5.048 -21.068) 21.676 1.904 ( 0.710 5.048 21.068) 21.676 2.168 ( 0.509 9.378 -23.268) 25.091 2.168 ( -0.509 9.378 23.268) 25.091 2.810 ( -1.624 0.818 -1.789) 2.551 2.810 ( 1.624 0.818 1.789) 2.551 3.132 ( 1.498 -9.478 -5.351) 10.987 3.132 ( -1.498 -9.478 5.351) 10.987 3.557 ( -3.562 -4.414 -8.379) 10.118 3.557 ( 3.562 -4.414 8.379) 10.118 3.681 ( 3.411 -3.451 -13.700) 14.534 3.681 ( -3.411 -3.451 13.700) 14.534 4.111 ( 1.069 6.635 -4.674) 8.185 4.111 ( -1.069 6.635 4.674) 8.185 4.364 ( 0.966 11.435 -4.580) 12.356 4.364 ( -0.966 11.435 4.580) 12.356 4.812 ( -6.994 0.357 -2.832) 7.553 4.812 ( 6.994 0.357 2.832) 7.553 5.166 ( 1.220 6.981 -5.564) 9.010 5.166 ( -1.220 6.981 5.564) 9.010 5.492 ( -0.431 0.509 -6.558) 6.592 5.492 ( 0.431 0.509 6.558) 6.592 5.873 ( 5.258 9.854 -3.265) 11.636 5.873 ( -5.258 9.854 3.265) 11.636 6.288 ( 1.505 -2.714 -19.309) 19.557 6.288 ( -1.505 -2.714 19.309) 19.557 6.723 ( -7.963 4.823 -11.106) 14.492 6.723 ( 7.963 4.823 11.106) 14.492 7.195 ( -2.673 16.309 -6.876) 17.900 7.195 ( 2.673 16.309 6.876) 17.900 7.703 ( -1.180 0.663 -5.506) 5.670 7.703 ( 1.180 0.663 5.506) 5.670 8.319 ( -2.450 -0.736 -6.485) 6.971 8.319 ( 2.450 -0.736 6.485) 6.971 8.787 ( -1.703 4.402 -15.311) 16.022 8.787 ( 1.703 4.402 15.311) 16.022 9.482 ( 5.806 -5.790 -4.190) 9.208 9.482 ( -5.806 -5.790 4.190) 9.208 10.022 ( -9.568 2.266 -13.608) 16.789 10.022 ( 9.568 2.266 13.608) 16.789 11.165 ( 4.135 -5.843 -9.905) 12.221 11.165 ( -4.135 -5.843 9.905) 12.221 11.724 ( 1.422 -4.369 -8.643) 9.788 11.724 ( -1.422 -4.369 8.643) 9.788 12.352 ( 1.599 -0.832 -13.113) 13.237 12.352 ( -1.599 -0.832 13.113) 13.237 12.535 ( -1.706 2.354 -11.242) 11.612 12.535 ( 1.706 2.354 11.242) 11.612 14.666 ( -1.362 10.611 -3.217) 11.171 14.666 ( 1.362 10.611 3.217) 11.171 15.194 ( 1.266 1.811 -0.963) 2.410 15.194 ( -1.266 1.811 0.963) 2.410 15.643 ( 1.591 0.144 -15.984) 16.063 15.643 ( -1.591 0.144 15.984) 16.063 16.229 ( 0.400 -1.512 -2.359) 2.831 16.229 ( -0.400 -1.512 2.359) 2.831 20.723 ( -2.051 1.938 -5.134) 5.859 20.723 ( 2.051 1.938 5.134) 5.859 22.604 ( -0.266 -2.430 -5.498) 6.017 22.604 ( 0.266 -2.430 5.498) 6.017 ======================= Grid point 311 (148/170) ======================= q-point: ( 0.09 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( 8.244 8.572 -18.398) 21.907 1.949 ( 6.852 14.191 -24.172) 28.855 2.188 ( 3.189 5.513 19.263) 20.288 2.443 ( 4.091 0.868 20.629) 21.049 2.767 ( -3.191 -1.179 0.412) 3.427 2.818 ( -4.210 3.148 3.940) 6.570 3.078 ( 1.374 -7.859 -3.203) 8.597 3.101 ( -5.422 -7.974 -2.052) 9.859 3.363 ( -0.402 0.076 -15.842) 15.847 3.584 ( 0.554 -2.995 -8.180) 8.729 3.640 ( -0.007 -4.062 1.525) 4.339 3.767 ( 0.191 -10.886 1.766) 11.030 4.102 ( -4.749 10.637 -3.184) 12.076 4.143 ( 4.164 -5.165 -0.659) 6.667 4.287 ( -3.564 10.825 -0.905) 11.433 4.355 ( -5.893 13.782 2.287) 15.163 4.619 ( -6.528 1.014 -7.660) 10.115 4.821 ( -1.709 11.898 2.820) 12.347 5.198 ( -0.103 3.037 2.004) 3.640 5.257 ( 1.975 5.262 11.971) 13.225 5.410 ( 0.917 2.531 -8.188) 8.619 5.594 ( 11.114 -4.640 -7.650) 14.268 5.942 ( 2.920 2.539 -19.767) 20.142 5.984 ( 8.498 3.169 6.766) 11.315 6.177 ( 16.254 9.150 -0.743) 18.668 6.393 ( -5.076 -1.272 8.999) 10.410 6.571 ( 1.978 3.255 -7.922) 8.790 6.980 ( 4.945 7.133 3.322) 9.293 7.101 ( 2.636 9.832 -1.018) 10.230 7.320 ( 2.751 16.665 9.196) 19.232 7.596 ( -3.631 1.180 -1.513) 4.106 7.724 ( -3.253 2.353 -1.654) 4.342 8.251 ( 0.205 -3.950 -3.188) 5.080 8.395 ( -1.032 -4.979 -1.830) 5.404 8.718 ( 6.323 9.330 -2.619) 11.571 9.080 ( 11.047 0.965 19.476) 22.412 9.400 ( -9.008 -8.283 3.768) 12.805 9.527 ( 4.091 -0.016 -2.598) 4.846 9.709 ( -10.883 1.494 -9.010) 14.207 10.247 ( -0.414 4.629 13.130) 13.928 11.021 ( -6.683 -5.551 -11.940) 14.766 11.137 ( -9.498 -4.857 6.022) 12.250 11.603 ( -5.559 -4.837 -6.199) 9.629 11.767 ( -4.587 -4.451 8.557) 10.680 12.328 ( 10.825 -1.283 -10.980) 15.472 12.420 ( 4.978 2.785 -11.764) 13.074 12.561 ( 8.505 -0.494 11.446) 14.268 12.700 ( 4.252 1.533 9.222) 10.271 14.635 ( 1.475 8.542 -2.526) 9.029 14.746 ( 3.931 10.720 3.534) 11.952 15.173 ( -2.360 1.701 0.380) 2.934 15.193 ( -0.391 0.841 0.461) 1.036 15.520 ( 5.941 0.688 -16.823) 17.855 15.806 ( 1.537 -0.045 12.300) 12.396 16.182 ( -3.420 -2.754 -0.937) 4.490 16.227 ( -3.203 -1.165 1.986) 3.944 20.687 ( 4.964 1.146 -5.432) 7.447 20.851 ( 7.242 2.353 3.589) 8.418 22.542 ( -1.183 -2.607 -3.328) 4.390 22.670 ( -0.614 -2.238 6.776) 7.162 ======================= Grid point 312 (149/170) ======================= q-point: ( 0.18 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 12.444 11.682 -14.239) 22.228 1.833 ( 9.827 15.554 -20.922) 27.861 2.397 ( -1.483 2.575 15.762) 16.039 2.690 ( 1.842 -1.688 11.519) 11.787 2.720 ( -1.707 -4.988 2.888) 6.011 2.881 ( 0.847 4.846 6.704) 8.315 2.965 ( -3.829 -4.928 -1.498) 6.418 3.108 ( 2.877 -7.081 -1.216) 7.739 3.207 ( -1.890 -1.674 -10.353) 10.656 3.452 ( -9.463 -3.165 -7.831) 12.684 3.546 ( -3.915 0.405 -8.631) 9.486 3.771 ( -0.821 -5.826 6.829) 9.014 3.952 ( -2.336 10.262 -15.501) 18.736 4.164 ( 2.765 -1.232 -4.245) 5.213 4.248 ( 0.953 -2.007 3.215) 3.907 4.340 ( 2.174 11.294 -3.347) 11.978 4.500 ( 0.271 2.019 -1.860) 2.759 4.883 ( 1.293 7.246 5.456) 9.162 5.143 ( -1.069 4.697 -6.035) 7.722 5.336 ( -1.741 4.641 -10.325) 11.453 5.450 ( 5.722 -4.258 -20.326) 21.541 5.539 ( 12.740 6.050 2.215) 14.277 5.913 ( 4.613 -1.382 6.158) 7.817 6.220 ( 8.806 1.915 4.588) 10.113 6.319 ( -7.914 -0.400 4.426) 9.077 6.412 ( 5.230 -1.517 0.613) 5.480 6.680 ( 17.195 13.305 -4.803) 22.266 6.985 ( 4.374 3.263 1.191) 5.586 7.131 ( -8.145 -2.446 -3.165) 9.074 7.407 ( 0.087 13.852 2.150) 14.018 7.591 ( -4.396 3.259 -2.775) 6.135 7.696 ( 11.004 8.050 4.190) 14.264 8.225 ( -0.906 -5.856 -2.494) 6.430 8.280 ( -4.447 -9.841 -6.339) 12.522 8.812 ( 8.816 8.520 -3.471) 12.742 9.269 ( -8.435 -5.945 4.874) 11.413 9.507 ( 3.205 1.202 5.973) 6.884 9.580 ( 6.133 3.295 10.780) 12.833 9.618 ( 7.982 0.489 5.735) 9.841 10.296 ( -9.099 5.226 9.874) 14.408 10.738 ( -11.550 -3.726 -11.127) 16.465 11.011 ( -11.331 -3.255 0.539) 11.802 11.450 ( -6.691 -4.309 -2.605) 8.374 11.756 ( -7.379 -3.868 5.465) 9.964 12.380 ( 9.844 2.058 -8.091) 12.908 12.488 ( 14.315 -2.211 -5.160) 15.376 12.822 ( 9.769 -0.680 8.205) 12.776 12.855 ( 3.951 1.515 6.785) 7.997 14.656 ( 4.365 4.724 -2.077) 6.758 14.861 ( 5.500 9.168 3.400) 11.219 15.141 ( 1.252 2.087 -2.698) 3.634 15.216 ( 1.193 -1.378 2.774) 3.319 15.461 ( 8.827 0.968 -15.041) 17.466 15.912 ( -2.494 -1.672 5.268) 6.063 16.123 ( -3.093 -1.874 0.463) 3.646 16.176 ( -6.395 -2.417 3.731) 7.788 20.754 ( 10.151 -0.128 -4.506) 11.107 21.000 ( 7.593 2.004 1.209) 7.946 22.498 ( -1.003 -2.461 -1.211) 2.920 22.729 ( -2.006 -2.073 7.378) 7.922 ======================= Grid point 313 (150/170) ======================= q-point: ( 0.27 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( 14.783 10.405 -17.111) 24.892 1.826 ( 14.164 10.515 -10.419) 20.488 2.490 ( -5.025 0.762 10.400) 11.576 2.667 ( -4.772 -7.041 -4.500) 9.622 2.816 ( -2.569 0.051 9.383) 9.729 2.827 ( -3.912 -0.395 4.731) 6.152 2.968 ( -12.327 -2.189 -1.835) 12.653 3.045 ( -4.532 2.922 -0.975) 5.479 3.152 ( 0.725 -5.710 6.132) 8.410 3.270 ( -5.090 0.649 0.185) 5.135 3.446 ( -4.232 2.951 -2.170) 5.597 3.763 ( 12.729 8.615 -23.221) 27.847 3.846 ( -5.071 -5.272 8.583) 11.277 4.137 ( -2.336 3.243 -14.983) 15.507 4.333 ( 11.709 -2.759 -0.813) 12.057 4.353 ( 14.579 -4.918 -7.069) 16.933 4.608 ( 5.685 3.545 8.111) 10.520 4.850 ( -5.137 -1.433 -6.460) 8.377 5.055 ( 2.997 0.630 -18.476) 18.728 5.212 ( 9.540 9.388 -3.157) 13.752 5.425 ( 4.844 7.356 -1.887) 9.007 5.760 ( 8.150 1.058 0.960) 8.274 6.053 ( -1.513 -2.820 7.829) 8.458 6.136 ( -8.880 2.782 0.614) 9.326 6.444 ( 7.068 -1.393 0.508) 7.222 6.530 ( 7.474 -7.131 3.908) 11.044 6.767 ( -2.051 6.802 -9.638) 11.974 6.829 ( -9.332 -5.763 -1.173) 11.030 7.173 ( 5.102 2.181 3.600) 6.614 7.380 ( -0.468 6.427 -3.638) 7.400 7.574 ( 5.202 11.410 0.449) 12.548 7.923 ( 9.132 3.289 2.719) 10.080 8.104 ( -5.090 -14.013 -3.958) 15.425 8.233 ( 0.045 -2.709 -0.438) 2.745 8.968 ( 16.614 7.785 -4.049) 18.789 9.222 ( -5.119 -4.323 6.685) 9.465 9.471 ( -2.842 7.995 -1.548) 8.625 9.774 ( 5.762 4.842 8.212) 11.139 9.987 ( 12.509 -4.285 12.847) 18.436 10.190 ( -10.728 -0.767 0.095) 10.756 10.468 ( -10.859 5.291 -3.542) 12.588 10.803 ( -12.098 -3.072 -2.818) 12.796 11.346 ( -4.604 -2.218 -0.773) 5.168 11.655 ( -10.252 -2.838 1.978) 10.819 12.492 ( 12.135 1.481 -3.332) 12.671 12.683 ( 12.678 -3.163 -0.174) 13.068 12.964 ( 2.142 1.499 4.440) 5.153 13.028 ( 6.282 -0.201 5.621) 8.432 14.719 ( 6.611 0.556 -2.264) 7.010 14.979 ( 6.642 4.644 0.709) 8.136 15.195 ( 6.943 2.162 0.754) 7.311 15.290 ( 3.760 -2.350 3.240) 5.492 15.460 ( 9.300 1.226 -11.580) 14.903 15.841 ( -7.791 -5.730 -0.140) 9.673 16.036 ( -8.143 -1.530 -0.303) 8.291 16.162 ( -3.351 -0.264 4.901) 5.943 20.887 ( 11.212 -2.666 -2.873) 11.877 21.103 ( 5.576 0.071 -1.259) 5.717 22.489 ( 0.419 -1.607 0.571) 1.756 22.762 ( -3.692 -1.759 6.540) 7.714 ======================= Grid point 314 (151/170) ======================= q-point: ( 0.36 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( 20.532 7.267 -15.085) 26.494 1.990 ( 14.367 4.580 -2.544) 15.293 2.452 ( -10.558 0.675 5.298) 11.832 2.508 ( -7.641 -4.003 -4.405) 9.685 2.786 ( -5.909 -0.643 1.437) 6.115 2.832 ( -5.943 0.806 4.100) 7.265 2.878 ( 0.142 -0.613 8.354) 8.378 2.984 ( -1.689 3.245 -1.759) 4.059 3.150 ( -14.114 2.662 8.479) 16.679 3.182 ( -3.001 -7.239 0.168) 7.838 3.396 ( -0.772 1.986 -1.984) 2.911 3.627 ( -12.938 0.559 -15.703) 20.355 3.802 ( 10.376 1.487 -12.658) 16.435 3.978 ( -1.828 -4.049 -3.360) 5.570 4.506 ( 8.541 -2.784 -1.558) 9.117 4.631 ( 22.167 -4.362 -5.779) 23.319 4.732 ( -0.670 5.258 3.073) 6.127 4.815 ( 17.102 -3.857 -3.776) 17.934 5.015 ( 9.101 3.946 -5.086) 11.148 5.342 ( 3.139 11.667 5.852) 13.425 5.526 ( 9.115 -1.257 -0.571) 9.219 5.854 ( 1.910 1.177 -3.357) 4.038 5.933 ( -5.171 3.548 1.916) 6.558 6.150 ( -2.841 -3.293 4.792) 6.471 6.341 ( -20.498 -16.349 -1.190) 26.246 6.447 ( -1.105 -2.371 -12.161) 12.439 6.659 ( -3.616 -7.851 2.717) 9.060 7.036 ( -3.941 3.095 -10.374) 11.521 7.076 ( 14.440 5.387 11.403) 19.172 7.478 ( 5.433 3.672 5.002) 8.248 7.654 ( 3.797 7.153 -1.566) 8.248 7.982 ( -1.148 -4.804 -1.238) 5.092 8.078 ( 2.088 -5.423 1.414) 5.981 8.221 ( -0.753 -2.174 -1.849) 2.952 9.175 ( 8.281 2.747 0.054) 8.725 9.279 ( 6.075 7.106 3.459) 9.968 9.407 ( -1.815 1.530 -1.195) 2.657 9.860 ( -4.406 4.807 -0.784) 6.567 10.035 ( 0.255 -1.556 -4.793) 5.046 10.203 ( -5.960 3.889 8.518) 11.100 10.373 ( 4.803 5.071 1.203) 7.088 10.634 ( -6.548 -1.760 1.295) 6.903 11.276 ( -1.791 -1.057 -2.826) 3.509 11.493 ( -12.429 -2.192 1.619) 12.724 12.670 ( 12.517 -0.075 -0.639) 12.533 12.852 ( 7.989 -1.967 0.505) 8.243 13.022 ( 0.160 2.254 3.243) 3.953 13.135 ( 1.311 0.693 2.825) 3.191 14.821 ( 9.361 -3.203 -1.628) 10.027 15.096 ( 7.827 0.308 -0.744) 7.868 15.306 ( 0.654 -2.942 3.896) 4.926 15.394 ( 6.337 -0.434 0.951) 6.422 15.496 ( 7.332 -0.586 -5.389) 9.119 15.727 ( -4.372 -4.949 -0.940) 6.670 15.895 ( -8.198 -1.427 -0.278) 8.326 16.122 ( -6.400 2.281 1.226) 6.904 21.024 ( 8.515 -6.105 -1.098) 10.535 21.154 ( 3.423 -3.617 -2.255) 5.466 22.526 ( 2.936 -0.290 1.295) 3.222 22.751 ( -5.395 -0.999 4.356) 7.006 ======================= Grid point 315 (152/170) ======================= q-point: ( 0.45 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 23.681 4.831 -8.651) 25.670 2.192 ( 10.799 0.974 1.709) 10.977 2.334 ( -14.272 2.923 8.991) 17.119 2.350 ( -6.478 -2.744 -4.176) 8.181 2.701 ( -7.122 0.559 3.364) 7.896 2.753 ( -4.417 2.210 -5.793) 7.612 2.938 ( 3.216 0.190 -3.074) 4.453 2.992 ( -7.124 -1.729 6.676) 9.915 3.065 ( 0.766 -1.988 8.538) 8.800 3.156 ( -3.397 -4.544 2.466) 6.186 3.280 ( -0.974 0.814 -10.544) 10.620 3.325 ( -5.344 2.405 -8.624) 10.427 3.845 ( 5.579 -3.549 -2.710) 7.146 3.912 ( -4.187 -5.813 -0.535) 7.184 4.587 ( 4.760 6.126 1.051) 7.828 4.684 ( -4.809 8.691 -1.570) 10.056 4.862 ( 14.567 -0.419 -1.881) 14.694 5.011 ( -2.702 3.688 -0.821) 4.645 5.264 ( 24.017 -10.724 2.225) 26.396 5.532 ( 11.510 5.027 6.217) 14.015 5.581 ( -4.676 -5.826 -3.564) 8.277 5.749 ( 0.297 1.624 -1.774) 2.423 6.012 ( -12.670 -10.892 1.349) 16.763 6.059 ( -10.091 -9.727 -3.205) 14.378 6.075 ( 7.055 1.663 2.015) 7.523 6.259 ( -11.243 -0.263 -1.795) 11.389 6.667 ( -0.077 -3.909 6.644) 7.709 6.807 ( -3.551 -1.559 -13.067) 13.631 7.466 ( 12.763 -2.542 8.067) 15.311 7.605 ( -4.041 2.435 8.367) 9.606 7.671 ( 10.990 6.449 -4.889) 13.648 7.894 ( -8.361 2.998 -4.356) 9.893 8.121 ( 1.478 -5.833 1.543) 6.212 8.168 ( -1.865 -4.812 -2.597) 5.777 9.251 ( 3.086 0.764 0.378) 3.202 9.299 ( -3.486 5.499 0.550) 6.534 9.520 ( 10.974 1.561 1.425) 11.176 9.701 ( -9.266 4.087 -3.011) 10.566 10.047 ( 6.187 5.935 -5.701) 10.296 10.111 ( -9.725 9.048 4.986) 14.188 10.527 ( 8.218 -0.161 0.944) 8.274 10.604 ( -3.466 0.487 3.259) 4.783 11.245 ( 4.295 -1.055 -4.962) 6.647 11.324 ( -11.456 -1.618 3.524) 12.095 12.841 ( 9.178 -1.684 -0.598) 9.351 12.920 ( -1.175 -2.147 0.884) 2.602 13.067 ( 2.915 3.628 1.778) 4.982 13.134 ( -3.201 2.505 0.172) 4.068 14.976 ( 11.271 -5.689 -0.467) 12.634 15.128 ( -6.065 -3.853 0.081) 7.185 15.343 ( 5.342 -5.974 0.520) 8.031 15.440 ( -2.513 -0.252 -1.270) 2.827 15.573 ( 5.179 -4.885 1.742) 7.330 15.669 ( -4.197 -4.951 -1.191) 6.599 15.854 ( 4.934 4.739 0.914) 6.902 15.996 ( -8.992 4.353 -1.237) 10.067 21.120 ( 3.942 -8.180 0.638) 9.102 21.162 ( 0.389 -7.125 -1.895) 7.383 22.604 ( 5.345 0.450 0.471) 5.384 22.691 ( -6.234 0.014 1.680) 6.456 ======================= Grid point 321 (153/170) ======================= q-point: ( 0.00 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( 0.156 5.736 -12.092) 13.385 2.024 ( -0.156 5.736 12.092) 13.385 2.311 ( 6.401 3.698 -14.219) 16.026 2.311 ( -6.401 3.698 14.219) 16.026 2.807 ( -2.209 -2.924 -5.136) 6.310 2.807 ( 2.209 -2.924 5.136) 6.310 2.914 ( 0.531 -8.974 -4.392) 10.005 2.914 ( -0.531 -8.974 4.392) 10.005 3.431 ( -4.228 -7.427 -4.018) 9.444 3.431 ( 4.228 -7.427 4.018) 9.444 3.497 ( -2.483 -9.128 -3.710) 10.161 3.497 ( 2.483 -9.128 3.710) 10.161 4.494 ( -2.929 21.842 -7.738) 23.356 4.494 ( 2.929 21.842 7.738) 23.356 4.670 ( -8.428 16.551 -4.053) 19.010 4.670 ( 8.428 16.551 4.053) 19.010 4.840 ( -3.401 4.983 -11.800) 13.253 4.840 ( 3.401 4.983 11.800) 13.253 5.344 ( 2.044 9.079 -4.531) 10.350 5.344 ( -2.044 9.079 4.531) 10.350 5.480 ( -4.267 -0.814 -1.430) 4.574 5.480 ( 4.267 -0.814 1.430) 4.574 6.122 ( 2.731 10.803 -1.730) 11.276 6.122 ( -2.731 10.803 1.730) 11.276 6.303 ( -1.361 4.406 -11.589) 12.472 6.303 ( 1.361 4.406 11.589) 12.472 6.807 ( -7.918 3.341 -10.287) 13.405 6.807 ( 7.918 3.341 10.287) 13.405 7.425 ( -4.971 2.375 -7.782) 9.535 7.425 ( 4.971 2.375 7.782) 9.535 7.766 ( 6.681 5.121 -4.670) 9.626 7.766 ( -6.681 5.121 4.670) 9.626 8.284 ( -1.556 -4.152 -6.320) 7.720 8.284 ( 1.556 -4.152 6.320) 7.720 8.900 ( 2.329 5.594 -10.836) 12.415 8.900 ( -2.329 5.594 10.836) 12.415 9.396 ( -8.825 0.657 -1.342) 8.951 9.396 ( 8.825 0.657 1.342) 8.951 10.095 ( -10.628 4.594 -13.471) 17.763 10.095 ( 10.628 4.594 13.471) 17.763 10.991 ( 5.100 -10.225 -11.500) 16.212 10.991 ( -5.100 -10.225 11.500) 16.212 11.592 ( 1.023 -7.719 -7.874) 11.074 11.592 ( -1.023 -7.719 7.874) 11.074 12.343 ( 0.797 0.009 -11.290) 11.318 12.343 ( -0.797 0.009 11.290) 11.318 12.592 ( -1.337 2.690 -8.793) 9.292 12.592 ( 1.337 2.690 8.793) 9.292 14.927 ( -2.951 12.594 -3.304) 13.350 14.927 ( 2.951 12.594 3.304) 13.350 15.257 ( -2.706 4.068 -1.689) 5.170 15.257 ( 2.706 4.068 1.689) 5.170 15.637 ( 3.212 -0.945 -16.159) 16.502 15.637 ( -3.212 -0.945 16.159) 16.502 16.175 ( -0.706 -3.639 -2.127) 4.273 16.175 ( 0.706 -3.639 2.127) 4.273 20.824 ( -3.583 7.738 -3.698) 9.295 20.824 ( 3.583 7.738 3.698) 9.295 22.525 ( -0.254 -4.960 -5.461) 7.382 22.525 ( 0.254 -4.960 5.461) 7.382 ======================= Grid point 323 (154/170) ======================= q-point: ( 0.09 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.971 ( 6.946 11.230 -7.901) 15.388 2.129 ( 6.718 4.094 -6.504) 10.207 2.356 ( 3.724 6.351 5.876) 9.420 2.420 ( 2.330 -1.425 12.234) 12.536 2.703 ( -5.625 -4.438 -1.795) 7.386 2.856 ( -3.795 -5.553 3.532) 7.597 2.900 ( 0.078 -4.131 5.079) 6.547 2.929 ( -2.157 -6.946 1.263) 7.382 3.288 ( -5.782 -5.324 -6.053) 9.921 3.415 ( -2.127 -10.125 -3.306) 10.862 3.519 ( 1.768 -8.133 3.626) 9.079 3.563 ( 1.604 -9.565 -0.333) 9.705 4.307 ( -1.231 21.363 -15.489) 26.417 4.413 ( -12.157 14.734 -1.019) 19.129 4.548 ( -2.035 11.079 -7.443) 13.501 4.676 ( -5.781 11.685 1.165) 13.089 4.743 ( 3.681 15.887 -10.383) 19.333 5.035 ( 0.684 8.552 8.700) 12.218 5.342 ( -0.425 7.906 4.274) 8.997 5.360 ( -2.670 5.200 -1.821) 6.122 5.448 ( 0.402 2.334 3.278) 4.044 5.553 ( 7.832 0.131 -4.722) 9.146 6.020 ( 0.384 4.288 -17.195) 17.726 6.135 ( 6.603 11.691 1.716) 13.536 6.234 ( 0.845 -0.531 -1.612) 1.896 6.461 ( -2.844 1.855 4.342) 5.512 6.715 ( 11.279 9.788 -1.464) 15.006 7.078 ( 9.849 2.759 7.065) 12.431 7.191 ( -14.040 -1.684 -3.985) 14.691 7.568 ( 3.928 1.014 -0.535) 4.091 7.696 ( -6.601 8.952 7.363) 13.339 7.839 ( 7.345 6.311 -4.704) 10.766 8.169 ( -1.825 -4.254 -6.218) 7.752 8.286 ( -4.163 -4.933 -2.636) 6.973 8.914 ( 5.671 7.779 -1.019) 9.680 9.097 ( 8.124 0.285 14.487) 16.612 9.267 ( -6.177 -0.066 1.240) 6.301 9.573 ( 9.482 5.268 3.502) 11.399 9.775 ( -11.795 5.127 -8.543) 15.439 10.338 ( 0.401 3.174 12.656) 13.054 10.870 ( -3.350 -8.052 -12.462) 15.210 10.999 ( -6.927 -7.708 8.158) 13.189 11.462 ( -6.566 -7.974 -5.439) 11.674 11.629 ( -4.456 -8.312 7.812) 12.246 12.317 ( 9.780 0.691 -9.680) 13.778 12.489 ( 6.881 2.417 -8.202) 10.976 12.555 ( 5.790 0.770 8.754) 10.524 12.732 ( 4.598 1.127 7.391) 8.778 14.847 ( -2.940 10.413 -2.781) 11.172 15.008 ( 2.453 12.775 3.097) 13.372 15.181 ( -3.299 0.652 -0.066) 3.364 15.283 ( -0.648 5.972 -0.850) 6.067 15.535 ( 6.502 0.704 -16.117) 17.394 15.783 ( 0.401 -2.505 12.523) 12.777 16.108 ( -4.962 -4.073 -0.274) 6.425 16.173 ( -4.156 -4.003 1.980) 6.101 20.765 ( 1.547 6.589 -3.806) 7.765 20.942 ( 6.220 6.091 2.464) 9.048 22.464 ( -1.292 -4.438 -2.515) 5.262 22.596 ( -0.100 -4.772 6.580) 8.129 ======================= Grid point 324 (155/170) ======================= q-point: ( 0.18 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( 7.815 12.749 -7.928) 16.926 2.130 ( 7.768 11.121 -14.767) 20.052 2.444 ( -3.128 0.359 10.027) 10.509 2.573 ( -1.699 -5.698 3.933) 7.129 2.646 ( -0.074 -2.744 7.372) 7.866 2.841 ( -4.892 -5.034 1.327) 7.144 2.918 ( 2.886 -7.448 2.978) 8.525 2.985 ( -1.773 -0.691 11.958) 12.109 3.115 ( -8.820 -5.750 -5.469) 11.865 3.349 ( -1.172 -5.667 -3.577) 6.803 3.537 ( 0.199 -5.736 -4.695) 7.415 3.602 ( 1.635 -8.524 7.224) 11.292 4.153 ( 1.857 11.538 -16.390) 20.130 4.272 ( -5.832 11.552 -0.207) 12.942 4.356 ( -6.368 11.425 -7.851) 15.255 4.606 ( -2.769 9.234 -9.065) 13.233 4.666 ( 0.399 17.646 -3.082) 17.917 5.044 ( -5.367 8.017 3.277) 10.189 5.247 ( -2.544 -0.145 -13.155) 13.399 5.379 ( 4.939 5.696 -12.182) 14.326 5.445 ( 4.934 1.251 2.447) 5.648 5.690 ( 9.335 6.250 1.797) 11.377 5.929 ( 0.239 1.721 1.551) 2.329 6.235 ( 2.981 -6.051 -3.227) 7.478 6.288 ( 1.305 1.316 -2.857) 3.406 6.398 ( 1.319 2.652 3.293) 4.429 6.876 ( -15.734 -6.279 0.177) 16.942 6.996 ( 8.400 5.138 2.211) 10.092 7.167 ( -0.209 7.707 -3.351) 8.407 7.526 ( -1.289 -0.348 -5.496) 5.656 7.749 ( 0.559 7.212 5.273) 8.952 7.913 ( 7.806 9.593 -2.157) 12.554 8.119 ( 2.352 -5.690 -4.210) 7.459 8.157 ( -6.785 -0.807 -1.904) 7.093 8.989 ( 7.361 8.573 -4.530) 12.174 9.170 ( -2.680 -0.259 0.464) 2.732 9.473 ( 11.028 -1.751 14.664) 18.431 9.635 ( 0.579 3.071 3.004) 4.335 9.759 ( 6.602 8.850 6.772) 12.952 10.343 ( -10.706 -1.419 2.222) 11.026 10.677 ( -6.733 -2.252 -3.614) 7.967 10.943 ( -8.183 -1.685 0.764) 8.389 11.318 ( -6.123 -8.054 -0.019) 10.118 11.629 ( -5.745 -8.001 5.563) 11.312 12.404 ( 11.800 1.326 -6.612) 13.591 12.522 ( 11.011 4.498 -6.888) 13.744 12.791 ( 8.683 -2.081 7.964) 11.964 12.885 ( 5.221 0.719 5.914) 7.921 14.775 ( -2.586 6.146 -1.961) 6.950 15.052 ( -1.685 5.408 3.151) 6.482 15.185 ( 3.208 4.319 0.533) 5.407 15.253 ( 1.438 4.834 -2.968) 5.852 15.490 ( 8.439 1.840 -13.372) 15.919 15.830 ( -7.371 -5.962 2.829) 9.893 16.081 ( -3.139 -3.035 1.869) 4.750 16.096 ( -5.339 -4.151 5.600) 8.780 20.781 ( 4.726 2.931 -3.188) 6.410 21.044 ( 3.886 1.769 0.560) 4.306 22.437 ( -0.092 -2.838 -0.208) 2.847 22.662 ( -1.414 -4.227 7.329) 8.578 ======================= Grid point 325 (156/170) ======================= q-point: ( 0.27 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( 7.418 8.743 -10.120) 15.293 2.068 ( 7.717 13.706 -13.826) 20.942 2.492 ( -3.141 -2.715 7.206) 8.316 2.507 ( -6.460 -4.786 0.143) 8.041 2.775 ( 0.729 -4.995 7.878) 9.356 2.803 ( -3.905 -1.737 5.524) 6.984 2.886 ( -10.388 -4.514 -3.446) 11.839 2.963 ( -0.210 -7.884 3.103) 8.476 3.112 ( -1.516 0.396 6.747) 6.926 3.303 ( -3.182 1.266 1.899) 3.916 3.505 ( -1.605 -0.463 -1.219) 2.068 3.692 ( -3.550 -8.244 7.526) 11.714 3.986 ( 5.839 11.036 -18.769) 22.543 4.168 ( -4.029 -0.302 -4.830) 6.297 4.286 ( 3.392 5.747 -6.288) 9.169 4.355 ( -0.980 1.792 -19.993) 20.097 4.756 ( 7.331 11.547 3.875) 14.215 4.932 ( -5.037 8.252 -5.977) 11.366 5.083 ( 0.634 2.705 -6.086) 6.690 5.423 ( 10.385 9.385 -3.570) 14.446 5.570 ( 5.287 2.951 1.668) 6.281 5.812 ( 5.252 4.481 -0.474) 6.920 6.008 ( 0.108 -2.747 8.273) 8.717 6.118 ( -10.927 -8.901 -5.203) 15.024 6.203 ( -7.261 -13.446 -3.745) 15.734 6.447 ( -1.922 -9.583 -1.337) 9.865 6.653 ( -6.427 0.928 -3.904) 7.577 6.980 ( -0.748 9.531 -0.068) 9.561 7.223 ( 0.225 0.515 0.700) 0.898 7.487 ( 4.721 5.231 -2.887) 7.615 7.776 ( 1.364 6.079 -1.874) 6.506 8.009 ( -0.762 -0.333 1.441) 1.664 8.017 ( -2.064 5.513 -1.958) 6.204 8.173 ( 5.061 -1.325 -1.114) 5.349 9.060 ( 8.187 2.575 -4.390) 9.640 9.205 ( 5.932 3.835 1.519) 7.225 9.608 ( 0.829 4.379 -0.188) 4.461 9.878 ( 10.364 -4.107 8.390) 13.953 9.953 ( 6.354 8.981 12.950) 16.992 10.139 ( -8.129 -0.763 -5.584) 9.892 10.598 ( -6.093 1.125 6.030) 8.646 10.757 ( -10.812 2.958 -4.717) 12.161 11.267 ( -3.751 -5.535 2.570) 7.163 11.555 ( -8.453 -6.624 1.567) 10.853 12.530 ( 11.200 2.413 -3.109) 11.872 12.680 ( 13.197 3.124 -1.374) 13.631 12.968 ( 5.534 -1.786 3.469) 6.771 13.023 ( 3.810 -0.214 6.002) 7.112 14.735 ( -0.067 1.292 -1.078) 1.684 15.036 ( -1.501 -0.738 0.662) 1.798 15.267 ( -0.098 3.199 1.903) 3.723 15.285 ( 9.115 3.767 -1.708) 10.009 15.497 ( 6.691 1.915 -8.342) 10.864 15.697 ( -7.846 -7.263 -0.873) 10.727 15.952 ( -8.608 -4.894 0.110) 9.903 16.168 ( -0.252 -0.048 5.357) 5.363 20.823 ( 4.147 -2.860 -2.400) 5.580 21.067 ( -0.216 -3.740 -1.493) 4.033 22.460 ( 2.132 -0.689 1.410) 2.648 22.708 ( -2.627 -3.319 6.604) 7.844 ======================= Grid point 326 (157/170) ======================= q-point: ( 0.36 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.039 ( 8.917 5.049 -8.234) 13.146 2.110 ( 12.439 7.970 -10.134) 17.915 2.392 ( -6.074 -4.855 -2.634) 8.210 2.492 ( -7.320 1.469 6.857) 10.137 2.718 ( -4.478 -5.602 -0.952) 7.235 2.828 ( -0.314 -2.669 7.454) 7.924 2.854 ( -2.702 0.298 4.470) 5.232 2.995 ( -0.951 -8.258 2.650) 8.724 3.088 ( -3.802 4.549 -0.115) 5.929 3.226 ( -12.637 3.838 4.685) 14.013 3.424 ( -4.146 -0.170 -3.102) 5.181 3.589 ( -12.366 -4.156 -7.155) 14.879 3.859 ( -4.382 2.049 -12.389) 13.299 3.947 ( 2.188 3.453 -12.942) 13.572 4.381 ( 13.581 -8.719 -4.651) 16.796 4.436 ( 23.523 -11.710 -3.049) 26.453 4.841 ( 4.438 10.234 -0.412) 11.163 4.916 ( -0.735 8.261 2.816) 8.759 5.121 ( 4.583 5.261 3.001) 7.596 5.555 ( 9.597 7.864 -4.909) 13.344 5.569 ( -10.016 -1.312 3.689) 10.754 5.854 ( -8.030 -6.760 -6.924) 12.575 5.889 ( -2.122 -9.009 -0.336) 9.262 5.947 ( -9.733 -12.339 -1.447) 15.782 6.065 ( -4.447 -1.894 7.682) 9.076 6.474 ( -2.096 0.661 5.048) 5.505 6.498 ( 2.037 -0.585 -11.741) 11.931 7.087 ( 3.478 -2.083 2.498) 4.762 7.122 ( -1.935 3.956 -4.850) 6.551 7.593 ( 4.573 6.019 5.783) 9.518 7.744 ( -1.557 0.022 -5.111) 5.343 7.939 ( -1.733 3.475 1.934) 4.338 8.062 ( 2.616 -0.261 -0.821) 2.754 8.203 ( 0.969 0.889 -3.778) 4.001 9.146 ( 5.838 -1.127 -0.351) 5.956 9.315 ( 3.719 -3.001 -0.824) 4.849 9.592 ( 2.566 10.860 -1.949) 11.328 9.939 ( -4.060 0.037 -3.834) 5.584 10.099 ( 6.988 9.122 1.242) 11.558 10.228 ( 6.465 2.060 10.907) 12.845 10.559 ( -6.676 3.495 -2.563) 7.959 10.611 ( -2.550 5.933 7.282) 9.733 11.230 ( -2.012 -3.575 -0.970) 4.216 11.413 ( -10.515 -5.479 0.525) 11.869 12.685 ( 10.334 1.822 -0.183) 10.495 12.849 ( 8.016 1.797 -0.081) 8.215 13.054 ( 2.996 0.269 1.190) 3.235 13.123 ( 1.098 -2.040 4.664) 5.207 14.760 ( 4.091 -1.837 0.160) 4.488 15.053 ( 4.320 -6.017 -1.002) 7.475 15.204 ( -9.267 -2.679 0.694) 9.671 15.436 ( 8.389 3.362 1.859) 9.227 15.467 ( -4.362 -4.766 -2.466) 6.916 15.624 ( 1.072 -3.247 -2.747) 4.387 15.875 ( 0.891 1.436 -0.573) 1.785 16.174 ( -4.179 1.774 1.956) 4.943 20.855 ( 2.568 -9.017 -1.186) 9.450 21.018 ( -2.566 -8.922 -2.558) 9.630 22.529 ( 4.147 0.712 1.709) 4.541 22.719 ( -3.774 -1.978 4.525) 6.215 ======================= Grid point 327 (158/170) ======================= q-point: ( 0.45 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.138 ( 6.888 -3.568 0.805) 7.799 2.220 ( 12.403 -0.792 -12.538) 17.654 2.286 ( -0.800 -0.404 1.959) 2.154 2.430 ( -12.326 4.279 7.807) 15.205 2.692 ( 3.680 -1.161 -1.308) 4.075 2.806 ( -6.684 2.818 0.929) 7.313 2.945 ( -1.672 -1.412 3.081) 3.779 2.959 ( -3.796 -2.947 0.050) 4.806 3.000 ( 1.104 1.370 -0.253) 1.777 3.112 ( -7.996 0.814 2.968) 8.568 3.287 ( 1.747 -0.894 -10.536) 10.717 3.336 ( -6.926 -1.479 -2.965) 7.678 3.785 ( -1.684 -2.432 3.832) 4.840 3.847 ( -0.022 1.114 -8.673) 8.744 4.606 ( 17.754 -11.083 -1.779) 21.005 4.774 ( 12.180 -8.859 1.599) 15.146 4.851 ( -0.715 2.516 -3.276) 4.192 5.030 ( 14.208 0.964 5.481) 15.259 5.079 ( -15.301 -2.814 2.080) 15.696 5.345 ( -15.407 -9.796 -3.661) 18.621 5.656 ( 7.974 -6.956 -6.012) 12.170 5.693 ( -4.318 -7.036 2.129) 8.526 5.803 ( -0.545 5.674 2.938) 6.413 5.921 ( -5.845 0.287 -1.383) 6.014 6.137 ( 1.950 1.539 11.543) 11.808 6.313 ( -1.535 4.044 -14.153) 14.800 6.630 ( 3.376 1.245 13.301) 13.779 6.869 ( -7.134 4.257 -13.684) 16.008 7.323 ( 12.561 -8.223 3.704) 15.463 7.550 ( -12.429 -7.884 -0.447) 14.725 7.809 ( 9.258 6.670 3.881) 12.053 7.943 ( -2.221 3.880 -0.527) 4.501 8.083 ( 3.380 0.015 -3.467) 4.842 8.127 ( -4.637 1.035 -1.590) 5.010 9.228 ( 5.067 -2.319 -0.520) 5.596 9.292 ( -3.966 -4.599 0.588) 6.101 9.679 ( 7.488 9.469 0.378) 12.078 9.811 ( -6.486 5.021 -3.338) 8.856 10.217 ( 8.319 9.968 -1.955) 13.130 10.310 ( -6.462 9.185 3.918) 11.894 10.561 ( 5.772 3.635 2.820) 7.382 10.644 ( -2.609 3.864 2.603) 5.340 11.202 ( 3.186 -3.164 -4.272) 6.198 11.264 ( -9.645 -4.282 2.860) 10.933 12.830 ( 7.141 0.734 0.637) 7.207 12.904 ( -0.859 0.530 -0.435) 1.099 13.111 ( 3.799 0.153 -0.226) 3.809 13.151 ( -2.363 -1.326 2.285) 3.544 14.866 ( 8.429 -3.784 0.946) 9.288 15.032 ( -11.150 -5.662 -0.428) 12.513 15.155 ( 9.543 -8.462 -1.101) 12.802 15.319 ( -11.366 -9.843 0.225) 15.037 15.564 ( 3.951 2.323 3.069) 5.516 15.620 ( 1.236 0.633 -3.437) 3.707 15.956 ( 7.838 4.830 0.392) 9.215 16.088 ( -7.541 3.702 -0.213) 8.403 20.888 ( 2.370 -12.729 0.634) 12.964 20.946 ( -2.910 -12.478 -2.181) 12.997 22.616 ( 5.017 0.687 0.516) 5.090 22.687 ( -4.724 -0.448 1.826) 5.084 ======================= Grid point 333 (159/170) ======================= q-point: ( 0.00 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 1.446 2.415 -9.112) 9.536 2.122 ( -1.446 2.415 9.112) 9.536 2.319 ( 4.545 -1.594 -8.359) 9.648 2.319 ( -4.545 -1.594 8.359) 9.648 2.708 ( -3.218 -5.030 -1.300) 6.111 2.708 ( 3.218 -5.030 1.300) 6.111 2.803 ( -2.024 -1.181 -1.861) 2.992 2.803 ( 2.024 -1.181 1.861) 2.992 3.256 ( -2.086 -7.250 -2.298) 7.886 3.256 ( 2.086 -7.250 2.298) 7.886 3.390 ( -1.018 -2.321 -4.872) 5.492 3.390 ( 1.018 -2.321 4.872) 5.492 4.720 ( -1.270 2.942 -1.086) 3.383 4.720 ( 1.270 2.942 1.086) 3.383 4.959 ( -0.639 9.695 -2.976) 10.161 4.959 ( 0.639 9.695 2.976) 10.161 5.137 ( -0.248 12.943 -5.330) 14.000 5.137 ( 0.248 12.943 5.330) 14.000 5.478 ( -1.926 1.148 -1.375) 2.630 5.478 ( 1.926 1.148 1.375) 2.630 5.615 ( 2.726 19.019 -17.591) 26.049 5.615 ( -2.726 19.019 17.591) 26.049 6.230 ( 4.443 -0.574 -12.702) 13.469 6.230 ( -4.443 -0.574 12.702) 13.469 6.452 ( -2.795 6.011 -7.657) 10.128 6.452 ( 2.795 6.011 7.657) 10.128 6.888 ( -6.054 5.639 -4.844) 9.588 6.888 ( 6.054 5.639 4.844) 9.588 7.352 ( -11.645 -7.498 -0.736) 13.870 7.352 ( 11.645 -7.498 0.736) 13.870 7.851 ( 2.435 2.868 -3.617) 5.219 7.851 ( -2.435 2.868 3.617) 5.219 8.118 ( -2.424 -10.067 -2.736) 10.710 8.118 ( 2.424 -10.067 2.736) 10.710 8.962 ( 2.785 0.344 -5.851) 6.489 8.962 ( -2.785 0.344 5.851) 6.489 9.575 ( -3.759 13.495 -7.420) 15.853 9.575 ( 3.759 13.495 7.420) 15.853 10.207 ( -8.185 5.387 -10.492) 14.356 10.207 ( 8.185 5.387 10.492) 14.356 10.751 ( 4.955 -11.516 -10.044) 16.064 10.751 ( -4.955 -11.516 10.044) 16.064 11.426 ( 0.422 -6.932 -5.360) 8.773 11.426 ( -0.422 -6.932 5.360) 8.773 12.348 ( 0.154 0.362 -6.547) 6.559 12.348 ( -0.154 0.362 6.547) 6.559 12.639 ( -0.767 1.547 -4.948) 5.240 12.639 ( 0.767 1.547 4.948) 5.240 15.160 ( -3.520 8.555 -4.987) 10.509 15.160 ( 3.520 8.555 4.987) 10.509 15.360 ( -5.890 5.449 -2.714) 8.470 15.360 ( 5.890 5.449 2.714) 8.470 15.598 ( 5.355 -2.698 -13.277) 14.568 15.598 ( -5.355 -2.698 13.277) 14.568 16.082 ( -0.973 -4.507 -1.402) 4.819 16.082 ( 0.973 -4.507 1.402) 4.819 21.021 ( -3.328 9.305 -1.828) 10.050 21.021 ( 3.328 9.305 1.828) 10.050 22.405 ( -0.281 -5.589 -3.950) 6.850 22.405 ( 0.281 -5.589 3.950) 6.850 ======================= Grid point 335 (160/170) ======================= q-point: ( 0.09 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.147 ( 7.613 3.721 0.211) 8.476 2.217 ( 1.649 5.896 0.623) 6.154 2.356 ( -0.302 -3.386 6.674) 7.490 2.390 ( 8.548 -4.252 4.965) 10.760 2.635 ( -6.233 -1.925 2.442) 6.966 2.724 ( -0.869 -1.646 -2.393) 3.032 2.788 ( -3.171 -5.912 6.984) 9.684 2.868 ( 1.474 -0.743 2.921) 3.355 3.176 ( -4.440 -5.205 -5.508) 8.783 3.277 ( -2.182 -2.240 -1.015) 3.287 3.321 ( 2.692 -8.558 -3.463) 9.616 3.406 ( -2.301 -5.291 1.739) 6.026 4.612 ( -7.150 5.910 -2.430) 9.589 4.717 ( 0.310 4.539 -7.803) 9.033 4.819 ( -8.454 19.413 -4.609) 21.670 4.936 ( -3.644 12.361 0.789) 12.911 5.094 ( 3.067 12.414 -6.892) 14.526 5.187 ( -1.460 5.438 2.797) 6.287 5.415 ( -4.822 2.288 -0.277) 5.344 5.497 ( 3.223 8.425 -14.991) 17.496 5.499 ( -1.217 0.166 1.867) 2.235 5.742 ( -3.133 17.414 9.018) 19.859 6.079 ( 3.553 -1.033 -20.334) 20.668 6.228 ( -2.185 0.715 -2.316) 3.264 6.351 ( -7.430 -1.931 -3.241) 8.333 6.480 ( -1.432 9.319 1.990) 9.636 6.867 ( 1.895 0.552 14.300) 14.436 6.987 ( -18.403 -8.715 1.837) 20.445 7.233 ( 11.961 7.651 1.518) 14.280 7.554 ( 12.236 -2.573 -5.655) 13.723 7.759 ( -6.124 0.026 1.433) 6.289 7.955 ( 8.113 4.426 -0.956) 9.291 8.020 ( -4.429 -9.523 -3.186) 10.975 8.153 ( -0.087 -7.218 0.439) 7.232 9.015 ( 7.447 2.111 -0.060) 7.740 9.076 ( 6.926 -1.684 6.616) 9.725 9.473 ( 0.524 15.750 -5.126) 16.572 9.745 ( 7.299 8.400 5.412) 12.374 9.933 ( -11.173 9.642 -7.730) 16.660 10.342 ( -4.774 -3.712 7.822) 9.887 10.714 ( 2.569 -5.562 -9.383) 11.206 10.834 ( 0.655 -7.293 11.242) 13.416 11.302 ( -8.789 -5.678 -2.953) 10.872 11.436 ( -5.350 -9.151 6.624) 12.500 12.358 ( 8.599 2.875 -5.392) 10.548 12.484 ( 8.987 -1.997 2.287) 9.486 12.617 ( 3.360 3.899 -1.101) 5.263 12.736 ( 4.556 -0.957 4.564) 6.519 15.048 ( -4.276 8.071 -4.428) 10.150 15.196 ( -6.252 0.940 -3.084) 7.034 15.268 ( 1.872 10.796 3.027) 11.368 15.419 ( -1.181 6.174 -0.777) 6.334 15.550 ( 6.202 0.632 -11.588) 13.159 15.687 ( -1.229 -6.572 10.671) 12.592 16.022 ( -5.003 -3.539 1.247) 6.253 16.067 ( -5.198 -5.324 1.761) 7.646 20.947 ( -2.894 9.421 -2.342) 10.130 21.076 ( 1.282 5.101 0.470) 5.280 22.375 ( 0.082 -3.134 -0.349) 3.154 22.474 ( 1.245 -6.206 5.406) 8.324 ======================= Grid point 336 (161/170) ======================= q-point: ( 0.18 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.217 ( 3.753 6.712 -6.390) 9.998 2.299 ( 6.948 4.773 1.625) 8.584 2.418 ( 1.376 -2.041 3.009) 3.888 2.524 ( -5.914 -1.484 4.986) 7.876 2.619 ( -1.304 2.556 1.469) 3.224 2.709 ( 2.318 -5.507 6.391) 8.749 2.790 ( -3.341 -4.618 4.211) 7.087 2.929 ( 0.001 -2.746 7.301) 7.800 3.000 ( -8.462 -5.210 -4.861) 11.062 3.283 ( 2.631 0.217 0.436) 2.676 3.296 ( 1.582 -13.763 -4.200) 14.476 3.443 ( 0.462 -6.025 6.638) 8.976 4.431 ( -7.040 8.853 -10.914) 15.718 4.594 ( -3.336 5.648 -9.595) 11.623 4.625 ( -11.203 23.708 -3.520) 26.457 4.849 ( -6.533 14.026 -8.672) 17.737 5.042 ( -0.372 15.306 -3.545) 15.715 5.173 ( -3.757 2.898 3.229) 5.739 5.299 ( -7.088 7.066 -6.024) 11.682 5.374 ( 0.373 -3.591 -6.454) 7.395 5.522 ( 4.557 0.106 0.111) 4.560 5.771 ( 2.733 3.082 0.559) 4.157 5.951 ( 5.002 -1.836 -15.344) 16.243 6.124 ( -14.436 -7.999 0.485) 16.511 6.159 ( -1.433 -5.225 -7.522) 9.270 6.428 ( -13.628 -7.468 -3.585) 15.948 6.774 ( -5.464 6.036 9.687) 12.654 7.069 ( 0.701 -1.342 9.920) 10.035 7.363 ( 0.424 10.461 -2.921) 10.870 7.579 ( 5.831 5.608 -8.220) 11.533 7.773 ( 4.179 -3.938 0.689) 5.783 7.936 ( -1.059 -9.011 -2.678) 9.460 8.091 ( 9.889 4.614 -0.755) 10.939 8.143 ( -2.328 -0.821 1.678) 2.985 9.142 ( 8.027 4.839 -3.563) 10.027 9.221 ( 4.276 0.906 -0.418) 4.391 9.531 ( 8.605 8.514 5.073) 13.125 9.740 ( -1.848 6.085 -2.750) 6.928 9.922 ( 5.142 5.613 5.018) 9.118 10.286 ( -8.014 -3.583 4.670) 9.944 10.609 ( -4.650 -1.286 -4.436) 6.554 10.975 ( 0.880 1.112 7.967) 8.092 11.126 ( -9.646 -7.054 -0.004) 11.950 11.430 ( -4.684 -10.265 5.487) 12.547 12.471 ( 10.816 4.735 -2.840) 12.144 12.618 ( 11.664 2.972 -4.928) 13.007 12.745 ( 6.357 -1.109 6.777) 9.358 12.871 ( 6.162 -2.204 4.035) 7.688 14.915 ( -7.949 6.858 -1.847) 10.660 15.085 ( -5.924 -0.220 0.143) 5.930 15.318 ( 5.094 5.584 -3.752) 8.438 15.359 ( -0.810 3.821 -4.074) 5.643 15.546 ( 3.195 2.888 -4.642) 6.332 15.688 ( -8.081 -6.307 1.980) 10.440 15.973 ( -7.549 -4.395 1.078) 8.801 16.034 ( 1.367 -3.349 6.661) 7.580 20.877 ( -3.014 5.696 -2.562) 6.934 21.058 ( -3.170 -0.949 -1.225) 3.529 22.402 ( 1.983 0.029 1.976) 2.800 22.555 ( 0.462 -5.514 6.509) 8.543 ======================= Grid point 337 (162/170) ======================= q-point: ( 0.27 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 2.778 5.899 -7.570) 9.991 2.330 ( 3.188 10.298 -10.114) 14.782 2.392 ( -4.448 -3.880 -0.333) 5.912 2.500 ( -4.819 1.882 7.773) 9.337 2.644 ( -0.145 -5.002 5.659) 7.554 2.732 ( -4.339 -5.797 -2.062) 7.529 2.838 ( -3.433 0.378 4.528) 5.694 2.852 ( 3.568 -0.809 -0.856) 3.757 3.059 ( 1.620 -5.105 8.334) 9.907 3.290 ( 0.681 -9.469 0.660) 9.517 3.359 ( 1.687 -3.637 3.804) 5.527 3.517 ( -1.721 -7.345 6.132) 9.722 4.179 ( -5.600 5.405 -13.010) 15.160 4.337 ( -13.011 8.167 -11.786) 19.362 4.389 ( -10.299 9.958 -15.803) 21.330 4.551 ( -9.833 17.028 -8.754) 21.524 5.055 ( 4.127 14.678 -3.501) 15.644 5.141 ( -7.416 7.014 1.375) 10.300 5.151 ( -1.062 2.954 0.266) 3.151 5.380 ( -2.182 -12.987 5.980) 14.463 5.638 ( 10.407 0.704 -3.129) 10.890 5.758 ( -6.951 -16.136 -7.128) 18.960 5.835 ( -11.519 -11.055 -6.876) 17.383 5.902 ( 7.095 0.847 -9.400) 11.807 6.082 ( -7.151 2.646 7.799) 10.907 6.276 ( -1.001 -5.703 3.055) 6.547 6.787 ( -1.620 8.408 -3.747) 9.347 7.098 ( -4.382 -2.352 2.537) 5.583 7.270 ( -3.071 8.332 -3.837) 9.673 7.620 ( 1.925 5.370 1.830) 5.991 7.779 ( -0.140 -5.355 -5.797) 7.893 7.954 ( 3.851 -4.375 0.788) 5.881 8.117 ( -2.733 5.492 1.668) 6.357 8.222 ( 8.664 3.511 -4.506) 10.378 9.135 ( 1.789 4.077 -5.454) 7.040 9.262 ( 2.077 -0.699 -3.133) 3.823 9.714 ( 8.122 6.099 -2.618) 10.489 9.816 ( 7.302 -1.414 5.248) 9.103 10.040 ( 4.146 2.220 6.693) 8.180 10.294 ( 2.035 7.745 6.646) 10.406 10.510 ( -4.304 -0.903 0.584) 4.436 10.936 ( -8.027 9.660 1.456) 12.644 11.096 ( -1.524 -10.401 4.979) 11.632 11.381 ( -6.484 -9.417 1.186) 11.495 12.616 ( 9.367 5.634 -0.134) 10.932 12.777 ( 12.288 4.719 -1.960) 13.308 12.900 ( 5.006 -3.900 4.759) 7.932 12.997 ( 3.938 -2.501 3.466) 5.812 14.792 ( -5.501 4.272 0.178) 6.968 14.986 ( -7.075 -3.161 0.823) 7.793 15.313 ( -2.303 1.614 -3.187) 4.250 15.379 ( 7.434 2.611 -2.909) 8.399 15.479 ( -8.398 -3.529 0.820) 9.147 15.583 ( -1.007 -3.398 -4.146) 5.454 15.913 ( 0.125 2.809 0.408) 2.841 16.135 ( 1.662 -3.284 5.065) 6.261 20.788 ( -4.493 0.064 -2.747) 5.266 20.955 ( -6.761 -6.151 -2.527) 9.483 22.472 ( 3.195 1.930 3.013) 4.797 22.626 ( -0.484 -4.241 6.124) 7.465 ======================= Grid point 338 (163/170) ======================= q-point: ( 0.36 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( -1.954 3.047 -6.037) 7.039 2.262 ( 3.226 2.378 -13.937) 14.501 2.293 ( -4.368 -1.031 -0.239) 4.494 2.555 ( -5.857 -0.702 0.125) 5.900 2.579 ( 1.724 -1.683 2.833) 3.719 2.739 ( 4.618 -4.469 3.830) 7.481 2.889 ( 1.366 0.738 -0.237) 1.571 2.916 ( 0.440 4.511 7.489) 8.754 3.128 ( 1.415 -1.806 0.688) 2.396 3.272 ( -6.911 -1.848 1.834) 7.385 3.354 ( -5.998 -4.349 -0.002) 7.409 3.474 ( -9.135 -5.993 -0.451) 10.935 3.902 ( -6.991 2.888 -20.782) 22.115 4.103 ( -1.347 -4.803 -4.865) 6.968 4.150 ( -1.891 6.811 0.711) 7.104 4.379 ( 1.141 5.121 -10.432) 11.677 4.942 ( -21.406 -14.323 1.384) 25.793 5.107 ( -0.718 3.731 2.023) 4.304 5.127 ( -3.360 -1.343 0.781) 3.702 5.378 ( -3.660 1.957 2.402) 4.795 5.537 ( -0.537 -10.374 -2.974) 10.805 5.721 ( 6.622 5.670 -8.568) 12.223 5.791 ( 2.384 -4.213 3.346) 5.885 5.903 ( 6.184 -1.069 -10.321) 12.080 6.110 ( -4.081 5.493 11.926) 13.750 6.367 ( 2.220 -5.343 6.401) 8.628 6.675 ( -0.699 9.904 -8.248) 12.907 7.028 ( -3.884 -4.537 -3.094) 6.727 7.205 ( -0.731 5.001 -2.450) 5.617 7.563 ( -10.874 -9.113 -0.633) 14.202 7.792 ( 6.306 6.575 2.343) 9.406 8.024 ( 3.334 -2.860 0.898) 4.483 8.093 ( -1.103 8.081 -0.731) 8.189 8.243 ( 2.399 1.949 -7.362) 7.985 9.136 ( 3.153 -0.111 -2.158) 3.822 9.221 ( -1.621 -4.765 -2.578) 5.654 9.778 ( 5.194 6.060 -3.128) 8.573 9.913 ( 1.179 -1.895 -1.117) 2.496 10.235 ( 9.312 5.191 6.797) 12.644 10.438 ( 5.245 9.964 5.673) 12.609 10.521 ( 2.293 2.351 4.871) 5.874 10.847 ( -6.475 11.004 3.037) 13.124 11.107 ( -1.144 -8.460 1.074) 8.604 11.263 ( -8.031 -8.227 -0.939) 11.535 12.757 ( 7.029 4.922 2.001) 8.811 12.910 ( 6.078 3.440 -1.494) 7.142 13.015 ( 4.760 -4.474 1.936) 6.813 13.060 ( -0.145 -3.230 2.839) 4.303 14.761 ( -0.014 1.884 2.025) 2.766 14.905 ( -3.154 -5.936 -0.239) 6.726 15.186 ( -9.044 -0.406 -0.694) 9.079 15.299 ( -11.715 -8.130 0.156) 14.261 15.512 ( 8.338 3.378 -0.151) 8.998 15.597 ( 6.616 -0.740 -3.700) 7.616 15.965 ( 4.984 6.172 0.093) 7.933 16.176 ( -1.557 -1.802 2.094) 3.171 20.688 ( -4.177 -5.453 -2.033) 7.164 20.808 ( -7.415 -9.658 -2.960) 12.530 22.558 ( 3.543 2.017 2.585) 4.827 22.669 ( -1.467 -2.688 4.336) 5.308 ======================= Grid point 339 (164/170) ======================= q-point: ( 0.45 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 264 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( -0.368 -3.109 -0.454) 3.164 2.118 ( -3.493 -5.598 -6.548) 9.296 2.305 ( 5.706 -0.227 -2.080) 6.077 2.411 ( -7.232 -5.503 -1.991) 9.303 2.740 ( 9.442 5.203 3.869) 11.454 2.885 ( -2.328 4.501 1.810) 5.381 2.899 ( 6.296 -0.850 2.453) 6.810 2.949 ( 1.163 3.182 1.138) 3.573 3.087 ( -9.736 2.884 1.712) 10.298 3.150 ( -10.729 2.616 -3.300) 11.526 3.226 ( 5.795 -5.009 -11.119) 13.502 3.284 ( -9.673 -2.849 3.177) 10.572 3.788 ( 5.725 3.746 -1.400) 6.983 3.940 ( -9.824 6.911 -2.872) 12.350 4.293 ( 10.719 -12.851 1.000) 16.764 4.440 ( 10.200 -16.035 -3.149) 19.264 4.616 ( -10.588 -18.687 -1.063) 21.505 4.842 ( -22.459 -20.161 0.572) 30.186 5.262 ( 8.953 14.641 1.722) 17.248 5.367 ( -4.309 12.112 3.099) 13.224 5.592 ( 6.703 0.297 -2.069) 7.022 5.678 ( -2.358 3.149 -4.094) 5.678 5.870 ( 1.064 -4.411 3.317) 5.621 5.890 ( 3.620 -3.141 -5.464) 7.268 6.205 ( -0.162 5.258 11.916) 13.026 6.352 ( -3.030 -0.379 -7.737) 8.317 6.708 ( 6.222 4.886 5.719) 9.762 6.893 ( -6.225 -2.462 -7.148) 9.793 7.225 ( 5.992 -0.598 -0.496) 6.042 7.369 ( -10.718 -7.149 -1.472) 12.967 7.945 ( 5.677 5.726 6.076) 10.096 8.057 ( -2.402 5.590 -1.731) 6.326 8.080 ( 3.215 -0.449 0.192) 3.251 8.158 ( -2.558 1.170 -5.985) 6.613 9.164 ( 2.594 -3.186 -1.536) 4.386 9.184 ( -1.701 -4.556 0.475) 4.887 9.821 ( 3.292 3.811 -0.800) 5.099 9.873 ( -2.587 0.868 -1.717) 3.224 10.430 ( 7.776 8.519 2.735) 11.854 10.515 ( -1.076 8.692 0.819) 8.796 10.658 ( 6.261 6.465 5.373) 10.482 10.783 ( -5.062 8.598 -0.023) 9.977 11.099 ( 1.635 -7.042 -2.290) 7.583 11.138 ( -6.727 -7.252 1.302) 9.977 12.871 ( 3.978 3.035 2.703) 5.687 12.934 ( 0.025 2.118 -2.500) 3.277 13.075 ( 3.211 -3.143 -2.560) 5.171 13.079 ( -1.936 -4.997 4.272) 6.853 14.816 ( 3.019 -1.688 2.099) 4.046 14.872 ( -1.430 -7.003 -0.881) 7.202 15.078 ( -1.928 -0.612 -0.501) 2.084 15.136 ( -8.264 -5.483 -0.001) 9.917 15.622 ( 3.869 2.621 1.365) 4.868 15.649 ( 2.916 1.350 -2.184) 3.885 16.053 ( 5.742 4.147 0.208) 7.086 16.138 ( -4.551 0.858 0.203) 4.635 20.636 ( -0.382 -9.484 -0.088) 9.492 20.681 ( -4.587 -10.976 -2.006) 12.064 22.632 ( 3.203 0.817 0.842) 3.411 22.672 ( -2.429 -0.929 1.728) 3.122 ======================= Grid point 345 (165/170) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 85 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 0.000 -0.000 -0.000) 0.000 2.127 ( 0.000 0.000 0.000) 0.000 2.310 ( 0.000 0.000 -0.000) 0.000 2.310 ( -0.000 0.000 0.000) 0.000 2.643 ( -0.000 0.000 -0.000) 0.000 2.643 ( -0.000 0.000 0.000) 0.000 2.809 ( 0.000 0.000 -0.000) 0.000 2.809 ( 0.000 0.000 0.000) 0.000 3.170 ( 0.000 0.000 -0.000) 0.000 3.170 ( -0.000 0.000 0.000) 0.000 3.367 ( 0.000 0.000 -0.000) 0.000 3.367 ( 0.000 0.000 0.000) 0.000 4.747 ( -0.000 0.000 0.000) 0.000 4.747 ( -0.000 0.000 0.000) 0.000 5.061 ( 0.000 0.000 0.000) 0.000 5.061 ( 0.000 0.000 0.000) 0.000 5.254 ( 0.000 0.000 0.000) 0.000 5.254 ( 0.000 0.000 0.000) 0.000 5.493 ( -0.000 0.000 0.000) 0.000 5.493 ( -0.000 0.000 0.000) 0.000 6.034 ( 0.000 0.000 0.000) 0.000 6.034 ( -0.000 0.000 0.000) 0.000 6.076 ( 0.000 -0.000 -0.000) 0.000 6.076 ( -0.000 0.000 0.000) 0.000 6.497 ( 0.000 0.000 0.000) 0.000 6.497 ( -0.000 0.000 0.000) 0.000 7.026 ( 0.000 0.000 0.000) 0.000 7.026 ( -0.000 0.000 0.000) 0.000 7.199 ( -0.000 0.000 0.000) 0.000 7.199 ( 0.000 0.000 0.000) 0.000 7.933 ( -0.000 -0.000 0.000) 0.000 7.933 ( 0.000 -0.000 0.000) 0.000 7.937 ( -0.000 0.000 0.000) 0.000 7.937 ( 0.000 0.000 -0.000) 0.000 8.960 ( 0.000 0.000 0.000) 0.000 8.960 ( -0.000 0.000 0.000) 0.000 9.765 ( 0.000 0.000 0.000) 0.000 9.765 ( -0.000 0.000 0.000) 0.000 10.281 ( -0.000 -0.000 -0.000) 0.000 10.281 ( 0.000 0.000 0.000) 0.000 10.591 ( -0.000 0.000 0.000) 0.000 10.591 ( 0.000 0.000 0.000) 0.000 11.343 ( -0.000 0.000 0.000) 0.000 11.343 ( -0.000 0.000 0.000) 0.000 12.353 ( 0.000 0.000 0.000) 0.000 12.353 ( -0.000 0.000 0.000) 0.000 12.655 ( -0.000 0.000 0.000) 0.000 12.655 ( 0.000 0.000 0.000) 0.000 15.256 ( -0.000 0.000 0.000) 0.000 15.256 ( -0.000 0.000 0.000) 0.000 15.449 ( 0.000 0.000 0.000) 0.000 15.449 ( -0.000 -0.000 0.000) 0.000 15.545 ( -0.000 0.000 0.000) 0.000 15.545 ( 0.000 0.000 0.000) 0.000 16.024 ( -0.000 0.000 0.000) 0.000 16.024 ( 0.000 0.000 0.000) 0.000 21.137 ( 0.000 0.000 0.000) 0.000 21.137 ( -0.000 0.000 0.000) 0.000 22.334 ( -0.000 0.000 0.000) 0.000 22.334 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 349 (166/170) ======================= q-point: ( 0.09 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( 5.266 -5.273 7.992) 10.928 2.225 ( 5.266 5.273 7.992) 10.928 2.323 ( 2.025 -2.904 -0.525) 3.579 2.323 ( 2.025 2.904 -0.525) 3.579 2.654 ( -2.738 -3.843 5.682) 7.385 2.654 ( -2.738 3.843 5.682) 7.385 2.809 ( -0.400 -4.849 0.455) 4.887 2.809 ( -0.400 4.849 0.455) 4.887 3.159 ( -0.091 -4.214 -5.146) 6.651 3.159 ( -0.091 4.214 -5.146) 6.651 3.315 ( -3.090 -3.183 -0.451) 4.459 3.315 ( -3.090 3.183 -0.451) 4.459 4.712 ( -1.649 -3.331 -4.224) 5.626 4.712 ( -1.649 3.331 -4.224) 5.626 5.058 ( -0.515 -3.609 1.468) 3.930 5.058 ( -0.515 3.609 1.468) 3.930 5.227 ( -3.754 -2.556 0.257) 4.549 5.227 ( -3.754 2.556 0.257) 4.549 5.462 ( -4.203 -2.517 -0.054) 4.899 5.462 ( -4.203 2.517 -0.054) 4.899 5.842 ( 0.451 -17.352 -21.325) 27.496 5.842 ( 0.451 17.352 -21.325) 27.496 6.092 ( -3.325 -9.687 -2.601) 10.567 6.092 ( -3.325 9.687 -2.601) 10.567 6.478 ( -12.766 -11.714 1.600) 17.399 6.478 ( -12.766 11.714 1.600) 17.399 6.866 ( -9.202 -5.706 12.839) 16.795 6.866 ( -9.202 5.706 12.839) 16.795 7.429 ( 18.731 -8.905 -3.652) 21.060 7.429 ( 18.731 8.905 -3.652) 21.060 7.823 ( -6.679 -6.936 -1.733) 9.784 7.823 ( -6.679 6.936 -1.733) 9.784 8.035 ( 6.365 -3.927 0.448) 7.492 8.035 ( 6.365 3.927 0.448) 7.492 9.043 ( 7.591 -1.220 2.965) 8.240 9.043 ( 7.591 1.220 2.965) 8.240 9.761 ( 2.772 -8.275 -5.529) 10.331 9.761 ( 2.772 8.275 -5.529) 10.331 10.173 ( -8.648 -11.393 0.256) 14.306 10.173 ( -8.648 11.393 0.256) 14.306 10.699 ( 5.468 -4.468 4.154) 8.193 10.699 ( 5.468 4.468 4.154) 8.193 11.282 ( -7.905 -4.091 2.895) 9.360 11.282 ( -7.905 4.091 2.895) 9.360 12.426 ( 8.453 -3.244 -0.266) 9.058 12.426 ( 8.453 3.244 -0.266) 9.058 12.693 ( 4.003 -2.977 1.060) 5.100 12.693 ( 4.003 2.977 1.060) 5.100 15.172 ( -3.690 -3.407 -5.520) 7.463 15.172 ( -3.690 3.407 -5.520) 7.463 15.474 ( -5.306 -6.064 -0.016) 8.057 15.474 ( -5.306 6.064 -0.016) 8.057 15.554 ( 4.957 -1.160 2.171) 5.534 15.554 ( 4.957 1.160 2.171) 5.534 15.988 ( -5.075 -1.139 1.737) 5.483 15.988 ( -5.075 1.139 1.737) 5.483 21.100 ( -3.730 -3.525 -1.292) 5.292 21.100 ( -3.730 3.525 -1.292) 5.292 22.368 ( 1.961 -2.828 2.878) 4.486 22.368 ( 1.961 2.828 2.878) 4.486 ======================= Grid point 351 (167/170) ======================= q-point: ( 0.18 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( 1.843 -4.062 -2.050) 4.909 2.326 ( 1.843 4.062 -2.050) 4.909 2.422 ( 3.336 -6.057 8.747) 11.151 2.422 ( 3.336 6.057 8.747) 11.151 2.681 ( -1.941 -1.987 4.682) 5.444 2.681 ( -1.941 1.987 4.682) 5.444 2.798 ( -3.083 -7.949 3.566) 9.242 2.798 ( -3.083 7.949 3.566) 9.242 3.043 ( -0.931 -8.575 -8.343) 12.000 3.043 ( -0.931 8.575 -8.343) 12.000 3.337 ( 0.953 -4.075 5.037) 6.548 3.337 ( 0.953 4.075 5.037) 6.548 4.578 ( -4.318 -4.972 -12.980) 14.555 4.578 ( -4.318 4.972 -12.980) 14.555 5.069 ( -5.540 -14.870 0.883) 15.893 5.069 ( -5.540 14.870 0.883) 15.893 5.125 ( -7.905 -8.813 1.391) 11.920 5.125 ( -7.905 8.813 1.391) 11.920 5.380 ( -4.637 -9.035 1.592) 10.279 5.380 ( -4.637 9.035 1.592) 10.279 5.627 ( -2.191 -17.524 -16.931) 24.465 5.627 ( -2.191 17.524 -16.931) 24.465 5.947 ( -3.830 -5.499 -9.396) 11.541 5.947 ( -3.830 5.499 -9.396) 11.541 6.233 ( -11.724 -7.805 0.579) 14.097 6.233 ( -11.724 7.805 0.579) 14.097 6.960 ( -1.692 -8.061 9.717) 12.738 6.960 ( -1.692 8.061 9.717) 12.738 7.602 ( 2.357 -11.154 -1.856) 11.550 7.602 ( 2.357 11.154 -1.856) 11.550 7.735 ( 4.751 -8.666 -4.670) 10.931 7.735 ( 4.751 8.666 -4.670) 10.931 8.142 ( 5.679 -0.414 1.444) 5.874 8.142 ( 5.679 0.414 1.444) 5.874 9.201 ( 7.818 -1.676 -0.704) 8.026 9.201 ( 7.818 1.676 -0.704) 8.026 9.730 ( 1.658 -7.499 -3.408) 8.402 9.730 ( 1.658 7.499 -3.408) 8.402 10.106 ( -1.236 -11.913 2.423) 12.220 10.106 ( -1.236 11.913 2.423) 12.220 10.769 ( -1.695 -13.598 3.511) 14.146 10.769 ( -1.695 13.598 3.511) 14.146 11.215 ( -5.740 -9.396 4.753) 11.992 11.215 ( -5.740 9.396 4.753) 11.992 12.581 ( 10.796 -4.884 0.034) 11.849 12.581 ( 10.796 4.884 0.034) 11.849 12.797 ( 6.360 -4.272 2.333) 8.009 12.797 ( 6.360 4.272 2.333) 8.009 15.042 ( -8.106 -4.292 -1.566) 9.305 15.042 ( -8.106 4.292 -1.566) 9.305 15.390 ( 1.052 -1.427 -6.097) 6.350 15.390 ( 1.052 1.427 -6.097) 6.350 15.593 ( -5.192 -3.063 1.702) 6.264 15.593 ( -5.192 3.063 1.702) 6.264 15.958 ( -0.667 -2.820 3.795) 4.775 15.958 ( -0.667 2.820 3.795) 4.775 20.995 ( -6.964 -4.772 -2.347) 8.762 20.995 ( -6.964 4.772 -2.347) 8.762 22.447 ( 2.502 -4.081 4.603) 6.642 22.447 ( 2.502 4.081 4.603) 6.642 ======================= Grid point 353 (168/170) ======================= q-point: ( 0.27 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( -1.997 -4.316 -3.712) 6.032 2.293 ( -1.997 4.316 -3.712) 6.032 2.528 ( 2.642 -5.401 2.570) 6.539 2.528 ( 2.642 5.401 2.570) 6.539 2.597 ( -6.862 -3.715 -3.241) 8.449 2.597 ( -6.862 3.715 -3.241) 8.449 2.892 ( 4.119 -3.695 8.742) 10.346 2.892 ( 4.119 3.695 8.742) 10.346 3.011 ( 2.534 -8.792 -0.942) 9.198 3.011 ( 2.534 8.792 -0.942) 9.198 3.399 ( -1.599 -3.926 5.258) 6.754 3.399 ( -1.599 3.926 5.258) 6.754 4.288 ( -7.690 -4.554 -21.008) 22.830 4.288 ( -7.690 4.554 -21.008) 22.830 4.801 ( -21.963 -13.849 -0.547) 25.970 4.801 ( -21.963 13.849 -0.547) 25.970 5.020 ( -13.553 -8.094 0.563) 15.796 5.020 ( -13.553 8.094 0.563) 15.796 5.350 ( -1.643 -11.692 -5.323) 12.951 5.350 ( -1.643 11.692 -5.323) 12.951 5.480 ( 3.983 -8.606 0.368) 9.490 5.480 ( 3.983 8.606 0.368) 9.490 5.870 ( 6.512 -3.851 -10.479) 12.925 5.870 ( 6.512 3.851 -10.479) 12.925 6.165 ( -2.942 -4.694 6.672) 8.672 6.165 ( -2.942 4.694 6.672) 8.672 6.967 ( -2.941 -8.068 -1.034) 8.650 6.967 ( -2.941 8.068 -1.034) 8.650 7.504 ( -7.006 -11.763 -3.057) 14.029 7.504 ( -7.006 11.763 -3.057) 14.029 7.828 ( 6.173 -6.840 0.292) 9.218 7.828 ( 6.173 6.840 0.292) 9.218 8.229 ( 4.953 -3.300 -2.066) 6.300 8.229 ( 4.953 3.300 -2.066) 6.300 9.210 ( -0.248 -3.087 -5.773) 6.551 9.210 ( -0.248 3.087 -5.773) 6.551 9.797 ( 6.180 -1.424 1.149) 6.445 9.797 ( 6.180 1.424 1.149) 6.445 10.177 ( 5.287 -9.936 4.705) 12.199 10.177 ( 5.287 9.936 4.705) 12.199 10.777 ( -1.777 -16.767 4.982) 17.582 10.777 ( -1.777 16.767 4.982) 17.582 11.171 ( -5.509 -10.135 1.923) 11.695 11.171 ( -5.509 10.135 1.923) 11.695 12.749 ( 8.911 -6.199 1.663) 10.982 12.749 ( 8.911 6.199 1.663) 10.982 12.919 ( 5.382 -4.487 1.785) 7.230 12.919 ( 5.382 4.487 1.785) 7.230 14.900 ( -8.355 -5.064 0.755) 9.799 14.900 ( -8.355 5.064 0.755) 9.799 15.349 ( -5.185 -2.469 -1.894) 6.048 15.349 ( -5.185 2.469 -1.894) 6.048 15.501 ( 0.819 -3.893 -3.243) 5.132 15.501 ( 0.819 3.893 -3.242) 5.132 16.030 ( 3.102 -6.270 3.222) 7.702 16.030 ( 3.102 6.270 3.222) 7.702 20.836 ( -9.084 -4.374 -3.077) 10.541 20.836 ( -9.084 4.374 -3.077) 10.541 22.537 ( 2.026 -3.893 4.827) 6.524 22.537 ( 2.026 3.893 4.827) 6.524 ======================= Grid point 355 (169/170) ======================= q-point: ( 0.36 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( -6.068 -3.442 -4.973) 8.567 2.181 ( -6.068 3.442 -4.973) 8.567 2.417 ( -3.823 -6.708 -7.998) 11.117 2.417 ( -3.823 6.708 -7.998) 11.117 2.657 ( 6.342 -3.378 4.582) 8.523 2.657 ( 6.342 3.378 4.582) 8.523 3.005 ( 7.670 -7.864 -5.348) 12.217 3.005 ( 7.670 7.864 -5.348) 12.217 3.086 ( -2.856 -10.098 10.983) 15.190 3.086 ( -2.856 10.098 10.983) 15.190 3.370 ( -7.501 -3.349 1.385) 8.330 3.370 ( -7.501 3.349 1.385) 8.330 3.970 ( -2.134 -3.745 -16.053) 16.622 3.970 ( -2.134 3.745 -16.053) 16.622 4.450 ( -20.415 -14.169 0.487) 24.855 4.450 ( -20.415 14.169 0.487) 24.855 4.742 ( -18.081 -15.454 -2.715) 23.940 4.742 ( -18.081 15.454 -2.715) 23.940 5.358 ( 7.892 -8.344 -1.459) 11.578 5.358 ( 7.892 8.344 -1.459) 11.578 5.606 ( 3.125 -10.691 7.002) 13.156 5.606 ( 3.125 10.691 7.002) 13.156 5.845 ( 5.740 -3.918 -12.976) 14.719 5.845 ( 5.740 3.919 -12.976) 14.719 6.245 ( -0.909 -6.284 10.189) 12.005 6.245 ( -0.909 6.284 10.189) 12.005 6.878 ( -2.128 -8.914 -5.960) 10.932 6.878 ( -2.128 8.914 -5.960) 10.932 7.358 ( -6.766 -9.034 -2.502) 11.561 7.358 ( -6.766 9.034 -2.502) 11.561 7.928 ( 3.844 -5.715 4.144) 8.038 7.928 ( 3.844 5.715 4.144) 8.038 8.232 ( 1.274 -3.802 -6.181) 7.367 8.232 ( 1.274 3.802 -6.181) 7.367 9.148 ( -0.591 -1.790 -2.853) 3.419 9.148 ( -0.591 1.790 -2.853) 3.419 9.864 ( 2.767 -2.780 -1.969) 4.388 9.864 ( 2.767 2.780 -1.969) 4.388 10.367 ( 8.976 -6.524 7.255) 13.258 10.367 ( 8.976 6.524 7.255) 13.258 10.829 ( 1.251 -15.068 4.370) 15.739 10.829 ( 1.251 15.068 4.370) 15.739 11.080 ( -6.566 -8.827 -0.645) 11.020 11.080 ( -6.566 8.827 -0.645) 11.020 12.884 ( 4.582 -6.606 3.061) 8.603 12.884 ( 4.582 6.606 3.061) 8.603 12.989 ( 2.654 -3.529 -0.540) 4.448 12.989 ( 2.654 3.529 -0.540) 4.448 14.817 ( -3.930 -2.981 1.508) 5.159 14.817 ( -3.930 2.981 1.508) 5.159 15.191 ( -9.773 -1.855 -0.359) 9.954 15.191 ( -9.773 1.855 -0.359) 9.954 15.570 ( 8.397 -1.950 -2.205) 8.898 15.570 ( 8.397 1.950 -2.205) 8.898 16.097 ( 1.957 -5.476 1.341) 5.968 16.097 ( 1.957 5.476 1.341) 5.968 20.661 ( -8.271 -3.222 -2.865) 9.328 20.661 ( -8.271 3.222 -2.865) 9.328 22.610 ( 1.243 -2.740 3.616) 4.704 22.610 ( 1.243 2.740 3.616) 4.704 ======================= Grid point 357 (170/170) ======================= q-point: ( 0.45 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( -4.101 -1.525 -3.394) 5.537 2.035 ( -4.101 1.525 -3.394) 5.537 2.312 ( -1.351 -2.341 -3.205) 4.192 2.312 ( -1.351 2.341 -3.205) 4.192 2.838 ( 10.964 -3.734 2.638) 11.879 2.838 ( 10.964 3.734 2.638) 11.879 3.018 ( -5.569 -2.321 -1.706) 6.269 3.018 ( -5.569 2.321 -1.706) 6.269 3.104 ( 3.722 -3.232 -1.740) 5.228 3.104 ( 3.722 3.232 -1.740) 5.228 3.219 ( -10.659 -3.228 1.645) 11.258 3.219 ( -10.659 3.228 1.645) 11.258 3.943 ( 7.569 -8.771 -2.304) 11.813 3.943 ( 7.569 8.771 -2.304) 11.813 4.230 ( -7.613 -6.194 1.229) 9.892 4.230 ( -7.613 6.194 1.229) 9.892 4.445 ( -12.858 -11.264 -3.038) 17.361 4.445 ( -12.858 11.264 -3.038) 17.361 5.519 ( 9.479 -6.884 3.468) 12.217 5.519 ( 9.479 6.884 3.468) 12.217 5.666 ( -4.196 -10.427 1.259) 11.310 5.666 ( -4.196 10.427 1.259) 11.310 5.781 ( 2.263 -4.383 -6.611) 8.248 5.781 ( 2.263 4.383 -6.611) 8.248 6.310 ( -1.096 -3.664 4.079) 5.591 6.310 ( -1.096 3.664 4.079) 5.591 6.807 ( -0.392 -4.554 -2.642) 5.279 6.807 ( -0.392 4.554 -2.642) 5.279 7.262 ( -2.485 -3.398 -0.971) 4.320 7.262 ( -2.485 3.398 -0.971) 4.320 8.040 ( 3.148 -3.068 5.813) 7.288 8.040 ( 3.148 3.068 5.813) 7.288 8.152 ( -1.720 -2.290 -6.784) 7.364 8.152 ( -1.720 2.290 -6.784) 7.364 9.127 ( 0.049 -0.449 -0.718) 0.848 9.127 ( 0.049 0.449 -0.718) 0.848 9.867 ( 0.463 -1.097 -1.020) 1.567 9.867 ( 0.463 1.097 -1.020) 1.567 10.557 ( 5.415 -3.081 3.870) 7.334 10.557 ( 5.415 3.081 3.870) 7.334 10.887 ( 1.889 -11.797 0.514) 11.958 10.887 ( 1.889 11.797 0.514) 11.958 10.973 ( -5.088 -8.178 -0.224) 9.634 10.973 ( -5.088 8.178 -0.224) 9.634 12.952 ( 0.390 -3.749 2.070) 4.300 12.952 ( 0.390 3.749 2.070) 4.300 13.006 ( 1.449 -2.083 -1.228) 2.819 13.006 ( 1.449 2.083 -1.228) 2.819 14.792 ( -1.177 -0.520 0.626) 1.431 14.792 ( -1.177 0.520 0.626) 1.431 15.083 ( -3.311 -0.991 -0.033) 3.456 15.083 ( -3.311 0.991 -0.033) 3.456 15.659 ( 3.736 -0.633 -0.432) 3.814 15.659 ( 3.736 0.633 -0.432) 3.814 16.123 ( 0.477 -2.184 0.229) 2.247 16.123 ( 0.477 2.184 0.229) 2.247 20.541 ( -3.422 -1.231 -1.204) 3.831 20.541 ( -3.422 1.231 -1.204) 3.831 22.651 ( 0.413 -0.983 1.337) 1.711 22.651 ( 0.413 0.983 1.337) 1.711 =================== 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 3/31680 10.0 1624.503 1968.307 2862.784 0.000 -406.439 0.000 3/31680 20.0 201.179 227.549 270.052 0.000 -5.994 0.000 3/31680 30.0 62.977 69.287 83.277 0.000 -0.982 0.000 3/31680 40.0 31.280 33.428 41.049 0.000 -0.428 0.000 3/31680 50.0 19.749 20.669 25.697 0.000 -0.294 0.000 3/31680 60.0 14.257 14.708 18.349 0.000 -0.231 0.000 3/31680 70.0 11.152 11.383 14.183 0.000 -0.188 0.000 3/31680 80.0 9.180 9.293 11.543 0.000 -0.155 0.000 3/31680 90.0 7.822 7.865 9.734 0.000 -0.128 0.000 3/31680 100.0 6.830 6.829 8.422 0.000 -0.108 0.000 3/31680 110.0 6.073 6.043 7.428 0.000 -0.091 0.000 3/31680 120.0 5.476 5.425 6.649 0.000 -0.078 0.000 3/31680 130.0 4.991 4.926 6.023 0.000 -0.068 0.000 3/31680 140.0 4.589 4.514 5.507 0.000 -0.059 0.000 3/31680 150.0 4.251 4.169 5.076 0.000 -0.052 0.000 3/31680 160.0 3.961 3.874 4.709 0.000 -0.047 0.000 3/31680 170.0 3.710 3.619 4.393 0.000 -0.042 0.000 3/31680 180.0 3.491 3.397 4.118 0.000 -0.038 0.000 3/31680 190.0 3.296 3.202 3.877 0.000 -0.035 0.000 3/31680 200.0 3.124 3.028 3.662 0.000 -0.032 0.000 3/31680 210.0 2.968 2.873 3.471 0.000 -0.030 0.000 3/31680 220.0 2.828 2.733 3.300 0.000 -0.028 0.000 3/31680 230.0 2.701 2.607 3.145 0.000 -0.026 0.000 3/31680 240.0 2.586 2.492 3.004 0.000 -0.024 0.000 3/31680 250.0 2.480 2.387 2.875 0.000 -0.023 0.000 3/31680 260.0 2.382 2.290 2.758 0.000 -0.022 0.000 3/31680 270.0 2.292 2.202 2.650 0.000 -0.021 0.000 3/31680 280.0 2.209 2.120 2.550 0.000 -0.020 0.000 3/31680 290.0 2.131 2.044 2.457 0.000 -0.019 0.000 3/31680 300.0 2.059 1.973 2.371 0.000 -0.018 0.000 3/31680 310.0 1.992 1.907 2.291 0.000 -0.017 0.000 3/31680 320.0 1.929 1.846 2.217 0.000 -0.016 0.000 3/31680 330.0 1.870 1.788 2.147 0.000 -0.016 0.000 3/31680 340.0 1.814 1.734 2.081 0.000 -0.015 0.000 3/31680 350.0 1.762 1.683 2.019 0.000 -0.015 0.000 3/31680 360.0 1.713 1.635 1.961 0.000 -0.014 0.000 3/31680 370.0 1.666 1.590 1.907 0.000 -0.014 0.000 3/31680 380.0 1.622 1.547 1.855 0.000 -0.013 0.000 3/31680 390.0 1.580 1.507 1.806 0.000 -0.013 0.000 3/31680 400.0 1.540 1.468 1.760 0.000 -0.012 0.000 3/31680 410.0 1.503 1.432 1.716 0.000 -0.012 0.000 3/31680 420.0 1.467 1.397 1.674 0.000 -0.012 0.000 3/31680 430.0 1.432 1.364 1.634 0.000 -0.011 0.000 3/31680 440.0 1.400 1.332 1.596 0.000 -0.011 0.000 3/31680 450.0 1.368 1.302 1.560 0.000 -0.011 0.000 3/31680 460.0 1.339 1.274 1.525 0.000 -0.011 0.000 3/31680 470.0 1.310 1.246 1.492 0.000 -0.010 0.000 3/31680 480.0 1.283 1.220 1.460 0.000 -0.010 0.000 3/31680 490.0 1.256 1.195 1.430 0.000 -0.010 0.000 3/31680 500.0 1.231 1.170 1.401 0.000 -0.010 0.000 3/31680 510.0 1.207 1.147 1.373 0.000 -0.009 0.000 3/31680 520.0 1.184 1.125 1.346 0.000 -0.009 0.000 3/31680 530.0 1.161 1.103 1.320 0.000 -0.009 0.000 3/31680 540.0 1.140 1.083 1.295 0.000 -0.009 0.000 3/31680 550.0 1.119 1.063 1.271 0.000 -0.009 0.000 3/31680 560.0 1.099 1.044 1.248 0.000 -0.008 0.000 3/31680 570.0 1.080 1.025 1.226 0.000 -0.008 0.000 3/31680 580.0 1.061 1.007 1.205 0.000 -0.008 0.000 3/31680 590.0 1.043 0.990 1.184 0.000 -0.008 0.000 3/31680 600.0 1.026 0.974 1.164 0.000 -0.008 0.000 3/31680 610.0 1.009 0.957 1.145 0.000 -0.008 0.000 3/31680 620.0 0.993 0.942 1.126 0.000 -0.008 0.000 3/31680 630.0 0.977 0.927 1.108 0.000 -0.007 0.000 3/31680 640.0 0.961 0.912 1.091 0.000 -0.007 0.000 3/31680 650.0 0.947 0.898 1.074 0.000 -0.007 0.000 3/31680 660.0 0.932 0.884 1.057 0.000 -0.007 0.000 3/31680 670.0 0.918 0.871 1.041 0.000 -0.007 0.000 3/31680 680.0 0.905 0.858 1.026 0.000 -0.007 0.000 3/31680 690.0 0.892 0.846 1.011 0.000 -0.007 0.000 3/31680 700.0 0.879 0.834 0.996 0.000 -0.007 0.000 3/31680 710.0 0.867 0.822 0.982 0.000 -0.007 0.000 3/31680 720.0 0.855 0.810 0.968 0.000 -0.006 0.000 3/31680 730.0 0.843 0.799 0.955 0.000 -0.006 0.000 3/31680 740.0 0.831 0.788 0.942 0.000 -0.006 0.000 3/31680 750.0 0.820 0.778 0.929 0.000 -0.006 0.000 3/31680 760.0 0.810 0.767 0.917 0.000 -0.006 0.000 3/31680 770.0 0.799 0.757 0.905 0.000 -0.006 0.000 3/31680 780.0 0.789 0.748 0.893 0.000 -0.006 0.000 3/31680 790.0 0.779 0.738 0.882 0.000 -0.006 0.000 3/31680 800.0 0.769 0.729 0.871 0.000 -0.006 0.000 3/31680 810.0 0.760 0.720 0.860 0.000 -0.006 0.000 3/31680 820.0 0.750 0.711 0.849 0.000 -0.006 0.000 3/31680 830.0 0.741 0.702 0.839 0.000 -0.006 0.000 3/31680 840.0 0.732 0.694 0.829 0.000 -0.005 0.000 3/31680 850.0 0.724 0.686 0.819 0.000 -0.005 0.000 3/31680 860.0 0.715 0.678 0.810 0.000 -0.005 0.000 3/31680 870.0 0.707 0.670 0.800 0.000 -0.005 0.000 3/31680 880.0 0.699 0.662 0.791 0.000 -0.005 0.000 3/31680 890.0 0.691 0.655 0.782 0.000 -0.005 0.000 3/31680 900.0 0.684 0.648 0.773 0.000 -0.005 0.000 3/31680 910.0 0.676 0.640 0.765 0.000 -0.005 0.000 3/31680 920.0 0.669 0.633 0.757 0.000 -0.005 0.000 3/31680 930.0 0.662 0.627 0.748 0.000 -0.005 0.000 3/31680 940.0 0.654 0.620 0.740 0.000 -0.005 0.000 3/31680 950.0 0.648 0.613 0.733 0.000 -0.005 0.000 3/31680 960.0 0.641 0.607 0.725 0.000 -0.005 0.000 3/31680 970.0 0.634 0.601 0.717 0.000 -0.005 0.000 3/31680 980.0 0.628 0.595 0.710 0.000 -0.005 0.000 3/31680 990.0 0.621 0.589 0.703 0.000 -0.005 0.000 3/31680 1000.0 0.615 0.583 0.696 0.000 -0.005 0.000 3/31680 Thermal conductivity related properties were written into "kappa-m1186.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 21:12:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|