----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 09:29:33]------------------------- 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 3 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/m (10) Number of symmetry operations in supercell: 24 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.651738470056515 0.000000000000000 0.000000000000000 b 0.000000000000000 3.606623130000001 0.000000000000000 c -0.789043444048778 0.000000000000000 9.074203112696146 Atomic positions (fractional): *1 Cl 0.16292696553419 0.50000000000000 0.66005388846685 35.453 *2 Cl 0.00000000000000 0.00000000000000 0.00000000000000 35.453 *3 Cl 0.50000000000000 0.50000000000000 0.00000000000000 35.453 4 Cl 0.83707303446582 0.50000000000000 0.33994611153315 35.453 *5 Li 0.52510642548423 0.50000000000000 0.73230615445686 6.941 *6 Li 0.95843813032722 0.00000000000000 0.74562151732123 6.941 7 Li 0.04156186967278 0.00000000000000 0.25437848267877 6.941 *8 Li 0.62925974925316 0.00000000000000 0.43629014497422 6.941 *9 Li 0.32592377553009 0.00000000000000 0.10794295728415 6.941 10 Li 0.67407622446991 0.00000000000000 0.89205704271584 6.941 11 Li 0.47489357451577 0.50000000000000 0.26769384554314 6.941 *12 Li 0.21937628962164 0.50000000000000 0.39924597682118 6.941 13 Li 0.37074025074684 0.00000000000000 0.56370985502578 6.941 14 Li 0.78062371037836 0.50000000000000 0.60075402317882 6.941 *15 N 0.66087239577469 0.00000000000000 0.66731643432737 14.007 16 N 0.33912760422531 0.00000000000000 0.33268356567263 14.007 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.651738470056515 0.000000000000000 0.000000000000000 b 0.000000000000000 3.606623130000001 0.000000000000000 c -0.789043444048778 0.000000000000000 9.074203112696146 Atomic positions (fractional): *1 Cl 0.16292696553419 0.50000000000000 0.66005388846685 35.453 > 1 *2 Cl 0.00000000000000 0.00000000000000 0.00000000000000 35.453 > 2 *3 Cl 0.50000000000000 0.50000000000000 0.00000000000000 35.453 > 3 4 Cl 0.83707303446582 0.50000000000000 0.33994611153315 35.453 > 4 *5 Li 0.52510642548423 0.50000000000000 0.73230615445686 6.941 > 5 *6 Li 0.95843813032722 0.00000000000000 0.74562151732123 6.941 > 6 7 Li 0.04156186967278 0.00000000000000 0.25437848267877 6.941 > 7 *8 Li 0.62925974925316 0.00000000000000 0.43629014497422 6.941 > 8 *9 Li 0.32592377553009 0.00000000000000 0.10794295728415 6.941 > 9 10 Li 0.67407622446991 0.00000000000000 0.89205704271584 6.941 > 10 11 Li 0.47489357451577 0.50000000000000 0.26769384554314 6.941 > 11 *12 Li 0.21937628962164 0.50000000000000 0.39924597682118 6.941 > 12 13 Li 0.37074025074684 0.00000000000000 0.56370985502578 6.941 > 13 14 Li 0.78062371037836 0.50000000000000 0.60075402317882 6.941 > 14 *15 N 0.66087239577469 0.00000000000000 0.66731643432737 14.007 > 15 16 N 0.33912760422531 0.00000000000000 0.33268356567263 14.007 > 16 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.303476940113031 0.000000000000000 0.000000000000000 b 0.000000000000000 10.819869390000003 0.000000000000000 c -0.789043444048778 0.000000000000000 9.074203112696146 Atomic positions (fractional): *1 Cl 0.08146348276709 0.16666666666667 0.66005388846685 35.453 > 1 2 Cl 0.58146348276709 0.16666666666667 0.66005388846685 35.453 > 1 3 Cl 0.08146348276709 0.50000000000000 0.66005388846685 35.453 > 1 4 Cl 0.58146348276709 0.50000000000000 0.66005388846685 35.453 > 1 5 Cl 0.08146348276709 0.83333333333333 0.66005388846685 35.453 > 1 6 Cl 0.58146348276709 0.83333333333333 0.66005388846685 35.453 > 1 *7 Cl 0.00000000000000 0.00000000000000 0.00000000000000 35.453 > 2 8 Cl 0.50000000000000 0.00000000000000 0.00000000000000 35.453 > 2 9 Cl 0.00000000000000 0.33333333333333 0.00000000000000 35.453 > 2 10 Cl 0.50000000000000 0.33333333333333 0.00000000000000 35.453 > 2 11 Cl 0.00000000000000 0.66666666666667 0.00000000000000 35.453 > 2 12 Cl 0.50000000000000 0.66666666666667 0.00000000000000 35.453 > 2 *13 Cl 0.25000000000000 0.16666666666667 0.00000000000000 35.453 > 3 14 Cl 0.75000000000000 0.16666666666667 0.00000000000000 35.453 > 3 15 Cl 0.25000000000000 0.50000000000000 0.00000000000000 35.453 > 3 16 Cl 0.75000000000000 0.50000000000000 0.00000000000000 35.453 > 3 17 Cl 0.25000000000000 0.83333333333333 0.00000000000000 35.453 > 3 18 Cl 0.75000000000000 0.83333333333333 0.00000000000000 35.453 > 3 19 Cl 0.41853651723291 0.16666666666667 0.33994611153315 35.453 > 4 20 Cl 0.91853651723291 0.16666666666667 0.33994611153315 35.453 > 4 21 Cl 0.41853651723291 0.50000000000000 0.33994611153315 35.453 > 4 22 Cl 0.91853651723291 0.50000000000000 0.33994611153315 35.453 > 4 23 Cl 0.41853651723291 0.83333333333333 0.33994611153315 35.453 > 4 24 Cl 0.91853651723291 0.83333333333333 0.33994611153315 35.453 > 4 *25 Li 0.26255321274212 0.16666666666667 0.73230615445686 6.941 > 5 26 Li 0.76255321274212 0.16666666666667 0.73230615445686 6.941 > 5 27 Li 0.26255321274212 0.50000000000000 0.73230615445686 6.941 > 5 28 Li 0.76255321274212 0.50000000000000 0.73230615445686 6.941 > 5 29 Li 0.26255321274212 0.83333333333333 0.73230615445686 6.941 > 5 30 Li 0.76255321274212 0.83333333333333 0.73230615445686 6.941 > 5 *31 Li 0.47921906516361 0.00000000000000 0.74562151732123 6.941 > 6 32 Li 0.97921906516361 0.00000000000000 0.74562151732123 6.941 > 6 33 Li 0.47921906516361 0.33333333333333 0.74562151732123 6.941 > 6 34 Li 0.97921906516361 0.33333333333333 0.74562151732123 6.941 > 6 35 Li 0.47921906516361 0.66666666666667 0.74562151732123 6.941 > 6 36 Li 0.97921906516361 0.66666666666667 0.74562151732123 6.941 > 6 37 Li 0.02078093483639 0.00000000000000 0.25437848267877 6.941 > 7 38 Li 0.52078093483639 0.00000000000000 0.25437848267877 6.941 > 7 39 Li 0.02078093483639 0.33333333333333 0.25437848267877 6.941 > 7 40 Li 0.52078093483639 0.33333333333333 0.25437848267877 6.941 > 7 41 Li 0.02078093483639 0.66666666666667 0.25437848267877 6.941 > 7 42 Li 0.52078093483639 0.66666666666667 0.25437848267877 6.941 > 7 *43 Li 0.31462987462658 0.00000000000000 0.43629014497422 6.941 > 8 44 Li 0.81462987462658 0.00000000000000 0.43629014497422 6.941 > 8 45 Li 0.31462987462658 0.33333333333333 0.43629014497422 6.941 > 8 46 Li 0.81462987462658 0.33333333333333 0.43629014497422 6.941 > 8 47 Li 0.31462987462658 0.66666666666667 0.43629014497422 6.941 > 8 48 Li 0.81462987462658 0.66666666666667 0.43629014497422 6.941 > 8 *49 Li 0.16296188776505 0.00000000000000 0.10794295728415 6.941 > 9 50 Li 0.66296188776505 0.00000000000000 0.10794295728415 6.941 > 9 51 Li 0.16296188776505 0.33333333333333 0.10794295728415 6.941 > 9 52 Li 0.66296188776505 0.33333333333333 0.10794295728415 6.941 > 9 53 Li 0.16296188776505 0.66666666666667 0.10794295728415 6.941 > 9 54 Li 0.66296188776505 0.66666666666667 0.10794295728415 6.941 > 9 55 Li 0.33703811223495 0.00000000000000 0.89205704271584 6.941 > 10 56 Li 0.83703811223495 0.00000000000000 0.89205704271584 6.941 > 10 57 Li 0.33703811223495 0.33333333333333 0.89205704271584 6.941 > 10 58 Li 0.83703811223495 0.33333333333333 0.89205704271584 6.941 > 10 59 Li 0.33703811223495 0.66666666666667 0.89205704271584 6.941 > 10 60 Li 0.83703811223495 0.66666666666667 0.89205704271584 6.941 > 10 61 Li 0.23744678725788 0.16666666666667 0.26769384554314 6.941 > 11 62 Li 0.73744678725788 0.16666666666667 0.26769384554314 6.941 > 11 63 Li 0.23744678725788 0.50000000000000 0.26769384554314 6.941 > 11 64 Li 0.73744678725788 0.50000000000000 0.26769384554314 6.941 > 11 65 Li 0.23744678725788 0.83333333333333 0.26769384554314 6.941 > 11 66 Li 0.73744678725788 0.83333333333333 0.26769384554314 6.941 > 11 *67 Li 0.10968814481082 0.16666666666667 0.39924597682118 6.941 > 12 68 Li 0.60968814481082 0.16666666666667 0.39924597682118 6.941 > 12 69 Li 0.10968814481082 0.50000000000000 0.39924597682118 6.941 > 12 70 Li 0.60968814481082 0.50000000000000 0.39924597682118 6.941 > 12 71 Li 0.10968814481082 0.83333333333333 0.39924597682118 6.941 > 12 72 Li 0.60968814481082 0.83333333333333 0.39924597682118 6.941 > 12 73 Li 0.18537012537342 0.00000000000000 0.56370985502578 6.941 > 13 74 Li 0.68537012537342 0.00000000000000 0.56370985502578 6.941 > 13 75 Li 0.18537012537342 0.33333333333333 0.56370985502578 6.941 > 13 76 Li 0.68537012537342 0.33333333333333 0.56370985502578 6.941 > 13 77 Li 0.18537012537342 0.66666666666667 0.56370985502578 6.941 > 13 78 Li 0.68537012537342 0.66666666666667 0.56370985502578 6.941 > 13 79 Li 0.39031185518918 0.16666666666667 0.60075402317882 6.941 > 14 80 Li 0.89031185518918 0.16666666666667 0.60075402317882 6.941 > 14 81 Li 0.39031185518918 0.50000000000000 0.60075402317882 6.941 > 14 82 Li 0.89031185518918 0.50000000000000 0.60075402317882 6.941 > 14 83 Li 0.39031185518918 0.83333333333333 0.60075402317882 6.941 > 14 84 Li 0.89031185518918 0.83333333333333 0.60075402317882 6.941 > 14 *85 N 0.33043619788735 0.00000000000000 0.66731643432737 14.007 > 15 86 N 0.83043619788735 0.00000000000000 0.66731643432737 14.007 > 15 87 N 0.33043619788735 0.33333333333333 0.66731643432737 14.007 > 15 88 N 0.83043619788735 0.33333333333333 0.66731643432737 14.007 > 15 89 N 0.33043619788735 0.66666666666667 0.66731643432737 14.007 > 15 90 N 0.83043619788735 0.66666666666667 0.66731643432737 14.007 > 15 91 N 0.16956380211266 0.00000000000000 0.33268356567263 14.007 > 16 92 N 0.66956380211265 0.00000000000000 0.33268356567263 14.007 > 16 93 N 0.16956380211266 0.33333333333333 0.33268356567263 14.007 > 16 94 N 0.66956380211265 0.33333333333333 0.33268356567263 14.007 > 16 95 N 0.16956380211266 0.66666666666667 0.33268356567263 14.007 > 16 96 N 0.66956380211265 0.66666666666667 0.33268356567263 14.007 > 16 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5827580 0.0000000 -0.0213968 0.0000000 3.6055245 0.0000000 -0.0214052 0.0000000 3.4980036 -------------------------- Born effective charges -------------------------- 1 Cl -1.5008732 0.0000000 0.1658039 0.0000000 -1.1211999 0.0000000 0.1612590 0.0000000 -0.8327659 2 Cl -1.2013338 0.0000000 -0.2987107 0.0000000 -0.6272964 0.0000000 -0.2979298 0.0000000 -1.5616392 3 Cl -0.7859131 0.0000000 0.3598515 0.0000000 -1.1848610 0.0000000 0.3731114 0.0000000 -1.4213335 4 Cl -1.5008732 0.0000000 0.1658039 0.0000000 -1.1211999 0.0000000 0.1612590 0.0000000 -0.8327659 5 Li 0.8296946 0.0000000 -0.0129095 0.0000000 0.8656316 0.0000000 -0.0223026 0.0000000 0.9342761 6 Li 1.0287926 0.0000000 -0.0403996 0.0000000 0.9431481 0.0000000 -0.0361799 0.0000000 1.0082423 7 Li 1.0287926 0.0000000 -0.0403996 0.0000000 0.9431481 0.0000000 -0.0361799 0.0000000 1.0082423 8 Li 0.8661819 0.0000000 -0.0296422 0.0000000 0.8827426 0.0000000 0.0120464 0.0000000 0.7593984 9 Li 0.9369006 0.0000000 0.0025752 0.0000000 0.9376754 0.0000000 -0.0342338 0.0000000 1.0189740 10 Li 0.9369006 0.0000000 0.0025752 0.0000000 0.9376754 0.0000000 -0.0342338 0.0000000 1.0189740 11 Li 0.8296946 0.0000000 -0.0129095 0.0000000 0.8656316 0.0000000 -0.0223026 0.0000000 0.9342761 12 Li 0.9370479 0.0000000 -0.0406226 0.0000000 0.8694836 0.0000000 -0.0435653 0.0000000 0.7110092 13 Li 0.8661819 0.0000000 -0.0296422 0.0000000 0.8827426 0.0000000 0.0120464 0.0000000 0.7593984 14 Li 0.9370479 0.0000000 -0.0406226 0.0000000 0.8694836 0.0000000 -0.0435653 0.0000000 0.7110092 15 N -2.1041210 0.0000000 -0.0753756 0.0000000 -2.4714028 0.0000000 -0.0746144 0.0000000 -2.1076478 16 N -2.1041210 0.0000000 -0.0753756 0.0000000 -2.4714028 0.0000000 -0.0746144 0.0000000 -2.1076478 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 288/288 Permutation basis: 7248/7248 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 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: 516 Use submatrix version of eigh solver. (1) Block: 516 / 516 (2) Block: 250 / 516 (2) 233 eigenvectors found. (2) Block: 516 / 516 (2) 249 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 499 eigenvectors found. (1) Complementary block size: 16 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 290 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 290 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 290 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 254 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 254 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1850), data: False |-- (254, 254), data: True |-- (254, 254), data: True |-- (290, 281), data: True |-- (290, 281), data: True |-- (290, 281), data: True |-- (516, 499), data: False |-- (516, 499), data: False |-- (516, 17), data: (516, 34) @ (34, 17) |-- (266, 249), data: True |-- (250, 233), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 480 - Time: 2.574 Solver_block: 200 / 480 - Time: 2.576 Solver_block: 300 / 480 - Time: 2.579 Solver_block: 400 / 480 - Time: 2.567 Solver_block: 480 / 480 - Time: 2.070 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 12.487 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 288/288 Permutation basis: 7248/7248 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 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: 516 Use submatrix version of eigh solver. (1) Block: 516 / 516 (2) Block: 250 / 516 (2) 233 eigenvectors found. (2) Block: 516 / 516 (2) 249 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 499 eigenvectors found. (1) Complementary block size: 16 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 290 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 290 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 290 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 254 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 254 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1850), data: False |-- (254, 254), data: True |-- (254, 254), data: True |-- (290, 281), data: True |-- (290, 281), data: True |-- (290, 281), data: True |-- (516, 499), data: False |-- (516, 499), data: False |-- (516, 17), data: (516, 34) @ (34, 17) |-- (266, 249), data: True |-- (250, 233), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 09:30:07]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 09:30:08]------------------------- 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 3 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/m (10) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.651738470056515 0.000000000000000 0.000000000000000 b 0.000000000000000 3.606623130000001 0.000000000000000 c -0.789043444048778 0.000000000000000 9.074203112696146 Atomic positions (fractional): 1 Cl 0.16292696553419 0.50000000000000 0.66005388846685 35.453 2 Cl 0.00000000000000 0.00000000000000 0.00000000000000 35.453 3 Cl 0.50000000000000 0.50000000000000 0.00000000000000 35.453 4 Cl 0.83707303446582 0.50000000000000 0.33994611153315 35.453 5 Li 0.52510642548423 0.50000000000000 0.73230615445686 6.941 6 Li 0.95843813032722 0.00000000000000 0.74562151732123 6.941 7 Li 0.04156186967278 0.00000000000000 0.25437848267877 6.941 8 Li 0.62925974925316 0.00000000000000 0.43629014497422 6.941 9 Li 0.32592377553009 0.00000000000000 0.10794295728415 6.941 10 Li 0.67407622446991 0.00000000000000 0.89205704271584 6.941 11 Li 0.47489357451577 0.50000000000000 0.26769384554314 6.941 12 Li 0.21937628962164 0.50000000000000 0.39924597682118 6.941 13 Li 0.37074025074684 0.00000000000000 0.56370985502578 6.941 14 Li 0.78062371037836 0.50000000000000 0.60075402317882 6.941 15 N 0.66087239577469 0.00000000000000 0.66731643432737 14.007 16 N 0.33912760422531 0.00000000000000 0.33268356567263 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.303476940113031 0.000000000000000 0.000000000000000 b 0.000000000000000 10.819869390000003 0.000000000000000 c -0.789043444048778 0.000000000000000 9.074203112696146 Atomic positions (fractional): 1 Cl 0.08146348276709 0.16666666666667 0.66005388846685 35.453 > 1 2 Cl 0.58146348276709 0.16666666666667 0.66005388846685 35.453 > 1 3 Cl 0.08146348276709 0.50000000000000 0.66005388846685 35.453 > 1 4 Cl 0.58146348276709 0.50000000000000 0.66005388846685 35.453 > 1 5 Cl 0.08146348276709 0.83333333333333 0.66005388846685 35.453 > 1 6 Cl 0.58146348276709 0.83333333333333 0.66005388846685 35.453 > 1 7 Cl 0.00000000000000 0.00000000000000 0.00000000000000 35.453 > 7 8 Cl 0.50000000000000 0.00000000000000 0.00000000000000 35.453 > 7 9 Cl 0.00000000000000 0.33333333333333 0.00000000000000 35.453 > 7 10 Cl 0.50000000000000 0.33333333333333 0.00000000000000 35.453 > 7 11 Cl 0.00000000000000 0.66666666666667 0.00000000000000 35.453 > 7 12 Cl 0.50000000000000 0.66666666666667 0.00000000000000 35.453 > 7 13 Cl 0.25000000000000 0.16666666666667 0.00000000000000 35.453 > 13 14 Cl 0.75000000000000 0.16666666666667 0.00000000000000 35.453 > 13 15 Cl 0.25000000000000 0.50000000000000 0.00000000000000 35.453 > 13 16 Cl 0.75000000000000 0.50000000000000 0.00000000000000 35.453 > 13 17 Cl 0.25000000000000 0.83333333333333 0.00000000000000 35.453 > 13 18 Cl 0.75000000000000 0.83333333333333 0.00000000000000 35.453 > 13 19 Cl 0.41853651723291 0.16666666666667 0.33994611153315 35.453 > 19 20 Cl 0.91853651723291 0.16666666666667 0.33994611153315 35.453 > 19 21 Cl 0.41853651723291 0.50000000000000 0.33994611153315 35.453 > 19 22 Cl 0.91853651723291 0.50000000000000 0.33994611153315 35.453 > 19 23 Cl 0.41853651723291 0.83333333333333 0.33994611153315 35.453 > 19 24 Cl 0.91853651723291 0.83333333333333 0.33994611153315 35.453 > 19 25 Li 0.26255321274212 0.16666666666667 0.73230615445686 6.941 > 25 26 Li 0.76255321274212 0.16666666666667 0.73230615445686 6.941 > 25 27 Li 0.26255321274212 0.50000000000000 0.73230615445686 6.941 > 25 28 Li 0.76255321274212 0.50000000000000 0.73230615445686 6.941 > 25 29 Li 0.26255321274212 0.83333333333333 0.73230615445686 6.941 > 25 30 Li 0.76255321274212 0.83333333333333 0.73230615445686 6.941 > 25 31 Li 0.47921906516361 0.00000000000000 0.74562151732123 6.941 > 31 32 Li 0.97921906516361 0.00000000000000 0.74562151732123 6.941 > 31 33 Li 0.47921906516361 0.33333333333333 0.74562151732123 6.941 > 31 34 Li 0.97921906516361 0.33333333333333 0.74562151732123 6.941 > 31 35 Li 0.47921906516361 0.66666666666667 0.74562151732123 6.941 > 31 36 Li 0.97921906516361 0.66666666666667 0.74562151732123 6.941 > 31 37 Li 0.02078093483639 0.00000000000000 0.25437848267877 6.941 > 37 38 Li 0.52078093483639 0.00000000000000 0.25437848267877 6.941 > 37 39 Li 0.02078093483639 0.33333333333333 0.25437848267877 6.941 > 37 40 Li 0.52078093483639 0.33333333333333 0.25437848267877 6.941 > 37 41 Li 0.02078093483639 0.66666666666667 0.25437848267877 6.941 > 37 42 Li 0.52078093483639 0.66666666666667 0.25437848267877 6.941 > 37 43 Li 0.31462987462658 0.00000000000000 0.43629014497422 6.941 > 43 44 Li 0.81462987462658 0.00000000000000 0.43629014497422 6.941 > 43 45 Li 0.31462987462658 0.33333333333333 0.43629014497422 6.941 > 43 46 Li 0.81462987462658 0.33333333333333 0.43629014497422 6.941 > 43 47 Li 0.31462987462658 0.66666666666667 0.43629014497422 6.941 > 43 48 Li 0.81462987462658 0.66666666666667 0.43629014497422 6.941 > 43 49 Li 0.16296188776505 0.00000000000000 0.10794295728415 6.941 > 49 50 Li 0.66296188776505 0.00000000000000 0.10794295728415 6.941 > 49 51 Li 0.16296188776505 0.33333333333333 0.10794295728415 6.941 > 49 52 Li 0.66296188776505 0.33333333333333 0.10794295728415 6.941 > 49 53 Li 0.16296188776505 0.66666666666667 0.10794295728415 6.941 > 49 54 Li 0.66296188776505 0.66666666666667 0.10794295728415 6.941 > 49 55 Li 0.33703811223495 0.00000000000000 0.89205704271584 6.941 > 55 56 Li 0.83703811223495 0.00000000000000 0.89205704271584 6.941 > 55 57 Li 0.33703811223495 0.33333333333333 0.89205704271584 6.941 > 55 58 Li 0.83703811223495 0.33333333333333 0.89205704271584 6.941 > 55 59 Li 0.33703811223495 0.66666666666667 0.89205704271584 6.941 > 55 60 Li 0.83703811223495 0.66666666666667 0.89205704271584 6.941 > 55 61 Li 0.23744678725788 0.16666666666667 0.26769384554314 6.941 > 61 62 Li 0.73744678725788 0.16666666666667 0.26769384554314 6.941 > 61 63 Li 0.23744678725788 0.50000000000000 0.26769384554314 6.941 > 61 64 Li 0.73744678725788 0.50000000000000 0.26769384554314 6.941 > 61 65 Li 0.23744678725788 0.83333333333333 0.26769384554314 6.941 > 61 66 Li 0.73744678725788 0.83333333333333 0.26769384554314 6.941 > 61 67 Li 0.10968814481082 0.16666666666667 0.39924597682118 6.941 > 67 68 Li 0.60968814481082 0.16666666666667 0.39924597682118 6.941 > 67 69 Li 0.10968814481082 0.50000000000000 0.39924597682118 6.941 > 67 70 Li 0.60968814481082 0.50000000000000 0.39924597682118 6.941 > 67 71 Li 0.10968814481082 0.83333333333333 0.39924597682118 6.941 > 67 72 Li 0.60968814481082 0.83333333333333 0.39924597682118 6.941 > 67 73 Li 0.18537012537342 0.00000000000000 0.56370985502578 6.941 > 73 74 Li 0.68537012537342 0.00000000000000 0.56370985502578 6.941 > 73 75 Li 0.18537012537342 0.33333333333333 0.56370985502578 6.941 > 73 76 Li 0.68537012537342 0.33333333333333 0.56370985502578 6.941 > 73 77 Li 0.18537012537342 0.66666666666667 0.56370985502578 6.941 > 73 78 Li 0.68537012537342 0.66666666666667 0.56370985502578 6.941 > 73 79 Li 0.39031185518918 0.16666666666667 0.60075402317882 6.941 > 79 80 Li 0.89031185518918 0.16666666666667 0.60075402317882 6.941 > 79 81 Li 0.39031185518918 0.50000000000000 0.60075402317882 6.941 > 79 82 Li 0.89031185518918 0.50000000000000 0.60075402317882 6.941 > 79 83 Li 0.39031185518918 0.83333333333333 0.60075402317882 6.941 > 79 84 Li 0.89031185518918 0.83333333333333 0.60075402317882 6.941 > 79 85 N 0.33043619788735 0.00000000000000 0.66731643432737 14.007 > 85 86 N 0.83043619788735 0.00000000000000 0.66731643432737 14.007 > 85 87 N 0.33043619788735 0.33333333333333 0.66731643432737 14.007 > 85 88 N 0.83043619788735 0.33333333333333 0.66731643432737 14.007 > 85 89 N 0.33043619788735 0.66666666666667 0.66731643432737 14.007 > 85 90 N 0.83043619788735 0.66666666666667 0.66731643432737 14.007 > 85 91 N 0.16956380211266 0.00000000000000 0.33268356567263 14.007 > 91 92 N 0.66956380211265 0.00000000000000 0.33268356567263 14.007 > 91 93 N 0.16956380211266 0.33333333333333 0.33268356567263 14.007 > 91 94 N 0.66956380211265 0.33333333333333 0.33268356567263 14.007 > 91 95 N 0.16956380211266 0.66666666666667 0.33268356567263 14.007 > 91 96 N 0.66956380211265 0.66666666666667 0.33268356567263 14.007 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5827580 0.0000000 -0.0213968 0.0000000 3.6055245 0.0000000 -0.0214052 0.0000000 3.4980036 -------------------------- Born effective charges -------------------------- 1 Cl -1.5008732 0.0000000 0.1658039 0.0000000 -1.1211999 0.0000000 0.1612590 0.0000000 -0.8327659 2 Cl -1.2013338 0.0000000 -0.2987107 0.0000000 -0.6272964 0.0000000 -0.2979298 0.0000000 -1.5616392 3 Cl -0.7859131 0.0000000 0.3598515 0.0000000 -1.1848610 0.0000000 0.3731114 0.0000000 -1.4213335 4 Cl -1.5008732 0.0000000 0.1658039 0.0000000 -1.1211999 0.0000000 0.1612590 0.0000000 -0.8327659 5 Li 0.8296946 0.0000000 -0.0129095 0.0000000 0.8656316 0.0000000 -0.0223026 0.0000000 0.9342761 6 Li 1.0287926 0.0000000 -0.0403996 0.0000000 0.9431481 0.0000000 -0.0361799 0.0000000 1.0082423 7 Li 1.0287926 0.0000000 -0.0403996 0.0000000 0.9431481 0.0000000 -0.0361799 0.0000000 1.0082423 8 Li 0.8661819 0.0000000 -0.0296422 0.0000000 0.8827426 0.0000000 0.0120464 0.0000000 0.7593984 9 Li 0.9369006 0.0000000 0.0025752 0.0000000 0.9376754 0.0000000 -0.0342338 0.0000000 1.0189740 10 Li 0.9369006 0.0000000 0.0025752 0.0000000 0.9376754 0.0000000 -0.0342338 0.0000000 1.0189740 11 Li 0.8296946 0.0000000 -0.0129095 0.0000000 0.8656316 0.0000000 -0.0223026 0.0000000 0.9342761 12 Li 0.9370479 0.0000000 -0.0406226 0.0000000 0.8694836 0.0000000 -0.0435653 0.0000000 0.7110092 13 Li 0.8661819 0.0000000 -0.0296422 0.0000000 0.8827426 0.0000000 0.0120464 0.0000000 0.7593984 14 Li 0.9370479 0.0000000 -0.0406226 0.0000000 0.8694836 0.0000000 -0.0435653 0.0000000 0.7110092 15 N -2.1041210 0.0000000 -0.0753756 0.0000000 -2.4714028 0.0000000 -0.0746144 0.0000000 -2.1076478 16 N -2.1041210 0.0000000 -0.0753756 0.0000000 -2.4714028 0.0000000 -0.0746144 0.0000000 -2.1076478 ---------------------------------------------------------------------------- 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 7, 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 13, 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 31, 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 43, 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 67, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Computing fc3[ 85, 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] [-0.0009 0.0000 0.0100] [ 0.0009 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yzy) -0.00000000 (yzy) -0.00000000 (yyz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 09:30:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 09:30:29]------------------------- 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 3 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/m (10) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.651738470056515 0.000000000000000 0.000000000000000 b 0.000000000000000 3.606623130000001 0.000000000000000 c -0.789043444048778 0.000000000000000 9.074203112696146 Atomic positions (fractional): 1 Cl 0.16292696553419 0.50000000000000 0.66005388846685 35.453 2 Cl 0.00000000000000 0.00000000000000 0.00000000000000 35.453 3 Cl 0.50000000000000 0.50000000000000 0.00000000000000 35.453 4 Cl 0.83707303446582 0.50000000000000 0.33994611153315 35.453 5 Li 0.52510642548423 0.50000000000000 0.73230615445686 6.941 6 Li 0.95843813032722 0.00000000000000 0.74562151732123 6.941 7 Li 0.04156186967278 0.00000000000000 0.25437848267877 6.941 8 Li 0.62925974925316 0.00000000000000 0.43629014497422 6.941 9 Li 0.32592377553009 0.00000000000000 0.10794295728415 6.941 10 Li 0.67407622446991 0.00000000000000 0.89205704271584 6.941 11 Li 0.47489357451577 0.50000000000000 0.26769384554314 6.941 12 Li 0.21937628962164 0.50000000000000 0.39924597682118 6.941 13 Li 0.37074025074684 0.00000000000000 0.56370985502578 6.941 14 Li 0.78062371037836 0.50000000000000 0.60075402317882 6.941 15 N 0.66087239577469 0.00000000000000 0.66731643432737 14.007 16 N 0.33912760422531 0.00000000000000 0.33268356567263 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.303476940113031 0.000000000000000 0.000000000000000 b 0.000000000000000 10.819869390000003 0.000000000000000 c -0.789043444048778 0.000000000000000 9.074203112696146 Atomic positions (fractional): 1 Cl 0.08146348276709 0.16666666666667 0.66005388846685 35.453 > 1 2 Cl 0.58146348276709 0.16666666666667 0.66005388846685 35.453 > 1 3 Cl 0.08146348276709 0.50000000000000 0.66005388846685 35.453 > 1 4 Cl 0.58146348276709 0.50000000000000 0.66005388846685 35.453 > 1 5 Cl 0.08146348276709 0.83333333333333 0.66005388846685 35.453 > 1 6 Cl 0.58146348276709 0.83333333333333 0.66005388846685 35.453 > 1 7 Cl 0.00000000000000 0.00000000000000 0.00000000000000 35.453 > 7 8 Cl 0.50000000000000 0.00000000000000 0.00000000000000 35.453 > 7 9 Cl 0.00000000000000 0.33333333333333 0.00000000000000 35.453 > 7 10 Cl 0.50000000000000 0.33333333333333 0.00000000000000 35.453 > 7 11 Cl 0.00000000000000 0.66666666666667 0.00000000000000 35.453 > 7 12 Cl 0.50000000000000 0.66666666666667 0.00000000000000 35.453 > 7 13 Cl 0.25000000000000 0.16666666666667 0.00000000000000 35.453 > 13 14 Cl 0.75000000000000 0.16666666666667 0.00000000000000 35.453 > 13 15 Cl 0.25000000000000 0.50000000000000 0.00000000000000 35.453 > 13 16 Cl 0.75000000000000 0.50000000000000 0.00000000000000 35.453 > 13 17 Cl 0.25000000000000 0.83333333333333 0.00000000000000 35.453 > 13 18 Cl 0.75000000000000 0.83333333333333 0.00000000000000 35.453 > 13 19 Cl 0.41853651723291 0.16666666666667 0.33994611153315 35.453 > 19 20 Cl 0.91853651723291 0.16666666666667 0.33994611153315 35.453 > 19 21 Cl 0.41853651723291 0.50000000000000 0.33994611153315 35.453 > 19 22 Cl 0.91853651723291 0.50000000000000 0.33994611153315 35.453 > 19 23 Cl 0.41853651723291 0.83333333333333 0.33994611153315 35.453 > 19 24 Cl 0.91853651723291 0.83333333333333 0.33994611153315 35.453 > 19 25 Li 0.26255321274212 0.16666666666667 0.73230615445686 6.941 > 25 26 Li 0.76255321274212 0.16666666666667 0.73230615445686 6.941 > 25 27 Li 0.26255321274212 0.50000000000000 0.73230615445686 6.941 > 25 28 Li 0.76255321274212 0.50000000000000 0.73230615445686 6.941 > 25 29 Li 0.26255321274212 0.83333333333333 0.73230615445686 6.941 > 25 30 Li 0.76255321274212 0.83333333333333 0.73230615445686 6.941 > 25 31 Li 0.47921906516361 0.00000000000000 0.74562151732123 6.941 > 31 32 Li 0.97921906516361 0.00000000000000 0.74562151732123 6.941 > 31 33 Li 0.47921906516361 0.33333333333333 0.74562151732123 6.941 > 31 34 Li 0.97921906516361 0.33333333333333 0.74562151732123 6.941 > 31 35 Li 0.47921906516361 0.66666666666667 0.74562151732123 6.941 > 31 36 Li 0.97921906516361 0.66666666666667 0.74562151732123 6.941 > 31 37 Li 0.02078093483639 0.00000000000000 0.25437848267877 6.941 > 37 38 Li 0.52078093483639 0.00000000000000 0.25437848267877 6.941 > 37 39 Li 0.02078093483639 0.33333333333333 0.25437848267877 6.941 > 37 40 Li 0.52078093483639 0.33333333333333 0.25437848267877 6.941 > 37 41 Li 0.02078093483639 0.66666666666667 0.25437848267877 6.941 > 37 42 Li 0.52078093483639 0.66666666666667 0.25437848267877 6.941 > 37 43 Li 0.31462987462658 0.00000000000000 0.43629014497422 6.941 > 43 44 Li 0.81462987462658 0.00000000000000 0.43629014497422 6.941 > 43 45 Li 0.31462987462658 0.33333333333333 0.43629014497422 6.941 > 43 46 Li 0.81462987462658 0.33333333333333 0.43629014497422 6.941 > 43 47 Li 0.31462987462658 0.66666666666667 0.43629014497422 6.941 > 43 48 Li 0.81462987462658 0.66666666666667 0.43629014497422 6.941 > 43 49 Li 0.16296188776505 0.00000000000000 0.10794295728415 6.941 > 49 50 Li 0.66296188776505 0.00000000000000 0.10794295728415 6.941 > 49 51 Li 0.16296188776505 0.33333333333333 0.10794295728415 6.941 > 49 52 Li 0.66296188776505 0.33333333333333 0.10794295728415 6.941 > 49 53 Li 0.16296188776505 0.66666666666667 0.10794295728415 6.941 > 49 54 Li 0.66296188776505 0.66666666666667 0.10794295728415 6.941 > 49 55 Li 0.33703811223495 0.00000000000000 0.89205704271584 6.941 > 55 56 Li 0.83703811223495 0.00000000000000 0.89205704271584 6.941 > 55 57 Li 0.33703811223495 0.33333333333333 0.89205704271584 6.941 > 55 58 Li 0.83703811223495 0.33333333333333 0.89205704271584 6.941 > 55 59 Li 0.33703811223495 0.66666666666667 0.89205704271584 6.941 > 55 60 Li 0.83703811223495 0.66666666666667 0.89205704271584 6.941 > 55 61 Li 0.23744678725788 0.16666666666667 0.26769384554314 6.941 > 61 62 Li 0.73744678725788 0.16666666666667 0.26769384554314 6.941 > 61 63 Li 0.23744678725788 0.50000000000000 0.26769384554314 6.941 > 61 64 Li 0.73744678725788 0.50000000000000 0.26769384554314 6.941 > 61 65 Li 0.23744678725788 0.83333333333333 0.26769384554314 6.941 > 61 66 Li 0.73744678725788 0.83333333333333 0.26769384554314 6.941 > 61 67 Li 0.10968814481082 0.16666666666667 0.39924597682118 6.941 > 67 68 Li 0.60968814481082 0.16666666666667 0.39924597682118 6.941 > 67 69 Li 0.10968814481082 0.50000000000000 0.39924597682118 6.941 > 67 70 Li 0.60968814481082 0.50000000000000 0.39924597682118 6.941 > 67 71 Li 0.10968814481082 0.83333333333333 0.39924597682118 6.941 > 67 72 Li 0.60968814481082 0.83333333333333 0.39924597682118 6.941 > 67 73 Li 0.18537012537342 0.00000000000000 0.56370985502578 6.941 > 73 74 Li 0.68537012537342 0.00000000000000 0.56370985502578 6.941 > 73 75 Li 0.18537012537342 0.33333333333333 0.56370985502578 6.941 > 73 76 Li 0.68537012537342 0.33333333333333 0.56370985502578 6.941 > 73 77 Li 0.18537012537342 0.66666666666667 0.56370985502578 6.941 > 73 78 Li 0.68537012537342 0.66666666666667 0.56370985502578 6.941 > 73 79 Li 0.39031185518918 0.16666666666667 0.60075402317882 6.941 > 79 80 Li 0.89031185518918 0.16666666666667 0.60075402317882 6.941 > 79 81 Li 0.39031185518918 0.50000000000000 0.60075402317882 6.941 > 79 82 Li 0.89031185518918 0.50000000000000 0.60075402317882 6.941 > 79 83 Li 0.39031185518918 0.83333333333333 0.60075402317882 6.941 > 79 84 Li 0.89031185518918 0.83333333333333 0.60075402317882 6.941 > 79 85 N 0.33043619788735 0.00000000000000 0.66731643432737 14.007 > 85 86 N 0.83043619788735 0.00000000000000 0.66731643432737 14.007 > 85 87 N 0.33043619788735 0.33333333333333 0.66731643432737 14.007 > 85 88 N 0.83043619788735 0.33333333333333 0.66731643432737 14.007 > 85 89 N 0.33043619788735 0.66666666666667 0.66731643432737 14.007 > 85 90 N 0.83043619788735 0.66666666666667 0.66731643432737 14.007 > 85 91 N 0.16956380211266 0.00000000000000 0.33268356567263 14.007 > 91 92 N 0.66956380211265 0.00000000000000 0.33268356567263 14.007 > 91 93 N 0.16956380211266 0.33333333333333 0.33268356567263 14.007 > 91 94 N 0.66956380211265 0.33333333333333 0.33268356567263 14.007 > 91 95 N 0.16956380211266 0.66666666666667 0.33268356567263 14.007 > 91 96 N 0.66956380211265 0.66666666666667 0.33268356567263 14.007 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5827580 0.0000000 -0.0213968 0.0000000 3.6055245 0.0000000 -0.0214052 0.0000000 3.4980036 -------------------------- Born effective charges -------------------------- 1 Cl -1.5008732 0.0000000 0.1658039 0.0000000 -1.1211999 0.0000000 0.1612590 0.0000000 -0.8327659 2 Cl -1.2013338 0.0000000 -0.2987107 0.0000000 -0.6272964 0.0000000 -0.2979298 0.0000000 -1.5616392 3 Cl -0.7859131 0.0000000 0.3598515 0.0000000 -1.1848610 0.0000000 0.3731114 0.0000000 -1.4213335 4 Cl -1.5008732 0.0000000 0.1658039 0.0000000 -1.1211999 0.0000000 0.1612590 0.0000000 -0.8327659 5 Li 0.8296946 0.0000000 -0.0129095 0.0000000 0.8656316 0.0000000 -0.0223026 0.0000000 0.9342761 6 Li 1.0287926 0.0000000 -0.0403996 0.0000000 0.9431481 0.0000000 -0.0361799 0.0000000 1.0082423 7 Li 1.0287926 0.0000000 -0.0403996 0.0000000 0.9431481 0.0000000 -0.0361799 0.0000000 1.0082423 8 Li 0.8661819 0.0000000 -0.0296422 0.0000000 0.8827426 0.0000000 0.0120464 0.0000000 0.7593984 9 Li 0.9369006 0.0000000 0.0025752 0.0000000 0.9376754 0.0000000 -0.0342338 0.0000000 1.0189740 10 Li 0.9369006 0.0000000 0.0025752 0.0000000 0.9376754 0.0000000 -0.0342338 0.0000000 1.0189740 11 Li 0.8296946 0.0000000 -0.0129095 0.0000000 0.8656316 0.0000000 -0.0223026 0.0000000 0.9342761 12 Li 0.9370479 0.0000000 -0.0406226 0.0000000 0.8694836 0.0000000 -0.0435653 0.0000000 0.7110092 13 Li 0.8661819 0.0000000 -0.0296422 0.0000000 0.8827426 0.0000000 0.0120464 0.0000000 0.7593984 14 Li 0.9370479 0.0000000 -0.0406226 0.0000000 0.8694836 0.0000000 -0.0435653 0.0000000 0.7110092 15 N -2.1041210 0.0000000 -0.0753756 0.0000000 -2.4714028 0.0000000 -0.0746144 0.0000000 -2.1076478 16 N -2.1041210 0.0000000 -0.0753756 0.0000000 -2.4714028 0.0000000 -0.0746144 0.0000000 -2.1076478 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yzy) -0.00000000 (yzy) -0.00000000 (yyz) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 14 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: 0.69, Number of G-points: 307, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/208) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 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 0.668 ( 0.000 0.000 0.000) 0.000 2.187 ( 0.000 0.000 0.000) 0.000 3.252 ( 0.000 0.000 0.000) 0.000 3.286 ( 0.000 0.000 0.000) 0.000 3.398 ( 0.000 0.000 0.000) 0.000 4.168 ( 0.000 0.000 0.000) 0.000 4.478 ( 0.000 0.000 0.000) 0.000 4.720 ( 0.000 0.000 0.000) 0.000 5.154 ( 0.000 0.000 0.000) 0.000 5.985 ( 0.000 0.000 0.000) 0.000 6.050 ( 0.000 0.000 0.000) 0.000 6.093 ( 0.000 0.000 0.000) 0.000 6.178 ( 0.000 0.000 0.000) 0.000 6.434 ( 0.000 0.000 0.000) 0.000 7.401 ( 0.000 0.000 0.000) 0.000 7.572 ( 0.000 0.000 0.000) 0.000 7.748 ( 0.000 0.000 0.000) 0.000 8.041 ( 0.000 0.000 0.000) 0.000 8.583 ( 0.000 0.000 0.000) 0.000 8.972 ( 0.000 0.000 0.000) 0.000 9.550 ( 0.000 0.000 0.000) 0.000 9.753 ( 0.000 0.000 0.000) 0.000 10.643 ( 0.000 0.000 0.000) 0.000 10.718 ( 0.000 0.000 0.000) 0.000 10.999 ( 0.000 0.000 0.000) 0.000 11.174 ( 0.000 0.000 0.000) 0.000 11.694 ( 0.000 0.000 0.000) 0.000 12.460 ( 0.000 0.000 0.000) 0.000 12.668 ( 0.000 0.000 0.000) 0.000 12.875 ( 0.000 0.000 0.000) 0.000 13.052 ( 0.000 0.000 0.000) 0.000 13.172 ( 0.000 0.000 0.000) 0.000 13.277 ( 0.000 0.000 0.000) 0.000 13.424 ( 0.000 0.000 0.000) 0.000 13.776 ( 0.000 0.000 0.000) 0.000 13.793 ( 0.000 0.000 0.000) 0.000 13.909 ( 0.000 0.000 0.000) 0.000 14.365 ( 0.000 0.000 0.000) 0.000 14.438 ( 0.000 0.000 0.000) 0.000 14.470 ( 0.000 0.000 0.000) 0.000 14.579 ( 0.000 0.000 0.000) 0.000 15.447 ( 0.000 0.000 0.000) 0.000 16.104 ( 0.000 0.000 0.000) 0.000 16.368 ( 0.000 0.000 0.000) 0.000 18.345 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/208) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.541 ( 12.833 0.000 -3.090) 13.200 0.814 ( 41.941 0.000 5.510) 42.301 0.834 ( 25.459 0.000 4.095) 25.786 1.204 ( 60.516 0.000 7.548) 60.985 2.363 ( 13.010 0.000 3.388) 13.444 3.228 ( -2.325 0.000 -2.440) 3.370 3.330 ( 4.218 0.000 2.247) 4.779 3.432 ( 3.203 0.000 1.549) 3.558 4.147 ( -4.501 0.000 4.781) 6.566 4.553 ( 4.066 0.000 5.254) 6.644 4.766 ( 5.416 0.000 -1.101) 5.527 5.161 ( -2.994 0.000 4.904) 5.746 5.710 ( -17.181 0.000 -2.671) 17.388 6.024 ( -6.274 0.000 -2.202) 6.649 6.188 ( 2.464 0.000 9.360) 9.679 6.243 ( 2.675 0.000 2.125) 3.417 6.516 ( 9.069 0.000 -7.280) 11.630 7.335 ( -19.619 0.000 -23.763) 30.815 7.763 ( -0.942 0.000 -6.669) 6.735 7.905 ( -5.477 0.000 -14.385) 15.393 8.045 ( 0.334 0.000 0.866) 0.928 8.747 ( 9.935 0.000 26.669) 28.459 8.948 ( -2.542 0.000 5.733) 6.271 9.647 ( -3.500 0.000 -17.059) 17.414 9.745 ( -0.851 0.000 -0.197) 0.874 10.514 ( -17.514 0.000 -16.112) 23.798 10.728 ( 0.986 0.000 0.682) 1.199 10.990 ( -0.926 0.000 -0.674) 1.145 11.207 ( 2.655 0.000 6.884) 7.378 11.696 ( 0.196 0.000 0.076) 0.210 12.453 ( -0.725 0.000 0.074) 0.729 12.641 ( -8.146 0.000 -12.578) 14.986 12.873 ( -0.191 0.000 -0.133) 0.233 13.047 ( -1.165 0.000 5.024) 5.157 13.149 ( 0.895 0.000 -8.781) 8.827 13.538 ( 2.605 0.000 -1.174) 2.858 13.633 ( 7.025 0.000 -4.571) 8.381 13.769 ( -0.715 0.000 -0.011) 0.716 13.892 ( -0.831 0.000 -1.072) 1.356 14.317 ( 0.892 0.000 -1.262) 1.545 14.453 ( 1.475 0.000 0.047) 1.475 14.520 ( 3.602 0.000 14.888) 15.317 14.630 ( 5.857 0.000 16.023) 17.060 15.456 ( 0.584 0.000 -11.318) 11.333 15.970 ( -4.966 0.000 -16.156) 16.902 16.487 ( 12.284 0.000 1.266) 12.349 16.862 ( -3.286 0.000 25.813) 26.022 18.307 ( -3.883 0.000 -0.879) 3.981 ======================= Grid point 2 (3/208) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.634 ( 2.517 0.000 -1.047) 2.726 1.445 ( 33.115 0.000 2.792) 33.232 1.574 ( 37.579 0.000 1.766) 37.620 2.180 ( 37.216 0.000 5.337) 37.597 2.761 ( 29.266 0.000 6.280) 29.932 3.152 ( -5.647 0.000 -2.932) 6.362 3.456 ( 10.110 0.000 6.194) 11.856 3.510 ( 4.418 0.000 1.334) 4.615 4.023 ( -9.244 0.000 5.090) 10.553 4.653 ( 5.148 0.000 0.164) 5.150 4.937 ( 10.565 0.000 8.614) 13.632 5.100 ( -2.210 0.000 0.536) 2.274 5.388 ( -15.991 0.000 -1.180) 16.034 5.847 ( -12.794 0.000 -1.637) 12.898 6.191 ( -2.155 0.000 5.424) 5.837 6.287 ( 0.830 0.000 0.275) 0.874 6.693 ( 9.442 0.000 -5.114) 10.738 6.864 ( -22.942 0.000 -31.607) 39.056 7.609 ( -11.194 0.000 -11.676) 16.175 7.898 ( 3.461 0.000 4.915) 6.011 8.056 ( 0.584 0.000 1.294) 1.420 8.829 ( -5.200 0.000 12.437) 13.480 9.012 ( 7.166 0.000 17.506) 18.916 9.530 ( -6.011 0.000 -10.949) 12.491 9.723 ( -1.258 0.000 -0.311) 1.296 10.091 ( -22.282 0.000 -16.371) 27.649 10.756 ( 1.655 0.000 1.151) 2.016 10.964 ( -1.595 0.000 -1.154) 1.968 11.287 ( 4.048 0.000 11.089) 11.805 11.701 ( 0.292 0.000 0.123) 0.316 12.436 ( -0.942 0.000 0.125) 0.950 12.454 ( -8.922 0.000 -10.994) 14.159 12.867 ( -0.378 0.000 -0.205) 0.430 13.029 ( -1.667 0.000 6.312) 6.528 13.197 ( 4.637 0.000 -5.278) 7.025 13.553 ( 0.542 0.000 -2.903) 2.953 13.650 ( -3.658 0.000 -4.644) 5.912 13.753 ( -0.834 0.000 -0.017) 0.834 13.894 ( -0.115 0.000 2.404) 2.407 14.327 ( 0.378 0.000 -0.459) 0.595 14.487 ( 1.937 0.000 0.066) 1.938 14.602 ( 3.509 0.000 6.198) 7.122 14.882 ( 13.151 0.000 31.025) 33.697 15.382 ( -5.099 0.000 -16.969) 17.718 15.987 ( 9.865 0.000 -17.818) 20.367 16.705 ( 10.136 0.000 2.505) 10.441 16.827 ( -3.773 0.000 10.769) 11.411 18.203 ( -6.679 0.000 -1.523) 6.851 ======================= Grid point 3 (4/208) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.669 ( 1.308 0.000 -0.350) 1.354 2.019 ( 26.248 0.000 2.298) 26.348 2.198 ( 27.917 0.000 -3.894) 28.187 2.604 ( 9.853 0.000 6.857) 12.004 2.999 ( -10.018 0.000 -2.574) 10.343 3.238 ( 15.503 0.000 3.301) 15.851 3.586 ( 3.149 0.000 0.682) 3.222 3.730 ( -3.154 0.000 -5.561) 6.393 4.008 ( 27.687 0.000 24.717) 37.115 4.746 ( 6.022 0.000 -8.365) 10.307 4.930 ( -8.127 0.000 6.812) 10.604 5.135 ( -9.967 0.000 -0.461) 9.978 5.268 ( 6.183 0.000 3.976) 7.351 5.550 ( -11.120 0.000 -3.297) 11.599 6.154 ( -1.958 0.000 2.322) 3.037 6.166 ( -15.665 0.000 -12.761) 20.205 6.531 ( -4.971 0.000 -11.446) 12.479 6.827 ( 5.194 0.000 -2.501) 5.765 7.385 ( -9.557 0.000 -5.785) 11.171 7.995 ( 5.078 0.000 5.698) 7.632 8.069 ( 0.507 0.000 0.968) 1.092 8.735 ( -5.337 0.000 7.950) 9.576 9.135 ( 3.226 0.000 7.570) 8.229 9.402 ( -5.969 0.000 -5.125) 7.867 9.701 ( -0.935 0.000 -0.245) 0.966 9.709 ( -13.660 0.000 -11.528) 17.875 10.790 ( 1.654 0.000 1.156) 2.017 10.930 ( -1.628 0.000 -1.168) 2.003 11.381 ( 3.566 0.000 9.151) 9.821 11.706 ( 0.217 0.000 0.098) 0.239 12.291 ( -6.085 0.000 -8.276) 10.272 12.421 ( -0.614 0.000 0.102) 0.622 12.860 ( -0.336 0.000 -0.157) 0.371 13.009 ( -1.152 0.000 3.614) 3.793 13.285 ( 4.926 0.000 -2.846) 5.689 13.548 ( -3.444 0.000 -0.995) 3.585 13.563 ( -1.227 0.000 -1.353) 1.826 13.740 ( -0.486 0.000 -0.014) 0.486 13.880 ( -1.381 0.000 2.266) 2.654 14.330 ( 0.030 0.000 -0.349) 0.350 14.519 ( 1.285 0.000 0.046) 1.285 14.681 ( 3.674 0.000 5.474) 6.593 15.054 ( -0.658 0.000 9.228) 9.251 15.318 ( 2.276 0.000 -3.677) 4.324 16.222 ( 15.665 0.000 -13.182) 20.473 16.740 ( -6.373 0.000 4.249) 7.659 16.872 ( 6.256 0.000 3.867) 7.355 18.072 ( -6.163 0.000 -1.428) 6.326 ======================= Grid point 4 (5/208) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.681 ( 0.000 0.000 -0.000) 0.000 2.325 ( 0.000 0.000 -0.000) 0.000 2.531 ( 0.000 0.000 -0.000) 0.000 2.636 ( -0.000 0.000 0.000) 0.000 2.849 ( -0.000 0.000 -0.000) 0.000 3.486 ( 0.000 0.000 0.000) 0.000 3.516 ( -0.000 0.000 -0.000) 0.000 3.618 ( 0.000 0.000 -0.000) 0.000 4.675 ( 0.000 0.000 0.000) 0.000 4.689 ( -0.000 0.000 -0.000) 0.000 4.903 ( -0.000 0.000 0.000) 0.000 4.948 ( 0.000 0.000 -0.000) 0.000 5.037 ( 0.000 0.000 0.000) 0.000 5.758 ( 0.000 0.000 0.000) 0.000 5.811 ( -0.000 0.000 -0.000) 0.000 6.136 ( 0.000 0.000 -0.000) 0.000 6.504 ( 0.000 0.000 -0.000) 0.000 6.875 ( 0.000 0.000 -0.000) 0.000 7.282 ( 0.000 0.000 0.000) 0.000 8.060 ( 0.000 0.000 0.000) 0.000 8.075 ( 0.000 0.000 -0.000) 0.000 8.685 ( 0.000 0.000 -0.000) 0.000 9.167 ( 0.000 0.000 -0.000) 0.000 9.324 ( -0.000 0.000 -0.000) 0.000 9.578 ( 0.000 0.000 0.000) 0.000 9.691 ( 0.000 0.000 0.000) 0.000 10.810 ( 0.000 0.000 0.000) 0.000 10.910 ( 0.000 0.000 -0.000) 0.000 11.427 ( 0.000 0.000 0.000) 0.000 11.709 ( 0.000 0.000 0.000) 0.000 12.223 ( 0.000 0.000 -0.000) 0.000 12.415 ( 0.000 0.000 0.000) 0.000 12.856 ( 0.000 0.000 0.000) 0.000 13.001 ( 0.000 0.000 0.000) 0.000 13.341 ( 0.000 0.000 0.000) 0.000 13.492 ( 0.000 0.000 -0.000) 0.000 13.562 ( 0.000 0.000 0.000) 0.000 13.736 ( 0.000 0.000 0.000) 0.000 13.866 ( 0.000 0.000 0.000) 0.000 14.329 ( 0.000 0.000 0.000) 0.000 14.532 ( 0.000 0.000 0.000) 0.000 14.730 ( 0.000 0.000 0.000) 0.000 15.020 ( 0.000 0.000 -0.000) 0.000 15.358 ( 0.000 0.000 -0.000) 0.000 16.415 ( 0.000 0.000 0.000) 0.000 16.639 ( 0.000 0.000 0.000) 0.000 16.939 ( 0.000 0.000 -0.000) 0.000 18.005 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 9 (6/208) ======================= q-point: ( 0.00 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.600 ( 0.000 30.630 0.000) 30.630 0.741 ( 0.000 36.382 0.000) 36.382 1.064 ( 0.000 32.143 0.000) 32.143 1.504 ( 0.000 60.788 0.000) 60.788 2.242 ( 0.000 5.901 0.000) 5.901 3.318 ( 0.000 6.219 0.000) 6.219 3.396 ( 0.000 9.429 0.000) 9.429 3.506 ( 0.000 10.015 0.000) 10.015 4.166 ( 0.000 -0.145 0.000) 0.145 4.465 ( 0.000 -1.250 0.000) 1.250 4.729 ( 0.000 0.958 0.000) 0.958 5.126 ( 0.000 -2.296 0.000) 2.296 6.101 ( 0.000 0.939 0.000) 0.939 6.174 ( 0.000 6.869 0.000) 6.869 6.220 ( 0.000 8.643 0.000) 8.643 6.380 ( 0.000 14.776 0.000) 14.776 6.529 ( 0.000 8.578 0.000) 8.578 7.351 ( 0.000 -5.714 0.000) 5.714 7.364 ( 0.000 -22.644 0.000) 22.644 7.657 ( 0.000 9.952 0.000) 9.952 8.376 ( 0.000 2.136 0.000) 2.136 8.525 ( 0.000 9.032 0.000) 9.032 8.939 ( 0.000 -3.046 0.000) 3.046 9.012 ( 0.000 -36.171 0.000) 36.171 9.861 ( 0.000 -0.634 0.000) 0.634 10.860 ( 0.000 -23.038 0.000) 23.038 10.915 ( 0.000 19.554 0.000) 19.554 11.070 ( 0.000 7.734 0.000) 7.734 11.220 ( 0.000 2.086 0.000) 2.086 12.208 ( 0.000 18.020 0.000) 18.020 12.341 ( 0.000 -25.833 0.000) 25.833 12.770 ( 0.000 -13.922 0.000) 13.922 13.068 ( 0.000 1.626 0.000) 1.626 13.156 ( 0.000 -2.673 0.000) 2.673 13.329 ( 0.000 10.709 0.000) 10.709 13.412 ( 0.000 -0.844 0.000) 0.844 13.682 ( 0.000 -1.845 0.000) 1.845 13.734 ( 0.000 -14.588 0.000) 14.588 13.954 ( 0.000 3.843 0.000) 3.843 14.406 ( 0.000 0.186 0.000) 0.186 14.468 ( 0.000 3.416 0.000) 3.416 14.639 ( 0.000 21.267 0.000) 21.267 14.742 ( 0.000 12.394 0.000) 12.394 15.408 ( 0.000 -3.679 0.000) 3.679 15.877 ( 0.000 -8.394 0.000) 8.394 16.299 ( 0.000 10.028 0.000) 10.028 16.352 ( 0.000 -1.286 0.000) 1.286 18.249 ( 0.000 -9.520 0.000) 9.520 ======================= Grid point 10 (7/208) ======================= q-point: ( 0.12 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.960 ( 5.601 28.659 0.541) 29.206 1.045 ( 32.260 19.140 13.809) 39.971 1.214 ( 24.711 23.121 0.401) 33.843 1.746 ( 27.519 49.472 -1.981) 56.645 2.410 ( 16.298 7.283 3.608) 18.212 3.306 ( -0.985 7.529 -2.549) 8.010 3.406 ( 1.839 7.443 1.053) 7.739 3.546 ( 3.229 10.227 2.585) 11.032 4.141 ( -3.722 -0.154 3.485) 5.101 4.526 ( 5.320 -1.551 4.273) 6.998 4.773 ( 5.139 0.747 -0.612) 5.229 5.117 ( -1.882 -2.904 3.948) 5.250 5.903 ( -19.721 15.354 -4.770) 25.444 6.038 ( -6.590 1.901 -2.002) 7.145 6.236 ( 2.362 1.548 2.770) 3.955 6.333 ( -2.731 11.073 7.661) 13.739 6.670 ( 9.189 12.788 -9.445) 18.362 7.331 ( -5.443 -12.293 -8.276) 15.788 7.458 ( -7.645 -7.474 -15.676) 18.975 7.526 ( 2.907 -11.125 -11.706) 16.409 8.477 ( 3.974 20.258 4.345) 21.096 8.619 ( 9.666 -9.639 20.976) 25.027 8.912 ( -3.094 -3.040 5.430) 6.949 9.021 ( -0.366 -35.858 -1.406) 35.887 9.805 ( -5.036 -4.634 -11.343) 13.248 10.797 ( -10.423 17.205 -1.281) 20.157 10.857 ( -2.086 -12.231 -2.202) 12.602 11.041 ( -2.313 4.409 -0.601) 5.015 11.111 ( -6.970 7.770 1.179) 10.505 12.056 ( -8.335 17.214 0.055) 19.126 12.373 ( 0.028 -16.838 -1.558) 16.910 12.722 ( -5.683 -15.163 -5.139) 16.989 12.860 ( -14.939 14.698 6.765) 22.022 13.075 ( -1.473 2.975 3.383) 4.740 13.221 ( -4.467 8.990 -10.527) 14.546 13.419 ( -4.435 -0.276 -10.005) 10.947 13.576 ( 6.583 0.615 -5.359) 8.511 13.760 ( 0.903 -9.730 1.041) 9.827 14.041 ( 6.641 6.291 -0.632) 9.169 14.414 ( 0.548 -0.168 -5.466) 5.496 14.511 ( 4.217 10.766 15.545) 19.373 14.617 ( -0.712 13.025 14.583) 19.566 14.779 ( 2.564 12.622 1.567) 12.974 15.438 ( 1.155 -2.226 -10.035) 10.344 15.909 ( 0.660 -6.151 -16.763) 17.868 16.480 ( 9.845 -1.743 4.377) 10.914 16.538 ( 11.591 -13.257 21.189) 27.552 18.212 ( -3.800 -9.438 -0.824) 10.207 ======================= Grid point 11 (8/208) ======================= q-point: ( 0.25 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.986 ( 0.523 27.989 -0.362) 27.996 1.672 ( 31.191 13.642 0.476) 34.047 1.780 ( 30.969 19.112 9.675) 37.656 2.300 ( 24.804 14.119 0.561) 28.547 2.863 ( 28.212 12.422 4.129) 31.101 3.262 ( -2.798 10.176 -3.049) 10.986 3.507 ( 10.396 5.379 4.665) 12.600 3.619 ( 3.719 9.852 2.189) 10.756 4.035 ( -7.679 1.745 6.128) 9.978 4.636 ( 5.134 -1.349 -0.117) 5.309 4.933 ( 9.084 -0.057 8.826) 12.666 5.073 ( -1.105 -2.149 0.554) 2.480 5.550 ( -16.198 14.647 -4.120) 22.223 5.853 ( -13.116 1.388 -2.156) 13.365 6.248 ( -5.810 4.741 0.474) 7.514 6.293 ( 1.418 1.520 0.278) 2.098 6.816 ( 7.104 11.067 -6.420) 14.634 7.019 ( -17.552 15.580 -24.192) 33.705 7.392 ( -1.222 -23.565 -4.211) 23.969 7.508 ( -2.940 -10.713 -3.175) 11.554 8.537 ( 2.819 20.800 2.746) 21.169 8.789 ( -1.181 -4.972 14.089) 14.987 8.896 ( 3.897 -11.032 12.876) 17.398 8.971 ( -4.102 -29.892 1.696) 30.220 9.651 ( -8.020 -9.791 -15.413) 19.944 10.544 ( -13.449 29.010 -8.621) 33.118 10.813 ( -1.601 -5.805 0.083) 6.023 11.025 ( 0.152 -7.954 5.621) 9.741 11.039 ( -1.833 6.305 0.269) 6.571 11.978 ( -1.052 15.427 2.623) 15.684 12.316 ( -5.108 -9.355 -5.167) 11.845 12.599 ( -3.813 -10.855 -2.017) 11.681 12.726 ( -4.522 4.116 2.869) 6.755 13.051 ( -1.656 2.624 3.646) 4.788 13.197 ( 2.381 1.413 -5.737) 6.370 13.347 ( -2.620 -0.519 -5.874) 6.453 13.618 ( -0.821 0.223 -2.673) 2.805 13.781 ( 0.269 -8.623 1.715) 8.796 14.089 ( -0.588 9.041 -2.312) 9.351 14.448 ( 3.293 -1.473 0.214) 3.614 14.567 ( 0.492 23.391 1.183) 23.426 14.723 ( 3.842 4.293 18.254) 19.142 14.897 ( 10.449 5.360 15.448) 19.405 15.382 ( -3.944 -0.225 -15.682) 16.172 15.978 ( 10.639 -1.289 -19.052) 21.859 16.656 ( 2.922 -11.425 15.584) 19.543 16.679 ( 6.502 -3.995 1.303) 7.741 18.111 ( -6.472 -9.147 -1.373) 11.289 ======================= Grid point 12 (9/208) ======================= q-point: ( 0.38 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.996 ( 0.544 26.975 -0.208) 26.981 2.187 ( 23.116 9.744 -1.411) 25.126 2.343 ( 25.736 15.346 3.973) 30.226 2.626 ( 9.380 3.947 4.218) 11.016 3.081 ( -5.809 8.483 -1.055) 10.335 3.317 ( 9.042 8.084 -0.273) 12.132 3.667 ( -0.588 6.614 2.139) 6.976 3.769 ( 0.907 5.229 -3.840) 6.550 4.087 ( 26.083 8.014 22.176) 35.161 4.721 ( 5.268 -2.275 -9.449) 11.055 4.905 ( -8.107 -1.558 5.853) 10.120 5.174 ( -2.838 -0.596 -1.546) 3.286 5.378 ( 0.667 14.108 4.146) 14.720 5.562 ( -10.855 2.270 -3.914) 11.761 6.077 ( -11.486 -0.706 -7.262) 13.607 6.302 ( -1.337 6.663 -0.463) 6.812 6.724 ( -9.064 18.297 -10.818) 23.108 6.898 ( 2.424 5.904 -3.963) 7.513 7.334 ( -2.733 -6.552 -6.260) 9.465 7.479 ( -0.482 -20.160 3.923) 20.544 8.602 ( 3.656 14.696 2.686) 15.381 8.726 ( -4.248 0.347 7.736) 8.833 8.845 ( -6.500 -26.476 -0.642) 27.270 9.036 ( 4.195 -8.501 8.876) 12.986 9.496 ( -5.367 -11.689 -9.767) 16.150 10.318 ( -8.363 31.759 -6.640) 33.506 10.805 ( 0.296 -4.364 0.403) 4.393 10.999 ( -1.622 6.259 0.348) 6.475 11.063 ( 1.548 -14.332 4.288) 15.039 11.996 ( 1.955 14.624 4.313) 15.371 12.195 ( -5.917 -4.289 -6.804) 9.985 12.570 ( 0.116 -15.992 1.206) 16.038 12.655 ( -3.288 2.529 -0.702) 4.207 13.029 ( -1.125 2.534 2.293) 3.597 13.261 ( 4.066 -1.119 0.125) 4.218 13.299 ( -1.276 -0.723 -5.627) 5.815 13.561 ( -4.400 0.009 0.311) 4.411 13.776 ( -0.556 -7.323 1.199) 7.441 14.068 ( -0.774 8.504 -0.861) 8.582 14.523 ( 3.968 0.063 0.894) 4.068 14.576 ( 0.254 18.802 2.448) 18.962 14.768 ( 0.156 10.100 5.490) 11.497 15.071 ( 2.144 3.230 7.318) 8.282 15.324 ( 1.546 0.728 -5.385) 5.650 16.213 ( 15.871 -2.021 -15.377) 22.191 16.629 ( -5.833 -8.766 9.431) 14.135 16.817 ( 5.615 -5.109 2.269) 7.923 17.985 ( -5.887 -8.630 -1.253) 10.521 ======================= Grid point 13 (10/208) ======================= q-point: (-0.50 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.002 ( 0.000 26.625 -0.000) 26.625 2.451 ( 0.000 4.853 -0.000) 4.853 2.662 ( 0.000 17.302 -0.000) 17.302 2.670 ( -0.000 3.728 0.000) 3.728 2.960 ( -0.000 9.244 -0.000) 9.244 3.457 ( 0.000 0.705 -0.000) 0.705 3.580 ( 0.000 7.335 0.000) 7.335 3.753 ( 0.000 10.641 -0.000) 10.641 4.601 ( 0.000 -5.411 0.000) 5.411 4.709 ( -0.000 2.147 -0.000) 2.147 4.886 ( -0.000 -1.140 0.000) 1.140 4.956 ( 0.000 1.001 0.000) 1.001 5.250 ( 0.000 18.726 -0.000) 18.726 5.716 ( 0.000 -2.171 0.000) 2.171 5.842 ( 0.000 4.003 0.000) 4.003 6.273 ( 0.000 9.873 -0.000) 9.873 6.642 ( 0.000 14.065 0.000) 14.065 6.911 ( 0.000 2.750 -0.000) 2.750 7.304 ( 0.000 3.573 0.000) 3.573 7.480 ( 0.000 -25.884 0.000) 25.884 8.659 ( 0.000 -6.486 -0.000) 6.486 8.694 ( 0.000 27.300 0.000) 27.300 8.754 ( -0.000 -30.541 -0.000) 30.541 9.082 ( 0.000 -6.956 0.000) 6.956 9.437 ( 0.000 -12.176 0.000) 12.176 10.231 ( 0.000 31.453 0.000) 31.453 10.811 ( 0.000 -4.744 0.000) 4.744 10.982 ( 0.000 6.979 -0.000) 6.979 11.084 ( 0.000 -16.340 0.000) 16.340 12.041 ( 0.000 21.108 0.000) 21.108 12.110 ( 0.000 -9.536 -0.000) 9.536 12.584 ( 0.000 -30.581 0.000) 30.581 12.612 ( 0.000 15.283 0.000) 15.283 13.020 ( 0.000 2.537 0.000) 2.537 13.278 ( 0.000 0.223 -0.000) 0.223 13.319 ( 0.000 -2.825 0.000) 2.825 13.502 ( 0.000 -0.412 -0.000) 0.412 13.772 ( 0.000 -6.465 0.000) 6.465 14.060 ( 0.000 7.912 0.000) 7.912 14.565 ( 0.000 15.138 -0.000) 15.138 14.586 ( 0.000 2.318 0.000) 2.318 14.769 ( 0.000 11.190 0.000) 11.190 15.070 ( 0.000 5.289 -0.000) 5.289 15.356 ( 0.000 0.285 -0.000) 0.285 16.449 ( 0.000 3.580 -0.000) 3.580 16.492 ( -0.000 -13.868 0.000) 13.868 16.875 ( 0.000 -6.091 -0.000) 6.091 17.921 ( 0.000 -8.283 -0.000) 8.283 ======================= Grid point 18 (11/208) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( 0.000 28.371 0.000) 28.371 1.414 ( 0.000 30.989 0.000) 30.989 1.665 ( 0.000 30.172 0.000) 30.172 2.453 ( 0.000 16.551 0.000) 16.551 2.738 ( 0.000 59.250 0.000) 59.250 3.513 ( 0.000 13.200 0.000) 13.200 3.636 ( 0.000 14.427 0.000) 14.427 3.738 ( 0.000 11.560 0.000) 11.560 4.177 ( 0.000 2.060 0.000) 2.060 4.437 ( 0.000 -1.254 0.000) 1.254 4.760 ( 0.000 2.168 0.000) 2.168 5.084 ( 0.000 -1.611 0.000) 1.611 6.130 ( 0.000 1.835 0.000) 1.835 6.280 ( 0.000 6.545 0.000) 6.545 6.458 ( 0.000 9.995 0.000) 9.995 6.754 ( 0.000 13.015 0.000) 13.015 6.768 ( 0.000 22.097 0.000) 22.097 6.979 ( 0.000 -15.397 0.000) 15.397 7.170 ( 0.000 -11.273 0.000) 11.273 7.996 ( 0.000 23.767 0.000) 23.767 8.162 ( 0.000 -11.057 0.000) 11.057 8.300 ( 0.000 -33.553 0.000) 33.553 8.774 ( 0.000 0.857 0.000) 0.857 8.898 ( 0.000 1.728 0.000) 1.728 9.762 ( 0.000 -8.152 0.000) 8.152 10.468 ( 0.000 -13.064 0.000) 13.064 11.149 ( 0.000 5.322 0.000) 5.322 11.228 ( 0.000 -2.450 0.000) 2.450 11.298 ( 0.000 8.651 0.000) 8.651 11.741 ( 0.000 -31.946 0.000) 31.946 12.479 ( 0.000 7.858 0.000) 7.858 12.578 ( 0.000 -1.937 0.000) 1.937 13.091 ( 0.000 -1.302 0.000) 1.302 13.109 ( 0.000 -2.416 0.000) 2.416 13.391 ( 0.000 -8.900 0.000) 8.900 13.485 ( 0.000 1.089 0.000) 1.089 13.529 ( 0.000 7.055 0.000) 7.055 13.664 ( 0.000 0.027 0.000) 0.027 13.982 ( 0.000 0.610 0.000) 0.610 14.417 ( 0.000 0.623 0.000) 0.623 14.567 ( 0.000 7.501 0.000) 7.501 14.972 ( 0.000 9.435 0.000) 9.435 15.082 ( 0.000 19.750 0.000) 19.750 15.316 ( 0.000 -5.111 0.000) 5.111 15.774 ( 0.000 -1.386 0.000) 1.386 16.340 ( 0.000 0.938 0.000) 0.938 16.464 ( 0.000 6.389 0.000) 6.389 17.980 ( 0.000 -17.229 0.000) 17.229 ======================= Grid point 19 (12/208) ======================= q-point: ( 0.12 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( 18.163 19.909 10.112) 28.784 1.541 ( 11.714 28.504 5.402) 31.287 1.727 ( 9.856 27.401 -2.884) 29.262 2.494 ( 5.531 20.416 0.883) 21.170 2.952 ( 19.949 49.293 -1.669) 53.203 3.518 ( 0.951 13.572 -2.141) 13.773 3.603 ( -1.979 11.552 -2.393) 11.962 3.780 ( 3.074 11.943 3.796) 12.903 4.165 ( -1.899 3.547 4.049) 5.708 4.504 ( 5.805 -0.657 4.311) 7.260 4.801 ( 4.764 2.130 0.503) 5.242 5.069 ( -1.800 -1.658 2.623) 3.588 6.054 ( -8.129 2.062 -6.147) 10.398 6.247 ( -12.646 13.448 -10.695) 21.334 6.322 ( 0.389 6.724 1.507) 6.902 6.578 ( -9.323 15.313 7.145) 19.299 6.958 ( 6.298 7.203 -3.349) 10.137 6.992 ( 2.014 -10.634 -2.161) 11.037 7.218 ( 4.103 -8.864 -0.797) 9.800 7.761 ( -12.666 19.501 -24.591) 33.844 8.285 ( -1.164 -31.889 -4.785) 32.267 8.377 ( 10.850 -7.336 21.582) 25.245 8.777 ( -0.941 -2.646 3.483) 4.474 8.914 ( 1.590 4.910 10.179) 11.412 9.668 ( -8.516 -8.369 -9.145) 15.040 10.468 ( 0.005 -13.453 1.524) 13.539 11.110 ( -3.768 3.996 -3.990) 6.789 11.185 ( -3.992 3.969 -1.173) 5.751 11.259 ( -3.456 9.290 -0.295) 9.917 11.741 ( 0.121 -31.801 -0.007) 31.802 12.383 ( -7.726 4.420 2.462) 9.236 12.558 ( -4.061 2.313 -0.172) 4.677 12.940 ( -5.294 -3.044 0.817) 6.161 13.166 ( -1.774 4.895 1.520) 5.424 13.324 ( -5.066 -5.214 -8.372) 11.087 13.480 ( -0.820 9.045 1.000) 9.137 13.583 ( 4.478 -0.610 -0.728) 4.577 13.663 ( 0.865 1.469 -5.231) 5.502 14.082 ( 8.517 0.222 -1.005) 8.579 14.421 ( 0.419 0.215 -6.802) 6.818 14.570 ( -0.172 2.557 22.301) 22.447 14.998 ( 1.533 8.516 0.744) 8.685 15.051 ( -0.721 20.461 1.317) 20.516 15.359 ( 2.985 -5.263 -6.718) 9.041 15.819 ( 5.279 -0.388 -9.152) 10.572 16.393 ( 4.208 -0.763 9.125) 10.078 16.523 ( 4.916 2.542 3.679) 6.646 17.946 ( -3.523 -17.036 -0.603) 17.407 ======================= Grid point 20 (13/208) ======================= q-point: ( 0.25 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( 1.155 27.509 0.367) 27.536 1.984 ( 24.194 17.278 7.810) 30.739 2.059 ( 23.471 11.057 6.423) 26.728 2.660 ( 10.909 18.542 1.296) 21.552 3.318 ( 12.347 28.907 -2.972) 31.573 3.500 ( -1.572 12.144 -4.674) 13.107 3.696 ( 15.797 15.875 -0.459) 22.401 3.836 ( 1.593 11.230 5.210) 12.482 4.137 ( -0.703 9.686 8.971) 13.221 4.611 ( 4.255 -0.987 -0.132) 4.370 4.940 ( 5.411 0.617 8.817) 10.363 5.038 ( 1.141 -0.989 -0.339) 1.547 5.795 ( -14.729 6.061 -16.144) 22.679 5.999 ( -11.574 14.186 -0.192) 18.310 6.361 ( -2.734 7.439 -0.120) 7.927 6.415 ( -4.149 12.597 1.571) 13.355 6.989 ( -2.000 -14.184 -4.804) 15.109 7.010 ( 0.693 -1.764 -2.391) 3.051 7.266 ( -1.192 4.467 -3.930) 6.068 7.537 ( -5.619 22.263 -15.019) 27.437 8.229 ( -4.052 -29.196 -4.737) 29.854 8.573 ( 6.672 -12.785 15.102) 20.882 8.737 ( -3.808 -4.206 7.363) 9.295 9.002 ( 5.174 6.355 12.550) 14.989 9.461 ( -9.977 -7.720 -12.920) 18.057 10.479 ( 1.017 -13.670 0.858) 13.734 11.010 ( -6.184 10.048 -7.907) 14.203 11.080 ( -5.295 7.591 -1.125) 9.324 11.205 ( -2.189 8.883 1.049) 9.209 11.748 ( 0.626 -31.997 0.093) 32.003 12.239 ( -7.579 -1.405 1.086) 7.784 12.462 ( -4.407 8.320 1.578) 9.547 12.906 ( -0.531 2.516 3.971) 4.731 13.093 ( -3.465 -0.830 -4.884) 6.045 13.255 ( -1.444 5.434 -3.228) 6.484 13.454 ( -1.974 8.519 0.413) 8.755 13.628 ( -0.737 0.896 -3.737) 3.913 13.672 ( 1.256 -0.710 -0.432) 1.506 14.167 ( 0.087 1.059 -1.327) 1.700 14.426 ( 1.553 -1.166 -1.714) 2.590 14.651 ( 2.140 -5.186 22.200) 22.898 15.062 ( 7.816 13.065 1.283) 15.279 15.091 ( 3.224 15.612 1.260) 15.991 15.370 ( 0.072 -0.320 -11.464) 11.469 15.931 ( 8.126 -2.300 -11.522) 14.286 16.492 ( 3.504 -2.313 13.083) 13.740 16.625 ( 4.958 -1.632 0.555) 5.249 17.853 ( -5.821 -16.392 -0.953) 17.421 ======================= Grid point 21 (14/208) ======================= q-point: ( 0.38 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 0.402 29.070 0.003) 29.073 2.349 ( 14.758 6.865 -1.336) 16.331 2.534 ( 21.192 4.603 11.831) 24.704 2.861 ( 9.357 15.947 1.466) 18.548 3.306 ( -7.888 10.083 -4.943) 13.723 3.551 ( 5.884 16.409 -4.265) 17.946 3.844 ( -1.156 12.876 8.302) 15.364 3.969 ( 5.079 14.509 -0.646) 15.386 4.313 ( 18.183 13.918 14.089) 26.885 4.673 ( 4.635 -1.778 -10.216) 11.358 4.888 ( -6.177 -0.036 3.898) 7.304 5.131 ( -1.420 -2.875 -1.082) 3.385 5.611 ( 1.167 7.447 -6.855) 10.189 5.794 ( -9.623 18.912 2.076) 21.321 6.186 ( -9.781 14.665 -2.038) 17.745 6.450 ( 2.007 9.030 0.177) 9.252 6.893 ( -5.644 -8.135 -4.599) 10.917 7.031 ( 1.593 -9.698 -5.411) 11.220 7.148 ( -7.403 12.128 -1.969) 14.345 7.504 ( 0.891 18.175 -3.345) 18.502 8.138 ( -4.024 -27.118 -2.670) 27.545 8.663 ( -1.446 -5.605 6.790) 8.923 8.695 ( 1.187 -13.015 7.540) 15.088 9.104 ( 2.691 -1.159 3.564) 4.614 9.308 ( -3.449 -0.085 -4.613) 5.760 10.508 ( 1.901 -12.652 -0.137) 12.795 10.854 ( -7.437 19.006 -8.078) 21.950 11.027 ( -1.108 2.826 1.891) 3.577 11.174 ( -1.255 9.479 0.189) 9.564 11.761 ( 0.603 -32.684 0.069) 32.690 12.118 ( -4.915 -5.367 -0.247) 7.282 12.414 ( -1.384 12.022 1.999) 12.265 12.886 ( -2.042 8.972 2.496) 9.534 13.066 ( 0.938 -4.542 -3.565) 5.850 13.247 ( 1.038 5.409 -1.410) 5.686 13.410 ( -2.759 7.016 0.837) 7.585 13.559 ( -4.406 0.722 -1.150) 4.610 13.702 ( 1.408 0.882 0.040) 1.662 14.141 ( -1.698 0.652 -0.098) 1.821 14.481 ( 4.070 -3.154 2.485) 5.717 14.657 ( -3.082 -4.265 5.801) 7.832 15.153 ( 2.811 10.678 2.282) 11.275 15.234 ( 5.371 17.594 3.204) 18.672 15.361 ( 2.460 4.111 -7.321) 8.749 16.072 ( 7.960 -11.229 -9.033) 16.463 16.552 ( 0.818 2.387 9.676) 10.000 16.699 ( 2.796 -5.464 -1.060) 6.229 17.743 ( -5.037 -15.304 -0.798) 16.132 ======================= Grid point 22 (15/208) ======================= q-point: (-0.50 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( 0.000 29.340 -0.000) 29.340 2.498 ( 0.000 1.403 0.000) 1.403 2.765 ( 0.000 4.898 0.000) 4.898 3.009 ( 0.000 11.517 0.000) 11.517 3.147 ( -0.000 9.353 -0.000) 9.353 3.621 ( 0.000 17.119 -0.000) 17.119 3.841 ( 0.000 18.681 0.000) 18.681 3.994 ( 0.000 12.956 0.000) 12.956 4.511 ( 0.000 -2.559 0.000) 2.559 4.775 ( -0.000 4.218 -0.000) 4.218 4.880 ( 0.000 0.942 -0.000) 0.942 4.978 ( 0.000 0.845 0.000) 0.845 5.664 ( 0.000 18.881 -0.000) 18.881 5.720 ( -0.000 3.106 -0.000) 3.106 6.065 ( 0.000 22.539 0.000) 22.539 6.465 ( 0.000 10.091 -0.000) 10.091 6.822 ( 0.000 -4.165 -0.000) 4.165 7.048 ( 0.000 12.871 -0.000) 12.871 7.065 ( -0.000 -15.749 0.000) 15.749 7.511 ( 0.000 18.523 -0.000) 18.523 8.096 ( 0.000 -26.036 0.000) 26.036 8.640 ( 0.000 -2.208 -0.000) 2.208 8.725 ( 0.000 -16.400 0.000) 16.400 9.115 ( 0.000 -10.185 0.000) 10.185 9.294 ( 0.000 8.861 0.000) 8.861 10.533 ( 0.000 -12.116 0.000) 12.116 10.764 ( 0.000 20.831 -0.000) 20.831 11.022 ( 0.000 2.026 0.000) 2.026 11.162 ( 0.000 9.899 -0.000) 9.899 11.768 ( 0.000 -33.096 0.000) 33.096 12.069 ( 0.000 -6.343 0.000) 6.343 12.404 ( 0.000 12.983 0.000) 12.983 12.865 ( 0.000 9.669 0.000) 9.669 13.078 ( 0.000 -2.411 0.000) 2.411 13.271 ( 0.000 3.759 0.000) 3.759 13.370 ( 0.000 3.650 0.000) 3.650 13.511 ( 0.000 2.564 -0.000) 2.564 13.717 ( 0.000 1.698 0.000) 1.698 14.122 ( 0.000 0.158 0.000) 0.158 14.556 ( 0.000 -4.443 0.000) 4.443 14.599 ( -0.000 -3.190 0.000) 3.190 15.189 ( 0.000 4.099 0.000) 4.099 15.255 ( 0.000 25.246 -0.000) 25.246 15.408 ( 0.000 6.014 0.000) 6.014 16.152 ( 0.000 -18.379 -0.000) 18.379 16.563 ( 0.000 8.031 0.000) 8.031 16.724 ( 0.000 -8.095 0.000) 8.095 17.690 ( 0.000 -14.611 -0.000) 14.611 ======================= Grid point 27 (16/208) ======================= q-point: ( 0.00 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( 0.000 17.985 0.000) 17.985 1.975 ( 0.000 26.191 0.000) 26.191 2.242 ( 0.000 27.550 0.000) 27.550 2.915 ( 0.000 29.270 0.000) 29.270 3.755 ( 0.000 34.439 0.000) 34.439 3.840 ( 0.000 23.829 0.000) 23.829 3.888 ( 0.000 2.718 0.000) 2.718 3.975 ( 0.000 23.325 0.000) 23.325 4.277 ( 0.000 7.353 0.000) 7.353 4.429 ( 0.000 1.205 0.000) 1.205 4.815 ( 0.000 3.284 0.000) 3.284 5.070 ( 0.000 0.347 0.000) 0.347 6.160 ( 0.000 0.692 0.000) 0.692 6.430 ( 0.000 7.840 0.000) 7.840 6.604 ( 0.000 4.198 0.000) 4.198 6.677 ( 0.000 -19.334 0.000) 19.334 6.764 ( 0.000 -5.624 0.000) 5.624 7.117 ( 0.000 8.909 0.000) 8.909 7.217 ( 0.000 14.082 0.000) 14.082 7.761 ( 0.000 -18.040 0.000) 18.040 8.139 ( 0.000 11.796 0.000) 11.796 8.535 ( 0.000 28.187 0.000) 28.187 8.654 ( 0.000 -9.345 0.000) 9.345 8.828 ( 0.000 -9.666 0.000) 9.666 9.565 ( 0.000 -11.178 0.000) 11.178 10.405 ( 0.000 4.911 0.000) 4.911 10.939 ( 0.000 -30.876 0.000) 30.876 11.090 ( 0.000 -11.757 0.000) 11.757 11.162 ( 0.000 -13.915 0.000) 13.915 11.543 ( 0.000 11.172 0.000) 11.172 12.537 ( 0.000 -0.876 0.000) 0.876 12.659 ( 0.000 6.087 0.000) 6.087 12.972 ( 0.000 -9.529 0.000) 9.529 13.072 ( 0.000 -0.203 0.000) 0.203 13.196 ( 0.000 -6.348 0.000) 6.348 13.578 ( 0.000 -0.476 0.000) 0.476 13.677 ( 0.000 0.002 0.000) 0.002 13.699 ( 0.000 14.589 0.000) 14.589 14.012 ( 0.000 2.396 0.000) 2.396 14.421 ( 0.000 -0.327 0.000) 0.327 14.778 ( 0.000 13.549 0.000) 13.549 15.089 ( 0.000 2.554 0.000) 2.554 15.230 ( 0.000 -2.909 0.000) 2.909 15.346 ( 0.000 6.572 0.000) 6.572 15.824 ( 0.000 5.595 0.000) 5.595 16.417 ( 0.000 6.743 0.000) 6.743 16.547 ( 0.000 2.052 0.000) 2.052 17.588 ( 0.000 -21.782 0.000) 21.782 ======================= Grid point 28 (17/208) ======================= q-point: ( 0.12 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.773 ( 9.883 13.510 4.820) 17.420 2.072 ( 9.540 24.508 6.283) 27.040 2.262 ( 2.311 26.225 -0.230) 26.327 2.948 ( 3.524 26.809 0.777) 27.051 3.771 ( -7.355 7.256 -7.550) 12.796 3.815 ( -2.153 17.134 -4.473) 17.838 3.874 ( 11.569 29.268 -2.267) 31.553 4.064 ( 6.202 24.799 5.993) 26.256 4.310 ( 2.397 10.358 5.599) 12.016 4.501 ( 5.866 0.495 5.197) 7.853 4.855 ( 4.357 3.188 1.527) 5.610 5.057 ( -1.485 0.484 1.022) 1.866 6.091 ( -6.575 1.823 -7.819) 10.378 6.450 ( -10.785 7.411 -9.801) 16.349 6.464 ( 2.275 7.734 1.223) 8.154 6.672 ( -0.151 -20.448 -4.646) 20.970 6.746 ( -3.001 -4.857 -1.180) 5.830 7.050 ( -3.901 16.349 12.406) 20.890 7.350 ( 7.264 5.147 1.613) 9.047 7.791 ( 3.386 -14.443 -1.338) 14.895 8.064 ( -5.779 14.566 -12.715) 20.180 8.529 ( -0.813 19.207 0.432) 19.229 8.662 ( -0.479 -5.900 4.859) 7.658 8.838 ( 0.447 -11.443 8.934) 14.524 9.487 ( -6.979 -9.950 -5.862) 13.493 10.394 ( -0.484 4.367 -0.805) 4.467 10.953 ( 1.253 -30.673 0.968) 30.714 11.060 ( -2.624 -10.808 2.228) 11.343 11.165 ( 0.286 -10.741 -5.993) 12.304 11.531 ( -1.338 11.621 -0.432) 11.706 12.492 ( -4.943 4.051 4.817) 8.003 12.640 ( -3.962 5.933 2.140) 7.448 12.816 ( -4.167 -8.567 -3.008) 9.991 13.126 ( -3.253 -6.212 -0.694) 7.046 13.284 ( 8.114 0.453 -1.445) 8.254 13.592 ( 1.786 0.844 1.927) 2.760 13.670 ( -1.213 4.801 -0.562) 4.983 13.712 ( 1.619 7.554 -0.421) 7.737 14.094 ( 7.389 1.366 -4.187) 8.602 14.415 ( -0.560 -0.725 -2.289) 2.466 14.676 ( -9.459 8.197 11.324) 16.879 15.100 ( 1.492 2.801 -0.857) 3.287 15.229 ( -0.845 -3.957 -7.112) 8.183 15.365 ( 3.714 7.390 5.178) 9.758 15.892 ( 5.254 6.316 -2.948) 8.728 16.444 ( 2.640 4.931 1.817) 5.881 16.582 ( 3.294 3.382 1.810) 5.057 17.559 ( -2.989 -21.457 -0.295) 21.666 ======================= Grid point 29 (18/208) ======================= q-point: ( 0.25 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.971 ( 8.627 12.326 2.708) 15.287 2.325 ( 10.692 15.822 3.409) 19.398 2.346 ( 10.785 20.307 9.289) 24.799 3.049 ( 6.553 21.218 1.316) 22.246 3.596 ( -9.108 2.466 -11.177) 14.628 3.806 ( 1.903 15.917 -0.193) 16.031 4.077 ( 7.090 17.472 5.133) 19.542 4.230 ( 10.099 29.021 -2.949) 30.869 4.400 ( 7.761 16.166 8.706) 19.934 4.601 ( 3.419 0.128 1.022) 3.570 4.954 ( 1.703 0.969 5.930) 6.245 5.038 ( 1.835 0.851 -0.881) 2.207 5.910 ( -9.123 7.121 -12.494) 17.030 6.235 ( -9.234 9.029 -2.788) 13.212 6.535 ( 3.515 9.089 -0.283) 9.749 6.654 ( -0.646 -18.347 -4.588) 18.923 6.664 ( -3.891 0.759 -4.559) 6.041 7.008 ( -3.387 15.666 12.635) 20.409 7.408 ( -1.790 0.118 -2.294) 2.912 7.859 ( 1.687 -2.984 -4.431) 5.602 7.946 ( -1.967 12.907 -7.860) 15.239 8.487 ( -3.805 8.528 -1.216) 9.417 8.640 ( -2.539 -5.077 8.210) 9.982 8.869 ( 0.590 -15.446 7.047) 16.988 9.338 ( -6.161 -7.485 -5.870) 11.333 10.408 ( 2.542 5.226 -0.458) 5.829 10.980 ( 1.150 -32.118 1.200) 32.161 11.021 ( -1.655 -6.426 3.099) 7.324 11.141 ( -1.674 -5.097 -9.515) 10.924 11.493 ( -2.400 12.548 -0.422) 12.782 12.371 ( -7.956 11.225 4.698) 14.538 12.561 ( -3.163 1.677 2.910) 4.613 12.825 ( 3.491 -7.735 -4.385) 9.552 13.048 ( -3.974 -3.418 -0.843) 5.309 13.368 ( 1.374 4.309 2.919) 5.383 13.614 ( -2.981 5.506 -1.550) 6.450 13.657 ( 2.254 2.430 -1.957) 3.849 13.737 ( 0.203 6.529 2.229) 6.902 14.164 ( -1.121 -0.708 -1.642) 2.110 14.399 ( -0.162 -1.209 -1.171) 1.691 14.578 ( -1.486 -1.244 9.810) 9.999 15.160 ( 4.830 1.538 -1.152) 5.198 15.221 ( 3.206 -3.061 -10.208) 11.129 15.466 ( 4.885 6.371 4.829) 9.369 15.952 ( 0.840 4.242 0.841) 4.405 16.515 ( 4.144 2.848 2.320) 5.538 16.662 ( 4.565 6.017 0.084) 7.554 17.483 ( -4.610 -20.368 -0.402) 20.887 ======================= Grid point 30 (19/208) ======================= q-point: ( 0.38 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( 3.281 20.303 0.543) 20.574 2.455 ( 5.996 5.210 0.183) 7.945 2.656 ( 14.463 8.236 12.679) 20.923 3.156 ( 2.745 13.298 0.270) 13.581 3.417 ( -6.750 4.201 -10.076) 12.835 3.892 ( 6.694 14.270 1.293) 15.815 4.175 ( 2.956 19.918 11.104) 22.995 4.322 ( 0.534 19.228 -2.308) 19.374 4.576 ( 1.626 10.182 1.478) 10.416 4.704 ( 12.953 7.203 -3.247) 15.173 4.909 ( -3.757 2.403 1.183) 4.614 5.074 ( -1.809 -2.613 -1.175) 3.388 5.801 ( 0.360 11.365 -5.239) 12.520 6.084 ( -7.513 11.853 0.970) 14.067 6.569 ( 2.169 11.015 -0.778) 11.254 6.608 ( -1.277 -11.144 -6.626) 13.028 6.677 ( 2.684 3.980 0.734) 4.856 6.960 ( -3.193 14.795 7.714) 16.988 7.283 ( -9.333 -0.088 -5.353) 10.759 7.813 ( -2.189 3.388 -6.157) 7.360 7.987 ( 3.065 15.399 1.284) 15.754 8.405 ( -3.689 -8.004 -1.798) 8.995 8.610 ( -1.897 -3.114 8.705) 9.438 8.857 ( -1.774 -15.760 -3.373) 16.214 9.276 ( -0.434 -8.908 0.771) 8.952 10.485 ( 4.865 8.680 1.178) 10.020 10.995 ( 0.440 -33.709 0.438) 33.715 11.010 ( -0.326 -2.212 2.714) 3.516 11.074 ( -3.354 -0.312 -8.632) 9.266 11.451 ( -1.771 12.892 -0.154) 13.014 12.245 ( -5.276 14.291 1.306) 15.290 12.529 ( -1.143 0.723 3.209) 3.482 12.885 ( 2.308 -10.382 -3.826) 11.303 13.003 ( 0.289 1.725 -1.055) 2.043 13.375 ( -1.394 2.036 7.299) 7.705 13.523 ( -5.131 8.143 -3.399) 10.207 13.641 ( -2.882 5.847 -1.333) 6.654 13.767 ( 2.639 4.080 1.265) 5.021 14.111 ( -2.965 -3.516 0.938) 4.694 14.426 ( 2.887 -1.490 3.675) 4.905 14.572 ( -1.511 -2.837 -1.313) 3.472 15.199 ( 0.855 -1.230 -2.361) 2.796 15.383 ( 12.222 -1.916 -7.090) 14.259 15.544 ( 2.247 6.160 4.886) 8.177 15.928 ( -3.343 -1.508 2.570) 4.478 16.590 ( 3.161 1.384 1.764) 3.875 16.733 ( 2.712 9.022 -1.226) 9.500 17.401 ( -3.573 -18.621 -0.253) 18.962 ======================= Grid point 31 (20/208) ======================= q-point: (-0.50 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 0.000 23.537 -0.000) 23.537 2.517 ( 0.000 0.410 0.000) 0.410 2.841 ( 0.000 3.121 0.000) 3.121 3.136 ( 0.000 4.112 0.000) 4.112 3.357 ( 0.000 12.291 -0.000) 12.291 3.986 ( 0.000 13.788 0.000) 13.788 4.258 ( 0.000 21.256 0.000) 21.256 4.260 ( -0.000 16.013 -0.000) 16.013 4.567 ( 0.000 9.143 0.000) 9.143 4.850 ( 0.000 3.066 -0.000) 3.066 4.937 ( 0.000 4.668 -0.000) 4.668 4.978 ( -0.000 -0.836 0.000) 0.836 5.845 ( 0.000 8.677 -0.000) 8.677 5.977 ( 0.000 14.993 0.000) 14.993 6.589 ( 0.000 -11.765 -0.000) 11.765 6.624 ( 0.000 16.085 0.000) 16.085 6.704 ( 0.000 8.372 -0.000) 8.372 6.931 ( 0.000 14.633 -0.000) 14.633 7.154 ( 0.000 -1.533 0.000) 1.533 7.787 ( 0.000 2.333 0.000) 2.333 8.020 ( 0.000 22.346 0.000) 22.346 8.366 ( 0.000 -18.248 -0.000) 18.248 8.599 ( 0.000 -1.649 -0.000) 1.649 8.831 ( 0.000 -14.841 0.000) 14.841 9.280 ( 0.000 -11.143 0.000) 11.143 10.546 ( 0.000 11.047 0.000) 11.047 10.999 ( 0.000 -27.840 0.000) 27.840 11.009 ( -0.000 -3.238 -0.000) 3.238 11.026 ( 0.000 -2.364 0.000) 2.364 11.433 ( 0.000 12.809 -0.000) 12.809 12.194 ( 0.000 15.074 -0.000) 15.074 12.521 ( 0.000 0.405 0.000) 0.405 12.894 ( 0.000 -10.050 0.000) 10.050 13.028 ( 0.000 3.191 0.000) 3.191 13.351 ( 0.000 -4.453 -0.000) 4.453 13.469 ( 0.000 13.202 0.000) 13.202 13.607 ( 0.000 5.269 -0.000) 5.269 13.799 ( 0.000 4.669 0.000) 4.669 14.079 ( 0.000 -4.503 0.000) 4.503 14.489 ( 0.000 -0.369 0.000) 0.369 14.527 ( -0.000 -3.585 -0.000) 3.585 15.205 ( 0.000 -1.292 -0.000) 1.292 15.534 ( 0.000 -1.058 -0.000) 1.058 15.556 ( -0.000 6.763 0.000) 6.763 15.879 ( 0.000 -6.373 0.000) 6.373 16.624 ( 0.000 0.122 -0.000) 0.122 16.757 ( 0.000 10.932 0.000) 10.932 17.365 ( 0.000 -17.591 -0.000) 17.591 ======================= Grid point 36 (21/208) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 0.000 11.632 0.000) 11.632 2.438 ( 0.000 19.792 0.000) 19.792 2.739 ( 0.000 22.335 0.000) 22.335 3.545 ( 0.000 32.313 0.000) 32.313 3.873 ( 0.000 -3.142 0.000) 3.142 4.122 ( 0.000 14.127 0.000) 14.127 4.286 ( 0.000 20.694 0.000) 20.694 4.354 ( 0.000 0.161 0.000) 0.161 4.550 ( 0.000 10.160 0.000) 10.160 4.666 ( 0.000 34.249 0.000) 34.249 4.884 ( 0.000 3.874 0.000) 3.874 5.098 ( 0.000 2.312 0.000) 2.312 6.149 ( 0.000 -26.657 0.000) 26.657 6.153 ( 0.000 -0.915 0.000) 0.915 6.556 ( 0.000 2.695 0.000) 2.695 6.733 ( 0.000 0.636 0.000) 0.636 6.803 ( 0.000 12.830 0.000) 12.830 7.162 ( 0.000 -0.240 0.000) 0.240 7.261 ( 0.000 -6.942 0.000) 6.942 7.784 ( 0.000 16.055 0.000) 16.055 8.293 ( 0.000 -10.718 0.000) 10.718 8.613 ( 0.000 -2.244 0.000) 2.244 8.721 ( 0.000 18.854 0.000) 18.854 9.004 ( 0.000 15.401 0.000) 15.401 9.361 ( 0.000 -6.843 0.000) 6.843 10.282 ( 0.000 -32.562 0.000) 32.562 10.538 ( 0.000 5.862 0.000) 5.862 10.781 ( 0.000 -17.811 0.000) 17.811 10.858 ( 0.000 -16.667 0.000) 16.667 11.834 ( 0.000 17.004 0.000) 17.004 12.452 ( 0.000 -8.618 0.000) 8.618 12.690 ( 0.000 -3.153 0.000) 3.153 12.808 ( 0.000 -4.655 0.000) 4.655 13.138 ( 0.000 6.001 0.000) 6.001 13.139 ( 0.000 0.055 0.000) 0.055 13.562 ( 0.000 -0.657 0.000) 0.657 13.654 ( 0.000 -1.876 0.000) 1.876 13.982 ( 0.000 13.041 0.000) 13.041 14.063 ( 0.000 2.539 0.000) 2.539 14.402 ( 0.000 -1.527 0.000) 1.527 15.072 ( 0.000 14.759 0.000) 14.759 15.107 ( 0.000 0.433 0.000) 0.433 15.211 ( 0.000 0.672 0.000) 0.672 15.388 ( 0.000 -0.159 0.000) 0.159 15.945 ( 0.000 5.428 0.000) 5.428 16.554 ( 0.000 -0.943 0.000) 0.943 16.565 ( 0.000 6.844 0.000) 6.844 17.142 ( 0.000 -22.602 0.000) 22.602 ======================= Grid point 37 (22/208) ======================= q-point: ( 0.12 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( 4.840 9.432 3.006) 11.019 2.492 ( 4.841 17.469 5.527) 18.951 2.745 ( 0.532 22.003 1.075) 22.035 3.515 ( -2.401 28.589 -0.241) 28.690 3.781 ( -7.549 -1.969 -10.051) 12.723 4.107 ( -2.445 12.483 -0.274) 12.723 4.303 ( 5.667 17.442 1.016) 18.368 4.479 ( 8.310 6.896 4.098) 11.550 4.558 ( 0.838 7.932 4.777) 9.298 4.729 ( 5.200 29.346 0.454) 29.806 4.926 ( 4.114 5.255 1.568) 6.856 5.089 ( -0.766 2.718 -0.614) 2.890 6.101 ( -4.214 -9.857 -2.899) 11.105 6.160 ( 0.558 -14.390 -2.381) 14.596 6.581 ( 1.827 2.351 2.068) 3.625 6.682 ( -5.682 5.940 -0.934) 8.273 6.730 ( -2.711 8.696 -6.306) 11.079 7.255 ( 1.408 0.205 1.539) 2.096 7.275 ( 6.032 -3.006 6.531) 9.385 7.805 ( 2.393 11.768 -0.336) 12.013 8.316 ( 1.219 -6.725 0.159) 6.837 8.604 ( -1.924 6.406 2.127) 7.019 8.630 ( -6.812 6.239 1.485) 9.356 8.967 ( -4.495 16.019 -7.243) 18.146 9.293 ( -5.680 -8.048 -6.997) 12.083 10.285 ( 0.401 -31.934 -0.418) 31.939 10.518 ( -0.425 3.546 -3.400) 4.931 10.796 ( 1.611 -15.693 5.455) 16.692 10.932 ( 5.518 -11.640 1.128) 12.931 11.826 ( -0.750 17.139 -0.844) 17.176 12.452 ( -0.031 -8.181 1.346) 8.291 12.656 ( -4.782 -5.539 -2.375) 7.693 12.763 ( -1.081 3.332 6.506) 7.389 13.047 ( -5.160 -0.536 3.119) 6.053 13.291 ( 8.775 0.933 -5.344) 10.317 13.600 ( 2.375 0.015 1.857) 3.014 13.667 ( 2.488 -1.440 1.253) 3.136 13.938 ( -2.923 10.989 1.399) 11.457 14.139 ( 6.056 3.316 -6.631) 9.573 14.397 ( -0.333 -1.026 -1.003) 1.473 14.870 ( -17.505 10.378 5.157) 20.993 15.127 ( 1.300 -0.322 -1.353) 1.904 15.183 ( -1.661 0.843 -3.685) 4.129 15.428 ( 3.287 0.052 4.012) 5.187 16.014 ( 3.986 4.723 0.454) 6.197 16.527 ( 1.217 2.784 0.340) 3.058 16.672 ( 7.332 5.389 -0.903) 9.144 17.121 ( -2.087 -22.054 -0.052) 22.153 ======================= Grid point 38 (23/208) ======================= q-point: ( 0.25 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 8.077 5.172 3.785) 10.311 2.599 ( 3.690 11.053 6.176) 13.188 2.772 ( 2.548 20.643 4.794) 21.345 3.461 ( -4.511 15.432 -1.522) 16.149 3.625 ( -4.648 6.123 -11.890) 14.159 4.073 ( -0.368 11.311 1.362) 11.399 4.453 ( 8.363 17.983 2.550) 19.996 4.581 ( 1.575 7.449 3.772) 8.496 4.644 ( 6.853 6.962 4.961) 10.956 4.822 ( 4.288 18.447 0.715) 18.953 5.007 ( 2.792 7.296 0.199) 7.815 5.073 ( -0.629 3.087 -1.300) 3.408 5.997 ( -5.443 -6.635 -4.300) 9.599 6.175 ( 1.736 -7.808 -2.179) 8.291 6.542 ( -3.729 8.401 -0.471) 9.204 6.657 ( -2.236 3.818 1.309) 4.614 6.702 ( 3.809 5.264 -3.653) 7.454 7.250 ( -0.605 3.257 -0.226) 3.320 7.413 ( 5.504 5.171 8.543) 11.402 7.872 ( 4.317 3.433 0.780) 5.571 8.255 ( -8.197 10.489 -6.910) 14.999 8.527 ( -0.852 2.277 1.396) 2.803 8.605 ( -1.187 -6.571 9.936) 11.971 8.794 ( -11.125 13.740 -11.586) 21.138 9.164 ( -6.017 -8.536 -10.095) 14.525 10.298 ( 0.990 -31.787 -0.652) 31.809 10.555 ( 5.098 4.577 -0.839) 6.902 10.848 ( 2.386 -11.223 7.319) 13.609 11.021 ( 3.461 -5.502 -2.114) 6.835 11.805 ( -1.240 17.778 -1.028) 17.851 12.455 ( 0.012 -6.893 2.302) 7.267 12.566 ( -3.376 -0.852 2.427) 4.244 12.772 ( -0.180 5.288 -0.393) 5.306 12.966 ( -2.598 -4.078 -0.407) 4.852 13.380 ( 0.180 -2.019 2.945) 3.575 13.648 ( 3.662 0.016 -2.157) 4.250 13.738 ( 2.650 2.554 1.833) 4.111 13.894 ( -2.372 9.305 3.381) 10.180 14.168 ( -5.153 1.452 -2.601) 5.952 14.393 ( 0.053 0.614 -0.694) 0.928 14.605 ( -6.139 3.521 -1.638) 7.264 15.141 ( 1.073 -2.345 -4.731) 5.388 15.188 ( 3.158 0.674 -2.518) 4.094 15.500 ( 3.128 -1.830 5.686) 6.743 16.018 ( -4.154 0.500 4.317) 6.012 16.599 ( 5.430 5.651 -0.315) 7.843 16.814 ( 7.267 7.209 -1.877) 10.407 17.075 ( -2.353 -19.700 -0.055) 19.840 ======================= Grid point 39 (24/208) ======================= q-point: ( 0.38 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.295 ( 9.381 2.975 2.519) 10.159 2.599 ( -4.020 6.405 1.932) 7.805 2.870 ( 5.482 13.761 8.922) 17.292 3.322 ( -7.393 4.158 -7.994) 11.655 3.605 ( 1.879 14.860 -4.092) 15.527 4.103 ( 2.752 8.397 2.522) 9.189 4.584 ( 2.633 17.829 10.223) 20.720 4.609 ( 2.794 9.649 -5.426) 11.417 4.759 ( 4.398 10.110 2.921) 11.406 4.883 ( 1.768 6.544 2.044) 7.080 5.011 ( -1.713 6.623 -4.308) 8.084 5.057 ( -0.599 4.368 -0.974) 4.515 5.913 ( -2.534 -7.287 -2.230) 8.031 6.221 ( 3.047 2.813 -1.262) 4.335 6.496 ( -1.925 9.461 0.453) 9.665 6.604 ( -1.789 0.445 -0.214) 1.855 6.795 ( 4.777 3.978 -0.317) 6.224 7.237 ( -0.709 9.387 0.133) 9.415 7.506 ( 3.122 15.461 6.500) 17.060 7.932 ( 0.082 0.685 -2.620) 2.709 8.085 ( -5.134 7.987 -2.580) 9.839 8.516 ( -7.384 7.745 -10.368) 14.900 8.555 ( -0.101 -1.438 10.951) 11.046 8.639 ( -1.934 -0.318 -1.319) 2.363 9.048 ( -4.179 -11.586 -8.127) 14.756 10.315 ( 0.780 -32.409 -0.445) 32.421 10.688 ( 7.621 7.656 2.631) 11.119 10.900 ( 1.985 -7.688 5.558) 9.692 11.044 ( -0.472 -1.113 -4.986) 5.131 11.782 ( -0.864 18.904 -0.666) 18.936 12.460 ( 0.152 -6.067 1.467) 6.244 12.542 ( -0.058 7.856 1.762) 8.051 12.734 ( -2.955 0.233 -1.671) 3.402 12.976 ( 3.850 -3.766 -5.025) 7.365 13.317 ( -7.559 -5.490 10.513) 14.064 13.699 ( 0.321 2.977 -2.040) 3.623 13.751 ( -0.303 6.976 -1.948) 7.249 13.845 ( -1.888 5.813 3.177) 6.888 14.023 ( -6.064 -4.348 1.070) 7.538 14.422 ( 2.795 0.243 4.926) 5.669 14.585 ( 0.729 4.501 -9.496) 10.534 15.162 ( 1.381 -1.850 -3.173) 3.925 15.288 ( 7.552 -5.147 -4.739) 10.295 15.563 ( 2.930 -2.689 6.276) 7.430 15.895 ( -8.899 -3.910 4.199) 10.588 16.692 ( 3.900 7.572 -0.161) 8.519 16.910 ( 2.678 2.743 -1.252) 4.033 17.052 ( 0.196 -11.330 -0.273) 11.335 ======================= Grid point 40 (25/208) ======================= q-point: (-0.50 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( 0.000 8.632 0.000) 8.632 2.503 ( -0.000 -2.113 -0.000) 2.113 2.945 ( 0.000 9.032 -0.000) 9.032 3.229 ( 0.000 5.734 0.000) 5.734 3.626 ( 0.000 14.373 -0.000) 14.373 4.143 ( 0.000 5.633 0.000) 5.633 4.594 ( 0.000 11.183 -0.000) 11.183 4.652 ( 0.000 20.699 0.000) 20.699 4.806 ( 0.000 11.372 -0.000) 11.372 4.899 ( 0.000 1.547 0.000) 1.547 4.976 ( -0.000 3.475 -0.000) 3.475 5.052 ( 0.000 6.797 -0.000) 6.797 5.890 ( 0.000 -9.758 -0.000) 9.758 6.256 ( 0.000 10.646 0.000) 10.646 6.469 ( 0.000 8.587 -0.000) 8.587 6.595 ( 0.000 -4.267 0.000) 4.267 6.846 ( 0.000 3.877 -0.000) 3.877 7.229 ( 0.000 12.314 -0.000) 12.314 7.545 ( 0.000 25.107 0.000) 25.107 7.888 ( 0.000 5.136 0.000) 5.136 8.072 ( 0.000 -6.665 0.000) 6.665 8.408 ( 0.000 13.777 -0.000) 13.777 8.592 ( -0.000 1.585 -0.000) 1.585 8.608 ( 0.000 -4.465 0.000) 4.465 9.000 ( 0.000 -14.707 0.000) 14.707 10.322 ( 0.000 -32.573 0.000) 32.573 10.779 ( 0.000 7.482 0.000) 7.482 10.935 ( -0.000 -4.322 -0.000) 4.322 11.014 ( 0.000 -0.141 0.000) 0.141 11.773 ( 0.000 19.537 -0.000) 19.537 12.463 ( 0.000 -7.138 0.000) 7.138 12.548 ( 0.000 18.601 -0.000) 18.601 12.697 ( 0.000 -7.703 -0.000) 7.703 13.044 ( 0.000 -0.270 0.000) 0.270 13.207 ( 0.000 -10.281 -0.000) 10.281 13.684 ( -0.000 2.295 -0.000) 2.295 13.737 ( 0.000 11.346 0.000) 11.346 13.862 ( 0.000 3.229 0.000) 3.229 13.959 ( 0.000 -6.944 0.000) 6.944 14.470 ( 0.000 -1.883 0.000) 1.883 14.571 ( 0.000 8.038 -0.000) 8.038 15.173 ( 0.000 -1.351 -0.000) 1.351 15.377 ( 0.000 -9.200 -0.000) 9.200 15.627 ( 0.000 -0.040 0.000) 0.040 15.767 ( -0.000 -7.667 0.000) 7.667 16.730 ( 0.000 8.218 0.000) 8.218 16.926 ( 0.000 -3.283 0.000) 3.283 17.061 ( 0.000 -3.748 0.000) 3.748 ======================= Grid point 45 (26/208) ======================= q-point: ( 0.00 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( 0.000 10.527 0.000) 10.527 2.738 ( 0.000 10.280 0.000) 10.280 3.116 ( 0.000 15.514 0.000) 15.514 3.768 ( 0.000 -5.859 0.000) 5.859 4.127 ( 0.000 21.365 0.000) 21.365 4.345 ( 0.000 1.211 0.000) 1.211 4.347 ( 0.000 8.493 0.000) 8.493 4.696 ( 0.000 19.646 0.000) 19.646 4.786 ( 0.000 14.599 0.000) 14.599 4.938 ( 0.000 3.485 0.000) 3.485 5.150 ( 0.000 2.559 0.000) 2.559 5.256 ( 0.000 23.738 0.000) 23.738 5.679 ( 0.000 -19.748 0.000) 19.748 6.138 ( 0.000 -0.901 0.000) 0.901 6.480 ( 0.000 -10.366 0.000) 10.366 6.712 ( 0.000 -3.149 0.000) 3.149 7.115 ( 0.000 16.013 0.000) 16.013 7.204 ( 0.000 4.375 0.000) 4.375 7.228 ( 0.000 6.761 0.000) 6.761 8.066 ( 0.000 -8.378 0.000) 8.378 8.095 ( 0.000 12.516 0.000) 12.516 8.504 ( 0.000 -4.747 0.000) 4.747 9.046 ( 0.000 -3.820 0.000) 3.820 9.217 ( 0.000 21.711 0.000) 21.711 9.352 ( 0.000 -4.897 0.000) 4.897 9.731 ( 0.000 -17.756 0.000) 17.756 10.393 ( 0.000 -15.454 0.000) 15.454 10.528 ( 0.000 -16.196 0.000) 16.196 10.655 ( 0.000 2.073 0.000) 2.073 12.181 ( 0.000 16.911 0.000) 16.911 12.211 ( 0.000 -13.893 0.000) 13.893 12.589 ( 0.000 -5.785 0.000) 5.785 12.799 ( 0.000 2.276 0.000) 2.276 13.179 ( 0.000 3.464 0.000) 3.464 13.246 ( 0.000 4.080 0.000) 4.080 13.561 ( 0.000 0.536 0.000) 0.536 13.617 ( 0.000 -1.581 0.000) 1.581 14.112 ( 0.000 2.512 0.000) 2.512 14.197 ( 0.000 8.344 0.000) 8.344 14.369 ( 0.000 -1.436 0.000) 1.436 15.135 ( 0.000 2.582 0.000) 2.582 15.243 ( 0.000 2.255 0.000) 2.255 15.243 ( 0.000 0.727 0.000) 0.727 15.478 ( 0.000 11.088 0.000) 11.088 16.008 ( 0.000 0.625 0.000) 0.625 16.528 ( 0.000 -1.449 0.000) 1.449 16.654 ( 0.000 1.850 0.000) 1.850 16.718 ( 0.000 -19.364 0.000) 19.364 ======================= Grid point 46 (27/208) ======================= q-point: ( 0.12 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 1.219 8.915 2.302) 9.288 2.747 ( 0.216 7.912 3.709) 8.741 3.118 ( 0.091 15.380 1.330) 15.438 3.688 ( -6.894 -4.063 -7.223) 10.780 4.069 ( -4.924 22.748 -2.053) 23.365 4.276 ( -2.416 4.141 0.849) 4.869 4.476 ( 7.731 5.050 1.643) 9.379 4.693 ( -0.127 9.198 -1.390) 9.303 4.793 ( 1.076 15.092 4.982) 15.929 4.976 ( 2.761 7.109 3.452) 8.371 5.153 ( 0.393 3.368 -1.520) 3.716 5.273 ( 0.857 18.608 2.296) 18.769 5.715 ( 3.496 -14.296 -2.357) 14.905 6.134 ( -0.034 -0.423 -1.076) 1.157 6.483 ( 0.085 -11.378 1.352) 11.459 6.707 ( -0.243 -1.174 3.720) 3.908 7.058 ( -2.671 18.994 -5.303) 19.901 7.275 ( 5.881 5.651 -1.858) 8.365 7.307 ( 5.917 4.660 7.406) 10.563 8.007 ( -2.390 2.968 -5.884) 7.010 8.156 ( 2.501 -0.936 3.849) 4.684 8.499 ( -0.930 -4.171 6.274) 7.591 8.986 ( -5.384 3.108 -0.874) 6.278 9.169 ( -5.950 9.762 -11.453) 16.182 9.262 ( -6.759 4.615 -9.618) 12.629 9.714 ( -0.833 -22.628 -2.544) 22.786 10.428 ( 2.465 -13.530 3.509) 14.193 10.543 ( 5.552 -7.705 -6.390) 11.447 10.781 ( 8.445 -2.992 13.213) 15.964 12.173 ( -0.704 15.008 -0.803) 15.046 12.211 ( -0.050 -12.171 1.186) 12.228 12.581 ( -0.650 -3.861 -2.808) 4.818 12.775 ( -1.328 0.321 2.902) 3.208 13.106 ( -6.465 4.965 9.386) 12.432 13.320 ( 4.868 1.471 -5.940) 7.820 13.598 ( 1.995 -0.175 0.484) 2.060 13.638 ( 3.523 -1.235 3.553) 5.154 14.107 ( -0.482 6.013 -2.858) 6.675 14.229 ( 3.159 5.457 -4.272) 7.617 14.376 ( 1.183 -1.067 -1.366) 2.098 15.036 ( -19.851 5.189 2.273) 20.643 15.138 ( 0.247 2.655 -0.606) 2.735 15.235 ( -1.699 3.307 -1.713) 4.094 15.432 ( -0.845 1.677 2.695) 3.285 16.043 ( -0.454 -1.838 2.085) 2.817 16.580 ( 5.897 3.048 -0.397) 6.650 16.679 ( -0.434 -15.525 0.251) 15.533 16.781 ( 8.721 -1.563 -1.806) 9.042 ======================= Grid point 47 (28/208) ======================= q-point: ( 0.25 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( 3.312 4.819 3.418) 6.773 2.732 ( -3.258 1.841 4.212) 5.634 3.127 ( 0.588 14.839 3.631) 15.288 3.530 ( -7.364 0.229 -9.699) 12.180 3.976 ( -3.888 20.503 -3.116) 21.099 4.250 ( -0.487 6.509 1.708) 6.747 4.613 ( 5.574 2.457 0.982) 6.170 4.721 ( 4.011 3.976 2.202) 6.062 4.827 ( 1.276 6.992 4.017) 8.164 5.027 ( 1.504 10.146 2.493) 10.556 5.157 ( 0.420 4.613 -2.048) 5.065 5.275 ( -1.152 13.198 3.802) 13.783 5.750 ( -0.794 -8.446 -2.786) 8.929 6.158 ( 3.480 0.012 -2.259) 4.149 6.496 ( 1.350 -8.927 3.055) 9.531 6.725 ( 1.057 1.144 4.252) 4.528 7.029 ( 0.381 23.901 -3.356) 24.138 7.399 ( 6.961 10.745 -1.600) 12.902 7.430 ( 5.590 -0.628 7.107) 9.064 7.972 ( -0.492 4.209 -5.355) 6.829 8.174 ( -1.111 -6.211 0.986) 6.386 8.502 ( 0.050 -2.676 11.306) 11.619 8.878 ( -5.107 9.820 -2.184) 11.282 8.943 ( -12.890 0.858 -17.585) 21.820 9.119 ( -7.281 12.260 -12.797) 19.159 9.705 ( 0.092 -27.193 -1.317) 27.225 10.517 ( 6.108 -10.792 3.661) 12.930 10.687 ( 9.364 -1.358 -0.952) 9.509 10.953 ( 7.181 -1.873 8.641) 11.391 12.158 ( -0.540 13.929 -1.016) 13.976 12.213 ( -0.038 -11.404 1.571) 11.512 12.569 ( 0.389 -0.051 -2.009) 2.047 12.785 ( 1.835 -4.586 0.384) 4.954 12.996 ( -6.219 6.570 7.948) 12.042 13.343 ( -2.219 -1.234 -1.300) 2.852 13.639 ( 3.265 -0.767 -2.269) 4.049 13.739 ( 4.469 -1.380 6.752) 8.214 14.085 ( -1.412 9.012 -0.914) 9.167 14.219 ( -7.629 3.476 -0.966) 8.439 14.409 ( 0.743 0.450 -0.602) 1.057 14.691 ( -8.314 4.620 -8.661) 12.864 15.138 ( 0.006 2.380 -1.396) 2.759 15.214 ( -0.139 1.819 -0.595) 1.919 15.445 ( 1.000 -2.720 3.846) 4.815 15.959 ( -8.415 -5.772 5.153) 11.432 16.655 ( -0.967 -16.594 0.089) 16.623 16.718 ( 7.100 3.878 -0.397) 8.100 16.976 ( 10.763 4.879 -2.379) 12.054 ======================= Grid point 48 (29/208) ======================= q-point: ( 0.38 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( 6.222 -0.028 3.048) 6.928 2.627 ( -7.999 -3.026 1.409) 8.667 3.153 ( 1.254 13.221 4.944) 14.170 3.405 ( -4.138 4.742 -7.912) 10.110 3.922 ( -1.405 16.032 -2.297) 16.256 4.260 ( 0.943 7.710 1.674) 7.946 4.681 ( 2.146 0.739 1.161) 2.549 4.834 ( 5.248 2.898 1.313) 6.137 4.850 ( 1.247 -0.194 3.169) 3.411 5.027 ( -1.148 10.612 0.349) 10.680 5.164 ( 0.398 4.149 -2.170) 4.699 5.256 ( -1.175 16.360 3.511) 16.774 5.685 ( -4.168 -9.083 -2.236) 10.241 6.231 ( 3.260 -3.959 -0.455) 5.149 6.557 ( 4.683 0.133 1.430) 4.898 6.731 ( -1.597 3.677 2.330) 4.637 7.055 ( 2.186 25.094 -0.576) 25.196 7.507 ( 4.199 15.039 0.265) 15.617 7.537 ( 4.509 -5.002 4.587) 8.148 7.956 ( -0.720 2.085 -4.498) 5.010 8.138 ( -1.811 -4.126 -1.382) 4.713 8.539 ( 1.163 -1.240 15.221) 15.316 8.705 ( -8.103 2.625 -11.871) 14.611 8.796 ( -3.274 5.225 -6.464) 8.934 8.955 ( -7.011 16.899 -10.652) 21.171 9.708 ( 0.269 -29.082 -0.488) 29.087 10.625 ( 3.744 -12.240 4.276) 13.496 10.878 ( 10.152 5.056 0.565) 11.356 11.058 ( 2.672 1.918 2.090) 3.897 12.154 ( 0.225 15.958 -0.797) 15.979 12.215 ( -0.027 -13.636 1.233) 13.692 12.603 ( 3.286 1.651 -1.986) 4.179 12.840 ( 4.397 -8.419 -3.700) 10.193 12.912 ( -3.277 9.236 4.583) 10.819 13.233 ( -9.919 -1.764 6.029) 11.741 13.700 ( 2.781 -1.347 -2.449) 3.943 13.791 ( -0.138 -0.972 4.146) 4.261 13.949 ( -13.655 -0.551 0.737) 13.686 14.057 ( -1.401 9.996 -0.179) 10.096 14.427 ( 1.736 0.359 3.758) 4.156 14.716 ( 6.140 7.411 -14.405) 17.325 15.149 ( 1.693 1.021 -2.363) 3.081 15.222 ( 0.738 -1.361 0.322) 1.581 15.480 ( 2.455 -4.728 4.085) 6.713 15.774 ( -11.308 -7.700 4.919) 14.538 16.640 ( -0.466 -16.882 0.022) 16.889 16.830 ( 4.387 5.209 -0.156) 6.812 17.139 ( 6.380 7.361 -1.550) 9.863 ======================= Grid point 49 (30/208) ======================= q-point: (-0.50 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.437 ( 0.000 -4.147 0.000) 4.147 2.484 ( -0.000 -2.426 -0.000) 2.426 3.174 ( 0.000 11.971 -0.000) 11.971 3.357 ( 0.000 6.660 0.000) 6.660 3.909 ( 0.000 13.841 -0.000) 13.841 4.274 ( 0.000 7.767 0.000) 7.767 4.703 ( 0.000 0.492 -0.000) 0.492 4.855 ( -0.000 -0.604 -0.000) 0.604 4.897 ( 0.000 -1.410 0.000) 1.410 5.022 ( -0.000 13.962 -0.000) 13.962 5.157 ( 0.000 2.120 -0.000) 2.120 5.249 ( -0.000 19.424 0.000) 19.424 5.637 ( 0.000 -10.378 0.000) 10.378 6.261 ( 0.000 -6.901 -0.000) 6.901 6.637 ( 0.000 4.973 0.000) 4.973 6.687 ( 0.000 5.746 -0.000) 5.746 7.080 ( 0.000 24.086 0.000) 24.086 7.548 ( 0.000 17.311 0.000) 17.311 7.590 ( 0.000 -8.303 -0.000) 8.303 7.939 ( 0.000 0.265 0.000) 0.265 8.120 ( 0.000 -0.057 -0.000) 0.057 8.548 ( 0.000 2.732 0.000) 2.732 8.659 ( 0.000 3.035 0.000) 3.035 8.730 ( -0.000 -8.057 -0.000) 8.057 8.875 ( 0.000 26.206 0.000) 26.206 9.710 ( 0.000 -29.656 0.000) 29.656 10.663 ( 0.000 -12.678 0.000) 12.678 11.007 ( -0.000 5.373 0.000) 5.373 11.063 ( 0.000 5.563 -0.000) 5.563 12.157 ( 0.000 18.031 -0.000) 18.031 12.215 ( -0.000 -15.747 0.000) 15.747 12.644 ( 0.000 1.096 0.000) 1.096 12.868 ( 0.000 7.704 -0.000) 7.704 12.964 ( -0.000 -8.307 0.000) 8.307 13.052 ( 0.000 1.159 0.000) 1.159 13.703 ( 0.000 -0.047 0.000) 0.047 13.796 ( -0.000 -1.400 0.000) 1.400 13.832 ( 0.000 -5.413 -0.000) 5.413 14.043 ( 0.000 11.060 0.000) 11.060 14.454 ( 0.000 0.032 0.000) 0.032 14.766 ( 0.000 10.812 -0.000) 10.812 15.172 ( 0.000 1.614 -0.000) 1.614 15.232 ( 0.000 -5.322 0.000) 5.322 15.560 ( 0.000 -6.127 0.000) 6.127 15.604 ( -0.000 -7.724 0.000) 7.724 16.637 ( 0.000 -16.543 0.000) 16.543 16.873 ( 0.000 5.330 0.000) 5.330 17.199 ( 0.000 8.082 0.000) 8.082 ======================= Grid point 54 (31/208) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( 0.000 9.143 0.000) 9.143 2.846 ( 0.000 1.028 0.000) 1.028 3.348 ( 0.000 7.850 0.000) 7.850 3.657 ( 0.000 -4.452 0.000) 4.452 4.238 ( 0.000 -1.569 0.000) 1.569 4.462 ( 0.000 3.391 0.000) 3.391 4.518 ( 0.000 8.595 0.000) 8.595 5.005 ( 0.000 8.954 0.000) 8.954 5.023 ( 0.000 6.129 0.000) 6.129 5.119 ( 0.000 10.677 0.000) 10.677 5.223 ( 0.000 10.366 0.000) 10.366 5.394 ( 0.000 -7.625 0.000) 7.625 5.623 ( 0.000 13.157 0.000) 13.157 6.109 ( 0.000 -1.428 0.000) 1.428 6.198 ( 0.000 -16.735 0.000) 16.735 6.636 ( 0.000 -3.986 0.000) 3.986 7.278 ( 0.000 4.995 0.000) 4.995 7.286 ( 0.000 3.098 0.000) 3.098 7.584 ( 0.000 20.681 0.000) 20.681 7.994 ( 0.000 0.253 0.000) 0.253 8.247 ( 0.000 4.770 0.000) 4.770 8.434 ( 0.000 -2.458 0.000) 2.458 8.938 ( 0.000 -23.003 0.000) 23.003 9.074 ( 0.000 0.926 0.000) 0.926 9.458 ( 0.000 2.529 0.000) 2.529 9.651 ( 0.000 1.440 0.000) 1.440 10.218 ( 0.000 -1.395 0.000) 1.395 10.240 ( 0.000 -12.062 0.000) 12.062 10.675 ( 0.000 0.084 0.000) 0.084 11.964 ( 0.000 -9.763 0.000) 9.763 12.431 ( 0.000 3.938 0.000) 3.938 12.519 ( 0.000 2.602 0.000) 2.602 12.852 ( 0.000 2.365 0.000) 2.365 13.253 ( 0.000 3.413 0.000) 3.413 13.295 ( 0.000 1.158 0.000) 1.158 13.576 ( 0.000 0.718 0.000) 0.718 13.594 ( 0.000 -0.778 0.000) 0.778 14.160 ( 0.000 2.070 0.000) 2.070 14.291 ( 0.000 0.940 0.000) 0.940 14.372 ( 0.000 2.030 0.000) 2.030 15.202 ( 0.000 3.653 0.000) 3.653 15.224 ( 0.000 -1.075 0.000) 1.075 15.290 ( 0.000 2.195 0.000) 2.195 15.698 ( 0.000 9.141 0.000) 9.141 15.984 ( 0.000 -2.197 0.000) 2.197 16.371 ( 0.000 -12.496 0.000) 12.496 16.534 ( 0.000 -0.442 0.000) 0.442 16.649 ( 0.000 -1.698 0.000) 1.698 ======================= Grid point 55 (32/208) ======================= q-point: ( 0.12 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( -1.240 8.501 1.816) 8.781 2.804 ( -4.554 -1.543 0.610) 4.847 3.348 ( -0.118 7.781 1.355) 7.899 3.619 ( -3.058 -2.364 -5.058) 6.366 4.257 ( 1.556 -0.402 3.402) 3.763 4.443 ( -1.766 9.971 -1.248) 10.203 4.563 ( 3.532 3.473 1.911) 5.309 4.866 ( -9.236 7.200 -2.826) 12.047 4.953 ( -4.740 3.492 -0.515) 5.910 5.151 ( 0.722 2.426 -2.070) 3.270 5.258 ( 1.963 10.853 1.540) 11.136 5.437 ( 2.527 2.942 12.645) 13.226 5.683 ( 4.194 5.913 -4.566) 8.567 6.099 ( -0.126 -5.351 3.896) 6.620 6.256 ( 5.777 -6.309 -3.951) 9.423 6.633 ( 0.206 -5.645 2.422) 6.146 7.281 ( 1.380 3.690 3.119) 5.025 7.381 ( 8.324 4.821 -3.739) 10.320 7.600 ( 1.481 20.291 1.659) 20.412 8.011 ( 1.664 1.450 0.398) 2.243 8.214 ( -3.239 4.278 -1.365) 5.537 8.440 ( 0.219 -2.042 4.753) 5.178 8.924 ( -1.761 -19.724 -2.922) 20.017 9.037 ( -2.897 -0.672 -10.973) 11.369 9.310 ( -9.970 -5.424 -14.662) 18.542 9.659 ( -2.098 11.085 2.347) 11.524 10.175 ( 1.320 -10.924 9.166) 14.321 10.433 ( 14.097 -2.746 -8.944) 16.919 10.752 ( 6.487 -0.854 11.634) 13.348 11.957 ( -0.828 -10.009 1.250) 10.120 12.431 ( 0.151 5.018 -0.824) 5.087 12.520 ( 0.263 1.442 -1.311) 1.967 12.802 ( -3.957 1.668 -0.349) 4.308 13.202 ( -5.325 4.194 10.574) 12.560 13.337 ( 2.454 0.309 -3.843) 4.570 13.593 ( 0.975 -0.340 -1.236) 1.610 13.621 ( 3.453 -0.496 5.504) 6.517 14.200 ( 3.620 3.740 -6.774) 8.542 14.309 ( 2.152 1.003 -2.599) 3.520 14.367 ( 0.109 1.078 -0.281) 1.119 15.090 ( -14.571 1.354 0.468) 14.642 15.216 ( 0.198 4.099 0.401) 4.124 15.286 ( -1.023 1.772 -0.243) 2.061 15.506 ( -10.713 4.671 1.030) 11.732 15.972 ( -4.473 -4.136 2.843) 6.723 16.361 ( -1.135 -13.023 0.015) 13.072 16.645 ( 8.033 3.036 -0.671) 8.614 16.776 ( 13.460 -1.099 -1.651) 13.605 ======================= Grid point 56 (33/208) ======================= q-point: ( 0.25 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -1.162 6.211 2.525) 6.805 2.681 ( -8.253 -5.976 0.295) 10.194 3.350 ( 0.002 7.572 3.135) 8.195 3.549 ( -2.917 1.310 -7.071) 7.760 4.288 ( -0.490 5.836 0.966) 5.936 4.386 ( -2.699 12.180 1.322) 12.545 4.619 ( 1.479 -1.205 1.192) 2.249 4.768 ( -0.423 -0.662 1.129) 1.375 4.880 ( -2.248 1.551 -0.241) 2.742 5.146 ( -0.514 -0.333 -2.243) 2.325 5.271 ( -0.733 9.040 1.711) 9.230 5.504 ( 2.288 8.443 9.651) 13.026 5.688 ( -3.140 -1.707 -2.484) 4.353 6.129 ( 2.089 -1.303 5.240) 5.789 6.399 ( 9.754 1.121 -5.402) 11.206 6.666 ( 2.539 -6.900 4.093) 8.415 7.331 ( 3.229 1.457 2.398) 4.278 7.545 ( 7.560 9.898 -0.916) 12.488 7.646 ( 4.105 16.687 0.331) 17.188 8.050 ( 1.991 4.112 0.161) 4.571 8.130 ( -4.808 3.833 -2.972) 6.830 8.459 ( 0.645 -1.718 10.527) 10.686 8.833 ( -6.929 -9.598 -10.608) 15.895 8.928 ( -5.819 -0.804 -20.223) 21.059 9.151 ( -3.837 -19.636 -5.225) 20.678 9.587 ( -4.671 19.542 -0.555) 20.100 10.260 ( 4.606 -13.739 8.762) 16.933 10.716 ( 17.068 2.899 -8.539) 19.304 10.920 ( 8.379 -1.723 12.373) 15.042 11.941 ( -0.962 -10.650 1.609) 10.814 12.434 ( 0.312 7.409 -0.778) 7.456 12.529 ( 1.266 -1.515 -2.596) 3.262 12.740 ( -2.400 0.276 0.941) 2.593 13.115 ( -5.313 4.705 11.641) 13.634 13.326 ( -2.753 -0.643 -4.567) 5.371 13.622 ( 2.487 -0.803 -2.311) 3.488 13.711 ( 3.806 -1.141 7.489) 8.478 14.225 ( -1.027 5.169 -1.043) 5.373 14.293 ( -6.920 3.167 -1.107) 7.690 14.401 ( 1.456 -0.996 0.565) 1.853 14.772 ( -8.430 3.185 -13.183) 15.969 15.221 ( -0.135 4.957 2.120) 5.393 15.255 ( -1.717 2.125 -0.411) 2.763 15.413 ( -1.645 -0.407 2.008) 2.627 15.829 ( -10.779 -6.170 6.253) 13.905 16.342 ( -0.677 -12.979 -0.249) 12.999 16.787 ( 7.097 2.030 -0.870) 7.432 17.050 ( 13.813 2.483 -1.805) 14.150 ======================= Grid point 57 (34/208) ======================= q-point: ( 0.38 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( 0.901 1.802 2.091) 2.903 2.520 ( -8.105 -6.779 -0.408) 10.574 3.359 ( 0.315 7.197 3.801) 8.145 3.493 ( -1.777 3.541 -5.922) 7.126 4.211 ( -4.585 12.359 -2.554) 13.427 4.405 ( 2.033 6.710 4.075) 8.110 4.629 ( -0.092 -5.026 0.565) 5.059 4.801 ( 2.202 -3.605 1.283) 4.414 4.869 ( 0.450 1.453 0.231) 1.538 5.136 ( -0.024 -1.355 -1.569) 2.073 5.251 ( -1.359 7.497 2.141) 7.915 5.546 ( 0.486 7.128 6.384) 9.581 5.599 ( -4.189 0.293 -3.361) 5.378 6.177 ( 1.771 2.681 3.611) 4.834 6.563 ( 7.384 -0.975 -2.999) 8.029 6.723 ( 2.264 -3.171 2.770) 4.780 7.399 ( 3.151 -3.256 2.236) 5.052 7.610 ( 0.729 20.061 1.601) 20.138 7.773 ( 7.241 9.677 -2.171) 12.280 8.022 ( -3.885 8.281 -4.362) 10.134 8.092 ( 0.720 1.431 0.915) 1.845 8.505 ( 1.932 -1.853 17.108) 17.316 8.676 ( -6.208 -3.041 -11.282) 13.231 8.777 ( -6.054 -1.598 -20.999) 21.912 9.123 ( 0.163 -27.025 -0.189) 27.026 9.507 ( -3.362 25.865 -0.652) 26.091 10.342 ( 2.676 -15.866 4.725) 16.769 10.990 ( 9.891 4.946 2.190) 11.274 11.098 ( 9.912 2.280 -0.260) 10.174 11.929 ( -0.483 -11.409 1.054) 11.468 12.440 ( 0.356 9.397 -0.233) 9.407 12.570 ( 3.805 -6.468 -3.924) 8.468 12.709 ( -1.412 -0.514 1.656) 2.236 13.059 ( -1.882 4.707 8.864) 10.211 13.236 ( -5.992 1.197 -1.939) 6.410 13.671 ( 2.756 -1.323 -2.431) 3.906 13.761 ( 0.343 -1.434 4.787) 5.009 13.948 ( -19.623 0.376 1.239) 19.665 14.227 ( -0.839 6.267 0.730) 6.365 14.435 ( 2.066 0.333 3.226) 3.846 14.836 ( 11.751 4.158 -22.209) 25.468 15.202 ( -2.683 3.364 5.836) 7.251 15.238 ( -0.082 2.986 -0.630) 3.053 15.404 ( -0.024 -2.570 3.135) 4.054 15.619 ( -11.507 -6.954 5.924) 14.693 16.335 ( -0.071 -12.964 -0.266) 12.967 16.896 ( 4.319 1.652 -0.575) 4.660 17.253 ( 7.582 3.923 -1.080) 8.605 ======================= Grid point 58 (35/208) ======================= q-point: (-0.50 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( 0.000 -3.319 0.000) 3.319 2.415 ( -0.000 -3.477 -0.000) 3.477 3.368 ( 0.000 6.995 -0.000) 6.995 3.469 ( 0.000 4.204 0.000) 4.204 4.162 ( 0.000 11.484 -0.000) 11.484 4.431 ( 0.000 7.204 0.000) 7.204 4.628 ( 0.000 -7.090 -0.000) 7.090 4.826 ( 0.000 -1.793 -0.000) 1.793 4.875 ( 0.000 -0.528 -0.000) 0.528 5.137 ( 0.000 -2.490 -0.000) 2.490 5.238 ( 0.000 7.412 -0.000) 7.412 5.533 ( 0.000 -1.451 0.000) 1.451 5.573 ( 0.000 10.240 -0.000) 10.240 6.198 ( 0.000 3.985 -0.000) 3.985 6.635 ( 0.000 -5.562 -0.000) 5.562 6.747 ( -0.000 1.773 0.000) 1.773 7.435 ( 0.000 -6.966 -0.000) 6.966 7.615 ( 0.000 22.105 -0.000) 22.105 7.845 ( 0.000 10.707 -0.000) 10.707 7.978 ( 0.000 9.782 0.000) 9.782 8.099 ( 0.000 0.030 0.000) 0.030 8.575 ( 0.000 0.121 0.000) 0.121 8.589 ( -0.000 -4.553 -0.000) 4.553 8.677 ( 0.000 -0.618 -0.000) 0.618 9.128 ( 0.000 -29.281 0.000) 29.281 9.472 ( 0.000 28.978 -0.000) 28.978 10.372 ( 0.000 -16.628 0.000) 16.628 11.075 ( 0.000 1.784 0.000) 1.784 11.218 ( 0.000 8.738 -0.000) 8.738 11.926 ( 0.000 -11.786 0.000) 11.786 12.444 ( 0.000 9.921 -0.000) 9.921 12.628 ( 0.000 -13.560 -0.000) 13.560 12.687 ( -0.000 2.358 0.000) 2.358 13.078 ( -0.000 1.172 -0.000) 1.172 13.132 ( 0.000 8.495 0.000) 8.495 13.693 ( 0.000 -0.668 0.000) 0.668 13.749 ( -0.000 -2.991 0.000) 2.991 13.762 ( 0.000 -1.565 -0.000) 1.565 14.220 ( 0.000 6.361 0.000) 6.361 14.462 ( 0.000 0.530 0.000) 0.530 14.971 ( 0.000 9.220 -0.000) 9.220 15.162 ( -0.000 -1.999 0.000) 1.999 15.237 ( 0.000 4.006 -0.000) 4.006 15.418 ( 0.000 -6.771 0.000) 6.771 15.485 ( -0.000 -4.053 0.000) 4.053 16.335 ( 0.000 -12.989 0.000) 12.989 16.938 ( 0.000 1.565 0.000) 1.565 17.324 ( 0.000 4.320 0.000) 4.320 ======================= Grid point 63 (36/208) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( 0.000 -0.000 0.000) 0.000 2.835 ( 0.000 0.000 0.000) 0.000 3.426 ( 0.000 0.000 0.000) 0.000 3.612 ( 0.000 0.000 0.000) 0.000 4.218 ( 0.000 0.000 0.000) 0.000 4.493 ( 0.000 0.000 0.000) 0.000 4.600 ( 0.000 -0.000 0.000) 0.000 5.090 ( 0.000 -0.000 0.000) 0.000 5.091 ( 0.000 0.000 0.000) 0.000 5.163 ( 0.000 0.000 0.000) 0.000 5.273 ( 0.000 0.000 0.000) 0.000 5.535 ( 0.000 -0.000 0.000) 0.000 5.759 ( 0.000 0.000 0.000) 0.000 5.939 ( 0.000 0.000 0.000) 0.000 6.098 ( 0.000 0.000 0.000) 0.000 6.585 ( 0.000 0.000 0.000) 0.000 7.318 ( 0.000 0.000 0.000) 0.000 7.332 ( 0.000 0.000 0.000) 0.000 7.826 ( 0.000 -0.000 0.000) 0.000 8.010 ( 0.000 0.000 0.000) 0.000 8.408 ( 0.000 0.000 0.000) 0.000 8.447 ( 0.000 0.000 0.000) 0.000 8.482 ( 0.000 0.000 0.000) 0.000 9.126 ( 0.000 0.000 0.000) 0.000 9.450 ( 0.000 0.000 0.000) 0.000 9.672 ( 0.000 0.000 0.000) 0.000 10.104 ( 0.000 0.000 0.000) 0.000 10.232 ( 0.000 0.000 0.000) 0.000 10.673 ( 0.000 0.000 0.000) 0.000 11.862 ( 0.000 0.000 0.000) 0.000 12.425 ( 0.000 0.000 0.000) 0.000 12.592 ( 0.000 0.000 0.000) 0.000 12.877 ( 0.000 0.000 0.000) 0.000 13.291 ( 0.000 0.000 0.000) 0.000 13.305 ( 0.000 0.000 0.000) 0.000 13.583 ( 0.000 0.000 0.000) 0.000 13.586 ( 0.000 0.000 0.000) 0.000 14.182 ( 0.000 0.000 0.000) 0.000 14.291 ( 0.000 0.000 0.000) 0.000 14.400 ( 0.000 0.000 0.000) 0.000 15.214 ( 0.000 0.000 0.000) 0.000 15.246 ( 0.000 0.000 0.000) 0.000 15.314 ( 0.000 -0.000 0.000) 0.000 15.796 ( 0.000 0.000 0.000) 0.000 15.957 ( 0.000 0.000 0.000) 0.000 16.236 ( 0.000 0.000 0.000) 0.000 16.533 ( 0.000 0.000 0.000) 0.000 16.624 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 65 (37/208) ======================= q-point: ( 0.12 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.455 ( -1.486 -0.000 2.115) 2.585 2.760 ( -7.438 0.000 -1.643) 7.617 3.425 ( -0.187 0.000 1.343) 1.356 3.597 ( -1.110 0.000 -3.549) 3.718 4.246 ( 2.642 0.000 4.525) 5.240 4.524 ( 2.807 0.000 0.817) 2.923 4.618 ( 1.646 0.000 -0.039) 1.647 4.907 ( -13.417 0.000 -3.843) 13.957 5.013 ( -6.328 0.000 -0.863) 6.386 5.156 ( -0.750 0.000 -0.226) 0.783 5.373 ( 5.165 0.000 0.053) 5.165 5.574 ( 2.398 0.000 1.997) 3.121 5.670 ( -7.028 0.000 12.352) 14.212 6.009 ( 6.861 0.000 -3.848) 7.866 6.244 ( 12.321 0.000 0.628) 12.337 6.550 ( -2.843 0.000 -0.509) 2.888 7.311 ( 0.105 0.000 3.602) 3.604 7.435 ( 9.242 0.000 -4.868) 10.446 7.832 ( 0.347 -0.000 0.476) 0.589 8.039 ( 2.759 0.000 1.114) 2.975 8.381 ( -2.934 0.000 11.638) 12.003 8.467 ( 1.912 -0.000 -5.844) 6.148 8.489 ( 0.604 0.000 -0.089) 0.610 9.063 ( -4.914 0.000 -15.150) 15.927 9.243 ( -13.576 0.000 -22.054) 25.897 9.803 ( 6.614 0.000 13.599) 15.122 10.036 ( -3.823 0.000 8.422) 9.249 10.416 ( 16.136 0.000 -11.052) 19.557 10.743 ( 5.925 0.000 10.310) 11.891 11.852 ( -1.121 0.000 1.265) 1.690 12.430 ( 0.635 0.000 -1.248) 1.400 12.585 ( -0.583 0.000 -0.189) 0.613 12.820 ( -4.408 0.000 -1.356) 4.612 13.249 ( -4.889 0.000 10.620) 11.691 13.338 ( 1.694 0.000 -2.999) 3.445 13.588 ( 0.749 0.000 -1.566) 1.736 13.617 ( 3.035 0.000 5.979) 6.706 14.248 ( 7.004 0.000 -12.231) 14.094 14.297 ( 0.338 0.000 3.214) 3.232 14.389 ( -0.737 0.000 -0.824) 1.105 15.103 ( -12.735 0.000 -0.271) 12.738 15.265 ( 0.890 0.000 1.734) 1.949 15.304 ( -0.928 -0.000 -1.007) 1.369 15.562 ( -14.169 0.000 0.741) 14.189 15.924 ( -5.962 0.000 3.269) 6.799 16.220 ( -1.276 0.000 -0.363) 1.327 16.683 ( 5.704 0.000 -0.966) 5.785 16.755 ( 17.923 -0.000 -1.275) 17.968 ======================= Grid point 67 (38/208) ======================= q-point: ( 0.25 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -2.157 -0.000 2.842) 3.567 2.579 ( -10.531 0.000 -2.143) 10.747 3.425 ( -0.129 0.000 2.889) 2.892 3.564 ( -1.424 0.000 -5.644) 5.821 4.321 ( 3.807 0.000 4.859) 6.173 4.567 ( 0.253 0.000 0.739) 0.781 4.654 ( -11.999 0.000 -0.614) 12.015 4.660 ( 3.510 -0.000 -0.662) 3.572 4.916 ( -3.036 0.000 0.047) 3.037 5.136 ( -1.174 0.000 -0.126) 1.181 5.395 ( -2.562 0.000 -0.296) 2.579 5.590 ( -1.298 0.000 1.921) 2.319 5.617 ( -0.155 -0.000 7.684) 7.686 6.154 ( 7.765 0.000 4.011) 8.740 6.489 ( 12.766 0.000 -1.110) 12.814 6.507 ( -1.245 -0.000 -0.177) 1.258 7.326 ( 0.850 0.000 1.898) 2.079 7.632 ( 11.810 0.000 -4.023) 12.477 7.827 ( -1.069 0.000 -0.943) 1.425 8.101 ( 2.935 0.000 1.740) 3.412 8.354 ( -1.695 0.000 12.458) 12.573 8.495 ( 1.585 -0.000 0.069) 1.587 8.497 ( 0.190 0.000 -0.315) 0.368 8.917 ( -6.499 0.000 -23.359) 24.246 8.955 ( -12.385 0.000 -19.744) 23.307 9.904 ( 2.348 0.000 7.621) 7.975 10.013 ( -0.283 0.000 6.642) 6.648 10.757 ( 21.371 0.000 -11.236) 24.145 10.896 ( 7.412 0.000 13.403) 15.316 11.829 ( -1.431 0.000 1.634) 2.172 12.442 ( 0.844 0.000 -1.785) 1.974 12.573 ( -0.660 0.000 -0.163) 0.680 12.749 ( -2.690 0.000 0.144) 2.694 13.165 ( -5.510 0.000 13.437) 14.523 13.318 ( -2.529 0.000 -6.420) 6.900 13.613 ( 2.169 0.000 -2.268) 3.138 13.699 ( 3.488 0.000 7.474) 8.248 14.298 ( -6.480 -0.000 -5.778) 8.682 14.304 ( -0.652 0.000 3.911) 3.965 14.391 ( 1.468 0.000 1.008) 1.781 14.806 ( -8.381 0.000 -14.849) 17.051 15.280 ( -1.300 0.000 -1.825) 2.240 15.280 ( -0.002 -0.000 4.769) 4.769 15.417 ( -3.126 0.000 1.169) 3.337 15.759 ( -11.735 0.000 7.185) 13.760 16.199 ( -0.765 0.000 -0.732) 1.059 16.805 ( 6.724 0.000 -1.205) 6.831 17.075 ( 15.012 0.000 -1.398) 15.077 ======================= Grid point 69 (39/208) ======================= q-point: ( 0.38 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.390 ( -1.566 0.000 1.905) 2.466 2.397 ( -7.444 0.000 -1.354) 7.567 3.431 ( 0.198 0.000 3.520) 3.525 3.530 ( -1.152 0.000 -5.244) 5.369 4.354 ( -1.812 0.000 -2.813) 3.347 4.512 ( -2.338 -0.000 6.664) 7.063 4.537 ( -2.269 0.000 -0.239) 2.282 4.744 ( 4.672 -0.000 -0.213) 4.677 4.888 ( -0.921 0.000 0.267) 0.959 5.116 ( -0.863 0.000 0.254) 0.900 5.335 ( -2.844 0.000 1.107) 3.052 5.550 ( -2.423 0.000 1.027) 2.631 5.643 ( 1.172 0.000 2.300) 2.581 6.287 ( 5.022 0.000 4.614) 6.820 6.499 ( 0.108 -0.000 0.144) 0.180 6.689 ( 7.963 -0.000 -1.092) 8.037 7.343 ( 0.688 0.000 0.843) 1.089 7.792 ( -2.003 -0.000 -2.263) 3.022 7.841 ( 10.276 0.000 -3.004) 10.706 8.131 ( -0.430 0.000 1.898) 1.946 8.359 ( -0.011 0.000 10.184) 10.184 8.495 ( -0.274 -0.000 -0.397) 0.482 8.527 ( 1.121 0.000 5.868) 5.974 8.740 ( -7.352 0.000 -11.515) 13.662 8.770 ( -4.526 0.000 -21.928) 22.390 9.929 ( -0.078 -0.000 2.738) 2.739 10.030 ( 0.787 0.000 3.636) 3.720 11.035 ( 4.826 0.000 9.101) 10.301 11.135 ( 18.558 0.000 -8.205) 20.291 11.809 ( -0.862 0.000 1.061) 1.367 12.453 ( 0.568 0.000 -1.325) 1.442 12.562 ( -0.389 0.000 -0.060) 0.394 12.719 ( -0.790 0.000 0.806) 1.129 13.104 ( -2.809 0.000 10.351) 10.726 13.252 ( -2.738 0.000 -4.783) 5.511 13.656 ( 2.595 0.000 -2.407) 3.540 13.746 ( 0.331 0.000 4.758) 4.770 13.954 ( -21.577 0.000 1.578) 21.635 14.291 ( -0.833 0.000 1.588) 1.793 14.438 ( 2.454 0.000 3.009) 3.883 14.877 ( 13.701 0.000 -25.830) 29.239 15.254 ( -0.984 -0.000 -1.626) 1.900 15.267 ( -3.727 0.000 11.059) 11.670 15.387 ( -1.197 0.000 2.166) 2.475 15.542 ( -10.906 0.000 6.055) 12.474 16.189 ( -0.188 0.000 -0.635) 0.662 16.910 ( 4.229 0.000 -0.787) 4.301 17.292 ( 8.000 0.000 -0.848) 8.045 ======================= Grid point 71 (40/208) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 0.000 0.000 -0.000) 0.000 2.376 ( 0.000 0.000 -0.000) 0.000 3.438 ( 0.000 0.000 -0.000) 0.000 3.512 ( 0.000 0.000 0.000) 0.000 4.316 ( 0.000 0.000 -0.000) 0.000 4.512 ( 0.000 0.000 -0.000) 0.000 4.514 ( 0.000 0.000 0.000) 0.000 4.802 ( 0.000 0.000 -0.000) 0.000 4.871 ( -0.000 0.000 -0.000) 0.000 5.108 ( 0.000 0.000 -0.000) 0.000 5.308 ( 0.000 0.000 0.000) 0.000 5.525 ( 0.000 0.000 0.000) 0.000 5.657 ( 0.000 0.000 -0.000) 0.000 6.340 ( 0.000 0.000 -0.000) 0.000 6.502 ( 0.000 -0.000 -0.000) 0.000 6.765 ( 0.000 0.000 -0.000) 0.000 7.351 ( 0.000 0.000 -0.000) 0.000 7.767 ( 0.000 0.000 -0.000) 0.000 7.959 ( 0.000 0.000 -0.000) 0.000 8.109 ( -0.000 0.000 0.000) 0.000 8.372 ( 0.000 0.000 0.000) 0.000 8.491 ( 0.000 0.000 0.000) 0.000 8.546 ( 0.000 0.000 0.000) 0.000 8.655 ( 0.000 0.000 -0.000) 0.000 8.705 ( 0.000 0.000 -0.000) 0.000 9.928 ( 0.000 -0.000 0.000) 0.000 10.042 ( 0.000 0.000 -0.000) 0.000 11.090 ( 0.000 0.000 0.000) 0.000 11.326 ( 0.000 0.000 -0.000) 0.000 11.801 ( 0.000 0.000 0.000) 0.000 12.458 ( 0.000 0.000 -0.000) 0.000 12.558 ( 0.000 0.000 -0.000) 0.000 12.714 ( 0.000 0.000 0.000) 0.000 13.091 ( 0.000 0.000 0.000) 0.000 13.220 ( 0.000 0.000 -0.000) 0.000 13.686 ( 0.000 0.000 0.000) 0.000 13.717 ( 0.000 0.000 -0.000) 0.000 13.745 ( 0.000 0.000 -0.000) 0.000 14.284 ( 0.000 0.000 0.000) 0.000 14.468 ( 0.000 0.000 -0.000) 0.000 15.091 ( 0.000 0.000 -0.000) 0.000 15.144 ( -0.000 0.000 0.000) 0.000 15.243 ( 0.000 0.000 -0.000) 0.000 15.373 ( 0.000 0.000 0.000) 0.000 15.445 ( -0.000 0.000 0.000) 0.000 16.187 ( 0.000 0.000 0.000) 0.000 16.950 ( 0.000 0.000 0.000) 0.000 17.367 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 135 (41/208) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.500 ( -4.891 0.000 14.886) 15.669 0.767 ( 2.970 0.000 16.918) 17.177 0.767 ( -8.043 0.000 40.345) 41.139 1.204 ( 7.836 0.000 63.615) 64.095 2.161 ( 2.749 0.000 -2.633) 3.807 3.139 ( -0.819 0.000 -10.121) 10.154 3.181 ( 1.595 0.000 -10.568) 10.688 3.444 ( 0.608 0.000 3.000) 3.061 4.237 ( 5.066 0.000 -4.787) 6.970 4.429 ( 6.222 0.000 -4.502) 7.680 4.788 ( -2.283 0.000 6.861) 7.231 5.133 ( 6.729 0.000 -1.863) 6.983 5.766 ( -2.043 0.000 -14.332) 14.477 6.047 ( -2.493 0.000 -3.649) 4.419 6.095 ( 6.673 0.000 0.921) 6.736 6.283 ( 1.202 0.000 8.551) 8.635 6.652 ( -5.675 0.000 18.232) 19.095 7.170 ( -6.239 0.000 -29.021) 29.684 7.646 ( -33.022 0.000 -15.584) 36.515 7.802 ( 3.212 0.000 1.262) 3.451 7.981 ( 1.419 0.000 -6.390) 6.546 8.865 ( 12.333 0.000 9.009) 15.273 9.139 ( 11.673 0.000 20.099) 23.243 9.533 ( -17.298 0.000 -7.399) 18.814 9.770 ( -0.315 0.000 1.659) 1.689 10.716 ( 0.615 0.000 -0.266) 0.670 10.716 ( -10.614 0.000 0.418) 10.622 10.995 ( -0.534 0.000 -0.462) 0.706 11.314 ( 3.073 0.000 12.072) 12.457 11.693 ( 0.069 0.000 -0.106) 0.127 12.467 ( 0.006 0.000 0.684) 0.685 12.744 ( -19.205 0.000 -0.243) 19.207 12.866 ( -0.044 0.000 -0.848) 0.849 13.071 ( 1.511 0.000 1.563) 2.174 13.231 ( -4.052 0.000 0.881) 4.147 13.420 ( -1.301 0.000 -0.348) 1.347 13.730 ( -13.950 0.000 -3.222) 14.317 13.776 ( -0.011 0.000 0.019) 0.021 13.855 ( 4.912 0.000 -6.878) 8.452 14.034 ( 20.472 0.000 0.196) 20.473 14.335 ( -2.367 0.000 -4.184) 4.807 14.440 ( 0.025 0.000 0.197) 0.198 14.601 ( 7.700 0.000 1.979) 7.950 15.282 ( -3.031 0.000 -13.919) 14.245 16.167 ( -5.217 0.000 6.598) 8.412 16.410 ( 0.575 0.000 15.061) 15.072 17.075 ( 19.271 0.000 -2.500) 19.433 18.316 ( -0.590 0.000 -2.975) 3.033 ======================= Grid point 136 (42/208) ======================= q-point: ( 0.12 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.549 ( 4.048 0.000 1.906) 4.475 1.033 ( 27.576 0.000 23.633) 36.318 1.072 ( 24.525 0.000 19.899) 31.583 1.804 ( 35.385 0.000 40.728) 53.953 2.387 ( 20.442 0.000 1.213) 20.478 3.107 ( -1.031 0.000 -9.559) 9.615 3.228 ( 5.939 0.000 -10.603) 12.153 3.478 ( 2.443 0.000 2.441) 3.454 4.256 ( -1.070 0.000 3.005) 3.189 4.548 ( 6.607 0.000 -6.104) 8.995 4.780 ( 1.771 0.000 3.370) 3.807 5.203 ( -0.688 0.000 0.945) 1.169 5.530 ( -15.887 0.000 -12.853) 20.435 6.010 ( -2.110 0.000 -0.584) 2.190 6.312 ( 0.188 0.000 5.899) 5.902 6.324 ( 12.237 0.000 -0.262) 12.240 6.588 ( -3.437 0.000 16.833) 17.180 6.806 ( -27.254 0.000 -35.766) 44.966 7.388 ( 4.606 0.000 -11.665) 12.542 7.880 ( 4.635 0.000 3.177) 5.620 7.998 ( 1.398 0.000 -5.863) 6.028 9.002 ( 2.186 0.000 2.602) 3.399 9.242 ( -9.774 0.000 -3.034) 10.234 9.369 ( 7.388 0.000 12.833) 14.808 9.759 ( -1.130 0.000 1.567) 1.932 10.369 ( -25.050 0.000 -0.272) 25.052 10.735 ( 1.432 0.000 -0.018) 1.432 10.976 ( -1.266 0.000 -0.652) 1.424 11.407 ( 4.081 0.000 12.143) 12.811 11.696 ( 0.243 0.000 -0.093) 0.260 12.460 ( -0.754 0.000 0.697) 1.027 12.466 ( -9.902 0.000 -4.471) 10.865 12.863 ( -0.166 0.000 -0.867) 0.882 12.992 ( -2.751 0.000 -2.934) 4.022 13.226 ( 0.241 0.000 5.131) 5.136 13.519 ( 0.741 0.000 -1.468) 1.645 13.605 ( 2.794 0.000 0.869) 2.926 13.769 ( -0.721 0.000 0.018) 0.721 13.883 ( 2.389 0.000 -0.857) 2.538 14.290 ( 0.787 0.000 -1.833) 1.994 14.456 ( 1.471 0.000 0.201) 1.485 14.479 ( 13.949 0.000 -6.036) 15.199 14.864 ( 24.082 0.000 1.650) 24.139 15.200 ( -3.925 0.000 -15.863) 16.342 15.963 ( -14.633 0.000 14.173) 20.372 16.565 ( 9.636 0.000 6.797) 11.792 17.123 ( -6.843 0.000 1.565) 7.020 18.266 ( -4.106 0.000 -3.307) 5.272 ======================= Grid point 137 (43/208) ======================= q-point: ( 0.25 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.613 ( 2.845 0.000 -0.906) 2.986 1.632 ( 29.601 0.000 15.999) 33.648 1.637 ( 30.562 0.000 8.852) 31.818 2.419 ( 23.593 0.000 13.975) 27.421 2.918 ( 29.969 0.000 9.133) 31.330 3.057 ( -3.394 0.000 -7.094) 7.864 3.372 ( 12.592 0.000 -10.409) 16.337 3.538 ( 3.415 0.000 1.461) 3.715 4.235 ( -1.482 0.000 14.228) 14.305 4.598 ( -0.846 0.000 -6.789) 6.842 4.903 ( 6.324 0.000 -11.976) 13.543 5.145 ( -0.478 0.000 2.694) 2.736 5.198 ( -15.964 0.000 -15.310) 22.119 5.920 ( -8.876 0.000 7.933) 11.905 6.256 ( -10.177 0.000 -5.113) 11.390 6.407 ( -4.835 0.000 -11.286) 12.278 6.420 ( -2.925 0.000 13.309) 13.626 6.659 ( 8.682 0.000 3.705) 9.440 7.372 ( -4.170 0.000 -11.349) 12.091 7.981 ( 5.032 0.000 3.229) 5.979 8.011 ( 1.003 0.000 -5.989) 6.073 8.967 ( -6.124 0.000 -0.419) 6.139 9.138 ( -0.399 0.000 -6.521) 6.533 9.452 ( -0.478 0.000 7.700) 7.715 9.736 ( -1.406 0.000 1.560) 2.100 9.845 ( -27.033 0.000 -6.934) 27.908 10.766 ( 1.718 0.000 -0.186) 1.728 10.948 ( -1.552 0.000 -0.378) 1.597 11.477 ( 0.896 0.000 6.856) 6.914 11.701 ( 0.289 0.000 -0.125) 0.314 12.303 ( -6.146 0.000 -2.737) 6.727 12.444 ( -1.029 0.000 0.629) 1.207 12.857 ( -0.257 0.000 -0.762) 0.804 12.995 ( 2.091 0.000 -5.861) 6.223 13.227 ( -0.640 0.000 4.647) 4.691 13.506 ( 0.208 0.000 -2.419) 2.428 13.641 ( -0.763 0.000 3.438) 3.522 13.753 ( -0.832 0.000 0.027) 0.832 13.926 ( 0.969 0.000 -0.008) 0.969 14.297 ( 0.600 0.000 -2.261) 2.339 14.490 ( 1.901 0.000 0.166) 1.908 14.631 ( 4.968 0.000 -0.893) 5.048 15.090 ( -4.513 0.000 -11.705) 12.545 15.437 ( 31.924 0.000 4.820) 32.285 15.744 ( -10.134 0.000 11.454) 15.293 16.733 ( 6.864 0.000 1.449) 7.015 17.004 ( -5.392 0.000 4.738) 7.178 18.159 ( -6.312 0.000 -2.833) 6.919 ======================= Grid point 138 (44/208) ======================= q-point: ( 0.38 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.655 ( 1.694 0.000 -0.961) 1.948 2.151 ( 22.657 0.000 1.040) 22.681 2.177 ( 24.223 0.000 14.018) 27.987 2.759 ( 9.056 0.000 9.033) 12.791 2.942 ( -7.815 0.000 -3.554) 8.586 3.263 ( 9.731 0.000 -5.635) 11.244 3.598 ( 2.388 0.000 0.505) 2.441 3.648 ( 7.509 0.000 0.846) 7.557 4.311 ( 4.762 0.000 -8.348) 9.611 4.560 ( 4.757 0.000 -4.187) 6.337 4.764 ( -8.955 0.000 -9.528) 13.076 4.918 ( -9.804 0.000 -18.986) 21.368 5.348 ( 8.529 0.000 2.851) 8.993 5.764 ( -4.217 0.000 16.681) 17.206 6.040 ( -10.227 0.000 5.553) 11.637 6.362 ( -4.629 0.000 15.666) 16.335 6.440 ( 5.181 0.000 -0.625) 5.219 6.820 ( 6.836 0.000 2.460) 7.265 7.258 ( -4.319 0.000 -7.093) 8.305 8.014 ( 0.291 0.000 -6.803) 6.809 8.049 ( 0.941 0.000 -0.815) 1.245 8.816 ( -9.420 0.000 -1.687) 9.570 9.150 ( 0.897 0.000 -1.323) 1.598 9.358 ( -8.249 0.000 -0.610) 8.272 9.496 ( -5.716 0.000 -10.145) 11.645 9.716 ( -0.912 0.000 1.689) 1.919 10.792 ( 0.909 0.000 -1.026) 1.371 10.924 ( -0.793 0.000 0.572) 0.977 11.443 ( -4.701 0.000 -3.496) 5.858 11.705 ( 0.154 0.000 -0.208) 0.259 12.255 ( 0.985 0.000 5.645) 5.730 12.427 ( -0.759 0.000 0.498) 0.907 12.852 ( -0.136 0.000 -0.575) 0.591 13.006 ( -0.472 0.000 -3.983) 4.010 13.237 ( 1.587 0.000 -0.495) 1.663 13.511 ( -0.060 0.000 -3.094) 3.094 13.616 ( -1.783 0.000 6.554) 6.792 13.741 ( -0.477 0.000 0.042) 0.479 13.913 ( -1.687 0.000 -0.799) 1.867 14.303 ( 0.402 0.000 -1.749) 1.794 14.521 ( 1.231 0.000 0.113) 1.237 14.674 ( -0.181 0.000 -4.660) 4.663 15.027 ( -0.374 0.000 -1.744) 1.784 15.608 ( -6.492 0.000 13.041) 14.567 15.995 ( 24.966 0.000 -0.448) 24.970 16.802 ( -0.261 0.000 2.324) 2.339 16.945 ( -1.560 0.000 1.614) 2.245 18.043 ( -4.812 0.000 -1.383) 5.007 ======================= Grid point 139 (45/208) ======================= q-point: (-0.50 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.672 ( 0.302 0.000 -0.829) 0.882 2.442 ( -5.723 0.000 11.887) 13.193 2.476 ( 11.447 0.000 -1.863) 11.598 2.699 ( -16.468 0.000 3.266) 16.789 2.852 ( 5.094 0.000 0.437) 5.113 3.412 ( 0.028 0.000 -6.957) 6.957 3.586 ( -1.662 0.000 3.486) 3.862 3.616 ( -0.658 0.000 -0.282) 0.716 4.164 ( -14.079 0.000 -27.589) 30.973 4.561 ( -2.298 0.000 -15.863) 16.029 4.805 ( 1.996 0.000 -21.108) 21.203 4.977 ( 16.281 0.000 6.319) 17.464 5.226 ( -11.106 0.000 15.580) 19.133 5.759 ( -8.214 0.000 2.521) 8.592 6.095 ( 15.591 0.000 17.611) 23.520 6.313 ( -3.218 0.000 14.755) 15.102 6.572 ( 9.363 0.000 10.518) 14.082 6.911 ( 2.089 0.000 4.458) 4.923 7.256 ( 5.831 0.000 -2.041) 6.178 7.994 ( -5.531 0.000 -6.663) 8.659 8.000 ( -0.338 0.000 -7.868) 7.875 8.641 ( -6.668 0.000 -4.408) 7.993 9.103 ( -6.462 0.000 -6.567) 9.214 9.342 ( 5.366 0.000 1.756) 5.646 9.519 ( 10.392 0.000 -5.983) 11.991 9.710 ( 0.066 0.000 1.863) 1.865 10.789 ( -0.902 0.000 -1.834) 2.043 10.927 ( 0.946 0.000 1.429) 1.714 11.316 ( -6.727 0.000 -10.007) 12.058 11.706 ( -0.067 0.000 -0.292) 0.300 12.340 ( 5.772 0.000 11.046) 12.463 12.419 ( -0.132 0.000 0.386) 0.409 12.852 ( 0.184 0.000 -0.421) 0.459 12.973 ( -2.042 0.000 -2.863) 3.517 13.274 ( 2.045 0.000 -4.446) 4.894 13.482 ( -1.202 0.000 -2.956) 3.191 13.619 ( 0.589 0.000 6.539) 6.565 13.736 ( 0.008 0.000 0.056) 0.056 13.883 ( -0.963 0.000 -0.603) 1.136 14.306 ( 0.216 0.000 -1.607) 1.622 14.532 ( -0.048 0.000 0.073) 0.087 14.626 ( -3.156 0.000 -6.221) 6.976 15.028 ( -1.959 0.000 0.260) 1.977 15.539 ( -2.299 0.000 12.467) 12.677 16.316 ( 7.903 0.000 -3.901) 8.813 16.770 ( -2.354 0.000 9.192) 9.489 16.911 ( -2.660 0.000 -2.935) 3.961 18.006 ( 1.444 0.000 0.093) 1.447 ======================= Grid point 140 (46/208) ======================= q-point: (-0.38 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.664 ( -0.922 0.000 -0.729) 1.176 2.097 ( -27.010 0.000 10.115) 28.842 2.215 ( -32.793 0.000 -1.275) 32.818 2.544 ( -5.183 0.000 0.056) 5.183 3.036 ( 9.067 0.000 1.322) 9.163 3.217 ( -10.230 0.000 -3.201) 10.719 3.574 ( -3.467 0.000 -0.641) 3.526 3.645 ( -35.017 0.000 -5.866) 35.505 3.767 ( 11.222 0.000 -4.235) 11.994 4.574 ( 4.618 0.000 -21.294) 21.789 4.902 ( -9.415 0.000 5.499) 10.904 4.925 ( 13.582 0.000 -19.214) 23.529 5.228 ( -6.329 0.000 -0.087) 6.329 5.744 ( 8.676 0.000 12.131) 14.914 6.286 ( -2.226 0.000 12.361) 12.560 6.290 ( 2.218 0.000 1.147) 2.497 6.913 ( -2.781 0.000 7.242) 7.758 6.918 ( 22.865 0.000 24.665) 33.633 7.457 ( 14.283 0.000 2.800) 14.555 7.868 ( -5.398 0.000 -7.490) 9.233 7.980 ( -0.289 0.000 -8.442) 8.447 8.579 ( 0.491 0.000 -8.165) 8.179 8.917 ( -9.752 0.000 -13.245) 16.448 9.481 ( 7.926 0.000 1.945) 8.161 9.723 ( 0.876 0.000 1.932) 2.121 9.844 ( 22.457 0.000 1.978) 22.544 10.761 ( -1.553 0.000 -1.685) 2.292 10.955 ( 1.512 0.000 1.222) 1.944 11.191 ( -4.114 0.000 -9.464) 10.319 11.702 ( -0.217 0.000 -0.302) 0.371 12.424 ( 0.564 0.000 0.381) 0.681 12.485 ( 7.337 0.000 11.476) 13.621 12.857 ( 0.410 0.000 -0.408) 0.578 12.931 ( -1.558 0.000 -3.835) 4.139 13.277 ( -0.568 0.000 -2.933) 2.988 13.509 ( 4.619 0.000 -5.170) 6.933 13.642 ( 0.979 0.000 5.720) 5.803 13.741 ( 0.484 0.000 0.056) 0.487 13.880 ( 0.590 0.000 0.316) 0.670 14.301 ( -0.817 0.000 -2.178) 2.326 14.519 ( -1.306 0.000 0.067) 1.308 14.551 ( -3.953 0.000 -4.562) 6.037 14.884 ( -12.851 0.000 -4.971) 13.779 15.579 ( 3.172 0.000 14.511) 14.853 16.288 ( -7.179 0.000 -3.851) 8.146 16.751 ( -2.734 0.000 4.483) 5.251 16.848 ( -3.276 0.000 1.928) 3.801 18.087 ( 6.258 0.000 0.049) 6.258 ======================= Grid point 141 (47/208) ======================= q-point: (-0.25 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.639 ( -1.495 0.000 -0.493) 1.574 1.544 ( -36.724 0.000 4.024) 36.944 1.547 ( -32.335 0.000 12.934) 34.826 2.286 ( -23.579 0.000 9.467) 25.408 2.771 ( -39.335 0.000 11.415) 40.958 3.150 ( 3.421 0.000 -3.483) 4.882 3.218 ( -3.062 0.000 -15.222) 15.526 3.500 ( -3.829 0.000 0.504) 3.862 3.955 ( 9.035 0.000 -7.015) 11.438 4.553 ( -5.030 0.000 -10.546) 11.684 4.829 ( 0.720 0.000 -0.459) 0.854 5.069 ( -6.146 0.000 -1.597) 6.350 5.217 ( 19.468 0.000 -15.694) 25.006 5.956 ( 9.326 0.000 8.133) 12.375 6.253 ( -3.657 0.000 8.030) 8.824 6.270 ( -2.646 0.000 -1.088) 2.861 6.840 ( -6.124 0.000 11.057) 12.640 7.352 ( 16.116 0.000 14.435) 21.635 7.744 ( 12.398 0.000 3.834) 12.977 7.792 ( 0.112 0.000 -7.414) 7.415 7.967 ( 0.385 0.000 -8.143) 8.152 8.563 ( -1.800 0.000 -10.837) 10.985 8.800 ( 1.723 0.000 -3.989) 4.345 9.620 ( 6.254 0.000 -1.764) 6.498 9.746 ( 1.050 0.000 1.874) 2.148 10.294 ( 23.237 0.000 3.404) 23.485 10.732 ( -1.220 0.000 -1.240) 1.740 10.982 ( 1.128 0.000 0.644) 1.299 11.153 ( 1.423 0.000 -2.138) 2.568 11.698 ( -0.225 0.000 -0.234) 0.325 12.440 ( 0.966 0.000 0.480) 1.079 12.643 ( 7.449 0.000 8.986) 11.672 12.864 ( 0.340 0.000 -0.539) 0.637 12.915 ( 1.014 0.000 -3.654) 3.792 13.284 ( 2.113 0.000 2.449) 3.234 13.567 ( 0.819 0.000 -3.508) 3.602 13.713 ( 6.206 0.000 -0.126) 6.207 13.754 ( 0.822 0.000 0.044) 0.823 13.904 ( 2.120 0.000 0.033) 2.120 14.216 ( -11.339 0.000 -6.404) 13.022 14.443 ( -6.572 0.000 -0.261) 6.577 14.488 ( -1.925 0.000 0.100) 1.928 14.627 ( -8.974 0.000 -5.324) 10.434 15.622 ( -2.689 0.000 3.244) 4.214 16.170 ( -2.578 0.000 5.604) 6.168 16.658 ( -7.293 0.000 2.335) 7.658 16.783 ( -4.436 0.000 2.686) 5.185 18.208 ( 6.090 0.000 -0.961) 6.165 ======================= Grid point 142 (48/208) ======================= q-point: (-0.12 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.607 ( -2.632 0.000 1.153) 2.873 0.956 ( -24.229 0.000 28.211) 37.187 0.981 ( -27.910 0.000 19.229) 33.892 1.619 ( -45.359 0.000 38.561) 59.535 2.280 ( -13.666 0.000 -3.728) 14.165 3.167 ( -0.088 0.000 -8.239) 8.240 3.179 ( 0.092 0.000 -11.630) 11.631 3.449 ( -1.725 0.000 2.488) 3.028 4.096 ( 7.757 0.000 -4.586) 9.011 4.431 ( -4.393 0.000 -6.489) 7.836 4.826 ( -2.272 0.000 5.362) 5.824 5.046 ( 3.292 0.000 -5.888) 6.746 5.566 ( 19.122 0.000 -13.754) 23.554 6.077 ( 1.734 0.000 0.693) 1.868 6.159 ( -7.192 0.000 2.921) 7.762 6.239 ( 0.623 0.000 4.050) 4.097 6.739 ( -6.525 0.000 15.690) 16.993 7.439 ( -8.681 0.000 -18.623) 20.547 7.747 ( 0.801 0.000 0.384) 0.889 7.956 ( 3.739 0.000 -10.797) 11.426 7.968 ( 1.069 0.000 -7.284) 7.362 8.608 ( 8.941 0.000 10.306) 13.644 8.921 ( 9.038 0.000 6.438) 11.097 9.689 ( 1.031 0.000 -8.275) 8.339 9.765 ( 0.562 0.000 1.769) 1.856 10.667 ( 14.301 0.000 -0.848) 14.326 10.714 ( -0.389 0.000 -0.728) 0.826 10.997 ( 0.348 0.000 0.023) 0.349 11.227 ( 4.868 0.000 7.861) 9.246 11.694 ( -0.115 0.000 -0.154) 0.192 12.458 ( 0.760 0.000 0.604) 0.970 12.793 ( 7.420 0.000 4.594) 8.727 12.867 ( 0.115 0.000 -0.719) 0.729 12.972 ( 5.139 0.000 0.056) 5.139 13.352 ( 0.964 0.000 5.413) 5.498 13.570 ( 1.281 0.000 0.977) 1.611 13.707 ( -12.574 0.000 -2.154) 12.757 13.769 ( 0.701 0.000 0.029) 0.702 13.885 ( -5.038 0.000 -22.414) 22.973 14.002 ( 1.780 0.000 6.288) 6.535 14.391 ( -0.415 0.000 3.496) 3.520 14.454 ( -1.443 0.000 0.154) 1.451 14.535 ( -1.664 0.000 -6.245) 6.463 15.463 ( -11.803 0.000 -12.329) 17.068 16.195 ( -0.075 0.000 9.759) 9.760 16.501 ( -8.625 0.000 5.974) 10.492 16.749 ( 4.182 0.000 8.355) 9.344 18.295 ( 3.191 0.000 -2.107) 3.824 ======================= Grid point 143 (49/208) ======================= q-point: ( 0.00 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.972 ( 1.891 29.635 7.832) 30.710 1.045 ( 0.285 22.190 24.844) 33.312 1.218 ( 3.748 22.517 29.722) 37.476 1.692 ( -3.564 51.918 25.541) 57.970 2.228 ( 3.471 7.225 -1.327) 8.125 3.217 ( -0.684 7.627 -9.550) 12.241 3.279 ( 0.571 9.514 -10.011) 13.823 3.551 ( 1.474 9.940 2.850) 10.445 4.191 ( 4.438 -1.578 -1.360) 4.903 4.412 ( 4.281 -0.576 -4.579) 6.295 4.787 ( -1.831 -0.040 6.103) 6.372 5.107 ( 4.911 -1.963 -0.983) 5.379 6.001 ( -4.227 13.534 -16.891) 22.053 6.073 ( -2.644 3.616 -4.077) 6.057 6.242 ( 8.009 13.374 -1.280) 15.641 6.291 ( 2.850 2.915 7.194) 8.269 6.712 ( -10.892 5.917 8.564) 15.066 7.240 ( -10.193 7.592 -20.402) 24.037 7.354 ( -5.821 -19.312 -1.386) 20.218 7.480 ( -8.509 -12.049 -4.031) 15.292 8.387 ( 2.245 18.604 -4.251) 19.215 8.747 ( 9.789 -13.774 8.251) 18.805 8.921 ( 7.323 -17.394 11.461) 22.080 9.123 ( -1.469 -15.842 8.402) 17.992 9.867 ( -8.541 -0.972 -0.543) 8.613 10.794 ( 2.279 -3.948 -2.001) 4.978 10.917 ( -3.630 4.569 -5.733) 8.181 11.088 ( 0.746 7.274 0.429) 7.325 11.123 ( -0.649 -0.367 -2.796) 2.893 12.193 ( 0.037 26.528 -0.797) 26.540 12.361 ( -1.940 -24.354 2.226) 24.532 12.643 ( 1.040 -0.336 -6.346) 6.439 13.066 ( -3.841 -3.608 -0.681) 5.314 13.121 ( 8.062 4.243 -2.370) 9.414 13.267 ( -12.635 14.251 -4.140) 19.490 13.395 ( -1.912 -0.130 -4.391) 4.791 13.504 ( -14.864 -4.339 -2.479) 15.681 13.775 ( -2.362 -8.167 0.843) 8.543 13.892 ( 11.291 2.639 -4.286) 12.362 14.140 ( 4.963 3.889 -10.903) 12.595 14.553 ( 5.511 6.522 2.827) 8.994 14.587 ( 2.219 23.118 -2.047) 23.315 14.753 ( 2.083 14.447 0.055) 14.597 15.258 ( -3.510 -2.161 -12.973) 13.612 16.148 ( -14.359 -7.582 13.135) 20.886 16.376 ( 8.152 0.384 10.470) 13.275 16.672 ( 14.584 -18.867 16.141) 28.796 18.222 ( -0.512 -9.377 -2.827) 9.808 ======================= Grid point 144 (50/208) ======================= q-point: ( 0.12 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( -1.319 30.979 -0.301) 31.009 1.251 ( 21.185 19.787 18.510) 34.394 1.544 ( 19.829 29.534 20.316) 40.966 1.977 ( 24.036 22.355 24.811) 41.147 2.477 ( 22.357 10.952 5.057) 25.404 3.198 ( -0.152 8.804 -8.260) 12.073 3.293 ( 3.514 6.108 -11.120) 13.165 3.598 ( 2.810 10.868 2.234) 11.445 4.239 ( 0.683 -0.502 4.178) 4.263 4.531 ( 7.196 -0.582 -4.867) 8.707 4.786 ( 2.153 0.685 2.860) 3.644 5.168 ( 0.275 -2.741 2.347) 3.619 5.696 ( -18.602 11.989 -13.593) 25.972 6.031 ( -2.717 2.543 -0.039) 3.722 6.309 ( 0.315 0.571 4.941) 4.984 6.412 ( -3.572 6.611 -6.189) 9.735 6.574 ( 3.124 5.421 -1.447) 6.422 6.979 ( -13.170 16.601 -13.481) 25.115 7.259 ( 0.355 -13.231 -6.650) 14.812 7.484 ( 2.819 -15.430 1.686) 15.776 8.426 ( 3.379 14.492 -5.898) 16.007 8.841 ( 0.969 -16.879 -4.948) 17.616 9.099 ( 6.367 -16.469 15.877) 23.746 9.111 ( -0.770 -6.192 10.254) 12.004 9.653 ( -13.544 -6.660 -3.017) 15.392 10.677 ( -13.775 20.782 -5.375) 25.505 10.836 ( -2.547 -5.017 -2.751) 6.263 11.076 ( -0.956 0.628 1.548) 1.925 11.098 ( -1.081 -3.457 -0.311) 3.635 12.109 ( -5.065 20.333 5.342) 21.624 12.333 ( -3.174 -9.007 -1.949) 9.746 12.627 ( -2.036 -6.829 -1.847) 7.362 12.883 ( -12.351 14.876 -6.377) 20.359 12.965 ( -2.786 -2.556 -3.850) 5.396 13.213 ( -0.275 -0.180 3.991) 4.005 13.367 ( -2.879 -0.089 0.656) 2.955 13.530 ( 7.472 -1.818 -0.919) 7.744 13.759 ( 0.451 -9.264 -1.191) 9.352 14.027 ( 2.702 7.428 -0.487) 7.919 14.298 ( 11.192 -3.689 -5.979) 13.214 14.561 ( 0.833 23.973 0.193) 23.988 14.791 ( 1.780 15.546 0.260) 15.650 14.871 ( 22.744 2.436 2.590) 23.020 15.186 ( -2.958 -1.417 -15.362) 15.708 15.886 ( -14.257 -7.294 12.745) 20.467 16.559 ( 8.667 -0.477 5.684) 10.376 16.883 ( 3.452 -16.559 9.942) 19.620 18.174 ( -3.973 -9.161 -3.085) 10.451 ======================= Grid point 145 (51/208) ======================= q-point: ( 0.25 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.980 ( 0.341 28.873 -0.331) 28.877 1.747 ( 26.441 12.122 9.388) 30.565 1.995 ( 24.334 27.656 12.717) 38.971 2.440 ( 20.251 3.687 11.126) 23.398 3.002 ( 24.602 9.853 8.763) 27.913 3.169 ( -1.201 10.022 -6.874) 12.213 3.406 ( 12.626 3.764 -10.729) 16.991 3.660 ( 3.306 11.080 1.623) 11.677 4.257 ( 1.064 2.594 14.178) 14.452 4.573 ( -2.587 -1.706 -7.622) 8.228 4.910 ( 6.427 0.953 -10.687) 12.507 5.095 ( -6.028 -2.638 -2.475) 7.030 5.386 ( -8.623 13.829 -5.811) 17.302 5.925 ( -9.660 1.767 7.705) 12.483 6.198 ( -10.607 -1.021 -6.737) 12.608 6.327 ( 0.572 1.093 1.810) 2.191 6.734 ( 9.159 8.003 -1.850) 12.303 6.784 ( -7.313 21.869 1.982) 23.145 7.238 ( -1.678 -13.134 -8.521) 15.746 7.527 ( 1.117 -15.622 1.596) 15.743 8.498 ( 5.108 10.007 -5.342) 12.440 8.803 ( -3.481 -10.952 -6.263) 13.087 9.114 ( -0.040 -1.232 3.202) 3.431 9.150 ( -6.433 -16.223 13.218) 21.893 9.386 ( -10.563 -14.945 -8.032) 19.986 10.397 ( -12.396 27.562 -5.510) 30.720 10.807 ( -0.365 -2.339 -0.431) 2.406 11.041 ( -2.281 7.579 -0.265) 7.919 11.099 ( -0.045 -16.909 1.320) 16.960 12.073 ( -0.323 17.721 6.997) 19.055 12.226 ( -6.585 -2.380 -3.003) 7.619 12.594 ( -0.982 -19.411 1.046) 19.463 12.718 ( -5.700 13.025 -2.953) 14.521 12.974 ( 2.802 -2.052 -6.703) 7.549 13.194 ( -1.890 -0.933 1.879) 2.823 13.336 ( -0.734 0.708 1.945) 2.197 13.603 ( 0.677 -0.373 1.627) 1.801 13.772 ( 0.603 -10.873 -2.799) 11.244 14.045 ( 0.320 8.193 -1.411) 8.320 14.459 ( 6.191 -0.858 1.324) 6.388 14.592 ( 2.212 26.022 0.937) 26.133 14.801 ( -1.302 12.433 -2.562) 12.761 15.096 ( -3.250 0.551 -10.295) 10.809 15.391 ( 27.710 -5.294 13.308) 31.192 15.698 ( -5.821 -2.925 0.868) 6.572 16.703 ( 5.598 -2.698 1.655) 6.431 16.892 ( -2.139 -9.435 7.363) 12.157 18.071 ( -6.102 -8.789 -2.630) 11.018 ======================= Grid point 146 (52/208) ======================= q-point: ( 0.38 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.991 ( 0.678 27.443 -0.344) 27.454 2.208 ( 20.287 6.650 3.492) 21.633 2.452 ( 20.979 22.313 9.274) 32.000 2.743 ( 8.316 -0.135 7.479) 11.185 3.061 ( -7.081 9.501 -2.135) 12.040 3.282 ( 7.636 3.432 -5.243) 9.878 3.688 ( 7.577 6.427 -2.602) 10.271 3.723 ( 3.046 9.886 3.827) 11.030 4.332 ( -4.562 1.229 -20.105) 20.653 4.512 ( 11.475 -1.486 5.578) 12.846 4.778 ( -8.002 1.456 -7.823) 11.285 5.048 ( -3.665 7.229 -11.529) 14.092 5.437 ( 5.599 12.205 0.790) 13.451 5.771 ( -3.229 0.833 18.990) 19.281 6.003 ( -9.985 -1.237 3.958) 10.811 6.347 ( 0.457 2.077 2.567) 3.333 6.693 ( -2.691 17.858 6.422) 19.167 6.872 ( 5.573 4.161 1.663) 7.151 7.207 ( 1.034 -4.400 -6.554) 7.961 7.523 ( -1.853 -17.864 0.185) 17.961 8.588 ( 4.365 11.151 -3.775) 12.556 8.715 ( -3.558 -11.556 -6.607) 13.779 8.894 ( -16.130 -11.570 0.569) 19.859 9.108 ( -2.430 -3.931 1.918) 5.004 9.304 ( 1.110 -14.436 -9.550) 17.345 10.245 ( -2.889 29.628 -0.824) 29.780 10.809 ( 0.264 -3.003 0.045) 3.015 11.003 ( -1.620 6.804 0.316) 7.002 11.079 ( -2.104 -17.142 -2.919) 17.515 12.064 ( -3.565 21.520 -1.478) 21.864 12.150 ( 0.812 -7.350 6.497) 9.844 12.584 ( -0.811 -29.181 -0.847) 29.205 12.641 ( -2.042 15.627 0.529) 15.769 13.003 ( 0.679 -0.448 -4.632) 4.703 13.170 ( -0.060 -1.410 -2.724) 3.068 13.344 ( 1.140 0.895 1.777) 2.293 13.580 ( -3.177 -0.087 3.975) 5.089 13.768 ( -0.139 -9.593 -2.869) 10.013 14.049 ( 0.347 6.943 -0.121) 6.953 14.538 ( 2.115 9.119 0.631) 9.382 14.646 ( 2.715 19.838 3.798) 20.380 14.715 ( -5.899 5.579 -9.453) 12.462 15.071 ( 1.220 4.483 0.224) 4.651 15.567 ( -4.701 -3.833 15.481) 16.627 15.957 ( 24.610 -3.775 -5.277) 25.451 16.743 ( -2.246 -4.871 2.947) 6.120 16.874 ( -0.282 -6.519 2.236) 6.897 17.958 ( -4.676 -8.387 -1.334) 9.695 ======================= Grid point 147 (53/208) ======================= q-point: (-0.50 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.999 ( 0.184 26.935 -0.273) 26.937 2.474 ( 5.000 2.220 2.002) 5.826 2.681 ( -4.233 14.895 5.369) 16.389 2.723 ( -13.056 5.271 2.221) 14.254 2.949 ( 5.037 9.164 -0.491) 10.468 3.436 ( 5.260 3.871 -3.343) 7.337 3.605 ( -9.046 3.745 -0.568) 9.807 3.742 ( 0.410 10.316 -0.157) 10.325 4.169 ( -6.711 1.896 -23.815) 24.815 4.584 ( -4.398 2.668 -14.200) 15.103 4.944 ( 14.249 5.215 -1.721) 15.271 4.985 ( 0.545 4.191 -4.740) 6.350 5.309 ( -9.573 11.882 9.826) 18.148 5.771 ( -8.569 1.659 2.776) 9.159 6.056 ( 15.167 -2.724 21.033) 26.074 6.348 ( -0.607 3.645 5.794) 6.873 6.730 ( 6.183 12.161 8.044) 15.837 6.970 ( 4.498 5.408 7.401) 10.210 7.272 ( 6.343 2.326 -1.994) 7.044 7.463 ( -3.845 -21.127 -2.318) 21.599 8.574 ( -2.881 16.979 -9.862) 19.845 8.637 ( -9.001 6.152 -4.756) 11.895 8.751 ( 5.235 -34.017 -0.004) 34.418 8.999 ( -8.298 -10.627 -8.815) 16.109 9.390 ( 9.189 -8.783 -4.024) 13.333 10.276 ( 5.403 32.123 4.065) 32.826 10.806 ( -0.556 -3.649 -0.480) 3.723 10.977 ( -1.742 -2.218 -2.399) 3.703 11.026 ( -1.732 -6.593 -3.616) 7.717 11.988 ( -3.052 16.191 -2.464) 16.659 12.224 ( 4.479 -5.909 8.511) 11.288 12.556 ( -1.080 -12.341 -1.770) 12.514 12.639 ( 0.704 -4.687 1.765) 5.058 12.989 ( -1.033 2.231 -2.968) 3.854 13.183 ( 1.572 0.055 -4.792) 5.043 13.383 ( 3.026 0.406 -1.096) 3.244 13.524 ( -2.683 -0.734 6.253) 6.843 13.764 ( 0.064 -8.375 -1.984) 8.607 14.057 ( 0.362 6.512 0.572) 6.548 14.540 ( -2.785 15.083 -6.355) 16.603 14.590 ( -3.290 1.653 -1.567) 4.001 14.700 ( 1.457 15.598 1.336) 15.723 15.084 ( -2.038 6.160 1.112) 6.583 15.520 ( -1.537 -1.587 11.570) 11.779 16.299 ( 11.008 -3.118 -5.012) 12.491 16.659 ( -6.436 -8.796 8.578) 13.870 16.857 ( -2.012 -5.099 -2.100) 5.870 17.921 ( 1.272 -8.402 -0.029) 8.498 ======================= Grid point 148 (54/208) ======================= q-point: (-0.38 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.997 ( -0.301 27.166 -0.149) 27.168 2.242 ( -30.100 3.254 -2.077) 30.347 2.292 ( -23.153 12.980 6.088) 27.232 2.600 ( -7.194 7.742 0.929) 10.609 3.120 ( 7.672 8.745 0.956) 11.672 3.292 ( -8.461 7.893 -4.269) 12.334 3.626 ( -2.069 5.322 -0.398) 5.724 3.783 ( -11.813 6.620 -0.896) 13.571 3.814 ( -8.939 11.347 -6.157) 15.702 4.572 ( 4.495 0.670 -19.777) 20.292 4.867 ( -7.926 -1.354 2.224) 8.342 5.122 ( 7.911 9.254 -8.447) 14.818 5.249 ( -3.709 9.810 -4.835) 11.549 5.765 ( 8.477 2.282 12.028) 14.891 6.284 ( 5.041 -0.091 9.016) 10.330 6.340 ( -1.443 3.935 7.291) 8.410 6.942 ( 8.538 5.587 7.628) 12.740 7.087 ( 10.168 11.637 15.879) 22.157 7.396 ( -1.837 -21.311 -2.871) 21.582 7.436 ( 10.362 -1.027 4.753) 11.446 8.484 ( -4.621 24.760 -10.243) 27.191 8.547 ( 0.016 -3.855 -9.011) 9.801 8.787 ( -8.897 -12.111 -13.888) 20.463 8.881 ( 5.937 -34.484 -0.022) 34.991 9.610 ( 13.358 -8.384 2.167) 15.919 10.433 ( 9.503 32.855 4.060) 34.442 10.793 ( -0.383 -4.279 -0.843) 4.378 10.928 ( -1.079 -9.744 -6.398) 11.707 11.024 ( 0.883 4.773 0.623) 4.894 11.950 ( -0.607 15.980 -0.879) 16.015 12.323 ( 4.203 -11.740 6.227) 13.938 12.558 ( 1.724 -0.332 -0.346) 1.790 12.654 ( 0.654 -15.324 -0.072) 15.338 12.973 ( 0.219 4.987 -2.575) 5.617 13.200 ( 1.081 2.735 -3.596) 4.645 13.445 ( 3.049 -0.472 0.113) 3.088 13.539 ( 4.104 -0.257 4.463) 6.069 13.760 ( -0.216 -8.911 -1.326) 9.011 14.061 ( -0.056 7.021 -0.194) 7.024 14.441 ( -4.446 3.542 -9.440) 11.020 14.570 ( -0.802 12.074 0.863) 12.131 14.693 ( -3.490 14.000 2.797) 14.697 14.952 ( -10.689 7.886 -3.779) 13.811 15.562 ( 2.763 -1.627 12.452) 12.858 16.322 ( -5.692 3.343 -4.793) 8.158 16.581 ( -3.574 -16.699 7.798) 18.773 16.795 ( -4.378 -3.818 -0.513) 5.832 17.997 ( 5.998 -8.894 -0.053) 10.728 ======================= Grid point 149 (55/208) ======================= q-point: (-0.25 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.991 ( -0.265 27.816 0.035) 27.817 1.611 ( -33.693 7.052 1.572) 34.459 1.838 ( -26.136 21.078 11.528) 35.500 2.370 ( -16.512 9.254 4.076) 19.362 2.942 ( -35.549 18.843 14.931) 42.915 3.247 ( 4.042 7.768 -8.148) 11.961 3.312 ( -6.806 10.571 -8.761) 15.324 3.595 ( -3.596 8.893 -0.456) 9.604 3.961 ( 8.434 0.927 -6.523) 10.703 4.548 ( -5.466 -0.300 -9.727) 11.162 4.811 ( 1.524 -1.045 -1.976) 2.706 5.047 ( -5.850 -1.659 -1.351) 6.229 5.436 ( 18.422 20.556 -12.504) 30.303 5.970 ( 9.048 1.496 7.990) 12.163 6.272 ( -3.304 1.436 -1.128) 3.775 6.359 ( -0.580 8.144 9.811) 12.764 6.957 ( -4.290 10.349 9.082) 14.422 7.328 ( 3.497 -15.511 1.222) 15.948 7.444 ( 10.146 -5.095 3.721) 11.948 7.646 ( 8.667 -3.501 8.593) 12.697 8.395 ( -4.095 19.026 -11.346) 22.527 8.489 ( -3.462 -4.232 -10.258) 11.625 8.696 ( 3.337 -10.410 -6.915) 12.935 9.009 ( 6.460 -33.081 1.876) 33.758 9.848 ( 9.873 -6.461 5.145) 12.872 10.594 ( 6.699 15.627 -4.353) 17.550 10.816 ( 3.413 3.894 0.259) 5.185 10.961 ( 5.539 -3.470 -0.171) 6.538 11.042 ( 0.753 5.080 0.631) 5.174 11.972 ( 3.278 18.191 1.593) 18.553 12.387 ( 1.722 -19.586 2.660) 19.841 12.610 ( 2.719 12.224 -4.485) 13.301 12.687 ( 4.383 -20.213 3.399) 20.960 12.995 ( 2.396 5.031 -1.291) 5.720 13.224 ( 2.248 4.803 -1.450) 5.498 13.503 ( 3.297 -0.025 2.658) 4.235 13.670 ( 7.473 1.315 2.618) 8.026 13.755 ( 0.175 -10.917 0.303) 10.922 14.054 ( -0.079 6.684 -5.174) 8.453 14.309 ( -12.469 4.624 -11.302) 17.453 14.502 ( -7.984 0.801 0.669) 8.052 14.585 ( -2.270 20.636 3.939) 21.131 14.799 ( -3.739 13.747 -2.726) 14.505 15.590 ( -3.077 -3.183 2.403) 5.037 16.218 ( -2.576 4.715 6.006) 8.058 16.500 ( -6.482 -19.358 4.210) 20.844 16.678 ( -8.322 -3.455 0.641) 9.033 18.115 ( 5.956 -9.296 -0.977) 11.084 ======================= Grid point 150 (56/208) ======================= q-point: (-0.12 0.07 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.983 ( -1.159 28.030 0.983) 28.071 1.099 ( -18.615 14.029 22.930) 32.697 1.403 ( -20.734 26.203 16.703) 37.357 1.989 ( -26.087 35.171 21.215) 48.658 2.365 ( -19.262 12.061 1.063) 22.751 3.247 ( -0.943 7.819 -9.526) 12.359 3.284 ( 0.989 9.996 -8.420) 13.107 3.545 ( -1.416 9.210 1.948) 9.520 4.089 ( 6.494 -0.050 -5.035) 8.217 4.424 ( -4.279 -0.614 -5.925) 7.334 4.817 ( -1.713 -0.717 4.297) 4.681 5.026 ( 3.368 -1.222 -4.627) 5.852 5.785 ( 19.910 19.420 -13.295) 30.827 6.091 ( 2.067 1.629 1.090) 2.849 6.229 ( -0.373 0.993 3.444) 3.604 6.314 ( -5.194 12.139 3.036) 13.548 6.864 ( -7.118 10.409 11.245) 16.896 7.356 ( 1.276 -21.492 -0.178) 21.530 7.490 ( -7.854 0.649 -14.411) 16.426 7.693 ( -5.385 -11.758 -5.257) 13.960 8.345 ( 1.835 14.296 -2.876) 14.698 8.529 ( 7.917 -2.445 9.305) 12.459 8.794 ( 6.381 -14.345 -1.997) 15.826 9.107 ( 2.776 -27.142 4.733) 27.691 9.953 ( -0.048 -1.909 2.841) 3.423 10.701 ( 6.446 -5.292 -5.247) 9.853 10.906 ( 5.129 11.418 -3.360) 12.960 11.055 ( 0.983 5.218 -0.050) 5.310 11.086 ( 5.337 0.536 1.879) 5.684 12.086 ( 7.872 22.580 2.492) 24.042 12.398 ( -0.972 -23.916 1.594) 23.989 12.630 ( 1.295 2.584 -7.472) 8.012 12.860 ( 13.115 -3.000 3.472) 13.894 13.051 ( 3.166 1.253 0.559) 3.450 13.279 ( 3.127 5.904 -0.524) 6.702 13.567 ( 0.517 -0.435 3.272) 3.341 13.718 ( -1.219 -7.187 -2.009) 7.561 13.811 ( 1.005 -4.139 9.231) 10.166 13.886 ( -18.078 9.232 -21.766) 29.762 14.098 ( 1.983 5.707 -4.892) 7.774 14.457 ( 1.838 3.350 -0.655) 3.877 14.590 ( 1.218 20.297 1.479) 20.387 14.750 ( -1.712 14.666 -1.399) 14.831 15.434 ( -11.327 -2.862 -10.958) 16.018 16.250 ( 1.896 4.647 10.633) 11.758 16.368 ( -8.025 -20.229 12.809) 25.253 16.524 ( -4.638 -5.047 4.773) 8.353 18.200 ( 3.167 -9.442 -2.040) 10.166 ======================= Grid point 151 (57/208) ======================= q-point: ( 0.00 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( 6.452 19.232 19.776) 28.330 1.565 ( 2.642 28.699 9.810) 30.444 1.726 ( -1.604 27.990 14.220) 31.436 2.472 ( 0.943 18.855 2.135) 18.998 2.803 ( -2.551 53.981 6.289) 54.406 3.438 ( -0.845 14.039 -8.232) 16.297 3.515 ( -2.264 13.589 -8.302) 16.084 3.794 ( 2.482 13.393 3.264) 14.007 4.205 ( 4.326 3.317 0.356) 5.463 4.412 ( 4.833 0.620 -2.493) 5.474 4.789 ( -0.747 0.351 3.692) 3.783 5.075 ( 3.155 -0.950 -0.016) 3.295 6.088 ( -4.380 0.658 -4.792) 6.525 6.213 ( -4.711 6.308 -8.779) 11.792 6.402 ( -6.338 7.542 -0.644) 9.873 6.636 ( 13.839 23.152 -4.423) 27.333 6.884 ( -10.352 8.755 1.257) 13.616 6.989 ( -1.846 -15.155 -1.116) 15.308 7.249 ( -0.538 -5.656 7.454) 9.372 7.582 ( -10.984 18.581 -21.891) 30.743 8.205 ( -3.132 -28.348 -7.143) 29.402 8.482 ( 9.782 -7.461 12.313) 17.406 8.799 ( 3.518 -2.494 5.000) 6.603 9.021 ( 7.272 1.705 10.844) 13.168 9.774 ( -8.505 -7.416 0.293) 11.288 10.456 ( 2.215 -15.190 -0.800) 15.371 11.077 ( -4.207 4.163 -7.432) 9.501 11.162 ( 1.111 0.664 -5.432) 5.584 11.281 ( -0.348 8.088 -1.391) 8.214 11.753 ( 0.050 -33.578 1.237) 33.601 12.548 ( 4.415 7.868 5.432) 10.531 12.609 ( -2.548 1.979 4.311) 5.385 13.031 ( -7.867 -0.193 -4.925) 9.283 13.128 ( 10.874 -2.622 1.184) 11.248 13.313 ( -6.876 -9.482 -6.183) 13.245 13.451 ( -1.639 6.196 -3.976) 7.542 13.543 ( -1.651 6.735 1.234) 7.043 13.686 ( -5.876 -0.212 3.037) 6.618 13.981 ( 2.680 5.403 -1.163) 6.142 14.220 ( 2.715 5.407 -10.933) 12.495 14.643 ( 6.839 4.323 1.044) 8.158 14.995 ( 1.098 12.642 1.323) 12.758 15.069 ( 3.822 14.330 -1.644) 14.921 15.231 ( -3.957 2.581 -7.191) 8.605 15.919 ( -9.765 -9.678 13.291) 19.123 16.430 ( 4.361 0.536 6.978) 8.246 16.509 ( 6.531 0.666 4.502) 7.961 17.957 ( -0.335 -16.957 -2.390) 17.128 ======================= Grid point 152 (58/208) ======================= q-point: ( 0.12 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( 0.891 24.552 4.688) 25.012 1.705 ( 13.241 24.878 6.381) 28.896 1.951 ( 19.378 18.807 27.739) 38.713 2.526 ( 5.767 23.404 2.603) 24.244 2.998 ( 19.016 41.278 5.637) 45.796 3.433 ( 1.752 9.662 -12.146) 15.619 3.443 ( -2.729 12.738 -6.443) 14.534 3.856 ( 3.347 14.319 3.061) 15.020 4.277 ( 2.928 4.995 5.667) 8.102 4.540 ( 6.601 1.463 -1.616) 6.951 4.810 ( 3.727 1.714 1.174) 4.267 5.115 ( 0.057 -2.357 2.691) 3.577 5.845 ( -16.684 3.451 -12.409) 21.077 6.130 ( -2.741 6.810 -2.701) 7.822 6.354 ( -0.246 4.359 1.743) 4.701 6.637 ( -13.881 13.760 -2.105) 19.658 6.824 ( 5.600 18.017 -9.380) 21.070 6.946 ( -2.123 -14.974 -4.871) 15.889 7.283 ( 3.095 -5.643 3.718) 7.433 7.417 ( -4.520 24.604 -6.417) 25.826 8.147 ( -1.516 -26.627 -7.512) 27.708 8.658 ( 7.188 -13.407 5.542) 16.190 8.840 ( -0.047 -5.376 5.141) 7.439 9.165 ( 5.229 4.793 14.990) 16.583 9.527 ( -16.122 -5.321 -5.780) 17.935 10.475 ( -0.162 -17.800 -0.531) 17.809 10.965 ( -5.988 6.817 -9.604) 13.212 11.128 ( -3.086 3.026 -3.588) 5.618 11.254 ( -1.994 8.795 -0.955) 9.068 11.759 ( 0.321 -33.482 1.824) 33.533 12.483 ( -9.860 4.837 7.374) 13.229 12.588 ( -2.838 9.246 3.386) 10.247 12.892 ( -2.721 -4.876 -6.085) 8.259 13.128 ( -8.295 1.616 -3.921) 9.316 13.261 ( 1.612 3.959 1.509) 4.533 13.471 ( 2.451 4.958 -3.531) 6.562 13.506 ( -0.625 5.223 -3.709) 6.436 13.651 ( 0.380 -0.207 2.115) 2.159 14.099 ( 5.463 1.043 2.543) 6.115 14.283 ( 7.070 1.714 -6.545) 9.786 14.822 ( 13.027 0.790 1.162) 13.103 15.042 ( 3.334 12.242 1.802) 12.815 15.112 ( -1.371 10.182 5.078) 11.460 15.177 ( -0.774 6.811 -9.143) 11.427 15.747 ( -7.067 -3.753 3.255) 8.638 16.532 ( 5.179 -3.158 4.888) 7.790 16.662 ( 5.893 -4.286 8.804) 11.429 17.915 ( -3.560 -16.541 -2.507) 17.105 ======================= Grid point 153 (59/208) ======================= q-point: ( 0.25 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -0.090 28.647 0.534) 28.653 2.036 ( 18.661 15.130 5.115) 24.563 2.393 ( 21.502 11.773 20.807) 32.154 2.698 ( 11.005 20.921 2.729) 23.796 3.340 ( -5.487 4.397 -9.827) 12.083 3.352 ( 11.470 23.816 2.832) 26.586 3.593 ( 18.734 17.669 -7.320) 26.772 3.922 ( 3.050 14.420 2.169) 14.898 4.356 ( 5.259 7.622 11.388) 14.678 4.556 ( -5.095 0.427 -6.128) 7.981 4.945 ( 6.116 2.441 -7.349) 9.868 5.040 ( -5.866 -2.806 -2.782) 7.072 5.617 ( -2.705 9.068 3.998) 10.272 6.052 ( -6.386 9.107 5.012) 12.199 6.315 ( -9.124 11.316 -5.930) 15.700 6.424 ( -2.390 10.901 -1.456) 11.255 6.861 ( 0.556 3.222 -9.232) 9.794 6.887 ( -2.834 -12.678 -4.607) 13.783 7.329 ( -2.590 6.330 8.995) 11.300 7.389 ( 4.218 19.066 -3.731) 19.881 8.113 ( -1.348 -25.917 -5.891) 26.612 8.757 ( 1.529 -19.594 3.356) 19.938 8.841 ( 0.751 -2.532 1.415) 2.996 9.132 ( -15.302 -9.148 -1.485) 17.890 9.315 ( 0.492 11.691 2.627) 11.993 10.462 ( -0.299 -17.081 -2.657) 17.289 10.839 ( -5.270 12.512 -6.859) 15.211 11.066 ( -2.671 3.685 -1.614) 4.829 11.212 ( -2.176 8.968 -0.479) 9.241 11.771 ( 0.590 -33.649 2.180) 33.725 12.292 ( -10.196 0.998 4.520) 11.198 12.517 ( -4.051 13.363 3.705) 14.447 12.901 ( 3.098 -5.803 -6.291) 9.102 12.992 ( -6.075 6.401 -2.299) 9.119 13.263 ( -0.769 8.091 2.171) 8.413 13.456 ( -1.215 8.507 0.424) 8.603 13.531 ( 1.055 -3.663 -6.497) 7.532 13.673 ( 1.274 1.069 1.234) 2.071 14.136 ( -0.386 2.134 -1.165) 2.462 14.433 ( 7.434 -1.398 2.241) 7.889 14.948 ( -8.278 3.969 -3.235) 9.734 15.111 ( 3.369 3.546 -0.234) 4.897 15.165 ( 2.417 22.152 -3.994) 22.638 15.203 ( 15.270 -12.890 18.807) 27.442 15.721 ( 4.532 6.263 -9.877) 12.543 16.628 ( 4.112 -5.360 1.341) 6.888 16.730 ( 0.250 -4.299 9.056) 10.028 17.823 ( -5.442 -15.776 -2.074) 16.816 ======================= Grid point 154 (60/208) ======================= q-point: ( 0.38 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( 0.240 29.344 0.068) 29.345 2.358 ( 13.597 7.004 2.227) 15.456 2.762 ( 11.931 5.496 12.348) 18.029 2.912 ( 10.986 17.745 3.647) 21.186 3.197 ( -7.609 3.263 -7.771) 11.355 3.490 ( 6.161 18.138 -1.020) 19.183 3.909 ( 6.872 16.123 -2.194) 17.664 3.977 ( 3.371 14.417 2.096) 14.954 4.337 ( -11.687 1.038 -23.991) 26.706 4.574 ( 15.829 6.767 9.830) 19.824 4.822 ( -6.061 2.952 -3.989) 7.834 5.094 ( 1.951 -1.000 -2.992) 3.709 5.755 ( 12.289 7.116 17.829) 22.793 5.905 ( -9.681 18.839 8.612) 22.864 6.087 ( -11.603 14.456 -7.102) 19.850 6.442 ( 1.672 7.202 -1.449) 7.534 6.796 ( -2.679 -8.533 -5.499) 10.499 6.906 ( 3.772 -2.947 -1.597) 5.046 7.276 ( -3.869 5.525 9.232) 11.434 7.467 ( 3.682 18.254 -1.017) 18.650 8.081 ( -0.795 -25.767 -2.439) 25.895 8.709 ( -6.810 -12.532 -3.463) 14.677 8.791 ( -8.360 -8.309 2.390) 12.026 8.965 ( 3.469 -9.057 -12.036) 15.458 9.318 ( -2.222 12.215 1.179) 12.471 10.474 ( 2.179 -12.905 -3.428) 13.529 10.770 ( -0.955 15.839 0.095) 15.868 11.020 ( -2.063 3.106 -2.208) 4.333 11.178 ( -1.232 8.995 -0.016) 9.079 11.784 ( 0.329 -34.212 2.083) 34.277 12.147 ( -5.485 -1.974 3.535) 6.817 12.456 ( -3.162 13.682 2.068) 14.194 12.888 ( -4.277 7.925 -2.674) 9.394 12.956 ( 3.593 -5.736 -6.788) 9.585 13.259 ( 0.301 9.786 1.855) 9.965 13.443 ( -0.752 4.965 2.504) 5.611 13.507 ( -2.044 -2.824 -4.167) 5.432 13.696 ( 0.932 2.275 0.535) 2.516 14.115 ( -1.056 1.068 -1.053) 1.835 14.553 ( 4.552 -1.750 2.980) 5.715 14.752 ( -9.900 -0.643 0.875) 9.959 15.139 ( 0.716 8.999 -3.984) 9.868 15.230 ( 4.137 18.704 2.846) 19.367 15.465 ( 5.580 -6.274 13.686) 16.056 15.883 ( 13.922 -1.344 -10.001) 17.195 16.662 ( -1.704 -3.587 -0.119) 3.973 16.736 ( 0.153 -4.669 6.013) 7.614 17.724 ( -4.186 -14.875 -1.145) 15.495 ======================= Grid point 155 (61/208) ======================= q-point: (-0.50 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( 0.035 29.409 0.030) 29.409 2.511 ( 1.405 1.333 1.497) 2.448 2.755 ( -13.895 1.502 -1.818) 14.094 3.001 ( -3.760 11.265 2.072) 12.055 3.203 ( 9.673 14.329 2.412) 17.456 3.613 ( 7.279 14.474 -1.726) 16.293 3.748 ( -15.297 10.120 -9.881) 20.834 4.007 ( -0.778 16.592 1.851) 16.713 4.280 ( 4.296 9.501 -12.768) 16.485 4.662 ( -4.480 4.812 -10.319) 12.235 4.950 ( 9.112 -0.233 5.475) 10.633 5.055 ( -1.959 0.358 2.138) 2.922 5.755 ( -4.435 24.354 7.302) 25.809 5.858 ( -10.005 8.918 2.696) 13.670 6.058 ( 13.145 8.313 11.016) 19.059 6.463 ( 0.549 7.901 -0.418) 7.931 6.807 ( 5.093 -5.469 -1.415) 7.606 6.989 ( 3.521 -8.761 -0.497) 9.455 7.246 ( 0.566 3.461 10.603) 11.168 7.533 ( 3.688 21.485 3.640) 22.101 8.091 ( 2.186 -25.450 -0.085) 25.544 8.565 ( -4.495 -4.445 -7.261) 9.627 8.658 ( -6.913 -15.943 -7.391) 18.884 9.010 ( -0.620 1.374 -11.560) 11.658 9.284 ( 2.016 2.527 0.365) 3.253 10.504 ( 0.487 -13.219 -3.070) 13.579 10.824 ( 6.352 20.408 5.288) 22.018 10.980 ( -1.453 3.662 -3.509) 5.276 11.169 ( 0.198 8.932 0.692) 8.961 11.787 ( -0.373 -34.102 1.825) 34.152 12.103 ( 0.093 -4.048 3.615) 5.428 12.405 ( -2.155 10.950 -0.190) 11.161 12.831 ( -1.234 10.051 -3.293) 10.649 13.007 ( 2.901 -3.918 -6.711) 8.295 13.284 ( 1.836 9.423 1.416) 9.704 13.413 ( -2.408 -4.927 3.377) 6.441 13.489 ( 1.132 4.731 -1.686) 5.148 13.706 ( 0.028 2.888 -0.254) 2.899 14.104 ( 0.054 -0.095 -0.358) 0.374 14.542 ( -5.555 -3.251 -5.708) 8.603 14.668 ( 0.250 1.367 7.990) 8.110 15.139 ( -0.233 14.015 -2.327) 14.209 15.280 ( -0.758 14.572 2.251) 14.764 15.506 ( -0.309 1.503 7.456) 7.612 16.105 ( 8.383 -15.048 -3.208) 17.522 16.574 ( -6.863 0.676 0.672) 6.928 16.749 ( -0.027 -3.827 2.080) 4.356 17.687 ( 0.813 -14.748 -0.295) 14.773 ======================= Grid point 156 (62/208) ======================= q-point: (-0.38 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -0.369 29.024 0.120) 29.026 2.330 ( -24.874 5.656 -6.031) 26.212 2.426 ( -13.037 2.367 3.506) 13.706 2.876 ( -10.248 16.394 3.652) 19.675 3.357 ( 6.354 13.734 -5.709) 16.174 3.530 ( -5.714 13.846 -1.207) 15.027 3.745 ( 6.119 7.916 -1.428) 10.107 3.977 ( -2.634 15.410 -0.300) 15.637 4.162 ( -18.092 20.375 -1.361) 27.282 4.611 ( 1.648 3.088 -14.761) 15.171 4.846 ( -7.473 -0.425 2.738) 7.970 5.125 ( -2.165 -2.185 -1.151) 3.284 5.744 ( 4.863 29.545 -3.993) 30.208 5.849 ( 7.566 7.825 10.603) 15.195 6.290 ( 9.106 2.335 11.314) 14.710 6.446 ( -2.123 7.329 0.929) 7.686 6.953 ( 7.591 -9.627 -0.205) 12.262 7.006 ( 0.564 -12.076 0.249) 12.091 7.328 ( 3.442 7.673 6.703) 10.754 7.654 ( 8.801 22.064 14.639) 27.903 8.156 ( 4.441 -25.734 -0.499) 26.119 8.485 ( -9.726 -13.094 -14.152) 21.594 8.544 ( 3.230 -5.579 -6.422) 9.100 8.892 ( -6.932 9.537 -14.458) 18.656 9.431 ( 11.104 -8.099 5.300) 14.730 10.478 ( -2.201 -12.718 -3.398) 13.347 10.952 ( 2.065 3.168 -2.498) 4.533 11.009 ( 8.408 20.789 4.072) 22.791 11.181 ( 0.672 8.678 1.174) 8.783 11.776 ( -1.080 -32.913 1.340) 32.958 12.153 ( 4.320 -4.465 3.607) 7.184 12.392 ( 1.372 7.297 -0.416) 7.436 12.821 ( 0.313 11.465 -4.014) 12.151 13.043 ( 2.198 -1.657 -5.404) 6.065 13.319 ( 1.496 5.154 3.807) 6.580 13.406 ( 0.956 -3.108 0.771) 3.342 13.543 ( 5.461 3.650 -2.085) 6.891 13.696 ( -0.960 2.774 0.371) 2.959 14.110 ( 0.322 -0.328 -0.633) 0.782 14.445 ( -2.932 -0.589 -5.554) 6.308 14.656 ( -4.302 1.035 6.206) 7.622 15.120 ( -1.549 15.120 -0.859) 15.224 15.182 ( -8.478 16.460 -0.893) 18.536 15.526 ( 0.392 -1.388 7.070) 7.215 16.159 ( -1.820 -21.095 -0.063) 21.174 16.438 ( -6.618 6.074 -0.723) 9.012 16.729 ( -2.817 -1.613 2.067) 3.848 17.748 ( 5.164 -15.704 -0.296) 16.534 ======================= Grid point 157 (63/208) ======================= q-point: (-0.25 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( -1.215 27.296 0.454) 27.327 1.824 ( -25.059 14.350 -1.315) 28.907 2.146 ( -17.229 10.791 8.819) 22.160 2.661 ( -11.665 18.827 1.858) 22.226 3.435 ( 1.400 13.311 -8.201) 15.697 3.469 ( -4.374 24.118 8.612) 25.981 3.651 ( -23.642 26.956 0.306) 35.856 3.796 ( -0.854 9.387 -1.372) 9.525 4.027 ( 4.007 7.466 -5.594) 10.153 4.547 ( -6.783 0.152 -7.498) 10.112 4.806 ( 1.367 0.740 -3.246) 3.599 5.025 ( -4.281 -0.268 -1.070) 4.421 5.949 ( 13.992 23.688 -3.918) 27.790 6.035 ( 10.324 10.574 5.624) 15.812 6.345 ( -3.203 5.816 -2.218) 7.001 6.487 ( 4.760 4.740 10.681) 12.618 6.977 ( 0.055 -15.459 -1.048) 15.495 7.094 ( 2.494 -7.256 2.946) 8.219 7.337 ( -2.504 3.181 3.002) 5.040 7.888 ( 10.632 22.179 15.624) 29.139 8.227 ( 0.380 -19.589 -6.212) 20.554 8.266 ( -7.232 -18.336 -12.347) 23.258 8.642 ( 6.520 -6.849 -2.682) 9.829 8.781 ( -1.034 8.954 -9.066) 12.784 9.661 ( 11.006 -10.799 7.488) 17.141 10.430 ( -1.671 -11.546 -4.183) 12.393 11.001 ( 4.503 2.234 -3.313) 6.020 11.169 ( 6.063 15.768 2.364) 17.058 11.187 ( 0.121 7.904 -0.580) 7.926 11.758 ( -0.799 -32.709 0.850) 32.729 12.266 ( 6.782 -0.642 4.394) 8.106 12.467 ( 6.246 3.703 1.760) 7.471 12.828 ( 1.660 8.985 -3.644) 9.837 13.082 ( 2.821 1.712 -4.436) 5.529 13.370 ( 3.279 0.348 5.031) 6.015 13.414 ( -0.050 -1.319 -3.763) 3.987 13.649 ( 0.451 1.949 -1.005) 2.239 13.705 ( 5.631 1.522 3.066) 6.590 14.114 ( 1.118 0.766 -3.994) 4.218 14.385 ( -7.292 4.638 -7.332) 11.333 14.519 ( -6.695 1.335 6.549) 9.460 15.039 ( -4.788 15.552 -0.924) 16.298 15.081 ( -2.633 17.102 0.567) 17.313 15.500 ( -4.619 -5.875 1.118) 7.557 16.081 ( -5.320 -17.823 3.459) 18.919 16.351 ( -2.290 7.436 1.038) 7.849 16.641 ( -6.856 -0.039 2.289) 7.228 17.853 ( 5.481 -16.627 -0.975) 17.534 ======================= Grid point 158 (64/208) ======================= q-point: (-0.12 0.14 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( -10.239 19.597 12.226) 25.266 1.566 ( -2.617 28.369 4.182) 28.795 1.859 ( -13.576 21.312 12.217) 28.067 2.496 ( -5.170 20.143 1.317) 20.838 3.065 ( -23.816 48.702 9.507) 55.041 3.465 ( -0.094 13.561 -8.566) 16.040 3.541 ( 0.740 15.585 -4.395) 16.209 3.769 ( -0.626 11.732 1.349) 11.826 4.116 ( 5.364 3.500 -3.893) 7.495 4.414 ( -4.321 -0.227 -4.874) 6.518 4.806 ( -1.164 -0.129 1.760) 2.115 5.016 ( 2.710 0.353 -2.437) 3.661 6.099 ( 3.032 3.596 -1.505) 4.939 6.264 ( 1.193 11.587 -6.275) 13.231 6.337 ( 14.071 21.536 -0.115) 25.726 6.526 ( -2.895 7.513 3.001) 8.593 6.986 ( 0.302 -15.065 0.498) 15.076 7.054 ( -6.110 -0.354 2.398) 6.574 7.282 ( -3.558 -5.799 5.701) 8.876 7.859 ( -12.121 16.372 -23.967) 31.454 8.253 ( 3.845 -18.252 2.582) 18.830 8.267 ( 5.465 -15.047 9.101) 18.415 8.720 ( 3.624 0.497 -0.841) 3.754 8.864 ( 7.829 -0.258 3.915) 8.757 9.819 ( 3.287 -10.023 5.895) 12.083 10.418 ( 1.304 -12.167 -3.465) 12.718 11.099 ( 5.598 0.761 -4.005) 6.925 11.150 ( -2.560 6.375 -3.633) 7.771 11.262 ( 2.815 9.566 -1.245) 10.049 11.751 ( -0.106 -33.330 0.939) 33.343 12.414 ( 7.733 4.081 5.319) 10.234 12.588 ( 4.417 2.200 3.007) 5.779 12.911 ( 8.753 2.730 -1.275) 9.257 13.115 ( 0.288 4.563 -3.686) 5.873 13.390 ( -1.532 -10.227 -4.133) 11.136 13.451 ( 3.654 3.694 -0.718) 5.245 13.598 ( -4.522 -0.003 2.304) 5.075 13.783 ( -1.348 -1.121 5.336) 5.617 14.101 ( -14.489 10.425 -5.009) 18.539 14.166 ( 4.822 3.682 -9.135) 10.966 14.537 ( 4.204 3.719 1.742) 5.877 14.995 ( -0.684 13.174 -0.324) 13.196 15.038 ( -1.170 16.226 0.386) 16.273 15.361 ( -8.314 -3.759 -5.765) 10.793 16.010 ( -3.454 -11.439 10.230) 15.730 16.356 ( 1.958 4.336 5.988) 7.647 16.506 ( -6.085 2.219 1.261) 6.599 17.934 ( 3.064 -17.017 -1.803) 17.385 ======================= Grid point 159 (65/208) ======================= q-point: ( 0.00 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( 3.402 13.681 10.258) 17.435 2.101 ( 3.846 25.037 10.627) 27.469 2.274 ( 0.481 26.520 6.179) 27.235 2.960 ( 0.306 29.270 4.468) 29.611 3.683 ( -4.648 8.588 -12.714) 16.032 3.689 ( -1.736 28.802 -7.070) 29.708 3.883 ( -7.059 27.603 1.475) 28.530 4.063 ( 5.839 14.836 4.801) 16.651 4.340 ( 4.602 10.646 4.228) 12.345 4.449 ( 6.210 3.832 1.813) 7.519 4.805 ( 0.370 1.381 -0.094) 1.433 5.073 ( 1.325 0.758 0.644) 1.657 6.091 ( -5.628 0.547 -5.683) 8.017 6.347 ( -2.265 6.596 -10.275) 12.418 6.548 ( -5.237 4.383 -0.906) 6.890 6.608 ( -2.349 -18.490 -3.967) 19.056 6.848 ( -3.781 -2.349 2.750) 5.232 7.167 ( 12.969 18.183 -0.323) 22.336 7.294 ( -0.075 3.397 10.832) 11.352 7.738 ( -1.308 -13.277 -1.522) 13.427 7.972 ( -8.674 20.381 -13.498) 25.939 8.497 ( -0.242 5.943 -4.045) 7.193 8.697 ( 3.217 -2.527 1.556) 4.377 8.951 ( 7.556 -10.074 12.466) 17.719 9.579 ( -5.926 -11.889 0.981) 13.320 10.356 ( -0.381 3.772 -4.491) 5.878 10.958 ( 0.544 -28.391 1.668) 28.445 11.063 ( -3.295 -13.548 -8.881) 16.531 11.106 ( 1.265 -7.971 1.114) 8.148 11.527 ( -0.309 11.032 -1.759) 11.176 12.593 ( 2.630 -3.039 5.275) 6.632 12.657 ( 2.085 1.959 0.156) 2.865 12.977 ( -5.794 -6.597 -1.713) 8.946 13.042 ( 8.888 -4.627 -1.397) 10.118 13.183 ( -6.811 -0.736 -0.659) 6.882 13.582 ( 0.825 2.186 -2.636) 3.523 13.679 ( 1.643 5.024 4.295) 6.810 13.730 ( -2.289 9.282 2.853) 9.977 14.061 ( -3.861 2.651 4.603) 6.567 14.358 ( 0.003 6.701 -5.463) 8.646 14.760 ( 6.120 8.665 -3.907) 11.305 15.089 ( -1.133 -0.549 -4.059) 4.250 15.197 ( 2.077 4.300 3.464) 5.900 15.403 ( 1.604 6.433 3.113) 7.325 15.835 ( -6.140 0.838 1.544) 6.386 16.457 ( 1.304 4.255 3.741) 5.814 16.556 ( 2.474 1.593 0.806) 3.051 17.571 ( -0.116 -21.422 -1.726) 21.491 ======================= Grid point 160 (66/208) ======================= q-point: ( 0.12 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( 7.081 11.494 7.844) 15.614 2.217 ( 5.481 24.877 2.255) 25.573 2.382 ( 10.161 23.156 18.892) 31.565 3.002 ( 3.631 25.934 4.710) 26.607 3.539 ( -7.676 2.807 -15.076) 17.149 3.772 ( 6.551 20.463 -5.896) 22.281 3.799 ( 2.700 31.566 -0.534) 31.685 4.162 ( 4.043 17.538 3.573) 18.350 4.443 ( 5.107 11.340 6.252) 13.920 4.588 ( 5.258 3.551 3.484) 7.239 4.851 ( 5.458 2.288 -1.641) 6.141 5.080 ( -1.375 -1.026 1.154) 2.067 5.927 ( -9.108 5.998 -5.660) 12.287 6.282 ( -3.086 8.816 -8.538) 12.655 6.473 ( -1.754 4.879 -1.685) 5.452 6.573 ( -0.131 -19.710 -3.411) 20.004 6.758 ( -6.065 1.146 1.407) 6.331 7.264 ( -3.295 7.147 6.589) 10.264 7.344 ( 2.340 18.175 -3.054) 18.578 7.740 ( 1.364 -5.538 -2.728) 6.322 7.854 ( 0.123 14.364 -4.771) 15.136 8.476 ( -1.526 -1.695 -6.093) 6.506 8.724 ( 0.078 -5.408 0.537) 5.436 9.078 ( 1.310 -11.479 15.439) 19.283 9.406 ( -9.800 -9.647 -2.607) 13.997 10.332 ( -0.504 2.397 -5.049) 5.611 10.973 ( 0.035 -8.556 -4.510) 9.672 10.998 ( -0.957 -30.010 -3.768) 30.261 11.118 ( -0.751 -4.518 2.322) 5.135 11.512 ( -1.050 11.243 -1.636) 11.410 12.584 ( -3.022 -0.467 3.356) 4.541 12.708 ( -0.659 5.758 5.796) 8.197 12.773 ( -8.782 -5.168 -1.713) 10.333 13.074 ( -4.047 -3.975 -4.147) 7.027 13.267 ( 10.508 -1.588 -1.076) 10.682 13.577 ( -0.313 3.286 -3.538) 4.838 13.669 ( -2.779 6.428 2.622) 7.478 13.741 ( 1.935 10.890 2.474) 11.334 14.088 ( 4.209 -1.805 3.171) 5.570 14.350 ( 0.876 4.172 -3.341) 5.417 14.838 ( 4.387 1.975 -0.808) 4.878 15.088 ( 1.122 -0.311 -3.881) 4.052 15.170 ( -8.978 -0.236 9.112) 12.794 15.433 ( 2.612 8.583 2.166) 9.229 15.803 ( 4.420 7.866 -6.177) 10.935 16.490 ( 2.077 0.564 2.456) 3.266 16.647 ( 4.890 0.791 4.511) 6.700 17.539 ( -2.863 -20.863 -1.683) 21.126 ======================= Grid point 161 (67/208) ======================= q-point: ( 0.25 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( 4.890 15.240 3.145) 16.312 2.335 ( 7.354 17.090 1.069) 18.636 2.659 ( 13.816 15.310 19.814) 28.599 3.110 ( 6.243 20.614 4.857) 22.079 3.360 ( -8.053 -0.859 -14.089) 16.251 3.794 ( 3.190 19.008 0.234) 19.275 4.059 ( 16.635 24.016 -5.960) 29.816 4.224 ( 1.963 17.517 -0.893) 17.649 4.549 ( 4.482 11.515 2.914) 12.695 4.607 ( -2.106 5.132 2.706) 6.172 4.982 ( 5.445 -0.719 -2.723) 6.130 5.003 ( -5.079 1.037 -3.265) 6.126 5.818 ( -1.193 11.078 5.595) 12.468 6.219 ( -2.559 8.475 0.417) 8.863 6.470 ( 2.041 -2.209 -6.718) 7.360 6.572 ( -2.295 -5.225 -0.337) 5.717 6.658 ( -1.663 1.396 0.478) 2.223 7.128 ( -9.567 24.954 -4.018) 27.026 7.337 ( -2.374 -0.970 -1.864) 3.170 7.757 ( 1.075 0.811 0.442) 1.417 7.934 ( 5.533 16.325 1.839) 17.336 8.410 ( -3.878 -11.184 -6.643) 13.574 8.735 ( 1.646 -7.725 -0.864) 7.945 8.945 ( -14.773 -8.907 2.635) 17.450 9.329 ( -0.036 -11.239 4.896) 12.259 10.355 ( 4.166 5.343 -4.386) 8.071 10.943 ( -0.573 -0.982 -8.078) 8.157 11.008 ( 0.536 -32.241 1.770) 32.294 11.092 ( -2.020 -2.545 1.716) 3.675 11.482 ( -1.806 11.956 -0.811) 12.118 12.452 ( -10.505 10.743 4.179) 15.596 12.623 ( -2.491 -1.865 1.832) 3.611 12.767 ( 1.316 -5.346 -0.905) 5.579 13.004 ( -2.812 -3.486 -3.882) 5.927 13.404 ( 4.331 6.415 0.207) 7.743 13.555 ( -2.044 3.814 -3.031) 5.284 13.636 ( -0.690 5.880 -0.192) 5.923 13.766 ( 0.617 9.776 1.192) 9.868 14.137 ( -0.322 -1.904 0.122) 1.935 14.411 ( 5.295 -0.612 1.528) 5.544 14.885 ( -11.409 -11.110 20.430) 25.903 15.009 ( 6.637 -2.108 -11.888) 13.777 15.143 ( 3.993 1.074 -0.869) 4.225 15.509 ( 4.426 9.643 0.336) 10.616 15.904 ( 5.262 10.162 -5.788) 12.824 16.544 ( 3.095 -1.265 0.543) 3.387 16.725 ( 2.532 2.674 5.682) 6.771 17.466 ( -4.247 -19.669 -1.284) 20.164 ======================= Grid point 162 (68/208) ======================= q-point: ( 0.38 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( 2.059 21.538 0.663) 21.646 2.471 ( 5.859 5.685 1.161) 8.246 2.894 ( 4.726 6.517 11.551) 14.080 3.129 ( -3.127 4.042 -4.873) 7.061 3.320 ( 5.948 12.196 2.140) 13.736 3.892 ( 6.368 18.831 -0.077) 19.879 4.172 ( -6.911 9.294 -13.134) 17.512 4.329 ( 9.773 21.332 -0.285) 23.465 4.482 ( -4.057 13.950 -5.541) 15.549 4.722 ( 8.934 7.562 1.707) 11.829 4.885 ( -3.134 2.948 0.213) 4.308 5.059 ( 0.981 -1.923 -0.789) 2.298 5.872 ( 4.079 5.835 10.627) 12.791 6.155 ( -6.411 9.860 5.749) 13.091 6.515 ( 0.408 -4.721 -2.744) 5.475 6.543 ( 6.276 12.226 -2.338) 13.940 6.699 ( 2.869 0.703 2.326) 3.760 6.942 ( -8.509 24.545 -7.812) 27.127 7.251 ( -5.668 -6.184 0.570) 8.407 7.790 ( 2.128 2.168 4.044) 5.058 8.011 ( 2.031 24.129 0.789) 24.227 8.345 ( -1.353 -18.723 -4.126) 19.220 8.663 ( -11.806 -7.849 -8.257) 16.406 8.792 ( 2.843 -7.574 2.793) 8.559 9.323 ( -1.875 -11.410 2.745) 11.885 10.446 ( 4.673 9.027 -5.049) 11.349 10.944 ( 1.785 1.902 -2.863) 3.873 11.016 ( 0.374 -31.773 1.792) 31.826 11.057 ( -1.452 -1.859 0.672) 2.453 11.449 ( -1.429 12.159 -0.117) 12.243 12.291 ( -6.455 12.937 3.870) 14.967 12.576 ( -3.537 0.028 1.220) 3.741 12.795 ( 2.589 -9.019 -5.763) 11.011 12.960 ( -0.891 -1.473 -3.438) 3.845 13.448 ( -0.839 10.204 -2.873) 10.634 13.495 ( -2.501 4.303 4.193) 6.508 13.615 ( -1.465 6.151 -0.915) 6.389 13.787 ( 1.435 6.545 1.027) 6.778 14.102 ( -2.481 -2.304 -0.254) 3.395 14.499 ( 2.193 -3.807 -0.572) 4.431 14.695 ( -7.424 -4.596 14.338) 16.787 15.143 ( 5.042 -5.166 -2.919) 7.786 15.277 ( 9.758 -5.282 -3.304) 11.578 15.586 ( 3.507 8.761 -0.022) 9.437 15.941 ( -0.944 4.419 -1.477) 4.754 16.595 ( 1.984 0.172 -1.015) 2.235 16.769 ( 1.458 5.887 4.288) 7.427 17.391 ( -3.167 -18.124 -0.776) 18.415 ======================= Grid point 163 (69/208) ======================= q-point: (-0.50 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( -0.234 23.554 0.142) 23.556 2.530 ( -0.089 0.594 1.261) 1.397 2.763 ( -13.658 0.223 -6.475) 15.117 3.193 ( 4.187 8.650 6.102) 11.384 3.445 ( 6.219 11.310 7.029) 14.697 3.935 ( -11.753 9.761 -16.520) 22.502 3.995 ( 3.786 20.707 -3.902) 21.409 4.387 ( -1.943 20.382 2.307) 20.604 4.517 ( 5.676 13.214 -4.243) 14.994 4.759 ( -2.331 4.835 -6.045) 8.084 4.963 ( 3.243 1.683 2.702) 4.545 5.038 ( -0.186 -1.479 3.127) 3.464 5.975 ( 2.740 2.000 11.590) 12.076 6.029 ( -3.433 12.564 4.560) 13.800 6.564 ( 3.124 -2.591 -1.901) 4.482 6.646 ( 2.951 24.325 -0.900) 24.520 6.701 ( -3.113 7.217 0.192) 7.862 6.838 ( -0.809 2.517 -2.579) 3.694 7.211 ( 3.329 -4.772 1.633) 6.043 7.858 ( 4.248 3.750 7.096) 9.080 8.014 ( -1.311 16.053 -0.753) 16.124 8.345 ( 1.349 -7.946 -2.621) 8.475 8.496 ( -3.932 -4.611 -7.723) 9.816 8.842 ( 1.321 -12.506 -1.296) 12.642 9.287 ( -1.164 -6.145 1.334) 6.395 10.468 ( -1.125 8.116 -7.137) 10.866 10.954 ( -0.784 -3.836 -3.465) 5.229 11.009 ( -1.072 -30.264 -0.116) 30.283 11.120 ( 7.069 2.422 8.147) 11.055 11.435 ( 0.043 11.845 0.072) 11.845 12.228 ( -1.289 14.138 3.566) 14.638 12.503 ( -3.243 0.304 -2.147) 3.901 12.844 ( 3.470 -10.382 -6.374) 12.667 12.973 ( 2.796 0.725 -3.690) 4.686 13.335 ( -7.416 2.035 -0.472) 7.705 13.521 ( 2.140 11.021 3.851) 11.869 13.604 ( 0.705 5.058 -0.295) 5.115 13.803 ( -0.377 5.524 0.630) 5.573 14.068 ( -0.695 -3.370 0.224) 3.448 14.461 ( -3.459 -4.868 -3.486) 6.915 14.684 ( 0.912 0.891 14.095) 14.153 15.209 ( 2.503 -2.258 0.505) 3.409 15.406 ( 3.915 -5.178 -7.239) 9.723 15.618 ( -1.615 6.697 1.004) 6.961 15.887 ( -3.123 -5.144 0.743) 6.063 16.603 ( -0.985 3.508 -1.571) 3.967 16.796 ( 0.608 7.675 3.311) 8.380 17.360 ( 0.254 -17.608 -0.479) 17.616 ======================= Grid point 164 (70/208) ======================= q-point: (-0.38 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( -3.947 19.315 0.101) 19.714 2.463 ( -14.964 8.186 -5.948) 18.064 2.478 ( -6.200 4.605 1.327) 7.836 3.189 ( -5.046 15.218 4.277) 16.594 3.594 ( 8.213 7.917 6.442) 13.101 3.756 ( -4.078 12.480 -11.178) 17.244 4.024 ( 0.075 18.268 -4.177) 18.740 4.331 ( -3.682 18.297 -2.161) 18.789 4.545 ( -4.771 14.836 0.317) 15.587 4.689 ( -4.801 5.855 -6.466) 9.957 4.878 ( -5.099 4.788 1.031) 7.070 5.084 ( -0.549 -1.787 -0.273) 1.890 5.988 ( 3.040 8.443 9.893) 13.356 6.135 ( 8.174 3.891 6.880) 11.370 6.554 ( -1.622 10.674 -2.638) 11.114 6.662 ( -1.351 5.029 -0.913) 5.287 6.718 ( 4.766 7.096 -0.750) 8.581 6.829 ( -0.187 -1.650 2.237) 2.786 7.334 ( 6.498 -5.911 -0.999) 8.841 7.921 ( -1.412 -0.021 0.220) 1.429 8.025 ( 4.979 8.231 8.390) 12.764 8.381 ( 3.631 5.722 -4.635) 8.210 8.476 ( 1.563 2.470 -4.366) 5.254 8.812 ( -3.482 -13.969 -6.426) 15.765 9.325 ( 5.048 -4.215 4.876) 8.186 10.413 ( -2.790 5.385 -5.987) 8.522 10.933 ( -0.085 -5.142 -4.270) 6.684 10.993 ( -0.719 -32.630 -0.012) 32.638 11.254 ( 3.944 -0.070 8.884) 9.721 11.452 ( 1.762 12.500 -0.147) 12.625 12.235 ( 1.605 11.252 0.112) 11.366 12.481 ( 1.593 1.065 -1.416) 2.382 12.907 ( 3.973 -9.572 -2.701) 10.710 13.005 ( -0.625 4.803 -0.915) 4.929 13.247 ( 0.007 -2.997 -4.609) 5.498 13.573 ( 2.734 11.371 1.907) 11.849 13.641 ( 3.553 5.259 -0.826) 6.400 13.767 ( -3.422 2.936 1.593) 4.782 14.074 ( 1.000 -2.875 -0.504) 3.085 14.422 ( 0.411 -2.035 -1.470) 2.544 14.694 ( -3.197 3.465 12.029) 12.920 15.231 ( -0.763 -0.532 1.223) 1.537 15.409 ( -1.615 0.273 -8.192) 8.354 15.504 ( -9.208 -0.889 5.088) 10.557 15.870 ( 0.987 -5.134 -3.357) 6.213 16.557 ( -3.323 6.018 -1.234) 6.984 16.787 ( -2.564 7.511 3.691) 8.753 17.398 ( 3.663 -18.919 -0.500) 19.276 ======================= Grid point 165 (71/208) ======================= q-point: (-0.25 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( -10.023 10.958 0.572) 14.862 2.204 ( -9.834 21.891 -1.481) 24.044 2.371 ( -5.689 13.916 3.966) 15.549 3.073 ( -6.790 22.186 3.922) 23.531 3.715 ( 2.684 15.366 -9.377) 18.200 3.770 ( 6.945 6.026 7.794) 12.054 3.983 ( -4.131 15.367 -5.160) 16.728 4.258 ( -3.564 13.810 -5.974) 15.463 4.330 ( -14.957 33.035 6.530) 36.847 4.553 ( -7.707 0.827 -4.177) 8.805 4.843 ( -0.532 3.105 -4.085) 5.159 5.040 ( -1.824 1.717 -0.418) 2.540 6.090 ( 4.643 4.696 4.541) 8.014 6.353 ( 12.745 -1.790 8.193) 15.257 6.505 ( -2.804 8.837 -2.960) 9.732 6.657 ( 0.464 -10.554 -0.996) 10.611 6.791 ( 4.106 23.905 -7.346) 25.343 6.854 ( 1.454 -7.121 10.523) 12.789 7.382 ( -1.148 -5.216 -4.143) 6.759 7.857 ( -3.862 -9.610 -2.172) 10.583 8.150 ( 4.192 8.586 7.277) 12.011 8.456 ( 3.466 23.186 -2.455) 23.571 8.519 ( 4.380 -2.620 -4.356) 6.710 8.742 ( -1.201 -11.581 -4.584) 12.513 9.466 ( 7.844 -8.287 6.370) 13.068 10.365 ( -1.074 4.296 -4.576) 6.368 10.947 ( 1.664 -12.298 -1.801) 12.540 10.985 ( 0.366 -27.725 -0.200) 27.728 11.270 ( -3.018 -5.815 2.572) 7.038 11.494 ( 2.377 13.066 -0.461) 13.288 12.307 ( 6.560 5.867 -0.835) 8.841 12.539 ( 3.974 -0.114 0.126) 3.978 12.915 ( -3.592 -2.029 5.177) 6.619 13.026 ( 4.553 -4.470 -3.251) 7.161 13.284 ( 3.209 1.124 -7.044) 7.822 13.600 ( -0.578 10.046 -1.169) 10.131 13.697 ( -3.616 1.595 2.707) 4.790 13.730 ( 4.196 1.713 1.374) 4.736 14.117 ( 4.872 0.243 -3.415) 5.955 14.470 ( 4.003 1.906 -1.054) 4.557 14.576 ( -10.839 6.030 11.429) 16.866 15.179 ( -3.858 1.911 0.737) 4.368 15.331 ( -5.849 -3.263 -8.119) 10.525 15.384 ( -3.013 2.195 7.003) 7.933 15.893 ( 2.006 -1.191 -4.820) 5.355 16.488 ( -3.565 5.880 -0.336) 6.884 16.708 ( -6.290 6.897 4.161) 10.220 17.479 ( 4.477 -20.536 -0.861) 21.036 ======================= Grid point 166 (72/208) ======================= q-point: (-0.12 0.21 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( -5.784 13.740 6.024) 16.079 2.085 ( -3.487 23.577 6.125) 24.608 2.294 ( -3.064 23.014 4.012) 23.561 2.979 ( -3.398 27.969 3.991) 28.456 3.740 ( 0.638 12.302 -8.070) 14.727 3.832 ( -9.926 20.920 -6.670) 24.096 3.921 ( 7.357 12.876 4.314) 15.444 4.052 ( -11.045 31.238 4.278) 33.408 4.269 ( 2.227 13.150 -0.201) 13.339 4.424 ( -3.850 1.735 -2.233) 4.777 4.817 ( -1.248 1.323 -1.429) 2.313 5.043 ( 1.552 2.295 -0.412) 2.801 6.144 ( 0.395 1.558 -1.271) 2.049 6.409 ( -2.892 5.962 -6.504) 9.285 6.599 ( 5.295 -14.742 2.761) 15.905 6.636 ( -2.495 -4.868 -1.580) 5.693 6.883 ( -0.439 -3.597 8.377) 9.127 6.910 ( 11.108 25.162 -2.795) 27.647 7.318 ( -3.565 -1.391 0.382) 3.846 7.786 ( -3.178 -14.230 -1.803) 14.691 8.139 ( -5.515 14.930 -6.392) 17.151 8.497 ( 1.220 19.304 -1.758) 19.422 8.609 ( 5.219 -4.564 -0.944) 6.997 8.796 ( 6.398 -9.623 4.969) 12.579 9.594 ( 3.510 -11.586 4.914) 13.065 10.356 ( 0.602 4.755 -4.236) 6.397 10.955 ( -0.279 -29.811 1.155) 29.835 11.034 ( 3.881 -11.058 0.030) 11.719 11.179 ( -5.492 -9.567 -5.072) 12.141 11.525 ( 0.925 11.810 -1.105) 11.897 12.465 ( 8.844 2.915 2.737) 9.705 12.615 ( 3.680 -2.261 -1.054) 4.446 12.887 ( 1.476 -4.687 4.658) 6.771 13.075 ( 0.248 -8.070 -5.665) 9.863 13.299 ( -2.657 3.972 -1.547) 5.023 13.564 ( -0.688 2.016 -0.460) 2.180 13.665 ( -0.500 7.642 0.705) 7.691 13.760 ( -0.987 0.446 4.160) 4.298 14.181 ( -3.652 1.581 2.298) 4.596 14.372 ( -4.283 11.885 -2.891) 12.959 14.607 ( 8.552 4.692 0.902) 9.796 15.128 ( -1.869 2.358 0.534) 3.056 15.210 ( -4.366 -0.539 -5.559) 7.089 15.373 ( 0.309 4.908 4.756) 6.842 15.911 ( -0.764 0.226 -0.488) 0.934 16.440 ( -0.986 4.592 1.162) 4.838 16.591 ( -5.578 5.528 2.697) 8.304 17.548 ( 2.755 -21.365 -1.380) 21.586 ======================= Grid point 167 (73/208) ======================= q-point: ( 0.00 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 2.163 10.827 6.944) 13.043 2.534 ( 4.109 18.004 9.118) 20.595 2.752 ( 1.201 21.447 2.163) 21.589 3.571 ( -1.000 31.163 2.362) 31.268 3.753 ( -7.612 -0.013 -10.752) 13.173 4.100 ( 0.090 16.307 -3.574) 16.694 4.275 ( -4.890 8.556 -2.220) 10.101 4.366 ( 7.967 14.105 3.263) 16.525 4.586 ( 5.027 10.186 4.095) 12.074 4.742 ( -0.194 27.902 5.142) 28.372 4.850 ( 1.461 3.230 -2.984) 4.634 5.102 ( -0.475 2.030 0.338) 2.112 6.083 ( 0.221 -24.273 -6.358) 25.093 6.122 ( -2.902 2.114 -1.987) 4.104 6.481 ( 0.007 2.526 -7.357) 7.778 6.755 ( -1.963 9.996 2.316) 10.447 6.824 ( -4.400 1.935 3.311) 5.837 7.235 ( -0.341 -4.990 -1.896) 5.349 7.315 ( 7.878 -0.411 13.030) 15.232 7.782 ( -0.321 13.388 0.474) 13.401 8.282 ( 0.583 -5.768 -1.683) 6.037 8.604 ( -3.792 23.023 -11.709) 26.107 8.729 ( 5.547 -8.567 11.259) 15.196 8.857 ( -3.779 9.227 -14.222) 17.369 9.350 ( -6.339 -9.809 -1.475) 11.772 10.282 ( -0.262 -32.625 -0.038) 32.626 10.460 ( -3.299 1.979 -5.128) 6.410 10.850 ( 1.997 -15.132 4.543) 15.925 10.909 ( 2.990 -6.405 4.129) 8.186 11.817 ( -0.617 17.204 -1.704) 17.299 12.444 ( 0.708 -11.171 -1.640) 11.313 12.673 ( -0.419 -0.547 1.005) 1.218 12.839 ( 4.847 -5.733 1.339) 7.626 12.976 ( 6.463 -1.357 -8.278) 10.589 13.237 ( -8.493 4.001 2.087) 9.617 13.588 ( 1.258 -0.465 -0.114) 1.346 13.696 ( 1.856 -0.641 7.698) 7.944 13.994 ( 1.597 12.874 1.661) 13.078 14.113 ( -6.907 3.221 3.973) 8.594 14.427 ( -2.533 0.621 2.335) 3.500 14.987 ( 3.252 12.151 -8.689) 15.288 15.092 ( 0.125 1.721 -1.096) 2.044 15.265 ( 1.323 3.120 6.228) 7.090 15.431 ( 1.968 -1.304 3.216) 3.989 15.902 ( -2.041 4.285 -4.552) 6.577 16.553 ( 4.118 -0.392 0.088) 4.137 16.576 ( -3.853 4.978 0.795) 6.345 17.132 ( 0.037 -22.232 -0.965) 22.253 ======================= Grid point 168 (74/208) ======================= q-point: ( 0.12 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( 4.852 8.715 7.044) 12.211 2.639 ( 4.168 16.818 6.763) 18.600 2.811 ( 4.764 19.456 8.716) 21.845 3.532 ( -2.952 21.752 -3.132) 22.174 3.559 ( -9.759 4.872 -8.086) 13.577 4.109 ( -1.230 14.335 0.712) 14.406 4.254 ( 5.727 14.488 -5.808) 16.626 4.507 ( 6.305 12.046 -0.130) 13.597 4.687 ( 4.057 8.691 8.382) 12.737 4.783 ( 2.767 22.869 2.345) 23.155 4.911 ( 5.166 4.483 -2.894) 7.427 5.081 ( -1.838 1.142 -0.503) 2.221 6.016 ( -5.057 -7.502 -5.680) 10.683 6.115 ( 1.432 -10.796 -0.448) 10.899 6.491 ( 1.927 9.427 -9.107) 13.248 6.661 ( -3.491 11.248 3.270) 12.222 6.789 ( -2.856 1.908 5.173) 6.210 7.230 ( 0.124 -3.723 -1.857) 4.163 7.484 ( 6.424 -0.643 12.783) 14.321 7.814 ( 3.588 6.194 1.761) 7.372 8.259 ( -4.400 11.922 -6.306) 14.186 8.469 ( -4.522 11.045 -11.725) 16.731 8.733 ( -5.102 2.906 -8.273) 10.144 8.860 ( 2.165 -7.038 9.859) 12.305 9.177 ( -10.320 -11.655 -5.685) 16.573 10.277 ( -0.261 -28.712 -0.187) 28.714 10.419 ( 1.670 -3.930 -4.394) 6.128 10.903 ( 2.839 -7.442 3.164) 8.571 10.985 ( 2.827 -3.836 3.995) 6.218 11.802 ( -0.669 17.253 -1.598) 17.340 12.445 ( -0.016 -11.211 -2.812) 11.559 12.654 ( -2.421 -3.934 3.402) 5.737 12.824 ( -2.126 0.302 -0.707) 2.261 13.075 ( -7.532 4.783 -0.659) 8.947 13.219 ( 14.572 -2.351 -2.209) 14.924 13.598 ( 0.219 -0.231 -0.957) 1.008 13.753 ( 1.024 2.639 8.058) 8.541 13.990 ( -1.284 10.875 3.393) 11.464 14.058 ( 0.874 0.772 -1.314) 1.757 14.401 ( -0.500 0.530 0.149) 0.744 14.931 ( -7.115 7.333 -2.449) 10.507 15.101 ( -2.358 1.543 0.778) 2.924 15.163 ( -7.756 0.425 4.220) 8.840 15.492 ( 3.662 -0.804 2.224) 4.360 15.963 ( 7.521 6.664 -6.007) 11.708 16.530 ( 0.524 2.025 -0.044) 2.092 16.681 ( 7.038 2.776 1.756) 7.767 17.112 ( -1.872 -21.601 -0.812) 21.697 ======================= Grid point 169 (75/208) ======================= q-point: ( 0.25 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( 6.349 5.703 4.961) 9.871 2.683 ( -0.224 14.779 2.463) 14.985 2.946 ( 5.897 12.537 12.899) 18.929 3.331 ( -9.811 0.642 -11.643) 15.240 3.536 ( 1.944 21.004 2.281) 21.217 4.097 ( 0.695 11.420 1.784) 11.580 4.395 ( 7.593 12.907 -7.753) 16.863 4.606 ( 4.936 13.586 -1.871) 14.576 4.754 ( 1.804 9.914 6.673) 12.086 4.843 ( 3.628 19.280 -1.525) 19.678 4.972 ( -0.479 1.311 -2.326) 2.712 5.044 ( -0.656 2.558 -1.534) 3.054 5.918 ( -3.941 -6.004 -3.982) 8.212 6.143 ( 1.981 -9.222 -0.661) 9.455 6.536 ( 4.069 20.256 1.694) 20.730 6.671 ( 1.995 5.352 0.589) 5.742 6.724 ( -3.454 2.175 4.147) 5.818 7.228 ( -0.164 0.397 -1.733) 1.786 7.578 ( 1.777 7.858 7.441) 10.967 7.888 ( 1.931 0.680 -0.088) 2.049 8.124 ( -5.231 16.243 -4.663) 17.690 8.419 ( -1.073 3.852 -8.890) 9.748 8.619 ( -4.613 1.653 -8.535) 9.841 8.815 ( -9.066 -3.894 7.077) 12.143 9.037 ( -1.917 -15.332 -0.390) 15.456 10.280 ( 0.785 -28.217 -0.918) 28.242 10.526 ( 9.452 -0.506 -0.018) 9.466 10.950 ( 1.539 -5.560 2.407) 6.252 11.009 ( -0.726 0.388 -0.224) 0.853 11.786 ( -0.745 17.802 -0.840) 17.837 12.442 ( 0.396 -11.742 -4.129) 12.453 12.581 ( -4.789 -0.211 0.654) 4.838 12.803 ( -1.265 4.307 2.295) 5.042 12.948 ( -5.184 1.151 -1.167) 5.437 13.458 ( 8.861 -1.749 3.984) 9.872 13.609 ( 1.850 1.368 -2.017) 3.060 13.739 ( -2.077 5.967 0.657) 6.352 13.983 ( -1.767 9.505 3.484) 10.276 14.079 ( 0.453 -2.436 -2.835) 3.765 14.414 ( 1.485 0.808 -0.017) 1.691 14.691 ( -14.715 -6.597 9.405) 18.668 15.025 ( 0.025 2.878 -5.245) 5.982 15.168 ( 2.706 1.638 -0.286) 3.176 15.562 ( 3.420 -2.390 1.027) 4.297 16.045 ( 0.226 2.923 -2.019) 3.560 16.592 ( 5.542 5.252 -0.365) 7.644 16.808 ( 5.840 4.533 1.397) 7.524 17.070 ( -2.085 -19.325 -0.407) 19.442 ======================= Grid point 170 (76/208) ======================= q-point: ( 0.38 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( 6.977 4.458 2.220) 8.572 2.635 ( -5.452 7.930 1.928) 9.815 2.971 ( -5.288 3.586 -3.116) 7.108 3.244 ( 2.696 8.584 5.088) 10.336 3.607 ( 4.357 15.522 3.448) 16.486 4.127 ( 1.074 7.062 0.048) 7.143 4.446 ( -0.060 16.145 -11.709) 19.944 4.707 ( 5.157 14.113 0.587) 15.037 4.779 ( -0.110 13.128 0.406) 13.134 4.891 ( 0.041 9.786 -6.621) 11.815 4.934 ( 0.901 3.847 2.841) 4.866 5.037 ( -0.569 0.528 -0.630) 1.000 5.869 ( -0.533 -9.205 -2.331) 9.511 6.203 ( 4.082 -1.810 -0.632) 4.510 6.558 ( -4.499 13.897 5.092) 15.469 6.671 ( 1.362 5.576 7.734) 9.631 6.773 ( 4.938 2.827 -2.171) 6.090 7.217 ( -0.634 6.874 -1.889) 7.157 7.564 ( -3.823 21.769 -2.486) 22.241 7.888 ( 1.338 4.057 1.872) 4.665 8.082 ( -1.693 -1.776 -1.198) 2.731 8.406 ( 1.513 11.135 0.609) 11.254 8.516 ( -4.975 -0.663 -10.476) 11.616 8.674 ( -4.314 -5.004 0.821) 6.658 9.056 ( 2.308 -12.156 8.234) 14.862 10.297 ( 1.049 -30.004 -1.271) 30.049 10.710 ( 7.058 5.062 0.320) 8.691 10.954 ( -3.912 -3.186 -2.615) 5.683 10.992 ( 3.306 -0.121 1.859) 3.795 11.774 ( -0.370 18.900 -0.200) 18.905 12.437 ( -0.705 -9.406 -4.005) 10.247 12.532 ( 1.122 2.551 -1.871) 3.357 12.742 ( -5.728 7.256 2.199) 9.502 12.895 ( -0.051 -3.296 -3.730) 4.978 13.512 ( -4.111 -2.253 9.390) 10.495 13.663 ( 2.093 4.712 -1.618) 5.404 13.713 ( -0.116 8.167 -1.618) 8.327 13.916 ( -4.001 5.346 3.437) 7.510 14.039 ( -3.932 -3.413 0.871) 5.279 14.398 ( -2.130 -5.700 -5.353) 8.105 14.602 ( 3.135 -3.497 8.037) 9.309 15.066 ( 4.325 -0.291 -5.362) 6.895 15.228 ( 3.516 -0.847 -1.302) 3.843 15.626 ( 3.448 -3.335 0.357) 4.810 15.963 ( -8.391 -2.059 2.168) 8.907 16.695 ( 4.398 7.747 0.410) 8.918 16.895 ( 3.025 2.268 -0.122) 3.782 17.048 ( 0.024 -12.250 -0.093) 12.250 ======================= Grid point 171 (77/208) ======================= q-point: (-0.50 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.437 ( -2.964 7.409 -0.899) 8.031 2.519 ( -1.134 -2.022 1.586) 2.809 2.843 ( -5.846 9.739 -7.512) 13.618 3.350 ( 5.430 7.512 9.966) 13.610 3.685 ( 2.802 12.822 5.689) 14.304 4.094 ( -3.777 7.490 -5.866) 10.236 4.419 ( -0.144 19.543 -10.295) 22.089 4.733 ( -3.251 11.761 -0.653) 12.219 4.756 ( -1.385 9.841 -3.501) 10.537 4.871 ( -0.408 7.805 -1.085) 7.891 5.002 ( 3.958 1.260 1.789) 4.522 5.037 ( 1.046 3.553 -0.959) 3.826 5.885 ( 2.069 -12.357 -0.332) 12.533 6.258 ( 0.881 7.058 -0.181) 7.115 6.491 ( -1.808 5.378 1.471) 5.861 6.692 ( -0.663 -0.614 9.256) 9.300 6.829 ( 0.457 6.126 -1.064) 6.234 7.205 ( -0.095 12.592 -2.176) 12.779 7.472 ( -4.027 21.494 -5.984) 22.672 7.973 ( 3.662 4.578 6.018) 8.402 8.036 ( 0.486 2.511 -1.452) 2.941 8.362 ( -3.032 -2.708 -12.035) 12.703 8.568 ( 8.241 12.610 10.613) 18.428 8.617 ( -2.032 -7.371 -3.233) 8.302 9.139 ( 4.522 -6.405 11.588) 13.991 10.312 ( 0.688 -31.028 -0.758) 31.045 10.714 ( -4.841 7.958 -6.886) 11.584 10.861 ( -4.436 -6.031 -6.115) 9.667 11.112 ( 6.050 -0.849 8.556) 10.513 11.775 ( 0.576 19.735 0.202) 19.745 12.416 ( -0.449 -7.982 -4.061) 8.967 12.574 ( -3.354 16.105 1.538) 16.522 12.655 ( 2.988 -5.988 -4.369) 7.992 12.932 ( 5.391 -2.111 -6.084) 8.398 13.355 ( -12.135 -2.722 10.006) 15.962 13.671 ( 0.675 1.655 -0.892) 1.998 13.743 ( 2.856 10.084 0.695) 10.504 13.891 ( -1.836 3.748 2.369) 4.798 13.976 ( -1.285 -5.685 1.797) 6.099 14.363 ( -0.702 -4.139 -5.672) 7.057 14.710 ( 5.380 1.527 8.064) 9.813 15.142 ( 4.006 -2.614 -3.612) 5.994 15.278 ( 1.820 -4.632 -5.333) 7.294 15.686 ( -0.331 -0.336 1.550) 1.620 15.778 ( -7.705 -6.725 2.348) 10.494 16.739 ( 0.016 8.419 0.856) 8.463 16.925 ( 0.797 -4.474 -0.091) 4.545 17.061 ( 0.592 -3.478 -0.039) 3.528 ======================= Grid point 172 (78/208) ======================= q-point: (-0.38 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.263 ( -10.313 2.225 -0.843) 10.584 2.570 ( 1.101 4.021 -0.729) 4.232 2.745 ( -2.885 17.528 -4.255) 18.267 3.450 ( 3.392 9.798 6.485) 12.229 3.740 ( 2.615 9.795 8.688) 13.351 4.019 ( -1.862 12.206 -6.914) 14.151 4.397 ( -0.836 17.860 -8.151) 19.650 4.642 ( -5.763 11.623 -3.484) 13.433 4.681 ( -5.682 4.036 -3.455) 7.779 4.860 ( -0.891 8.663 -0.335) 8.715 5.043 ( -0.730 7.792 -0.351) 7.834 5.067 ( 1.955 2.280 0.561) 3.055 5.945 ( 4.340 -13.795 0.944) 14.493 6.237 ( -2.309 7.265 0.195) 7.626 6.491 ( 1.415 -0.838 -0.309) 1.673 6.689 ( -1.628 1.065 4.176) 4.607 6.809 ( -0.922 7.001 5.115) 8.720 7.210 ( 0.980 12.873 -2.310) 13.115 7.396 ( -3.624 11.771 -4.989) 13.289 7.938 ( -3.428 5.176 -0.424) 6.223 8.180 ( 8.960 7.148 4.389) 12.273 8.340 ( 2.581 -4.022 -9.890) 10.985 8.547 ( -2.710 -6.833 -4.153) 8.443 8.790 ( 10.675 16.739 11.768) 23.079 9.247 ( 4.554 -2.824 11.045) 12.276 10.318 ( -0.153 -32.056 0.346) 32.058 10.585 ( -5.862 8.226 -8.180) 12.998 10.778 ( -3.081 -10.239 -6.854) 12.700 11.178 ( -1.079 -4.186 8.785) 9.791 11.793 ( 1.187 19.242 0.422) 19.283 12.407 ( 0.069 -8.954 -3.772) 9.716 12.464 ( -4.036 8.669 -6.156) 11.373 12.769 ( 5.628 -2.059 1.864) 6.276 13.049 ( 1.595 2.335 -0.085) 2.829 13.199 ( 0.404 -4.071 0.722) 4.154 13.699 ( 1.863 1.184 -1.718) 2.797 13.790 ( -1.945 2.052 2.379) 3.695 13.823 ( -0.887 9.553 0.292) 9.599 14.012 ( 4.058 -2.755 0.386) 4.920 14.367 ( 2.352 -2.929 -1.192) 3.941 14.794 ( 0.822 6.076 11.585) 13.107 15.189 ( 0.953 -2.181 -0.216) 2.390 15.266 ( -2.101 -7.475 -8.385) 11.428 15.516 ( -9.748 -0.915 3.695) 10.465 15.821 ( 5.520 -3.226 -3.938) 7.509 16.699 ( -4.114 7.848 0.528) 8.876 16.931 ( -0.892 -1.634 0.885) 2.062 17.057 ( -0.533 -7.856 0.289) 7.879 ======================= Grid point 173 (79/208) ======================= q-point: (-0.25 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( -7.316 5.535 0.828) 9.211 2.530 ( -3.649 11.365 -0.033) 11.936 2.730 ( 0.598 19.828 -0.744) 19.851 3.503 ( 1.951 19.198 3.655) 19.640 3.821 ( 3.721 3.324 7.078) 8.659 4.022 ( 3.300 13.763 -3.933) 14.690 4.353 ( -3.251 19.576 -5.188) 20.511 4.521 ( -5.599 12.422 -4.922) 14.488 4.549 ( -6.726 0.720 -3.174) 7.472 4.834 ( -1.957 10.954 0.881) 11.163 4.980 ( -5.607 14.198 -1.366) 15.326 5.090 ( 0.666 3.502 0.459) 3.594 6.034 ( 4.263 -18.298 -1.256) 18.830 6.195 ( -1.771 1.187 -0.308) 2.154 6.550 ( 4.439 -1.428 2.092) 5.111 6.623 ( -3.919 2.810 -3.884) 6.192 6.850 ( 2.702 7.299 11.924) 14.239 7.227 ( 0.901 8.653 -2.153) 8.962 7.308 ( -4.847 3.862 -3.095) 6.927 7.872 ( -3.510 11.248 0.613) 11.799 8.309 ( 2.257 -5.469 -1.319) 6.062 8.388 ( 5.034 -3.994 -8.361) 10.545 8.560 ( 4.954 5.061 2.558) 7.529 8.958 ( 4.604 20.787 2.843) 21.479 9.342 ( 3.875 -3.741 8.164) 9.781 10.306 ( -1.035 -32.618 0.486) 32.638 10.505 ( -1.376 7.297 -5.159) 9.042 10.738 ( 0.109 -14.031 -3.034) 14.355 11.104 ( -7.418 -9.117 5.197) 12.852 11.816 ( 1.033 18.117 0.075) 18.146 12.408 ( 0.900 -7.179 -2.302) 7.593 12.448 ( 3.732 2.248 -8.171) 9.259 12.838 ( -0.056 -2.414 4.459) 5.071 12.969 ( -3.650 -3.600 0.909) 5.207 13.335 ( 7.080 2.745 -3.304) 8.281 13.669 ( -6.957 -0.853 0.178) 7.012 13.710 ( -1.536 -1.194 1.516) 2.467 13.879 ( 3.632 12.004 0.558) 12.554 14.133 ( 7.954 1.247 -3.149) 8.645 14.469 ( 8.702 -0.690 3.237) 9.310 14.743 ( -8.060 9.504 12.986) 17.998 15.177 ( -2.056 -1.606 0.305) 2.626 15.200 ( -1.582 -4.349 -5.186) 6.951 15.421 ( -1.826 -0.702 0.530) 2.027 15.913 ( 4.823 0.229 -6.618) 8.192 16.602 ( -5.682 5.989 0.023) 8.255 16.859 ( -7.042 5.941 2.549) 9.560 17.072 ( 2.099 -18.878 -0.357) 18.998 ======================= Grid point 174 (80/208) ======================= q-point: (-0.12 0.29 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( -2.392 9.708 4.178) 10.836 2.487 ( -0.562 16.635 4.832) 17.332 2.739 ( 0.353 20.922 0.408) 20.929 3.549 ( 2.195 27.821 3.146) 28.084 3.854 ( -1.417 0.904 -3.214) 3.627 4.108 ( 3.563 11.577 -1.013) 12.155 4.267 ( -1.922 19.376 -1.217) 19.509 4.391 ( -6.582 6.912 -3.286) 10.095 4.510 ( 2.118 9.166 -0.575) 9.425 4.786 ( -3.913 24.129 4.871) 24.925 4.870 ( -3.681 7.533 -3.555) 9.107 5.101 ( 0.380 3.440 0.504) 3.498 6.079 ( 1.260 -22.588 -5.018) 23.173 6.168 ( -1.452 -1.137 -1.582) 2.430 6.523 ( -3.258 1.168 -5.149) 6.204 6.687 ( 6.273 1.325 3.536) 7.321 6.899 ( -0.913 7.256 7.535) 10.501 7.218 ( -0.475 4.928 4.041) 6.391 7.248 ( -0.607 -2.820 -1.914) 3.461 7.813 ( -2.696 15.407 0.539) 15.650 8.288 ( -1.282 -10.502 -1.841) 10.739 8.529 ( 9.225 -2.304 -5.569) 11.019 8.659 ( 3.212 11.573 4.142) 12.705 8.958 ( -3.356 18.277 -8.824) 20.571 9.402 ( 0.572 -6.613 3.516) 7.511 10.290 ( -0.642 -32.975 0.120) 32.981 10.496 ( 0.186 6.953 -3.442) 7.760 10.777 ( 3.735 -16.178 3.810) 17.035 10.956 ( -7.384 -11.874 1.600) 14.073 11.826 ( 0.000 17.413 -0.891) 17.436 12.426 ( 1.254 -10.472 -1.836) 10.705 12.578 ( 10.207 2.898 -5.820) 12.102 12.784 ( -3.638 -4.560 5.825) 8.243 12.959 ( 0.882 -4.006 -6.351) 7.561 13.369 ( -4.136 2.438 1.418) 5.006 13.573 ( -1.468 -0.207 0.641) 1.616 13.684 ( -1.133 -1.967 3.087) 3.831 13.945 ( 3.060 12.647 1.838) 13.141 14.208 ( -1.112 1.397 0.115) 1.789 14.513 ( -7.886 2.830 11.021) 13.844 14.789 ( 15.181 12.490 -4.432) 20.152 15.127 ( -2.564 -0.905 -2.385) 3.617 15.207 ( 2.063 1.125 0.411) 2.386 15.408 ( -0.029 -0.862 2.503) 2.648 15.957 ( -0.034 2.680 -5.373) 6.005 16.519 ( -1.895 3.159 -0.391) 3.704 16.706 ( -8.699 5.261 2.266) 10.415 17.114 ( 1.968 -21.739 -0.775) 21.842 ======================= Grid point 175 (81/208) ======================= q-point: ( 0.00 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( 1.548 10.312 6.304) 12.185 2.797 ( 3.229 8.393 5.941) 10.778 3.112 ( 1.044 14.636 -0.440) 14.680 3.714 ( -6.924 -3.197 -5.479) 9.391 4.135 ( -1.810 22.973 0.593) 23.052 4.336 ( -0.193 1.617 -0.190) 1.639 4.353 ( 2.825 9.418 0.096) 9.833 4.652 ( -1.132 13.069 -4.536) 13.880 4.832 ( 3.864 14.306 4.848) 15.591 4.932 ( 3.901 5.243 -1.116) 6.630 5.150 ( -1.682 2.834 0.294) 3.308 5.226 ( 1.881 17.505 -2.802) 17.827 5.695 ( -1.600 -12.159 1.184) 12.321 6.149 ( -0.750 0.200 1.438) 1.635 6.420 ( 1.484 -8.453 -4.975) 9.920 6.754 ( 2.875 -4.241 4.022) 6.513 7.099 ( -4.489 18.954 1.781) 19.560 7.197 ( 0.402 1.591 -0.227) 1.657 7.377 ( 3.575 7.367 10.722) 13.491 7.972 ( -4.193 1.456 -5.061) 6.732 8.144 ( 2.774 -1.326 0.205) 3.081 8.553 ( 5.434 -6.025 4.871) 9.463 8.897 ( -3.129 -0.549 -14.807) 15.144 9.189 ( -6.846 7.117 -4.450) 10.831 9.212 ( -6.746 11.206 -12.097) 17.816 9.678 ( -1.072 -26.285 -3.683) 26.564 10.411 ( -6.861 -7.606 -2.379) 10.515 10.542 ( 5.622 -13.046 11.876) 18.516 10.849 ( 6.738 -0.907 10.826) 12.784 12.170 ( -0.618 14.735 -1.035) 14.785 12.190 ( 1.260 -10.792 -2.034) 11.054 12.610 ( -3.046 -5.417 2.470) 6.687 12.796 ( 3.580 1.147 -0.047) 3.759 12.997 ( 8.345 3.101 -12.542) 15.380 13.296 ( -5.415 1.626 -0.308) 5.663 13.579 ( 0.724 -0.393 0.163) 0.840 13.674 ( 3.152 -1.290 7.595) 8.323 14.161 ( -3.126 4.501 4.198) 6.904 14.237 ( -2.297 8.433 2.883) 9.204 14.414 ( -4.500 -1.333 4.938) 6.813 15.124 ( 0.221 3.971 -1.620) 4.295 15.194 ( 2.594 5.561 -2.509) 6.629 15.281 ( -0.697 -2.142 2.920) 3.688 15.500 ( 3.292 9.625 1.813) 10.333 15.956 ( -0.070 0.642 -5.597) 5.634 16.522 ( 0.255 -1.869 -0.619) 1.985 16.647 ( -0.481 0.689 -0.643) 1.058 16.716 ( -0.893 -18.492 -0.240) 18.516 ======================= Grid point 176 (82/208) ======================= q-point: ( 0.12 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 1.555 8.374 6.747) 10.866 2.854 ( 0.778 4.570 7.081) 8.463 3.138 ( 1.749 13.308 0.420) 13.429 3.542 ( -8.934 0.192 -7.317) 11.549 4.048 ( -6.020 23.006 -0.380) 23.784 4.299 ( -1.996 5.200 1.787) 5.850 4.477 ( 7.295 8.899 -1.670) 11.627 4.649 ( 1.984 5.181 -3.834) 6.744 4.875 ( 1.539 8.105 3.939) 9.142 5.029 ( 3.189 6.702 1.483) 7.569 5.126 ( -0.479 4.028 -0.926) 4.160 5.265 ( 2.185 22.107 -3.277) 22.455 5.698 ( 1.479 -12.117 0.378) 12.213 6.119 ( -2.007 1.718 0.049) 2.642 6.479 ( 4.794 -9.997 -1.278) 11.161 6.784 ( 0.059 -2.086 4.287) 4.768 7.039 ( -1.868 23.551 3.668) 23.908 7.254 ( 5.255 5.080 -0.758) 7.349 7.479 ( 4.853 2.420 10.067) 11.435 7.905 ( -1.873 2.634 -4.519) 5.556 8.181 ( 0.771 -5.804 -1.225) 5.982 8.626 ( 0.287 -4.021 2.512) 4.750 8.780 ( -3.750 -3.792 -13.524) 14.538 8.984 ( -11.845 -8.099 -9.615) 17.273 9.090 ( -6.113 30.095 -7.571) 31.629 9.672 ( 0.762 -29.158 -2.007) 29.237 10.374 ( 4.060 -2.492 0.533) 4.793 10.659 ( 4.405 -14.022 8.492) 16.975 10.996 ( 6.294 1.288 8.246) 10.453 12.154 ( -0.901 12.652 -1.105) 12.732 12.201 ( 0.244 -8.197 -2.140) 8.475 12.576 ( -1.280 -4.441 2.038) 5.051 12.800 ( -1.280 -0.859 -0.160) 1.550 13.176 ( -0.284 3.444 -5.513) 6.506 13.209 ( 6.943 1.900 -2.630) 7.664 13.588 ( 0.592 -0.609 -0.136) 0.860 13.770 ( 4.195 -0.625 9.568) 10.466 14.068 ( -4.596 3.187 0.744) 5.642 14.215 ( -1.284 8.459 1.608) 8.705 14.388 ( 0.666 -1.252 0.538) 1.517 15.080 ( -16.177 5.534 0.597) 17.108 15.135 ( -4.912 2.571 2.343) 6.019 15.204 ( -0.472 3.659 -0.520) 3.726 15.474 ( -1.009 0.320 1.416) 1.768 16.029 ( 4.566 -0.219 -4.017) 6.085 16.567 ( 5.331 2.262 -0.863) 5.855 16.679 ( -0.215 -14.323 -0.225) 14.326 16.755 ( 7.693 -3.488 -0.698) 8.476 ======================= Grid point 177 (83/208) ======================= q-point: ( 0.25 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( 2.390 4.515 5.562) 7.552 2.815 ( -6.342 -1.678 4.084) 7.728 3.161 ( -0.013 9.874 -2.918) 10.296 3.411 ( -2.978 6.818 0.513) 7.458 3.948 ( -3.900 19.814 -0.106) 20.195 4.274 ( -0.677 7.470 0.789) 7.542 4.596 ( 5.293 5.734 -2.637) 8.237 4.717 ( 5.504 2.199 -2.485) 6.427 4.909 ( 0.851 3.152 4.089) 5.232 5.034 ( -1.423 3.971 -1.360) 4.432 5.121 ( -0.541 5.905 -1.701) 6.168 5.277 ( -0.444 21.371 -4.407) 21.825 5.707 ( -1.689 -8.661 -1.657) 8.979 6.128 ( 3.959 4.242 0.085) 5.803 6.558 ( 2.663 -12.536 2.507) 13.059 6.790 ( 0.010 1.980 2.229) 2.982 7.045 ( 1.548 27.609 5.431) 28.181 7.367 ( 6.283 10.363 -1.654) 12.231 7.575 ( 3.452 -2.400 6.957) 8.129 7.888 ( 0.799 1.652 -2.796) 3.344 8.156 ( -2.807 -7.403 -2.626) 8.341 8.576 ( -1.744 3.025 -10.138) 10.723 8.737 ( -11.842 -7.491 -12.395) 18.708 8.784 ( 2.553 -5.916 9.589) 11.553 8.961 ( -5.892 29.614 -4.810) 30.575 9.687 ( 0.909 -29.514 -0.799) 29.539 10.546 ( 11.763 0.278 3.935) 12.407 10.737 ( 3.750 -11.599 3.607) 12.712 11.089 ( 2.185 3.644 3.580) 5.557 12.136 ( -0.617 8.203 -1.548) 8.371 12.197 ( -0.138 -3.964 -2.575) 4.728 12.558 ( -0.842 -2.095 0.620) 2.341 12.785 ( -0.015 -2.546 -0.866) 2.689 13.072 ( -5.606 7.167 1.097) 9.165 13.389 ( 6.058 -3.673 4.243) 8.258 13.614 ( 2.566 -0.530 -0.529) 2.673 13.829 ( 1.330 1.660 3.448) 4.051 14.035 ( 1.004 1.987 -4.286) 4.830 14.173 ( -3.907 6.882 -1.047) 7.983 14.429 ( 2.175 0.480 0.073) 2.228 14.627 ( -23.426 -0.614 1.116) 23.460 15.118 ( -0.122 6.356 0.277) 6.363 15.208 ( 0.774 2.270 0.539) 2.458 15.487 ( 1.387 -3.972 0.459) 4.233 16.025 ( -4.503 -3.956 1.228) 6.119 16.654 ( -0.760 -15.582 -0.208) 15.602 16.710 ( 7.651 2.978 -0.473) 8.223 16.936 ( 10.285 3.822 -1.436) 11.065 ======================= Grid point 178 (84/208) ======================= q-point: ( 0.38 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.377 ( 4.500 0.328 3.533) 5.731 2.645 ( -11.036 -5.025 0.333) 12.131 3.127 ( -1.989 10.011 -6.670) 12.193 3.425 ( 2.295 8.776 9.327) 13.011 3.912 ( -0.093 14.813 0.716) 14.830 4.269 ( -0.348 7.914 -0.809) 7.962 4.661 ( 2.140 3.807 -2.953) 5.272 4.826 ( 5.541 0.146 -2.090) 5.924 4.902 ( -1.931 -0.150 2.322) 3.023 4.998 ( -1.761 6.326 -2.840) 7.154 5.109 ( -0.030 6.431 -3.331) 7.242 5.235 ( -2.569 17.884 -6.160) 19.089 5.655 ( -2.219 -7.637 -0.979) 8.012 6.226 ( 4.425 2.097 0.578) 4.931 6.596 ( 1.790 -7.092 1.704) 7.510 6.775 ( -2.190 4.741 1.893) 5.555 7.093 ( 1.882 26.079 4.510) 26.533 7.461 ( 3.572 13.387 -3.055) 14.189 7.611 ( -0.420 -4.249 0.112) 4.271 7.937 ( 4.367 1.670 3.818) 6.037 8.102 ( -1.455 -3.792 -2.534) 4.787 8.489 ( -9.536 -7.597 -15.118) 19.422 8.597 ( 2.810 5.761 1.078) 6.500 8.862 ( -2.017 27.240 -3.301) 27.514 8.894 ( 4.856 -3.121 15.983) 16.993 9.702 ( 0.719 -29.400 -0.208) 29.409 10.669 ( 0.002 -11.165 0.357) 11.171 10.899 ( 10.558 3.574 2.849) 11.505 11.093 ( -0.736 5.698 0.199) 5.749 12.132 ( 0.570 4.488 -2.459) 5.149 12.187 ( -0.497 -1.123 -2.598) 2.874 12.563 ( 2.197 0.622 -1.884) 2.960 12.795 ( 1.321 -3.772 -2.277) 4.599 12.982 ( -4.394 10.332 3.929) 11.895 13.414 ( -5.078 -6.498 11.889) 14.469 13.666 ( 2.017 -1.566 -0.537) 2.609 13.852 ( -0.197 2.014 1.662) 2.618 13.970 ( -14.696 -0.106 1.765) 14.802 14.048 ( -0.699 6.737 -1.040) 6.853 14.327 ( -0.707 -1.052 -13.815) 13.873 14.560 ( 6.853 -1.481 -3.272) 7.737 15.129 ( 1.063 5.876 1.246) 6.100 15.229 ( 1.020 0.854 1.472) 1.984 15.522 ( 2.553 -5.710 0.177) 6.257 15.885 ( -10.504 -5.246 5.630) 13.021 16.640 ( -0.417 -16.432 -0.078) 16.438 16.834 ( 4.790 4.711 0.545) 6.741 17.103 ( 7.218 6.824 -1.996) 10.132 ======================= Grid point 179 (85/208) ======================= q-point: (-0.50 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.437 ( -9.752 -3.779 -0.299) 10.463 2.487 ( 6.011 -1.842 0.633) 6.318 3.083 ( -1.428 11.878 -5.783) 13.288 3.496 ( 3.213 6.970 10.774) 13.228 3.937 ( 2.150 12.261 2.431) 12.683 4.246 ( -1.698 7.788 -2.996) 8.515 4.664 ( -1.243 3.842 -3.928) 5.633 4.832 ( -2.142 0.882 -2.113) 3.135 4.903 ( -3.608 -1.189 -1.052) 3.942 4.967 ( 1.928 9.652 -3.109) 10.322 5.110 ( 1.321 3.605 -3.695) 5.328 5.205 ( 0.417 14.491 -4.767) 15.260 5.642 ( 1.098 -8.017 -0.044) 8.092 6.259 ( -0.701 -4.867 -0.413) 4.934 6.622 ( -0.725 3.548 -1.277) 3.840 6.733 ( -1.640 3.768 3.949) 5.699 7.111 ( -0.613 23.152 2.981) 23.351 7.474 ( -1.453 7.076 -4.765) 8.654 7.586 ( -1.589 5.177 -1.791) 5.704 8.013 ( 1.566 -0.313 5.331) 5.566 8.124 ( 3.498 -0.720 0.818) 3.664 8.315 ( -5.074 -5.131 -15.036) 16.678 8.714 ( 6.924 7.217 6.654) 12.012 8.830 ( 1.248 23.813 2.813) 24.011 9.059 ( 8.233 -1.742 17.107) 19.065 9.715 ( 0.652 -28.682 0.779) 28.700 10.619 ( -4.208 -12.821 -4.899) 14.356 10.908 ( -6.470 5.349 -9.906) 12.985 11.170 ( 4.130 7.505 10.764) 13.757 12.143 ( 0.920 -3.681 -4.055) 5.553 12.171 ( -0.729 6.285 -1.403) 6.481 12.623 ( 2.544 1.053 -1.767) 3.272 12.813 ( -0.549 2.148 -5.170) 5.625 12.963 ( 5.482 8.524 1.866) 10.305 13.220 ( -15.367 -9.157 13.581) 22.460 13.674 ( 0.372 -0.997 -1.888) 2.167 13.811 ( 0.614 -2.200 1.971) 3.017 13.870 ( -1.742 -3.913 2.815) 5.125 14.035 ( 0.100 9.312 -0.860) 9.353 14.327 ( 0.845 0.621 -11.068) 11.118 14.725 ( 11.003 -0.383 -7.893) 13.546 15.157 ( 1.531 3.939 0.988) 4.340 15.236 ( -0.992 0.157 1.835) 2.092 15.594 ( 5.189 -6.914 -0.027) 8.645 15.671 ( -12.726 -4.679 7.760) 15.622 16.637 ( 0.000 -16.074 -0.010) 16.074 16.881 ( -0.032 5.095 0.823) 5.162 17.185 ( 1.555 7.441 -1.367) 7.724 ======================= Grid point 180 (86/208) ======================= q-point: (-0.38 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -6.455 0.692 -0.179) 6.494 2.604 ( 5.644 -0.878 -0.783) 5.765 3.061 ( 0.134 13.486 -3.955) 14.055 3.582 ( 4.346 4.745 9.707) 11.646 3.990 ( 2.732 13.916 4.067) 14.753 4.211 ( -0.924 7.085 -3.455) 7.937 4.618 ( -2.111 2.931 -5.082) 6.234 4.772 ( -7.298 3.547 -4.494) 9.275 4.803 ( -1.292 5.583 -1.798) 6.006 5.004 ( 0.548 7.366 -1.207) 7.484 5.142 ( 2.310 0.857 -4.102) 4.785 5.205 ( -0.184 12.620 -1.572) 12.719 5.696 ( 4.307 -8.603 -1.562) 9.747 6.226 ( -2.183 -7.183 -0.922) 7.564 6.555 ( -4.798 5.293 0.480) 7.160 6.714 ( -2.188 0.952 0.785) 2.512 7.102 ( -0.270 22.008 4.109) 22.390 7.416 ( -3.473 2.897 -4.259) 6.213 7.535 ( -3.965 11.072 -0.232) 11.763 8.036 ( 0.671 1.184 2.644) 2.973 8.143 ( -1.245 -6.908 -1.850) 7.258 8.295 ( 3.703 -0.619 -7.807) 8.662 8.773 ( 1.893 21.603 -3.642) 21.990 9.008 ( 12.379 5.978 16.911) 21.794 9.227 ( 6.156 0.180 13.743) 15.060 9.729 ( 0.564 -26.110 2.344) 26.221 10.510 ( -5.814 -13.735 -7.775) 16.820 10.749 ( -7.110 4.995 -11.447) 14.372 11.163 ( -7.108 3.684 11.755) 14.222 12.141 ( -0.036 -14.964 -5.633) 15.989 12.168 ( 0.424 17.237 0.410) 17.247 12.597 ( -3.443 5.198 -3.395) 7.100 12.799 ( 1.775 3.242 -5.218) 6.394 12.980 ( -10.478 -12.315 10.722) 19.401 13.192 ( 13.416 5.720 -0.390) 14.590 13.680 ( -0.368 -2.182 -3.320) 3.990 13.784 ( -4.990 -1.048 2.905) 5.869 13.942 ( 10.375 -0.275 -0.314) 10.383 14.057 ( 2.201 7.981 -0.314) 8.285 14.332 ( 2.261 -0.279 -4.783) 5.298 14.904 ( 7.399 4.227 -0.372) 8.529 15.182 ( -0.700 1.643 -0.396) 1.829 15.185 ( -3.234 -0.278 2.004) 3.814 15.469 ( -8.244 -3.094 4.485) 9.882 15.715 ( 7.572 -7.058 -2.123) 10.567 16.640 ( 0.378 -16.548 -0.046) 16.553 16.837 ( -4.578 5.362 0.444) 7.064 17.153 ( -4.866 6.377 -0.109) 8.022 ======================= Grid point 181 (87/208) ======================= q-point: (-0.25 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -2.341 5.665 1.659) 6.350 2.684 ( 3.069 4.070 -0.659) 5.141 3.073 ( 1.384 14.185 -2.178) 14.418 3.692 ( 5.478 1.661 7.208) 9.204 4.050 ( 2.934 17.820 3.689) 18.433 4.212 ( 1.534 4.915 -2.288) 5.634 4.570 ( -4.300 0.966 -3.107) 5.392 4.651 ( -2.045 8.463 -4.493) 9.798 4.771 ( -2.220 11.984 -1.616) 12.295 4.975 ( -2.734 8.348 -2.343) 9.092 5.171 ( 1.113 1.414 -2.267) 2.894 5.203 ( 0.473 8.795 -1.714) 8.973 5.762 ( 1.943 -7.202 -2.208) 7.779 6.181 ( -2.360 -4.474 0.375) 5.073 6.483 ( -2.754 -2.841 1.452) 4.215 6.660 ( -2.069 0.803 -2.301) 3.196 7.123 ( 1.420 18.963 6.081) 19.965 7.333 ( -4.711 2.948 -2.612) 6.141 7.439 ( -5.930 10.637 2.055) 12.351 8.052 ( 0.842 -0.174 2.337) 2.490 8.121 ( -0.884 -5.180 -4.003) 6.606 8.354 ( 3.551 0.902 -3.842) 5.309 8.830 ( 4.761 16.295 -4.639) 17.599 9.243 ( 8.330 4.368 10.158) 13.844 9.315 ( 1.252 0.616 6.474) 6.622 9.738 ( -0.224 -21.596 1.557) 21.653 10.404 ( -3.237 -16.257 -4.462) 17.166 10.642 ( -2.265 3.836 -6.232) 7.660 10.970 ( -13.887 -3.165 9.797) 17.287 12.141 ( 1.051 -13.096 -4.612) 13.924 12.177 ( 0.389 15.522 -0.044) 15.527 12.567 ( 1.852 6.137 -3.983) 7.547 12.813 ( -5.692 -4.173 3.689) 7.964 12.863 ( 2.083 -3.128 -3.793) 5.340 13.381 ( 5.561 1.705 0.594) 5.847 13.630 ( -4.589 -2.591 -2.912) 6.021 13.689 ( -4.035 -0.667 2.820) 4.967 14.101 ( 3.127 8.848 1.131) 9.452 14.170 ( 9.147 3.308 -4.292) 10.632 14.455 ( 11.727 -1.045 2.405) 12.016 14.926 ( -5.999 8.626 15.257) 18.525 15.127 ( 1.213 -1.081 -5.089) 5.342 15.197 ( 1.025 1.877 -1.303) 2.505 15.395 ( -0.941 -1.109 0.064) 1.456 15.859 ( 7.895 -5.442 -5.414) 11.012 16.651 ( 0.731 -16.567 -0.264) 16.585 16.721 ( -7.173 4.091 -0.095) 8.258 17.009 ( -10.126 3.922 0.987) 10.904 ======================= Grid point 182 (88/208) ======================= q-point: (-0.12 0.36 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 0.562 9.350 4.228) 10.276 2.734 ( 2.597 8.209 2.290) 8.909 3.095 ( 1.089 14.611 -1.164) 14.698 3.776 ( 1.208 -2.716 1.803) 3.477 4.109 ( 2.885 21.644 1.417) 21.881 4.259 ( 3.609 3.394 -1.011) 5.056 4.445 ( -6.825 4.504 -0.902) 8.227 4.679 ( 1.609 13.413 -6.501) 14.992 4.734 ( 1.280 15.144 3.367) 15.567 4.926 ( -1.498 5.689 -2.194) 6.279 5.175 ( -0.707 3.806 0.875) 3.969 5.210 ( 0.704 9.595 -3.855) 10.365 5.745 ( -2.918 -7.650 -0.118) 8.189 6.153 ( -0.542 -1.680 1.098) 2.079 6.437 ( -2.058 -8.121 -3.033) 8.910 6.677 ( 3.748 -1.881 1.009) 4.313 7.153 ( -0.292 16.385 4.066) 16.884 7.239 ( -4.408 2.421 -0.614) 5.067 7.349 ( -3.048 9.798 6.522) 12.158 8.057 ( -2.855 -7.464 -3.348) 8.665 8.097 ( 1.209 6.403 0.211) 6.520 8.437 ( 5.767 -2.296 -0.105) 6.208 8.907 ( 3.440 7.529 -7.643) 11.266 9.286 ( -3.476 13.715 -0.024) 14.149 9.322 ( -1.502 -5.109 -4.881) 7.223 9.717 ( -1.876 -20.996 -3.057) 21.300 10.409 ( 3.599 -18.120 5.981) 19.418 10.598 ( -6.050 1.306 -3.550) 7.135 10.769 ( -4.063 -5.784 11.951) 13.885 12.163 ( 1.839 -13.127 -3.259) 13.650 12.179 ( -0.151 16.185 -0.501) 16.194 12.646 ( 4.244 -0.699 1.241) 4.477 12.710 ( -2.237 0.323 -1.143) 2.532 12.921 ( 3.792 0.442 -9.387) 10.134 13.392 ( -4.057 -0.037 1.301) 4.261 13.565 ( -0.447 -0.546 0.018) 0.706 13.650 ( -0.960 -1.364 2.696) 3.170 14.153 ( 1.950 7.027 2.779) 7.804 14.255 ( 1.470 4.280 -1.321) 4.714 14.539 ( -7.469 0.205 12.806) 14.826 15.006 ( 14.003 7.919 -0.829) 16.109 15.142 ( 0.386 2.846 -0.265) 2.884 15.237 ( 3.254 1.450 -0.940) 3.684 15.407 ( 2.396 2.204 0.265) 3.266 15.966 ( 3.342 -2.132 -5.990) 7.183 16.578 ( -6.202 3.109 -0.565) 6.961 16.672 ( 0.234 -16.318 -0.477) 16.327 16.809 ( -9.784 -1.265 0.979) 9.914 ======================= Grid point 183 (89/208) ======================= q-point: ( 0.00 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 1.168 9.047 6.026) 10.933 2.872 ( 0.597 -0.284 2.610) 2.693 3.324 ( 0.793 6.686 -2.469) 7.171 3.657 ( -4.513 -1.875 -0.032) 4.888 4.294 ( 2.644 -0.160 5.326) 5.948 4.446 ( -1.295 3.816 -1.524) 4.308 4.512 ( 2.445 6.394 -0.893) 6.904 4.945 ( -6.888 14.544 -8.013) 17.977 5.027 ( -0.910 5.364 0.776) 5.496 5.092 ( 3.854 9.683 -1.992) 10.610 5.228 ( 0.140 5.981 1.514) 6.171 5.317 ( 9.456 -3.406 -3.509) 10.645 5.677 ( -0.465 2.829 0.285) 2.881 6.142 ( 3.432 0.252 4.027) 5.298 6.216 ( -4.312 -9.510 3.462) 11.001 6.655 ( 1.653 -4.971 1.815) 5.544 7.248 ( 1.726 2.319 0.130) 2.894 7.415 ( -2.876 9.615 9.434) 13.774 7.628 ( 1.218 17.418 4.288) 17.979 7.958 ( 0.565 0.578 -3.537) 3.628 8.150 ( 0.138 0.917 -8.409) 8.460 8.473 ( 3.244 -2.341 1.991) 4.469 8.916 ( -8.080 -1.441 -15.403) 17.453 8.920 ( -2.544 -17.576 -2.189) 17.893 9.235 ( -9.255 -10.726 -15.004) 20.635 9.689 ( 0.890 16.508 -2.328) 16.695 10.196 ( 6.420 -10.838 4.613) 13.415 10.389 ( -7.247 -4.243 9.869) 12.958 10.835 ( 7.302 -0.803 13.331) 15.221 11.955 ( 1.227 -9.132 -0.939) 9.262 12.434 ( -0.604 5.389 0.414) 5.438 12.531 ( -1.445 1.001 1.363) 2.224 12.833 ( 0.006 1.791 -1.196) 2.153 13.077 ( 9.164 4.210 -14.097) 17.333 13.304 ( -3.102 -0.483 -2.263) 3.870 13.573 ( 0.320 -0.198 0.016) 0.377 13.651 ( 3.529 -0.954 6.084) 7.097 14.244 ( -2.257 3.976 4.318) 6.289 14.363 ( -2.924 3.355 5.570) 7.130 14.386 ( -5.147 -0.855 5.251) 7.403 15.201 ( 2.475 2.416 0.248) 3.468 15.238 ( -0.501 0.529 1.295) 1.486 15.280 ( -0.113 2.576 -0.748) 2.685 15.701 ( 3.266 8.570 0.219) 9.174 15.937 ( 0.303 -1.699 -4.987) 5.278 16.368 ( 0.232 -12.484 -0.288) 12.490 16.518 ( -0.584 -0.845 -1.522) 1.836 16.638 ( -1.432 -1.981 -1.094) 2.678 ======================= Grid point 184 (90/208) ======================= q-point: ( 0.12 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( -1.197 8.221 6.277) 10.413 2.837 ( -4.953 -4.921 2.734) 7.498 3.330 ( 0.277 6.036 -3.613) 7.040 3.571 ( -3.757 2.244 0.585) 4.415 4.338 ( 0.242 3.082 4.250) 5.256 4.420 ( -1.125 10.255 -0.849) 10.352 4.562 ( 2.347 0.692 -2.819) 3.732 4.808 ( -4.364 8.506 -3.231) 10.091 4.964 ( -4.574 1.836 1.810) 5.251 5.111 ( -0.312 3.248 -2.010) 3.832 5.253 ( 1.497 7.483 -1.297) 7.740 5.515 ( 8.798 0.003 -5.516) 10.384 5.673 ( -0.580 9.958 3.734) 10.651 6.195 ( 1.425 -11.076 5.137) 12.293 6.213 ( 3.709 3.440 1.778) 5.362 6.689 ( 1.954 -7.226 2.978) 8.057 7.341 ( 7.342 2.596 -0.114) 7.788 7.411 ( 0.953 8.918 9.492) 13.059 7.661 ( 1.181 16.062 4.291) 16.667 7.976 ( 1.827 5.409 -3.945) 6.940 8.106 ( -2.882 0.543 -8.257) 8.762 8.554 ( 4.539 -2.947 4.592) 7.097 8.720 ( -8.758 -1.781 -19.818) 21.740 8.818 ( -7.564 -9.725 -7.083) 14.211 9.108 ( -1.887 -24.470 -6.074) 25.283 9.647 ( -4.352 23.193 -4.080) 23.948 10.336 ( 5.437 -2.804 9.223) 11.067 10.387 ( 7.270 -11.785 2.703) 14.109 11.000 ( 7.231 -0.687 12.549) 14.500 11.959 ( -0.628 -9.264 -1.044) 9.344 12.429 ( -0.019 5.121 0.688) 5.167 12.513 ( -0.663 1.876 0.472) 2.045 12.803 ( -2.412 0.668 0.638) 2.583 13.224 ( 3.129 2.050 -8.153) 8.970 13.256 ( 2.622 1.740 -5.385) 6.237 13.578 ( 0.540 -0.374 0.329) 0.735 13.749 ( 4.631 -1.046 7.075) 8.520 14.141 ( -5.903 3.503 4.081) 7.985 14.337 ( -2.683 3.566 0.338) 4.476 14.368 ( 2.740 -0.386 2.055) 3.447 15.108 ( -16.633 -0.185 1.280) 16.683 15.233 ( 0.593 4.916 1.396) 5.144 15.277 ( -0.382 3.014 0.073) 3.039 15.520 ( -11.033 3.643 0.396) 11.626 15.984 ( 0.954 -3.080 -1.983) 3.785 16.360 ( -1.174 -13.396 -0.106) 13.448 16.622 ( 8.233 2.751 -1.656) 8.837 16.739 ( 12.306 -1.335 -1.955) 12.532 ======================= Grid point 185 (91/208) ======================= q-point: ( 0.25 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( -2.095 5.371 5.227) 7.781 2.701 ( -9.309 -7.865 1.613) 12.293 3.319 ( -0.657 5.516 -5.782) 8.018 3.539 ( -0.238 5.022 5.690) 7.593 4.273 ( -6.092 10.952 -1.717) 12.650 4.426 ( 1.130 9.051 1.612) 9.263 4.586 ( 1.453 -3.081 -4.725) 5.825 4.793 ( 1.321 0.764 0.918) 1.781 4.896 ( -2.533 -1.096 2.178) 3.516 5.098 ( -0.510 3.211 -2.195) 3.923 5.261 ( -0.135 7.588 -2.146) 7.886 5.565 ( -2.076 0.437 -8.875) 9.125 5.662 ( -1.212 7.905 4.760) 9.307 6.234 ( 1.034 -2.463 4.744) 5.444 6.343 ( 9.709 1.696 0.495) 9.868 6.740 ( 2.531 -6.720 2.886) 7.739 7.437 ( 2.110 3.547 7.743) 8.774 7.530 ( 9.649 5.932 -0.233) 11.329 7.677 ( -0.059 14.428 2.423) 14.630 7.989 ( -0.447 12.032 -4.883) 12.993 8.058 ( 0.255 -0.708 -3.803) 3.876 8.526 ( -8.504 -6.315 -20.590) 23.154 8.629 ( 0.635 -1.181 -2.509) 2.845 8.713 ( 0.734 -3.116 8.252) 8.851 9.103 ( 0.963 -29.185 -1.374) 29.233 9.548 ( -4.724 26.888 -3.786) 27.561 10.382 ( 0.479 -15.548 3.467) 15.937 10.676 ( 19.233 3.659 5.948) 20.462 11.121 ( 3.394 -0.238 7.259) 8.017 11.933 ( -1.556 -9.806 -2.311) 10.194 12.435 ( 0.439 7.097 0.903) 7.168 12.509 ( 0.329 0.011 0.099) 0.344 12.762 ( -1.881 0.075 1.044) 2.153 13.176 ( -2.519 3.263 -2.603) 4.875 13.341 ( 1.528 -1.163 2.473) 3.131 13.599 ( 1.664 -0.729 0.030) 1.817 13.821 ( 1.910 -1.173 4.110) 4.681 14.110 ( 3.002 3.971 -7.172) 8.731 14.276 ( -3.843 3.349 -2.005) 5.478 14.437 ( 3.068 0.460 2.155) 3.777 14.632 ( -28.218 0.522 -2.536) 28.336 15.237 ( -0.167 2.713 0.287) 2.733 15.274 ( -0.039 6.121 2.836) 6.746 15.432 ( -0.982 -1.399 -0.075) 1.710 15.933 ( -6.130 -4.352 4.049) 8.539 16.341 ( -0.573 -13.266 0.161) 13.279 16.770 ( 7.586 1.550 -0.830) 7.788 17.003 ( 13.933 2.542 -2.862) 14.449 ======================= Grid point 186 (92/208) ======================= q-point: ( 0.38 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( -0.266 0.741 3.942) 4.020 2.523 ( -9.015 -6.170 0.614) 10.941 3.292 ( -0.941 5.923 -6.336) 8.725 3.566 ( 1.364 4.986 9.171) 10.527 4.173 ( -3.157 11.105 -2.087) 11.732 4.434 ( -0.870 7.723 -1.155) 7.857 4.607 ( 1.039 -5.987 -2.321) 6.505 4.813 ( 0.724 -3.651 -0.361) 3.740 4.876 ( -0.323 0.298 0.633) 0.771 5.088 ( -0.093 2.942 -2.619) 3.940 5.246 ( -1.011 6.664 -2.542) 7.204 5.465 ( -5.059 3.128 -9.900) 11.550 5.646 ( -1.181 5.129 3.646) 6.403 6.236 ( -1.437 0.173 1.238) 1.904 6.527 ( 8.418 0.621 0.266) 8.445 6.781 ( 1.178 -3.426 2.462) 4.380 7.468 ( -0.064 -0.259 4.125) 4.134 7.647 ( -0.675 16.742 2.305) 16.913 7.722 ( 7.474 8.193 -3.252) 11.557 7.984 ( 0.876 7.904 1.535) 8.100 8.079 ( 1.631 3.416 -2.023) 4.292 8.343 ( -6.710 -5.718 -19.593) 21.485 8.634 ( 2.270 -0.461 2.251) 3.230 8.830 ( 6.816 -2.648 16.284) 17.851 9.124 ( 1.216 -28.428 0.713) 28.463 9.471 ( -2.594 28.861 -2.793) 29.112 10.375 ( -1.435 -17.338 -1.220) 17.440 11.025 ( 9.842 7.263 3.757) 12.796 11.174 ( 6.386 2.447 5.354) 8.685 11.901 ( -1.175 -10.530 -3.560) 11.178 12.444 ( 0.305 9.547 0.553) 9.568 12.536 ( 2.965 -3.169 -0.306) 4.350 12.736 ( -1.050 -0.971 0.855) 1.666 13.145 ( -0.533 5.752 2.351) 6.237 13.305 ( -6.610 -3.904 7.243) 10.555 13.633 ( 1.749 -1.425 -0.743) 2.375 13.839 ( -0.571 -1.470 2.843) 3.251 13.978 ( -22.495 0.657 2.059) 22.598 14.196 ( 0.051 6.081 -4.633) 7.645 14.343 ( 4.289 2.502 -18.226) 18.891 14.523 ( 5.247 -2.491 -5.267) 7.841 15.237 ( 0.058 2.071 0.720) 2.193 15.284 ( 0.432 6.296 4.431) 7.711 15.434 ( 1.024 -2.869 0.019) 3.047 15.783 ( -10.537 -4.181 9.688) 14.912 16.340 ( 0.239 -12.849 0.699) 12.870 16.890 ( 4.884 1.207 -0.030) 5.031 17.213 ( 8.435 3.923 -2.910) 9.747 ======================= Grid point 187 (93/208) ======================= q-point: (-0.50 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( -4.746 -2.030 1.455) 5.363 2.430 ( 3.042 -3.327 1.708) 4.821 3.269 ( -0.302 6.553 -5.671) 8.672 3.610 ( 1.595 4.188 10.038) 10.993 4.165 ( 2.519 10.728 -0.605) 11.036 4.387 ( -3.441 5.758 -4.500) 8.077 4.606 ( -0.712 -7.975 -1.709) 8.187 4.825 ( -0.380 -1.028 -0.084) 1.099 4.865 ( -0.478 -0.876 -0.972) 1.393 5.087 ( 0.697 1.437 -4.103) 4.403 5.218 ( -1.197 6.703 -2.202) 7.156 5.399 ( 0.391 4.074 -9.785) 10.607 5.627 ( -1.453 4.040 2.463) 4.950 6.187 ( -3.453 0.162 -2.532) 4.285 6.622 ( 1.340 -3.166 0.236) 3.446 6.790 ( -1.050 1.656 3.409) 3.933 7.452 ( -1.996 -2.040 2.097) 3.542 7.616 ( -1.835 22.333 -0.196) 22.409 7.822 ( 2.362 11.073 -3.115) 11.742 8.006 ( 1.309 1.789 -0.333) 2.242 8.090 ( -1.631 -0.834 -0.668) 1.950 8.252 ( 1.116 0.553 -11.984) 12.048 8.733 ( 6.804 -2.474 10.382) 12.657 8.987 ( 6.710 -6.890 14.640) 17.516 9.149 ( 0.925 -17.750 5.849) 18.712 9.454 ( 1.430 24.555 -1.226) 24.627 10.321 ( -3.801 -16.958 -5.231) 18.149 10.979 ( -7.087 2.052 -9.476) 12.009 11.381 ( 4.904 12.075 15.859) 20.527 11.879 ( -0.504 -10.938 -4.331) 11.775 12.447 ( -0.017 10.026 0.233) 10.029 12.621 ( 5.227 -5.320 -0.325) 7.465 12.724 ( -0.618 -4.081 2.443) 4.796 13.076 ( -16.596 -1.680 0.461) 16.687 13.178 ( 4.071 7.406 4.015) 9.357 13.649 ( 0.267 -1.113 -2.292) 2.562 13.747 ( 0.497 -3.087 0.546) 3.174 13.818 ( -2.339 -1.767 3.462) 4.537 14.176 ( -0.509 4.202 -4.911) 6.483 14.382 ( 0.012 4.363 -8.183) 9.273 14.698 ( 14.868 -1.981 -18.322) 23.679 15.238 ( -0.172 2.817 1.223) 3.076 15.295 ( -0.493 5.411 5.170) 7.500 15.474 ( 3.343 -4.783 0.851) 5.897 15.584 ( -12.027 -3.208 12.951) 17.963 16.346 ( 0.162 -12.377 1.094) 12.427 16.942 ( 0.441 1.426 0.430) 1.554 17.301 ( 1.197 4.003 -2.347) 4.792 ======================= Grid point 188 (94/208) ======================= q-point: (-0.38 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( -1.351 3.056 1.129) 3.527 2.540 ( 7.479 -5.053 1.687) 9.183 3.265 ( 0.808 6.959 -4.557) 8.358 3.657 ( 1.651 2.702 9.546) 10.058 4.256 ( 6.761 12.607 0.505) 14.315 4.304 ( -3.893 2.619 -5.341) 7.110 4.587 ( -0.740 -4.398 -3.149) 5.460 4.779 ( -3.161 -1.571 -1.042) 3.680 4.869 ( 0.508 1.151 0.437) 1.332 5.103 ( 1.632 0.072 -4.621) 4.901 5.209 ( 0.414 8.033 -1.487) 8.179 5.425 ( 2.348 5.594 -7.318) 9.506 5.606 ( -0.274 -0.540 -0.688) 0.916 6.113 ( -3.400 -1.701 -3.940) 5.476 6.598 ( -3.291 -1.855 1.227) 3.972 6.733 ( -5.606 1.462 3.640) 6.842 7.405 ( -3.252 -0.376 2.524) 4.133 7.588 ( -1.172 22.485 -0.871) 22.533 7.790 ( -4.866 11.300 -0.806) 12.329 8.026 ( 0.079 -3.517 -6.944) 7.784 8.048 ( -0.048 1.134 -2.651) 2.884 8.307 ( 4.202 2.365 -1.987) 5.215 8.877 ( 5.129 -12.286 7.927) 15.495 9.143 ( 8.298 -9.632 9.974) 16.159 9.171 ( 0.138 4.259 12.582) 13.284 9.520 ( 4.758 12.480 2.353) 13.562 10.216 ( -5.960 -15.625 -8.582) 18.797 10.813 ( -7.611 1.632 -11.923) 14.239 11.316 ( -14.095 10.079 17.978) 24.969 11.872 ( 0.576 -10.716 -4.450) 11.617 12.447 ( -0.023 9.845 0.294) 9.850 12.681 ( -3.131 0.588 2.666) 4.154 12.689 ( -0.491 -11.435 4.490) 12.295 12.867 ( -2.133 2.578 -10.900) 11.402 13.302 ( 6.995 4.284 3.153) 8.788 13.640 ( -1.340 -1.551 -3.432) 3.998 13.760 ( -4.318 -1.084 3.448) 5.631 13.932 ( 17.620 -0.319 -0.611) 17.633 14.174 ( 1.301 3.142 -5.073) 6.108 14.358 ( -0.245 2.498 -3.694) 4.466 14.951 ( 13.521 0.996 -15.691) 20.737 15.219 ( -4.701 3.585 8.644) 10.472 15.268 ( -2.654 5.310 5.107) 7.831 15.409 ( -5.826 -3.023 6.502) 9.239 15.573 ( 6.798 -6.156 -0.288) 9.176 16.348 ( -0.135 -12.107 0.951) 12.145 16.907 ( -4.164 1.866 0.434) 4.584 17.248 ( -6.393 3.213 -1.484) 7.307 ======================= Grid point 189 (95/208) ======================= q-point: (-0.25 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 1.655 6.604 2.350) 7.203 2.692 ( 7.738 -2.726 1.335) 8.312 3.283 ( 1.617 6.945 -3.378) 7.891 3.699 ( 1.123 -0.022 7.945) 8.024 4.243 ( -1.556 -0.067 -2.234) 2.723 4.389 ( 5.976 14.151 -0.368) 15.365 4.561 ( -1.623 -0.578 -4.295) 4.628 4.752 ( 2.137 2.025 -0.872) 3.071 4.900 ( 3.020 1.788 2.044) 4.061 5.129 ( 1.808 0.129 -5.438) 5.732 5.205 ( -1.126 10.268 -2.361) 10.596 5.404 ( -3.782 9.169 -1.384) 10.015 5.641 ( 3.877 -7.865 -6.302) 10.799 6.064 ( -0.924 -4.132 -1.795) 4.599 6.502 ( -8.020 3.303 4.890) 9.956 6.633 ( -3.572 -3.240 1.038) 4.933 7.341 ( -3.962 1.342 2.511) 4.879 7.559 ( -2.387 18.396 1.063) 18.581 7.674 ( -6.228 11.941 2.618) 13.720 7.999 ( -1.368 -0.432 -4.485) 4.709 8.074 ( 3.063 -1.619 -7.566) 8.321 8.377 ( 3.146 1.389 0.298) 3.452 8.935 ( 0.973 -21.743 1.169) 21.797 9.150 ( -2.566 9.437 2.056) 9.994 9.362 ( 9.460 0.067 14.608) 17.404 9.595 ( 2.040 3.303 -0.455) 3.909 10.095 ( -4.315 -14.311 -7.268) 16.620 10.691 ( -3.029 1.252 -5.616) 6.502 10.989 ( -21.173 3.937 15.145) 26.328 11.887 ( 1.778 -9.983 -3.608) 10.763 12.447 ( -0.010 9.155 0.422) 9.165 12.604 ( -3.276 -5.071 4.707) 7.655 12.724 ( 2.690 1.914 -1.415) 3.592 12.881 ( 3.936 1.735 -11.361) 12.148 13.401 ( 2.377 0.448 1.767) 2.996 13.586 ( -3.326 -1.565 -3.705) 5.219 13.678 ( -4.151 -0.471 3.065) 5.181 14.188 ( 3.069 2.401 -3.568) 5.284 14.289 ( 9.778 5.794 -0.733) 11.389 14.421 ( 10.986 -2.203 1.680) 11.330 15.072 ( -7.360 5.645 17.330) 19.656 15.131 ( 6.255 1.031 -8.549) 10.643 15.260 ( 0.498 4.049 0.287) 4.090 15.388 ( 1.813 0.323 0.299) 1.865 15.730 ( 9.779 -6.465 -4.221) 12.460 16.348 ( 0.217 -12.278 0.384) 12.286 16.796 ( -7.348 2.446 -0.029) 7.745 17.061 ( -13.010 1.463 -0.634) 13.107 ======================= Grid point 190 (96/208) ======================= q-point: (-0.12 0.43 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( 2.535 8.461 4.327) 9.835 2.816 ( 4.828 0.434 1.673) 5.128 3.308 ( 1.395 6.817 -2.573) 7.419 3.711 ( -1.318 -2.699 4.118) 5.097 4.244 ( 1.521 -0.958 2.203) 2.844 4.451 ( 1.337 7.116 -0.815) 7.286 4.513 ( -2.166 4.464 -3.176) 5.892 4.888 ( 11.016 9.181 -2.442) 14.547 4.980 ( 4.072 6.507 2.635) 8.116 5.118 ( -3.695 12.386 -9.380) 15.971 5.181 ( 1.499 -0.631 0.429) 1.682 5.317 ( -4.565 4.909 -0.197) 6.707 5.683 ( 1.007 -5.529 -5.082) 7.577 6.078 ( 2.331 -4.457 1.877) 5.368 6.339 ( -8.946 -0.433 5.363) 10.440 6.620 ( 1.334 -3.376 0.804) 3.718 7.271 ( -3.395 1.971 1.163) 4.094 7.484 ( -5.446 10.761 6.719) 13.806 7.614 ( -0.802 17.481 3.092) 17.771 7.968 ( -0.969 -0.567 -3.622) 3.792 8.127 ( 3.362 -1.047 -8.280) 8.997 8.425 ( 2.064 -0.076 0.686) 2.176 8.939 ( -0.277 -23.626 -0.566) 23.635 9.070 ( -5.689 6.635 -6.614) 10.961 9.421 ( -5.549 -0.652 -8.416) 10.102 9.636 ( 3.851 5.228 1.136) 6.592 10.083 ( 3.752 -13.559 2.132) 14.229 10.612 ( -15.215 1.473 7.529) 17.040 10.718 ( 0.834 -0.979 10.045) 10.127 11.922 ( 2.230 -9.379 -2.151) 9.877 12.445 ( -0.413 7.445 0.413) 7.468 12.562 ( -2.167 -2.326 3.083) 4.428 12.790 ( 4.167 3.925 -2.293) 6.166 12.958 ( 6.188 2.477 -13.552) 15.102 13.378 ( -4.167 -0.999 0.472) 4.311 13.554 ( 0.816 -0.513 -0.787) 1.244 13.630 ( -1.476 -0.668 2.537) 3.010 14.229 ( 1.983 2.173 -0.934) 3.086 14.361 ( 1.504 4.659 1.433) 5.101 14.528 ( -6.168 -1.068 13.268) 14.671 15.105 ( 7.547 2.938 2.777) 8.562 15.209 ( 2.889 2.605 -0.817) 3.975 15.275 ( 0.916 2.906 -1.036) 3.218 15.490 ( 10.497 4.754 -0.555) 11.537 15.893 ( 7.221 -4.168 -5.395) 9.931 16.359 ( 0.812 -12.662 -0.157) 12.689 16.643 ( -8.661 3.210 -0.893) 9.279 16.790 ( -13.820 -1.918 -0.222) 13.955 ======================= Grid point 191 (97/208) ======================= q-point: ( 0.00 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( 1.499 -0.000 6.150) 6.330 2.846 ( -1.626 0.000 1.035) 1.927 3.386 ( 0.719 0.000 -3.475) 3.549 3.642 ( -2.888 0.000 2.499) 3.819 4.288 ( 3.401 0.000 6.900) 7.693 4.477 ( 1.427 0.000 -1.854) 2.340 4.569 ( -0.045 -0.000 -3.351) 3.351 5.067 ( -1.517 0.000 -1.742) 2.310 5.102 ( -10.595 -0.000 0.568) 10.610 5.183 ( -0.021 0.000 1.380) 1.380 5.267 ( 7.505 0.000 -0.003) 7.505 5.425 ( 3.084 0.000 -10.086) 10.546 5.600 ( 10.673 0.000 -9.258) 14.128 6.124 ( -11.172 0.000 9.336) 14.560 6.165 ( 7.832 0.000 9.626) 12.409 6.593 ( -0.730 0.000 0.547) 0.912 7.271 ( 1.759 0.000 -0.037) 1.760 7.505 ( -3.775 0.000 12.532) 13.089 7.834 ( 0.188 -0.000 0.216) 0.287 7.968 ( 1.377 0.000 -4.154) 4.376 8.265 ( 6.507 0.000 -8.257) 10.513 8.456 ( 0.296 -0.000 -2.932) 2.947 8.553 ( -0.860 0.000 4.418) 4.501 8.946 ( -11.369 0.000 -16.562) 20.089 9.139 ( -13.687 0.000 -20.695) 24.812 9.887 ( 6.828 0.000 11.340) 13.237 10.056 ( 9.840 0.000 -2.816) 10.235 10.347 ( -12.787 0.000 9.501) 15.930 10.824 ( 7.116 0.000 13.883) 15.601 11.859 ( 1.179 0.000 -0.269) 1.209 12.436 ( -1.157 0.000 1.253) 1.706 12.593 ( -0.315 0.000 0.265) 0.412 12.852 ( -0.912 0.000 -1.638) 1.875 13.127 ( 9.448 0.000 -14.532) 17.333 13.295 ( -2.602 0.000 -2.772) 3.802 13.571 ( 0.222 0.000 0.019) 0.223 13.641 ( 3.607 0.000 5.354) 6.456 14.299 ( 2.779 -0.000 -0.299) 2.795 14.349 ( -11.790 0.000 14.755) 18.887 14.411 ( -1.194 0.000 1.838) 2.191 15.207 ( 1.106 0.000 -0.310) 1.149 15.271 ( 1.239 0.000 2.274) 2.589 15.308 ( -0.764 -0.000 -0.609) 0.977 15.790 ( 4.653 0.000 -0.754) 4.714 15.919 ( -0.725 0.000 -3.844) 3.912 16.231 ( -0.187 0.000 -0.425) 0.464 16.513 ( -1.155 0.000 -1.926) 2.246 16.610 ( -0.850 0.000 -1.382) 1.623 ======================= Grid point 193 (98/208) ======================= q-point: ( 0.12 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( -1.388 -0.000 6.538) 6.684 2.750 ( -8.136 0.000 0.647) 8.162 3.387 ( 0.040 0.000 -4.497) 4.497 3.599 ( -1.839 0.000 3.047) 3.559 4.360 ( 2.348 0.000 6.344) 6.765 4.525 ( 3.309 0.000 -0.315) 3.324 4.569 ( 0.658 0.000 -5.769) 5.807 4.877 ( -11.600 0.000 0.730) 11.623 4.983 ( -5.300 0.000 -1.894) 5.628 5.165 ( -1.263 0.000 1.176) 1.726 5.366 ( 2.592 0.000 -0.746) 2.697 5.502 ( 4.408 0.000 -8.414) 9.499 5.784 ( 4.974 0.000 -3.431) 6.043 5.992 ( 0.233 0.000 7.034) 7.038 6.362 ( 10.217 0.000 9.320) 13.829 6.560 ( -2.124 -0.000 1.127) 2.405 7.359 ( 6.496 0.000 0.428) 6.510 7.484 ( -0.127 0.000 10.592) 10.593 7.826 ( -1.170 0.000 -1.962) 2.284 8.013 ( 3.821 0.000 -3.674) 5.300 8.365 ( 4.938 -0.000 -3.937) 6.315 8.462 ( 0.689 0.000 -2.887) 2.968 8.561 ( 1.208 0.000 4.733) 4.885 8.701 ( -10.750 0.000 -19.177) 21.985 8.871 ( -10.774 0.000 -15.836) 19.154 9.979 ( 1.681 0.000 5.388) 5.644 10.137 ( -4.827 0.000 -3.041) 5.705 10.346 ( 15.069 0.000 8.747) 17.424 10.988 ( 7.139 0.000 13.726) 15.471 11.861 ( -0.940 0.000 -0.348) 1.002 12.428 ( 0.109 0.000 1.170) 1.175 12.583 ( -0.700 0.000 -0.030) 0.701 12.811 ( -2.705 0.000 0.604) 2.772 13.246 ( -1.950 0.000 -6.382) 6.673 13.273 ( 7.216 -0.000 -8.877) 11.440 13.574 ( 0.437 0.000 0.519) 0.678 13.738 ( 4.605 0.000 5.935) 7.512 14.180 ( -6.699 0.000 5.979) 8.980 14.352 ( 1.186 0.000 -2.563) 2.824 14.383 ( -0.217 0.000 4.640) 4.645 15.106 ( -14.862 0.000 0.269) 14.865 15.285 ( -1.431 0.000 -0.825) 1.652 15.311 ( 2.169 -0.000 3.415) 4.046 15.569 ( -14.783 0.000 -0.024) 14.783 15.948 ( -0.215 0.000 -1.092) 1.113 16.212 ( -1.378 0.000 -0.377) 1.429 16.657 ( 5.533 0.000 -1.590) 5.757 16.716 ( 17.320 -0.000 -2.614) 17.516 ======================= Grid point 195 (99/208) ======================= q-point: ( 0.25 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.500 ( -3.606 -0.000 4.875) 6.064 2.573 ( -10.038 0.000 1.505) 10.150 3.373 ( -0.555 0.000 -5.884) 5.910 3.590 ( 0.086 0.000 6.209) 6.210 4.369 ( -2.158 0.000 0.567) 2.232 4.519 ( -2.489 0.000 -6.738) 7.183 4.631 ( 5.601 0.000 -1.627) 5.832 4.702 ( -7.238 0.000 4.506) 8.526 4.910 ( -1.996 0.000 -0.529) 2.065 5.145 ( -1.146 0.000 1.228) 1.680 5.374 ( -1.267 0.000 -1.911) 2.293 5.522 ( -0.798 0.000 -7.975) 8.015 5.745 ( -4.166 0.000 4.748) 6.317 6.148 ( 9.833 0.000 -2.384) 10.118 6.541 ( -0.177 0.000 2.893) 2.899 6.558 ( 9.138 -0.000 5.896) 10.875 7.433 ( 0.265 0.000 8.994) 8.998 7.589 ( 9.911 0.000 -0.339) 9.917 7.788 ( -1.867 0.000 -2.796) 3.362 8.084 ( 3.787 0.000 -3.490) 5.149 8.415 ( -3.312 -0.000 -4.709) 5.758 8.466 ( 0.162 0.000 -3.020) 3.024 8.474 ( -3.238 -0.000 -17.405) 17.703 8.645 ( 2.076 0.000 4.217) 4.700 8.722 ( -0.964 0.000 0.691) 1.186 9.983 ( -1.347 -0.000 1.654) 2.134 10.058 ( -2.692 0.000 -2.793) 3.879 10.730 ( 22.945 0.000 9.089) 24.679 11.109 ( 3.085 0.000 8.013) 8.586 11.828 ( -2.117 0.000 -1.673) 2.698 12.441 ( 0.961 0.000 1.756) 2.002 12.570 ( -0.635 0.000 -0.124) 0.647 12.766 ( -2.117 0.000 1.244) 2.456 13.207 ( -0.946 0.000 -4.571) 4.668 13.333 ( -0.786 0.000 2.138) 2.277 13.591 ( 1.248 0.000 0.211) 1.266 13.808 ( 1.828 0.000 3.577) 4.017 14.154 ( 3.709 0.000 -6.820) 7.763 14.308 ( -2.845 0.000 -3.574) 4.568 14.443 ( 3.050 0.000 3.962) 5.000 14.638 ( -29.784 0.000 -3.758) 30.020 15.259 ( -1.045 0.000 -0.141) 1.055 15.350 ( 1.194 0.000 3.316) 3.524 15.427 ( -2.537 0.000 -0.116) 2.539 15.885 ( -6.381 0.000 5.479) 8.411 16.193 ( -0.504 0.000 0.158) 0.528 16.782 ( 7.155 0.000 -1.079) 7.236 17.029 ( 15.219 0.000 -3.143) 15.540 ======================= Grid point 197 (100/208) ======================= q-point: ( 0.38 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( -6.502 0.000 2.801) 7.080 2.434 ( -3.611 -0.000 2.582) 4.439 3.351 ( -0.601 0.000 -6.252) 6.281 3.616 ( 1.089 0.000 8.786) 8.853 4.315 ( -2.036 0.000 -1.220) 2.374 4.460 ( -1.835 0.000 -8.061) 8.267 4.594 ( -5.862 0.000 1.722) 6.110 4.737 ( 5.567 -0.000 -0.424) 5.583 4.885 ( -1.229 0.000 -0.494) 1.325 5.123 ( -1.401 0.000 0.717) 1.574 5.327 ( -2.783 0.000 -1.920) 3.381 5.471 ( -2.333 0.000 -8.129) 8.457 5.697 ( -1.803 0.000 2.937) 3.446 6.260 ( 2.354 0.000 -6.356) 6.778 6.552 ( 0.361 0.000 4.361) 4.376 6.720 ( 7.029 -0.000 3.097) 7.681 7.439 ( -0.994 0.000 9.203) 9.257 7.771 ( 0.448 0.000 0.740) 0.866 7.788 ( 10.476 0.000 -2.647) 10.805 8.123 ( 0.482 0.000 -2.810) 2.851 8.238 ( -7.723 -0.000 -20.549) 21.952 8.459 ( -0.146 0.000 -3.298) 3.301 8.492 ( 1.528 -0.000 0.180) 1.538 8.662 ( 2.833 0.000 4.085) 4.972 8.846 ( 8.212 0.000 17.269) 19.122 9.948 ( -2.231 -0.000 -0.368) 2.261 10.016 ( -1.554 0.000 -4.538) 4.797 11.114 ( -3.186 -0.000 -1.124) 3.379 11.196 ( 22.940 0.000 13.564) 26.650 11.787 ( -1.636 0.000 -3.022) 3.437 12.466 ( 1.190 0.000 2.447) 2.721 12.560 ( -0.371 0.000 -0.165) 0.405 12.735 ( -1.421 0.000 0.514) 1.512 13.207 ( 1.521 -0.000 0.286) 1.548 13.262 ( -7.217 0.000 5.958) 9.359 13.618 ( 1.537 0.000 -0.791) 1.729 13.822 ( -0.628 0.000 2.650) 2.723 13.986 ( -24.799 0.000 1.834) 24.867 14.252 ( -2.152 0.000 -5.411) 5.823 14.399 ( 12.663 -0.000 -24.715) 27.770 14.476 ( -0.242 0.000 0.554) 0.604 15.252 ( 0.319 0.000 1.497) 1.530 15.365 ( -0.063 0.000 2.363) 2.364 15.410 ( 0.129 0.000 0.183) 0.223 15.741 ( -10.138 0.000 12.365) 15.990 16.194 ( 0.427 0.000 1.147) 1.224 16.899 ( 4.935 0.000 -0.334) 4.947 17.253 ( 8.748 0.000 -3.120) 9.288 ======================= Grid point 199 (101/208) ======================= q-point: (-0.50 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.361 ( 0.822 0.000 3.772) 3.860 2.385 ( -1.735 0.000 1.008) 2.006 3.335 ( -0.017 0.000 -5.731) 5.731 3.653 ( 1.110 0.000 9.591) 9.655 4.327 ( 3.749 0.000 -0.076) 3.750 4.439 ( 1.075 0.000 -7.836) 7.909 4.470 ( -6.971 0.000 -2.887) 7.545 4.810 ( 0.048 0.000 0.813) 0.815 4.859 ( 0.033 0.000 -1.170) 1.170 5.101 ( -0.579 0.000 -0.550) 0.799 5.284 ( -0.914 0.000 -2.344) 2.516 5.433 ( 0.053 0.000 -8.214) 8.214 5.672 ( -1.653 0.000 1.535) 2.256 6.229 ( -3.423 0.000 -10.310) 10.864 6.559 ( -0.545 0.000 4.928) 4.958 6.807 ( 0.917 0.000 3.647) 3.760 7.427 ( -1.752 0.000 7.838) 8.031 7.798 ( 1.638 0.000 2.663) 3.127 7.937 ( 4.466 0.000 -2.126) 4.947 8.089 ( -2.861 0.000 -2.227) 3.625 8.097 ( -3.301 0.000 -20.570) 20.834 8.457 ( 0.643 -0.000 -3.523) 3.581 8.511 ( 0.524 0.000 1.543) 1.630 8.794 ( 9.516 0.000 14.113) 17.021 9.036 ( 7.951 0.000 21.779) 23.185 9.900 ( -2.679 -0.000 -3.515) 4.420 9.976 ( -1.901 0.000 -5.641) 5.952 10.998 ( -7.635 0.000 -9.282) 12.018 11.536 ( 6.829 0.000 20.700) 21.798 11.761 ( -0.493 0.000 -3.742) 3.774 12.491 ( 0.837 0.000 3.049) 3.162 12.557 ( 0.124 0.000 -0.084) 0.150 12.714 ( -0.741 0.000 -0.021) 0.741 13.063 ( -12.943 0.000 -3.418) 13.387 13.263 ( 3.750 0.000 3.832) 5.361 13.638 ( 0.560 0.000 -2.129) 2.202 13.712 ( -0.378 0.000 -0.517) 0.640 13.800 ( -2.213 0.000 3.469) 4.115 14.213 ( -0.830 0.000 -7.297) 7.344 14.441 ( -2.772 0.000 -2.420) 3.680 14.670 ( 18.258 0.000 -24.178) 30.298 15.271 ( 1.125 0.000 2.608) 2.840 15.360 ( -0.635 0.000 1.124) 1.291 15.420 ( 0.285 0.000 1.726) 1.749 15.559 ( -10.908 0.000 16.886) 20.103 16.206 ( 0.444 0.000 1.906) 1.957 16.953 ( 0.665 0.000 0.260) 0.714 17.341 ( 1.012 0.000 -2.670) 2.856 ======================= Grid point 201 (102/208) ======================= q-point: (-0.38 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.377 ( 0.753 -0.000 0.741) 1.056 2.454 ( 7.837 0.000 4.152) 8.869 3.334 ( 0.901 0.000 -4.841) 4.924 3.684 ( 0.552 0.000 9.024) 9.041 4.328 ( -5.747 0.000 -7.055) 9.100 4.468 ( 2.885 -0.000 -7.739) 8.259 4.469 ( 9.868 0.000 4.509) 10.849 4.745 ( -4.970 -0.000 -0.131) 4.972 4.877 ( 0.733 0.000 -0.845) 1.119 5.110 ( 1.502 0.000 -0.201) 1.515 5.295 ( 2.488 0.000 -2.945) 3.855 5.446 ( 2.408 0.000 -8.339) 8.680 5.625 ( -3.795 0.000 0.441) 3.821 6.127 ( -4.862 0.000 -10.461) 11.536 6.551 ( -0.947 0.000 4.588) 4.685 6.755 ( -7.001 0.000 4.906) 8.549 7.398 ( -2.566 0.000 6.125) 6.641 7.826 ( 0.854 -0.000 1.207) 1.479 7.892 ( -7.691 0.000 2.435) 8.067 8.050 ( 1.429 0.000 -18.098) 18.155 8.066 ( -0.033 0.000 -4.683) 4.683 8.467 ( 0.816 -0.000 -3.426) 3.521 8.524 ( 0.674 0.000 2.563) 2.650 9.049 ( 13.916 0.000 20.842) 25.061 9.194 ( 4.531 0.000 20.738) 21.228 9.826 ( -4.484 0.000 -9.113) 10.156 9.928 ( -1.930 0.000 -5.618) 5.940 10.827 ( -7.801 0.000 -11.720) 14.079 11.446 ( -18.553 0.000 22.886) 29.462 11.759 ( 0.912 0.000 -3.659) 3.771 12.502 ( -0.286 0.000 3.344) 3.356 12.565 ( 0.614 0.000 0.448) 0.760 12.715 ( 1.034 0.000 0.195) 1.052 12.895 ( -2.290 0.000 -12.070) 12.285 13.346 ( 3.966 0.000 3.974) 5.614 13.624 ( -1.601 0.000 -3.280) 3.650 13.748 ( -3.958 0.000 3.622) 5.365 13.929 ( 20.691 0.000 -1.062) 20.718 14.200 ( 0.734 0.000 -7.467) 7.503 14.391 ( -1.570 0.000 -1.882) 2.451 14.960 ( 15.244 0.000 -19.763) 24.959 15.296 ( 0.949 -0.000 2.417) 2.597 15.308 ( -11.160 0.000 17.923) 21.114 15.366 ( -0.586 0.000 1.319) 1.443 15.512 ( 4.200 0.000 1.856) 4.592 16.214 ( -0.014 0.000 1.780) 1.780 16.923 ( -3.871 0.000 0.460) 3.898 17.280 ( -7.008 0.000 -2.008) 7.290 ======================= Grid point 203 (103/208) ======================= q-point: (-0.25 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( 2.631 -0.000 1.897) 3.244 2.638 ( 9.987 0.000 3.671) 10.640 3.351 ( 1.493 0.000 -3.978) 4.249 3.699 ( -0.540 0.000 7.435) 7.454 4.238 ( -2.508 0.000 -2.681) 3.671 4.497 ( 0.862 0.000 -7.268) 7.319 4.653 ( -4.238 0.000 -1.017) 4.358 4.711 ( 14.390 -0.000 4.444) 15.061 4.908 ( 3.637 0.000 -0.734) 3.710 5.141 ( 1.432 0.000 0.309) 1.465 5.362 ( 4.993 0.000 -4.473) 6.704 5.473 ( 1.264 0.000 -8.578) 8.671 5.521 ( -7.317 0.000 -1.474) 7.464 6.039 ( -2.397 0.000 -5.795) 6.271 6.549 ( 0.382 0.000 3.490) 3.511 6.581 ( -11.894 -0.000 6.663) 13.633 7.350 ( -3.330 0.000 3.780) 5.038 7.732 ( -9.267 -0.000 6.557) 11.352 7.834 ( -0.083 0.000 0.157) 0.178 8.031 ( -2.501 -0.000 -5.184) 5.755 8.080 ( 4.382 0.000 -14.737) 15.375 8.471 ( 0.069 -0.000 -3.333) 3.333 8.545 ( 0.841 0.000 3.201) 3.310 9.250 ( -1.757 0.000 10.133) 10.284 9.354 ( 13.561 0.000 21.378) 25.317 9.693 ( -7.285 0.000 -14.730) 16.433 9.898 ( -0.033 0.000 -4.561) 4.561 10.702 ( -3.224 0.000 -5.009) 5.957 11.046 ( -24.656 0.000 17.621) 30.305 11.783 ( 2.151 0.000 -2.795) 3.527 12.490 ( -1.423 0.000 2.981) 3.303 12.579 ( 0.736 0.000 0.743) 1.045 12.759 ( 3.486 0.000 0.491) 3.520 12.901 ( 4.156 0.000 -14.105) 14.704 13.404 ( 0.991 0.000 1.954) 2.191 13.571 ( -2.952 0.000 -3.860) 4.860 13.673 ( -3.994 0.000 3.144) 5.083 14.216 ( 2.014 0.000 -5.127) 5.509 14.356 ( 20.257 0.000 1.288) 20.298 14.386 ( 0.924 -0.000 0.622) 1.113 15.122 ( -5.182 0.000 11.409) 12.530 15.155 ( 4.360 0.000 -3.127) 5.365 15.312 ( 0.392 0.000 1.413) 1.466 15.396 ( 3.670 0.000 -0.525) 3.707 15.654 ( 10.376 0.000 -3.738) 11.029 16.215 ( 0.080 0.000 0.884) 0.888 16.819 ( -6.850 0.000 0.173) 6.852 17.074 ( -14.361 0.000 -1.379) 14.427 ======================= Grid point 205 (104/208) ======================= q-point: (-0.12 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( 3.034 -0.000 4.080) 5.084 2.801 ( 5.922 0.000 2.366) 6.377 3.372 ( 1.330 0.000 -3.426) 3.675 3.685 ( -2.042 0.000 4.827) 5.241 4.230 ( 1.464 0.000 2.943) 3.287 4.480 ( -0.849 0.000 -4.468) 4.548 4.592 ( -1.981 0.000 -2.295) 3.031 4.998 ( 14.368 0.000 5.059) 15.233 5.012 ( 6.375 -0.000 -0.743) 6.418 5.163 ( 1.016 -0.000 0.086) 1.019 5.350 ( -10.047 0.000 -3.770) 10.731 5.449 ( -1.986 0.000 -9.260) 9.471 5.459 ( 6.462 -0.000 -7.432) 9.848 6.040 ( 3.172 0.000 1.867) 3.681 6.352 ( -13.364 0.000 9.172) 16.209 6.577 ( 1.711 0.000 1.836) 2.509 7.291 ( -3.036 0.000 1.126) 3.238 7.588 ( -7.125 0.000 10.856) 12.986 7.831 ( -0.061 -0.000 0.379) 0.384 7.979 ( -1.622 0.000 -4.900) 5.162 8.159 ( 6.142 0.000 -11.509) 13.045 8.462 ( -0.303 -0.000 -3.166) 3.181 8.558 ( -0.135 0.000 3.535) 3.537 9.156 ( -8.244 0.000 -5.698) 10.022 9.415 ( -10.748 0.000 -15.653) 18.988 9.693 ( 10.274 0.000 13.688) 17.115 9.928 ( 4.280 0.000 -3.125) 5.299 10.642 ( -20.104 0.000 12.321) 23.580 10.704 ( 3.169 0.000 6.886) 7.580 11.825 ( 2.416 0.000 -1.426) 2.805 12.463 ( -1.804 0.000 2.083) 2.755 12.592 ( 0.396 0.000 0.652) 0.763 12.830 ( 3.338 0.000 -0.955) 3.472 12.989 ( 7.536 0.000 -15.300) 17.055 13.365 ( -4.368 0.000 0.054) 4.368 13.548 ( 1.236 0.000 -1.012) 1.597 13.623 ( -1.711 0.000 2.479) 3.012 14.253 ( 2.440 0.000 -2.346) 3.385 14.410 ( 0.844 0.000 2.052) 2.218 14.513 ( -5.252 0.000 13.723) 14.694 15.134 ( 5.130 0.000 3.665) 6.305 15.236 ( 3.124 0.000 -1.745) 3.579 15.316 ( -0.115 -0.000 0.208) 0.237 15.544 ( 13.423 0.000 -1.014) 13.461 15.844 ( 9.223 0.000 -4.954) 10.469 16.223 ( 0.697 0.000 -0.047) 0.698 16.687 ( -6.369 0.000 -0.544) 6.392 16.756 ( -18.171 0.000 -1.163) 18.208 ======================= Grid point 255 (105/208) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.588 ( -1.439 0.000 0.915) 1.705 1.200 ( 0.604 0.000 22.216) 22.224 1.446 ( -5.522 0.000 31.986) 32.459 2.077 ( -0.879 0.000 -0.680) 1.112 2.318 ( 5.140 0.000 50.550) 50.810 2.928 ( -0.595 0.000 -11.555) 11.571 2.939 ( 4.292 0.000 -14.230) 14.863 3.485 ( 0.357 0.000 1.467) 1.510 3.958 ( 4.699 0.000 -24.176) 24.629 4.414 ( 3.836 0.000 1.524) 4.128 4.934 ( -2.003 0.000 7.489) 7.752 5.150 ( 9.168 0.000 4.327) 10.137 5.548 ( -0.308 0.000 -8.562) 8.568 5.978 ( -1.360 0.000 -3.364) 3.629 6.103 ( 2.730 0.000 0.129) 2.733 6.414 ( -5.052 0.000 -3.665) 6.241 6.557 ( -10.603 0.000 -22.445) 24.824 6.989 ( -4.226 0.000 16.728) 17.254 7.451 ( -10.842 0.000 -7.182) 13.005 7.825 ( 2.166 0.000 -9.709) 9.948 7.866 ( 2.523 0.000 4.046) 4.769 8.924 ( 6.898 0.000 -0.193) 6.901 9.247 ( -6.262 0.000 -6.415) 8.965 9.658 ( 5.205 0.000 16.517) 17.317 9.803 ( -0.316 0.000 1.635) 1.665 10.710 ( 0.638 0.000 -0.297) 0.704 10.748 ( -5.381 0.000 2.267) 5.839 10.985 ( -0.543 0.000 -0.445) 0.702 11.514 ( 3.616 0.000 8.037) 8.813 11.691 ( 0.065 0.000 -0.131) 0.146 12.481 ( 0.009 0.000 0.765) 0.765 12.778 ( -16.537 0.000 4.170) 17.055 12.848 ( -0.046 0.000 -0.916) 0.917 13.091 ( 0.884 0.000 0.212) 0.909 13.254 ( -0.195 0.000 1.572) 1.584 13.411 ( -0.127 0.000 -0.940) 0.949 13.657 ( -6.610 0.000 -4.319) 7.896 13.686 ( 9.118 0.000 -9.276) 13.007 13.777 ( -0.011 0.000 0.019) 0.021 14.053 ( 8.232 0.000 1.263) 8.329 14.254 ( -1.931 0.000 -3.992) 4.434 14.444 ( 0.025 0.000 0.195) 0.197 14.640 ( 7.721 0.000 2.097) 8.001 15.048 ( -4.951 0.000 -9.950) 11.113 16.305 ( -3.067 0.000 7.045) 7.684 16.669 ( -0.292 0.000 11.292) 11.296 17.019 ( 7.610 0.000 -3.106) 8.220 18.251 ( -0.647 0.000 -3.491) 3.551 ======================= Grid point 256 (106/208) ======================= q-point: ( 0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.576 ( 0.539 0.000 1.077) 1.204 1.457 ( 20.714 0.000 18.676) 27.890 1.565 ( 12.274 0.000 29.797) 32.226 2.221 ( 14.827 0.000 2.124) 14.978 2.606 ( 16.404 0.000 15.948) 22.879 2.913 ( 0.741 0.000 -10.236) 10.263 3.073 ( 11.118 0.000 1.916) 11.282 3.509 ( 1.961 0.000 0.986) 2.194 4.073 ( 12.372 0.000 -24.015) 27.014 4.457 ( 0.995 0.000 -2.443) 2.638 4.881 ( -5.824 0.000 5.707) 8.154 5.204 ( -5.058 0.000 -2.672) 5.720 5.323 ( -17.895 0.000 -8.437) 19.784 5.991 ( 2.861 0.000 -0.891) 2.997 6.247 ( -2.846 0.000 -13.131) 13.436 6.292 ( 13.211 0.000 -2.088) 13.375 6.461 ( -4.050 0.000 4.726) 6.224 6.936 ( -4.246 0.000 18.222) 18.710 7.308 ( -3.565 0.000 -0.099) 3.566 7.845 ( 1.671 0.000 -9.965) 10.104 7.929 ( 3.411 0.000 1.406) 3.689 8.940 ( -6.201 0.000 -10.424) 12.129 9.125 ( -1.803 0.000 2.312) 2.932 9.671 ( -5.595 0.000 9.061) 10.650 9.792 ( -1.126 0.000 1.738) 2.071 10.435 ( -26.679 0.000 6.127) 27.374 10.727 ( 1.206 0.000 -0.795) 1.444 10.971 ( -0.948 0.000 0.086) 0.952 11.557 ( -0.681 0.000 2.675) 2.760 11.693 ( 0.215 0.000 -0.179) 0.279 12.474 ( -0.831 0.000 0.683) 1.076 12.507 ( -10.996 0.000 9.399) 14.466 12.846 ( -0.055 0.000 -0.786) 0.788 12.957 ( -6.099 0.000 -1.151) 6.207 13.281 ( 0.850 0.000 1.159) 1.437 13.466 ( -0.834 0.000 -4.433) 4.511 13.651 ( 7.016 0.000 3.840) 7.997 13.769 ( -0.712 0.000 0.029) 0.713 13.850 ( 5.466 0.000 -2.626) 6.063 14.230 ( 1.459 0.000 -4.377) 4.613 14.371 ( 19.560 0.000 -5.117) 20.219 14.459 ( 1.437 0.000 0.153) 1.445 14.800 ( 9.669 0.000 -8.936) 13.166 14.995 ( 2.863 0.000 -2.911) 4.083 16.260 ( -3.975 0.000 14.741) 15.268 16.695 ( 1.760 0.000 6.239) 6.482 17.055 ( -2.037 0.000 -6.795) 7.093 18.206 ( -3.520 0.000 -2.607) 4.380 ======================= Grid point 257 (107/208) ======================= q-point: ( 0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( 2.022 0.000 -0.019) 2.022 1.912 ( 18.017 0.000 18.544) 25.855 1.952 ( 27.120 0.000 15.947) 31.461 2.574 ( 20.465 0.000 3.491) 20.760 2.906 ( 13.606 0.000 -12.909) 18.755 2.911 ( 0.169 0.000 -7.606) 7.608 3.340 ( 15.208 0.000 8.098) 17.229 3.557 ( 2.713 0.000 0.437) 2.748 4.281 ( 4.605 0.000 -17.743) 18.331 4.418 ( -3.312 0.000 -9.288) 9.861 4.714 ( -5.828 0.000 -1.516) 6.022 4.936 ( -20.322 0.000 -11.320) 23.262 5.141 ( 4.053 0.000 -1.184) 4.222 6.045 ( 1.452 0.000 3.612) 3.893 6.290 ( 0.186 0.000 11.690) 11.692 6.398 ( 1.922 0.000 6.540) 6.817 6.499 ( 7.763 0.000 -1.154) 7.848 6.910 ( -0.810 0.000 18.343) 18.361 7.248 ( -4.000 0.000 -1.483) 4.266 7.852 ( 0.709 0.000 -10.677) 10.700 7.982 ( 1.698 0.000 -3.446) 3.842 8.776 ( -6.379 0.000 -12.319) 13.872 9.149 ( 2.300 0.000 4.787) 5.311 9.511 ( -10.937 0.000 -3.966) 11.634 9.770 ( -1.349 0.000 1.836) 2.278 9.872 ( -31.441 0.000 8.236) 32.502 10.749 ( 1.195 0.000 -1.438) 1.870 10.953 ( -0.897 0.000 0.832) 1.223 11.478 ( -7.253 0.000 -5.835) 9.309 11.697 ( 0.229 0.000 -0.246) 0.336 12.408 ( -1.764 0.000 12.842) 12.962 12.456 ( -1.162 0.000 0.537) 1.280 12.844 ( -0.079 0.000 -0.587) 0.592 12.919 ( 0.862 0.000 -2.166) 2.331 13.261 ( -2.433 0.000 -1.621) 2.924 13.461 ( 0.997 0.000 -1.820) 2.076 13.738 ( 1.381 0.000 5.729) 5.893 13.754 ( -0.818 0.000 0.044) 0.819 13.880 ( -1.162 0.000 -4.676) 4.818 14.261 ( 1.893 0.000 -0.895) 2.093 14.492 ( 1.855 0.000 0.099) 1.858 14.589 ( 3.865 0.000 -3.064) 4.932 14.920 ( 6.480 0.000 -8.911) 11.018 15.252 ( 19.878 0.000 -8.022) 21.435 16.237 ( -0.522 0.000 26.609) 26.614 16.756 ( 3.954 0.000 0.808) 4.036 16.976 ( -4.252 0.000 -7.210) 8.370 18.119 ( -5.039 0.000 -1.094) 5.156 ======================= Grid point 258 (108/208) ======================= q-point: ( 0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.640 ( 1.558 0.000 -0.494) 1.635 2.253 ( 15.500 0.000 8.751) 17.800 2.472 ( 24.087 0.000 15.306) 28.539 2.873 ( -3.845 0.000 -3.154) 4.974 2.925 ( 9.425 0.000 9.184) 13.160 3.034 ( 6.411 0.000 -15.563) 16.832 3.601 ( 1.614 0.000 -0.324) 1.646 3.611 ( 11.010 0.000 -22.030) 24.628 3.917 ( -21.791 0.000 -3.350) 22.047 4.498 ( 1.072 0.000 -9.346) 9.408 4.568 ( -14.908 0.000 -16.434) 22.188 4.810 ( 12.795 0.000 7.595) 14.880 5.341 ( 13.574 0.000 -2.530) 13.807 5.993 ( -9.155 0.000 11.218) 14.480 6.205 ( -3.802 0.000 1.146) 3.971 6.562 ( -0.453 0.000 4.290) 4.314 6.619 ( 12.655 0.000 22.447) 25.769 6.975 ( 3.988 0.000 14.337) 14.882 7.173 ( -1.337 0.000 -0.415) 1.400 7.836 ( -0.330 0.000 -11.676) 11.681 7.958 ( -3.385 0.000 -8.047) 8.730 8.672 ( -4.280 0.000 -10.576) 11.409 9.204 ( -1.009 0.000 5.849) 5.936 9.288 ( -8.916 0.000 -14.152) 16.726 9.407 ( -13.759 0.000 7.086) 15.476 9.752 ( -0.833 0.000 1.888) 2.064 10.762 ( 0.399 0.000 -1.812) 1.855 10.944 ( -0.183 0.000 1.322) 1.334 11.299 ( -9.270 0.000 -9.953) 13.602 11.700 ( 0.093 0.000 -0.305) 0.319 12.436 ( -0.868 0.000 0.416) 0.963 12.457 ( 3.761 0.000 13.993) 14.489 12.842 ( 0.003 0.000 -0.437) 0.437 12.935 ( 0.464 0.000 -2.617) 2.658 13.212 ( -1.777 0.000 -3.791) 4.187 13.469 ( -0.612 0.000 -1.090) 1.250 13.742 ( -0.465 0.000 0.056) 0.469 13.745 ( -1.046 0.000 6.528) 6.611 13.834 ( -1.631 0.000 -6.429) 6.633 14.284 ( 0.671 0.000 -0.387) 0.775 14.522 ( 1.200 0.000 0.067) 1.202 14.596 ( -0.987 0.000 -2.864) 3.029 15.024 ( 4.111 0.000 -0.828) 4.193 15.522 ( 9.775 0.000 -8.081) 12.682 16.335 ( 4.496 0.000 22.791) 23.230 16.842 ( 4.798 0.000 2.175) 5.268 16.886 ( -3.817 0.000 -7.785) 8.670 18.031 ( -3.559 0.000 0.209) 3.565 ======================= Grid point 259 (109/208) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.657 ( 0.260 0.000 -0.678) 0.726 2.510 ( 9.937 0.000 5.239) 11.233 2.693 ( -13.072 0.000 11.760) 17.583 2.734 ( -21.816 0.000 1.197) 21.849 2.883 ( 12.815 0.000 4.505) 13.584 3.232 ( 1.420 0.000 -10.869) 10.962 3.428 ( -4.211 0.000 -19.266) 19.721 3.604 ( -1.202 0.000 -1.222) 1.714 3.944 ( 10.241 0.000 2.282) 10.492 4.373 ( -12.325 0.000 -4.581) 13.149 4.398 ( 1.756 0.000 -20.262) 20.338 5.039 ( 5.014 0.000 1.686) 5.290 5.428 ( -6.219 0.000 5.249) 8.138 5.870 ( -2.267 0.000 9.756) 10.016 6.208 ( 4.252 0.000 -2.473) 4.919 6.535 ( -2.908 0.000 7.599) 8.136 6.865 ( 11.615 0.000 11.915) 16.639 7.065 ( 2.534 0.000 12.073) 12.336 7.290 ( 12.279 0.000 9.123) 15.297 7.806 ( -0.617 0.000 -12.371) 12.386 7.852 ( -5.553 0.000 -7.451) 9.292 8.550 ( -6.046 0.000 -4.618) 7.608 8.944 ( -14.510 0.000 -9.852) 17.539 9.344 ( 8.254 0.000 -3.951) 9.151 9.433 ( 11.222 0.000 -0.014) 11.222 9.748 ( 0.071 0.000 1.816) 1.817 10.757 ( -0.666 0.000 -1.460) 1.605 10.951 ( 0.705 0.000 1.014) 1.235 11.135 ( -5.785 0.000 -8.139) 9.985 11.700 ( -0.066 0.000 -0.294) 0.301 12.427 ( -0.140 0.000 0.408) 0.431 12.568 ( 5.251 0.000 12.417) 13.482 12.843 ( 0.190 0.000 -0.440) 0.479 12.918 ( -1.636 0.000 -2.493) 2.982 13.189 ( -0.125 0.000 -5.421) 5.422 13.439 ( -1.304 0.000 -1.128) 1.724 13.736 ( -1.079 0.000 4.954) 5.071 13.737 ( 0.009 0.000 0.056) 0.056 13.819 ( 1.044 0.000 -4.403) 4.525 14.292 ( 0.424 0.000 -0.430) 0.604 14.534 ( -0.048 0.000 0.073) 0.087 14.566 ( -1.788 0.000 -0.851) 1.981 15.028 ( -4.282 0.000 -0.132) 4.284 15.641 ( 4.341 0.000 -0.617) 4.385 16.389 ( -2.154 0.000 10.223) 10.448 16.813 ( -2.468 0.000 -6.044) 6.529 16.928 ( 2.499 0.000 5.778) 6.295 18.008 ( 1.343 0.000 0.075) 1.345 ======================= Grid point 260 (110/208) ======================= q-point: (-0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.649 ( -0.942 0.000 -0.824) 1.252 2.250 ( -27.039 0.000 6.553) 27.822 2.340 ( -25.071 0.000 14.625) 29.025 2.592 ( -4.628 0.000 5.652) 7.305 3.032 ( 2.864 0.000 -2.471) 3.782 3.052 ( -7.099 0.000 -8.883) 11.371 3.558 ( 10.141 0.000 -16.734) 19.567 3.567 ( -2.280 0.000 0.069) 2.281 3.852 ( -28.761 0.000 20.279) 35.191 4.252 ( 7.955 0.000 -13.056) 15.289 4.569 ( 17.954 0.000 -16.674) 24.502 4.953 ( -9.435 0.000 0.092) 9.435 5.257 ( -11.073 0.000 2.402) 11.330 5.953 ( 7.493 0.000 10.608) 12.988 6.267 ( 1.042 0.000 -3.104) 3.275 6.482 ( -4.357 0.000 7.626) 8.783 7.098 ( -1.000 0.000 11.858) 11.900 7.149 ( 15.788 0.000 -1.536) 15.862 7.521 ( 7.713 0.000 -0.250) 7.717 7.767 ( -1.718 0.000 -1.756) 2.457 7.782 ( 0.322 0.000 -11.981) 11.985 8.473 ( -1.111 0.000 -1.801) 2.116 8.766 ( -1.084 0.000 0.264) 1.116 9.459 ( 4.414 0.000 -4.133) 6.047 9.759 ( 0.808 0.000 1.647) 1.834 9.780 ( 24.244 0.000 -8.160) 25.581 10.737 ( -1.117 0.000 -0.777) 1.361 10.969 ( 0.966 0.000 0.274) 1.004 11.084 ( 1.753 0.000 -1.496) 2.304 11.697 ( -0.149 0.000 -0.206) 0.254 12.433 ( 0.657 0.000 0.516) 0.835 12.680 ( 4.548 0.000 8.333) 9.494 12.847 ( 0.284 0.000 -0.593) 0.657 12.885 ( -0.810 0.000 -0.799) 1.138 13.181 ( 0.655 0.000 -7.090) 7.120 13.449 ( 2.340 0.000 -0.418) 2.377 13.718 ( -1.101 0.000 1.731) 2.051 13.742 ( 0.472 0.000 0.042) 0.474 13.844 ( 1.388 0.000 -2.015) 2.447 14.301 ( 0.556 0.000 0.573) 0.799 14.521 ( -1.274 0.000 0.113) 1.279 14.528 ( -2.299 0.000 1.022) 2.516 14.859 ( -13.565 0.000 2.147) 13.733 15.652 ( -3.973 0.000 -6.392) 7.526 16.352 ( -1.341 0.000 12.584) 12.655 16.768 ( -1.849 0.000 -1.647) 2.476 16.920 ( -4.275 0.000 2.364) 4.886 18.074 ( 5.199 0.000 -1.252) 5.347 ======================= Grid point 261 (111/208) ======================= q-point: (-0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 208 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.625 ( -1.252 0.000 -0.903) 1.544 1.817 ( -20.242 0.000 22.854) 30.529 1.848 ( -28.660 0.000 17.497) 33.579 2.391 ( -14.257 0.000 4.837) 15.055 2.944 ( -8.133 0.000 -14.344) 16.489 3.026 ( -1.475 0.000 -9.402) 9.517 3.191 ( -35.335 0.000 28.134) 45.168 3.524 ( -2.309 0.000 1.709) 2.872 3.749 ( 10.119 0.000 -11.932) 15.645 4.367 ( 2.763 0.000 -8.471) 8.910 4.830 ( -0.937 0.000 -1.278) 1.584 4.943 ( 22.798 0.000 -11.892) 25.713 5.079 ( -7.143 0.000 2.542) 7.581 6.073 ( 1.542 0.000 2.971) 3.347 6.282 ( 2.843 0.000 3.518) 4.524 6.382 ( -7.696 0.000 5.420) 9.413 7.077 ( -3.037 0.000 12.880) 13.233 7.255 ( -6.808 0.000 -20.474) 21.577 7.602 ( 4.921 0.000 -15.193) 15.970 7.777 ( 2.615 0.000 2.910) 3.912 7.781 ( 1.523 0.000 -10.798) 10.905 8.542 ( 8.361 0.000 3.535) 9.078 8.913 ( 13.254 0.000 17.028) 21.578 9.500 ( 1.536 0.000 -9.759) 9.879 9.780 ( 1.002 0.000 1.529) 1.828 10.243 ( 24.755 0.000 -7.180) 25.775 10.716 ( -0.872 0.000 -0.276) 0.915 10.985 ( 0.649 0.000 -0.335) 0.730 11.197 ( 9.226 0.000 5.729) 10.860 11.694 ( -0.159 0.000 -0.123) 0.201 12.451 ( 1.088 0.000 0.660) 1.272 12.757 ( 3.164 0.000 1.787) 3.634 12.850 ( 0.173 0.000 -0.790) 0.808 12.918 ( 4.190 0.000 3.697) 5.588 13.216 ( 5.342 0.000 -9.935) 11.280 13.474 ( -1.241 0.000 -2.100) 2.439 13.727 ( 2.454 0.000 1.504) 2.878 13.754 ( 0.808 0.000 0.026) 0.808 13.829 ( -3.913 0.000 -2.258) 4.518 14.304 ( -2.028 0.000 5.378) 5.747 14.482 ( -2.640 0.000 3.221) 4.165 14.490 ( -1.879 0.000 0.165) 1.886 14.561 ( -16.213 0.000 0.576) 16.223 15.469 ( -12.338 0.000 -13.670) 18.415 16.404 ( 2.588 0.000 17.025) 17.220 16.720 ( -4.861 0.000 2.887) 5.653 16.812 ( -4.021 0.000 -1.586) 4.323 18.172 ( 4.979 0.000 -2.677) 5.653 ======================= Grid point 262 (112/208) ======================= q-point: (-0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( -0.645 0.000 -0.596) 0.878 1.384 ( -21.852 0.000 20.988) 30.299 1.575 ( -11.635 0.000 32.030) 34.078 2.174 ( -8.025 0.000 4.729) 9.315 2.462 ( -29.202 0.000 34.755) 45.395 2.946 ( -2.646 0.000 -9.716) 10.070 2.972 ( -1.939 0.000 -11.646) 11.806 3.492 ( -1.296 0.000 1.882) 2.285 3.901 ( 7.089 0.000 -16.508) 17.966 4.354 ( 0.322 0.000 -0.971) 1.023 4.914 ( 6.056 0.000 1.837) 6.328 5.008 ( 0.197 0.000 3.327) 3.333 5.339 ( 19.743 0.000 -9.464) 21.894 6.036 ( -3.434 0.000 -3.422) 4.848 6.213 ( -10.249 0.000 2.558) 10.563 6.379 ( 4.570 0.000 8.614) 9.751 6.930 ( -19.172 0.000 -32.338) 37.594 7.036 ( -3.592 0.000 14.856) 15.284 7.616 ( -2.011 0.000 -16.392) 16.515 7.799 ( 2.130 0.000 -9.944) 10.169 7.830 ( 1.178 0.000 3.816) 3.993 8.744 ( 11.066 0.000 2.750) 11.403 9.213 ( 11.342 0.000 15.970) 19.588 9.520 ( 3.798 0.000 -4.752) 6.083 9.798 ( 0.559 0.000 1.543) 1.641 10.631 ( 15.810 0.000 -2.401) 15.992 10.706 ( -0.177 0.000 -0.107) 0.207 10.991 ( 0.063 0.000 -0.594) 0.598 11.392 ( 8.446 0.000 8.490) 11.976 11.691 ( -0.090 0.000 -0.104) 0.137 12.472 ( 0.836 0.000 0.755) 1.127 12.847 ( 6.268 0.000 1.217) 6.385 12.851 ( 0.005 0.000 -0.917) 0.917 13.015 ( 4.128 0.000 1.963) 4.571 13.332 ( -0.173 0.000 -15.860) 15.861 13.394 ( 2.168 0.000 -1.345) 2.551 13.661 ( -11.814 0.000 2.712) 12.121 13.770 ( 0.692 0.000 0.018) 0.693 13.789 ( 1.694 0.000 1.048) 1.991 14.145 ( -14.694 0.000 6.541) 16.084 14.342 ( -6.855 0.000 -8.630) 11.021 14.458 ( -1.409 0.000 0.200) 1.423 14.505 ( 5.071 0.000 4.556) 6.817 15.211 ( -11.022 0.000 -12.086) 16.357 16.388 ( -6.607 0.000 8.518) 10.780 16.658 ( -0.599 0.000 9.362) 9.381 16.847 ( 7.242 0.000 2.307) 7.601 18.239 ( 2.491 0.000 -3.519) 4.311 ======================= Grid point 263 (113/208) ======================= q-point: ( 0.00 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.983 ( -0.033 30.558 -0.610) 30.565 1.539 ( -1.041 13.757 23.948) 27.637 1.705 ( 0.191 32.563 20.875) 38.680 2.182 ( -2.382 11.544 1.135) 11.841 2.388 ( 4.815 10.487 35.140) 36.986 3.003 ( 0.463 8.712 -12.731) 15.433 3.106 ( -0.166 13.937 -4.858) 14.760 3.591 ( 0.990 9.847 1.354) 9.988 3.969 ( 5.997 1.956 -21.646) 22.547 4.395 ( 3.576 -0.724 1.858) 4.094 4.919 ( -1.533 -1.365 6.731) 7.037 5.135 ( 8.266 -1.309 4.448) 9.477 5.747 ( -2.182 16.478 -8.889) 18.850 6.004 ( -0.939 2.630 -3.362) 4.370 6.189 ( -1.061 6.485 -6.824) 9.474 6.439 ( 1.253 1.195 6.543) 6.768 6.549 ( -14.119 6.303 -19.558) 24.931 7.110 ( -4.662 7.584 7.751) 11.804 7.303 ( -6.814 -15.601 -3.803) 17.443 7.437 ( 1.893 -8.902 -2.833) 9.531 8.334 ( 0.988 17.605 -0.401) 17.637 8.692 ( 3.379 -20.494 -5.950) 21.607 9.144 ( 2.635 -3.302 4.659) 6.289 9.360 ( 4.827 -22.259 14.865) 27.198 9.838 ( -6.445 -1.349 -1.741) 6.811 10.790 ( 3.626 -3.084 -0.388) 4.776 10.827 ( -3.855 9.261 -1.008) 10.082 11.052 ( 0.562 3.947 -1.139) 4.146 11.140 ( -1.338 -13.594 0.046) 13.659 12.192 ( 0.997 29.422 0.248) 29.440 12.422 ( -1.980 -24.900 3.756) 25.259 12.636 ( 2.063 7.270 3.847) 8.480 13.024 ( -11.564 -3.729 -3.405) 12.619 13.104 ( 0.900 5.269 0.143) 5.347 13.218 ( -4.449 4.370 -1.345) 6.380 13.338 ( 7.063 -2.248 -1.099) 7.493 13.501 ( -12.505 -2.244 -0.223) 12.706 13.710 ( 6.768 2.806 -8.627) 11.319 13.849 ( 7.926 -9.204 1.089) 12.195 14.015 ( -1.184 6.311 -3.333) 7.234 14.553 ( 1.014 25.384 -1.676) 25.460 14.601 ( 7.250 2.526 2.394) 8.042 14.738 ( 0.903 15.155 -1.872) 15.297 15.044 ( -4.635 -0.012 -8.466) 9.652 16.339 ( -7.950 1.591 8.226) 11.550 16.576 ( 2.706 -9.266 8.686) 12.986 16.820 ( 8.843 -14.369 2.801) 17.103 18.160 ( -0.565 -9.023 -3.285) 9.620 ======================= Grid point 264 (114/208) ======================= q-point: ( 0.12 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( -0.458 30.556 -0.461) 30.563 1.680 ( 11.385 10.361 23.680) 28.244 1.868 ( 14.090 33.885 14.723) 39.541 2.287 ( 12.601 7.139 6.463) 15.860 2.679 ( 17.403 9.380 8.500) 21.520 3.028 ( 3.396 9.564 -9.612) 13.978 3.139 ( 5.251 7.441 3.189) 9.649 3.625 ( 2.330 10.563 0.739) 10.842 4.109 ( 12.876 3.996 -20.489) 24.527 4.439 ( 0.713 -0.692 -2.854) 3.022 4.877 ( -4.793 -0.325 5.195) 7.076 5.173 ( -6.966 -2.377 -3.875) 8.318 5.523 ( -14.026 16.355 -3.821) 21.882 6.019 ( 2.439 2.845 -0.634) 3.801 6.153 ( -1.056 -0.939 -10.153) 10.250 6.442 ( -3.126 -1.254 5.591) 6.527 6.501 ( 9.856 14.606 -2.299) 17.769 7.035 ( -4.697 7.776 11.001) 14.267 7.197 ( -3.467 -10.957 -0.678) 11.512 7.486 ( 2.710 -10.900 -2.379) 11.481 8.348 ( 1.419 12.025 -1.799) 12.241 8.706 ( -0.730 -15.188 -8.600) 17.469 9.137 ( -3.486 3.117 -0.751) 4.736 9.378 ( -4.414 -23.611 7.453) 25.150 9.692 ( -9.504 -7.701 5.812) 13.543 10.635 ( -15.746 13.175 0.003) 20.531 10.805 ( -0.362 2.397 -0.245) 2.437 11.049 ( -0.534 6.086 -1.629) 6.322 11.118 ( -1.011 -19.965 0.104) 19.991 12.177 ( -2.137 28.026 0.475) 28.111 12.374 ( -4.115 -15.989 6.496) 17.742 12.667 ( -0.282 1.236 5.536) 5.680 12.754 ( -10.518 1.134 -5.526) 11.935 12.949 ( -7.091 1.843 -0.211) 7.330 13.237 ( -0.456 -0.167 -0.362) 0.606 13.370 ( -2.662 0.121 -1.685) 3.152 13.546 ( 10.745 -5.016 3.040) 12.242 13.727 ( -0.863 -7.349 -1.960) 7.655 14.009 ( 0.884 7.711 -2.112) 8.044 14.215 ( 21.887 -3.247 -2.632) 22.282 14.553 ( 0.479 26.802 -1.437) 26.844 14.735 ( -0.015 4.998 -7.799) 9.263 14.823 ( 14.218 11.989 -4.267) 19.081 15.003 ( 2.763 0.855 -2.151) 3.604 16.179 ( -9.578 -8.915 15.574) 20.341 16.659 ( 4.004 -2.820 4.229) 6.471 16.927 ( 2.094 -10.393 -3.234) 11.084 18.117 ( -3.411 -8.813 -2.482) 9.771 ======================= Grid point 265 (115/208) ======================= q-point: ( 0.25 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( 0.385 29.123 -0.162) 29.126 1.993 ( 16.764 7.428 14.743) 23.528 2.236 ( 21.300 24.672 11.772) 34.655 2.599 ( 17.360 3.481 6.175) 18.751 2.949 ( 9.966 6.360 -14.635) 18.814 3.073 ( 3.125 13.277 -5.506) 14.709 3.350 ( 14.913 2.535 6.973) 16.657 3.675 ( 2.645 10.289 -0.271) 10.627 4.316 ( -2.818 3.146 -16.901) 17.421 4.384 ( 3.384 -1.296 -6.248) 7.223 4.734 ( -5.925 2.550 -2.677) 6.984 5.016 ( -6.257 1.129 -2.768) 6.934 5.294 ( -6.302 20.001 -6.809) 22.048 6.070 ( 1.402 2.281 4.709) 5.417 6.227 ( 5.771 -3.796 14.167) 15.761 6.363 ( -4.197 -0.345 2.518) 4.907 6.704 ( 9.893 13.524 -0.171) 16.757 6.976 ( -3.321 4.135 13.188) 14.215 7.147 ( -2.026 -6.970 -0.272) 7.264 7.512 ( 0.244 -11.526 -3.599) 12.078 8.398 ( 4.368 11.132 -5.347) 13.099 8.643 ( -3.863 -8.498 -9.680) 13.447 9.021 ( -8.192 -8.110 -6.291) 13.133 9.260 ( -7.411 -18.551 -3.221) 20.235 9.476 ( -15.307 -8.782 12.677) 21.729 10.357 ( -10.719 22.783 0.613) 25.186 10.803 ( 0.150 1.666 -0.076) 1.675 11.032 ( -0.968 6.517 -0.610) 6.617 11.078 ( -3.470 -19.449 -2.655) 19.934 12.114 ( -4.597 24.953 -2.003) 25.452 12.312 ( -2.574 -7.770 10.168) 13.053 12.596 ( -3.815 -21.556 -2.166) 21.998 12.685 ( -0.974 12.457 1.387) 12.571 12.901 ( 0.934 -1.704 -1.754) 2.617 13.199 ( -2.946 -1.628 -0.489) 3.401 13.337 ( -1.022 2.251 -2.368) 3.423 13.687 ( 3.383 -2.921 6.611) 7.980 13.707 ( -0.620 -9.387 -3.076) 9.898 14.031 ( 1.552 6.006 -0.549) 6.227 14.484 ( 5.377 6.819 -0.348) 8.691 14.555 ( 0.846 16.570 -6.259) 17.733 14.707 ( -0.404 10.343 -2.910) 10.752 15.002 ( 6.435 8.365 -2.267) 10.795 15.262 ( 20.307 2.019 -9.391) 22.464 16.093 ( -1.355 -13.915 24.321) 28.053 16.729 ( 2.949 -2.776 0.856) 4.140 16.910 ( -2.362 -5.592 -4.907) 7.805 18.032 ( -4.947 -8.594 -1.114) 9.978 ======================= Grid point 266 (116/208) ======================= q-point: ( 0.38 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( 0.648 27.906 -0.187) 27.914 2.310 ( 14.489 4.981 6.409) 16.607 2.651 ( 19.141 15.413 10.151) 26.589 2.869 ( 7.300 2.259 2.384) 8.005 2.986 ( -4.835 2.050 -2.703) 5.907 3.150 ( 7.602 12.744 -6.593) 16.238 3.625 ( 12.115 5.264 -14.036) 19.275 3.695 ( -2.510 6.115 -9.423) 11.511 3.951 ( -16.692 4.533 1.071) 17.330 4.526 ( 1.980 2.878 -7.600) 8.364 4.730 ( -0.768 9.583 -5.613) 11.132 4.880 ( 0.600 9.814 -0.259) 9.836 5.375 ( 11.042 6.126 -5.487) 13.768 6.023 ( -8.763 2.980 11.125) 14.472 6.213 ( -2.822 0.851 3.174) 4.331 6.467 ( 7.590 -4.421 17.500) 19.581 6.801 ( -0.269 10.360 4.228) 11.193 7.003 ( 5.112 -3.201 8.775) 10.648 7.160 ( 4.735 4.944 5.430) 8.738 7.476 ( -3.168 -12.167 -4.964) 13.518 8.437 ( -1.394 24.315 -12.348) 27.306 8.586 ( 1.304 -13.840 -6.588) 15.384 8.822 ( -10.377 -24.730 -3.482) 27.044 9.076 ( -13.035 -18.428 -11.633) 25.393 9.259 ( -4.853 1.124 8.100) 9.510 10.274 ( 0.762 28.034 3.329) 28.241 10.805 ( -0.104 0.263 -0.543) 0.612 10.979 ( -5.908 -16.720 -5.922) 18.696 11.018 ( -0.346 6.509 0.491) 6.537 12.020 ( -4.234 20.422 -2.168) 20.969 12.322 ( 1.310 -7.080 9.550) 11.960 12.546 ( -1.472 -15.215 -2.329) 15.463 12.672 ( -0.583 -1.834 2.021) 2.791 12.928 ( 1.478 -1.504 -2.598) 3.346 13.146 ( -2.087 -0.552 -0.322) 2.183 13.317 ( -0.535 3.809 -3.678) 5.322 13.696 ( 0.014 -11.727 -2.487) 11.988 13.712 ( -1.245 2.261 7.490) 7.922 14.061 ( 1.461 3.964 0.912) 4.322 14.442 ( -4.351 16.558 -12.352) 21.111 14.592 ( 1.417 1.035 0.282) 1.778 14.727 ( 1.816 17.196 3.239) 17.593 15.110 ( 3.962 8.578 2.226) 9.708 15.517 ( 8.292 0.190 -9.028) 12.260 16.221 ( 8.407 -12.036 21.309) 25.877 16.771 ( 1.506 -6.165 0.160) 6.349 16.846 ( -3.180 -3.268 -5.052) 6.805 17.946 ( -3.552 -8.480 0.065) 9.195 ======================= Grid point 267 (117/208) ======================= q-point: (-0.50 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.993 ( 0.187 27.441 -0.271) 27.443 2.535 ( 6.647 1.709 4.639) 8.284 2.722 ( -21.420 -0.368 -1.082) 21.451 2.826 ( -6.600 11.502 7.189) 15.084 2.949 ( 6.355 5.738 -0.659) 8.587 3.325 ( 6.157 9.363 -6.303) 12.857 3.480 ( -5.585 5.700 -10.150) 12.911 3.699 ( -0.779 9.666 -4.292) 10.604 3.986 ( 10.370 5.118 1.429) 11.652 4.418 ( -11.474 4.988 -3.563) 13.009 4.659 ( 1.649 22.550 -16.188) 27.807 5.027 ( 4.644 -0.970 1.672) 5.030 5.438 ( -6.735 2.372 2.695) 7.632 5.896 ( -2.910 2.736 10.371) 11.113 6.231 ( 4.250 2.535 -1.882) 5.294 6.574 ( 0.990 0.965 14.884) 14.948 6.840 ( 6.619 0.156 3.572) 7.523 7.128 ( 5.694 -1.413 5.666) 8.156 7.356 ( 12.346 8.417 12.986) 19.796 7.392 ( -3.875 -11.357 -4.363) 12.769 8.348 ( -3.749 22.130 -12.563) 25.722 8.539 ( -6.169 0.620 -4.979) 7.952 8.761 ( 1.329 -34.915 0.205) 34.941 8.788 ( -10.749 -18.396 -11.847) 24.378 9.321 ( 9.788 -2.352 -3.013) 10.508 10.350 ( 5.466 33.262 3.457) 33.885 10.793 ( -1.063 -4.489 -1.023) 4.725 10.866 ( -3.860 -11.800 -6.175) 13.866 11.022 ( 0.574 6.617 0.880) 6.700 11.961 ( -1.755 18.171 -0.742) 18.271 12.372 ( 2.136 -12.457 6.630) 14.272 12.530 ( 0.122 -2.008 -1.039) 2.265 12.667 ( -0.277 -18.343 1.284) 18.390 12.936 ( 0.055 1.442 -2.132) 2.575 13.131 ( 0.467 2.315 -0.786) 2.489 13.311 ( 0.857 4.378 -4.955) 6.668 13.689 ( -1.522 2.082 9.131) 9.489 13.705 ( 0.916 -10.626 -3.050) 11.093 14.087 ( 0.980 4.110 2.270) 4.797 14.339 ( -4.200 9.458 -11.656) 15.587 14.603 ( -0.156 6.936 1.298) 7.059 14.764 ( 1.191 17.315 3.043) 17.620 15.112 ( -4.776 9.010 1.806) 10.356 15.614 ( 3.707 -2.407 -0.989) 4.529 16.348 ( 1.190 -5.296 8.725) 10.275 16.773 ( -3.542 -7.790 1.680) 8.721 16.802 ( 1.041 -6.429 -1.638) 6.715 17.921 ( 1.202 -8.615 -0.025) 8.698 ======================= Grid point 268 (118/208) ======================= q-point: (-0.38 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.992 ( -0.272 27.720 -0.382) 27.724 2.242 ( -25.791 0.382 4.643) 26.208 2.476 ( -16.438 7.093 11.322) 21.182 2.667 ( -11.122 11.115 6.713) 17.097 3.002 ( 3.290 2.762 -9.197) 10.151 3.277 ( -4.270 15.502 0.522) 16.088 3.575 ( 7.814 2.247 -11.305) 13.925 3.663 ( -1.078 9.138 -4.471) 10.230 3.966 ( -25.380 11.349 17.548) 32.877 4.270 ( 7.271 2.596 -12.238) 14.470 4.761 ( 8.068 13.557 -11.364) 19.443 4.995 ( -1.760 6.903 -3.023) 7.738 5.249 ( -10.855 1.431 2.164) 11.161 5.970 ( 7.086 1.827 10.467) 12.771 6.279 ( 0.178 1.734 -3.022) 3.489 6.580 ( -2.344 7.092 10.531) 12.910 7.042 ( 10.493 -2.539 1.103) 10.852 7.228 ( 4.809 -4.645 2.561) 7.160 7.318 ( -1.308 -9.894 -4.633) 11.003 7.585 ( 6.360 7.608 2.846) 10.317 8.279 ( -1.909 23.306 -9.156) 25.113 8.437 ( -3.208 -4.405 -1.644) 5.692 8.609 ( -0.458 -13.945 -1.300) 14.012 8.874 ( 6.480 -36.093 -1.222) 36.691 9.577 ( 16.601 -5.038 -5.434) 18.180 10.434 ( 2.558 29.296 -3.391) 29.602 10.785 ( 0.760 -1.989 0.158) 2.136 10.851 ( 3.664 -8.348 -1.344) 9.215 11.037 ( 0.819 6.212 0.428) 6.281 11.955 ( 1.262 18.733 1.168) 18.812 12.412 ( 1.198 -20.207 3.535) 20.549 12.540 ( 0.625 8.579 -1.518) 8.735 12.678 ( 1.795 -24.148 2.219) 24.316 12.940 ( 1.003 2.819 -1.452) 3.326 13.149 ( 1.522 4.789 -1.337) 5.200 13.337 ( 2.767 3.891 -6.694) 8.222 13.685 ( 0.077 -0.155 1.436) 1.447 13.736 ( 2.422 -8.214 4.932) 9.882 14.102 ( -0.101 6.709 4.400) 8.024 14.247 ( -3.683 3.508 -10.358) 11.540 14.592 ( -1.374 8.624 1.244) 8.821 14.777 ( -0.264 17.562 2.526) 17.744 14.942 ( -13.194 9.683 4.038) 16.856 15.621 ( -3.704 -2.913 -5.897) 7.548 16.351 ( -0.087 -0.910 9.480) 9.524 16.692 ( -5.064 -12.475 1.805) 13.584 16.794 ( -2.778 -5.541 0.425) 6.213 17.984 ( 5.034 -8.952 -1.217) 10.342 ======================= Grid point 269 (119/208) ======================= q-point: (-0.25 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( -0.241 28.457 -0.539) 28.463 1.831 ( -18.581 3.034 19.399) 27.033 2.108 ( -22.436 19.289 16.965) 34.106 2.422 ( -13.823 5.591 2.911) 15.192 3.030 ( -2.027 8.478 -12.038) 14.863 3.171 ( -8.068 13.199 -9.429) 18.117 3.359 ( -30.378 16.589 25.776) 43.156 3.609 ( -2.247 8.284 2.268) 8.877 3.764 ( 8.565 2.193 -11.835) 14.773 4.370 ( 1.696 0.500 -8.317) 8.503 4.792 ( 1.814 -0.844 -1.401) 2.442 5.041 ( -3.472 -1.062 -0.494) 3.664 5.228 ( 15.938 22.589 -7.289) 28.591 6.090 ( 1.819 1.852 3.599) 4.437 6.275 ( 1.788 -0.168 2.689) 3.234 6.511 ( -6.715 10.409 5.516) 13.559 7.109 ( -3.005 2.502 2.325) 4.549 7.273 ( 0.234 -16.297 -6.731) 17.633 7.353 ( 0.221 2.043 -7.629) 7.901 7.568 ( -2.842 -3.549 -14.748) 15.433 8.250 ( 0.894 20.654 -3.555) 20.977 8.478 ( 6.135 -7.252 2.548) 9.834 8.749 ( 11.965 -14.568 15.188) 24.209 9.008 ( 8.138 -28.106 -1.726) 29.311 9.847 ( 10.593 -3.534 -4.675) 12.106 10.483 ( 5.687 10.423 -5.819) 13.223 10.803 ( 1.419 7.513 -0.764) 7.684 10.984 ( 8.008 -4.848 1.378) 9.461 11.052 ( 0.890 3.198 0.115) 3.322 12.018 ( 5.034 23.016 2.935) 23.742 12.432 ( 0.521 -25.172 2.473) 25.299 12.548 ( 1.052 5.563 -1.462) 5.847 12.752 ( 5.609 -11.690 2.375) 13.182 12.976 ( 3.275 -0.852 -2.138) 4.003 13.188 ( 3.006 5.120 -1.592) 6.147 13.383 ( 3.263 4.710 -9.282) 10.908 13.689 ( 0.319 -7.047 -1.988) 7.329 13.789 ( 0.211 -0.514 3.929) 3.968 14.082 ( -3.727 10.395 3.657) 11.633 14.171 ( -2.658 -1.925 -2.359) 4.042 14.527 ( -7.416 3.301 1.189) 8.204 14.694 ( -10.050 16.839 5.699) 20.421 14.766 ( -1.246 17.280 0.660) 17.337 15.451 ( -11.653 -1.622 -12.630) 17.261 16.403 ( 2.415 -1.399 12.757) 13.059 16.602 ( -3.722 -17.577 2.619) 18.157 16.704 ( -6.319 -1.413 2.380) 6.899 18.080 ( 4.925 -9.161 -2.522) 10.703 ======================= Grid point 270 (120/208) ======================= q-point: (-0.12 0.07 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.983 ( 0.065 29.286 -0.526) 29.290 1.617 ( -9.544 8.184 25.038) 28.017 1.779 ( -13.337 26.427 23.382) 37.723 2.229 ( -5.803 6.964 4.851) 10.281 2.620 ( -29.181 17.693 17.750) 38.466 3.046 ( -2.693 9.903 -8.379) 13.249 3.145 ( -3.550 15.769 -2.180) 16.310 3.586 ( -0.699 8.818 1.944) 9.057 3.897 ( 6.660 0.610 -15.576) 16.951 4.347 ( -0.075 -0.364 -1.437) 1.484 4.893 ( 5.577 -1.443 2.484) 6.273 4.999 ( 1.433 -0.523 2.483) 2.914 5.563 ( 17.976 20.499 -9.033) 28.722 6.057 ( -3.218 2.399 -3.102) 5.073 6.333 ( -7.159 6.048 2.504) 9.701 6.373 ( 0.946 3.132 5.771) 6.634 6.914 ( -16.718 3.504 -19.466) 25.897 7.189 ( -5.240 6.492 0.203) 8.345 7.343 ( 1.784 -14.565 -2.808) 14.940 7.500 ( -4.468 -11.725 -11.422) 16.968 8.295 ( 3.116 20.190 -0.541) 20.436 8.605 ( 6.366 -15.741 -1.942) 17.090 9.010 ( 10.299 -13.863 15.818) 23.419 9.182 ( 10.159 -19.644 5.815) 22.867 9.921 ( -0.952 1.073 -4.808) 5.017 10.647 ( 10.491 -4.758 -1.156) 11.578 10.836 ( 1.837 11.274 -1.998) 11.596 11.044 ( 0.311 4.722 -0.801) 4.799 11.122 ( 3.876 -9.695 0.442) 10.451 12.129 ( 5.236 27.809 2.088) 28.374 12.438 ( -0.388 -27.425 2.528) 27.544 12.585 ( 2.625 5.933 1.617) 6.686 12.903 ( 10.596 -1.720 1.197) 10.801 13.054 ( 4.611 -5.867 -2.186) 7.776 13.255 ( 4.076 2.292 -1.753) 4.994 13.412 ( -0.389 9.414 -14.848) 17.585 13.658 ( -11.715 2.048 1.714) 12.015 13.686 ( -0.974 -10.699 -2.194) 10.965 13.966 ( -9.967 6.056 0.503) 11.674 14.088 ( -7.474 0.128 4.599) 8.776 14.443 ( 3.632 4.913 0.014) 6.110 14.605 ( -2.584 18.856 0.306) 19.035 14.741 ( -1.195 17.169 0.575) 17.220 15.203 ( -10.825 -0.558 -11.360) 15.702 16.412 ( -2.162 0.074 5.568) 5.973 16.591 ( -5.418 -9.787 8.559) 14.085 16.647 ( 6.733 -11.323 8.152) 15.492 18.147 ( 2.522 -9.159 -3.300) 10.057 ======================= Grid point 271 (121/208) ======================= q-point: ( 0.00 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 0.840 31.093 0.085) 31.105 1.771 ( 0.804 10.333 13.865) 17.310 2.228 ( 5.100 19.284 30.399) 36.359 2.539 ( 1.243 23.326 5.441) 23.985 2.886 ( -2.169 35.365 -1.098) 35.449 3.229 ( -3.204 12.172 -13.107) 18.172 3.452 ( -4.394 21.284 4.328) 22.160 3.831 ( 2.847 13.604 -0.113) 13.899 4.076 ( 7.732 9.422 -13.165) 17.941 4.412 ( 4.139 2.583 2.264) 5.379 4.883 ( -0.628 -2.159 5.297) 5.755 5.109 ( 5.643 -1.146 3.438) 6.707 5.983 ( -10.476 4.716 -3.444) 11.994 6.075 ( -1.155 4.284 -4.866) 6.585 6.356 ( -2.961 7.242 -9.357) 12.198 6.578 ( 7.820 20.893 -0.714) 22.320 6.800 ( -11.115 8.354 -9.350) 16.755 6.953 ( -2.816 -11.926 1.324) 12.326 7.190 ( -2.058 -0.047 -9.082) 9.313 7.518 ( 0.110 14.430 7.042) 16.057 8.126 ( -2.942 -22.764 -0.605) 22.961 8.549 ( 4.754 -6.650 -1.212) 8.264 8.937 ( 3.037 -16.760 6.175) 18.118 9.230 ( 9.355 7.970 10.615) 16.240 9.746 ( -10.169 -6.657 -3.150) 12.556 10.455 ( 2.951 -20.467 0.756) 20.693 10.923 ( -4.987 -0.551 -7.706) 9.195 11.092 ( 1.021 6.203 -1.492) 6.461 11.249 ( -0.167 8.745 -2.016) 8.975 11.782 ( 0.365 -36.515 1.695) 36.556 12.622 ( 3.341 11.233 3.050) 12.110 12.731 ( -0.445 2.375 6.582) 7.012 12.952 ( -7.933 0.156 -2.639) 8.362 13.145 ( 10.343 -4.445 -0.214) 11.260 13.214 ( -6.022 -7.771 -4.040) 10.629 13.363 ( -1.784 9.508 -4.053) 10.488 13.586 ( -5.363 5.549 3.271) 8.382 13.765 ( -7.020 3.498 4.737) 9.162 13.890 ( 11.279 14.922 -7.866) 20.292 14.120 ( -0.453 3.743 -1.074) 3.920 14.599 ( 5.932 -0.709 -4.611) 7.547 14.978 ( 1.015 5.973 -3.075) 6.794 15.045 ( 0.396 16.892 0.182) 16.898 15.138 ( -1.380 14.797 -2.558) 15.080 16.162 ( -10.010 -16.496 11.264) 22.343 16.514 ( 4.783 3.030 1.685) 5.907 16.607 ( 6.116 -7.335 5.059) 10.808 17.905 ( -0.357 -16.294 -2.702) 16.521 ======================= Grid point 272 (122/208) ======================= q-point: ( 0.12 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( -1.497 29.792 -0.127) 29.830 1.906 ( 10.477 11.603 11.145) 19.199 2.447 ( 12.412 18.429 24.006) 32.710 2.586 ( 5.078 25.821 3.816) 26.590 3.042 ( 12.059 25.127 -8.073) 29.016 3.193 ( 4.888 7.889 -8.414) 12.527 3.409 ( -0.769 19.048 5.346) 19.799 3.883 ( 2.460 14.682 -0.264) 14.890 4.245 ( 12.054 9.704 -11.135) 19.064 4.463 ( 0.603 3.569 -4.260) 5.590 4.869 ( -1.836 -0.584 4.151) 4.576 5.117 ( -6.846 -3.021 -3.722) 8.357 5.802 ( -3.828 10.607 9.864) 14.982 6.092 ( 2.529 3.597 -1.291) 4.582 6.303 ( -3.095 8.291 -10.798) 13.961 6.505 ( -9.562 16.672 -3.923) 19.615 6.749 ( 3.244 7.056 -0.028) 7.766 6.901 ( -2.879 -14.003 1.329) 14.357 7.222 ( 5.620 6.548 -4.036) 9.526 7.515 ( -1.740 14.428 6.222) 15.809 8.080 ( -1.508 -21.453 1.049) 21.532 8.626 ( 3.859 -8.821 -5.373) 11.026 8.922 ( -4.936 -17.821 1.114) 18.525 9.334 ( -3.309 13.626 -2.186) 14.191 9.521 ( -9.639 -9.247 9.498) 16.390 10.449 ( -3.034 -22.197 -2.527) 22.546 10.841 ( -2.663 2.801 -2.281) 4.488 11.081 ( -1.765 6.310 -1.395) 6.698 11.225 ( -1.635 9.714 -1.920) 10.036 11.794 ( 0.556 -36.442 1.526) 36.478 12.635 ( -11.738 3.656 8.979) 15.224 12.649 ( -2.251 16.951 1.859) 17.201 12.784 ( -4.001 -3.906 -4.027) 6.891 13.061 ( -6.893 -0.025 -4.080) 8.010 13.302 ( 3.222 1.530 2.499) 4.355 13.355 ( 2.883 0.335 -6.105) 6.760 13.504 ( -2.812 8.436 1.495) 9.017 13.711 ( -0.171 3.928 4.115) 5.692 14.116 ( 0.419 3.772 -2.850) 4.746 14.225 ( 19.220 3.420 1.742) 19.599 14.695 ( 5.209 -3.191 -12.172) 13.619 15.014 ( 3.429 3.006 -2.964) 5.438 15.084 ( 3.954 21.528 1.131) 21.917 15.179 ( 6.204 17.403 -0.874) 18.496 15.921 ( -14.242 -14.969 12.569) 24.184 16.598 ( 2.889 -4.152 2.104) 5.478 16.752 ( 6.596 -5.240 0.647) 8.448 17.868 ( -3.070 -15.898 -2.096) 16.327 ======================= Grid point 273 (123/208) ======================= q-point: ( 0.25 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( -0.429 29.506 -0.017) 29.509 2.158 ( 13.785 8.392 5.912) 17.187 2.731 ( 13.418 15.998 11.976) 24.070 2.760 ( 11.751 19.560 4.985) 23.357 3.096 ( 0.124 5.276 -11.246) 12.423 3.395 ( 5.766 18.521 -6.502) 20.459 3.524 ( 16.689 17.011 4.732) 24.296 3.908 ( -0.155 11.996 -3.672) 12.547 4.354 ( -9.576 2.915 -7.879) 12.739 4.475 ( 9.816 9.200 -5.716) 14.617 4.817 ( -2.644 5.466 -2.987) 6.767 4.992 ( -0.641 -2.111 -0.398) 2.242 5.816 ( -0.728 25.983 5.797) 26.632 6.130 ( -0.170 5.066 4.274) 6.630 6.234 ( -0.373 4.734 4.699) 6.681 6.392 ( -2.437 5.272 -1.490) 5.997 6.787 ( -0.225 -4.337 0.479) 4.369 6.861 ( -0.078 -9.126 2.087) 9.362 7.345 ( 6.779 10.892 -1.078) 12.874 7.474 ( -3.163 14.291 4.911) 15.439 8.073 ( 0.168 -20.870 2.207) 20.987 8.672 ( 1.934 -11.750 -9.826) 15.438 8.782 ( -8.342 -12.343 -6.732) 16.348 9.069 ( -17.301 -0.515 -4.821) 17.968 9.460 ( -4.480 5.919 9.903) 12.377 10.387 ( -1.371 -16.923 -4.753) 17.631 10.817 ( -0.197 7.296 4.165) 8.403 11.033 ( -2.817 5.585 -1.674) 6.475 11.192 ( -1.431 9.028 -1.435) 9.253 11.807 ( 0.521 -36.381 1.142) 36.403 12.403 ( -11.963 4.196 7.158) 14.558 12.567 ( -5.198 15.784 0.816) 16.638 12.786 ( 2.247 -4.265 -4.470) 6.574 12.936 ( -5.901 2.916 -4.342) 7.886 13.309 ( -0.765 11.301 2.609) 11.624 13.404 ( 1.886 -5.475 -5.714) 8.135 13.483 ( -0.296 3.716 1.594) 4.054 13.741 ( 1.737 3.113 6.092) 7.058 14.111 ( -0.427 2.639 -1.775) 3.209 14.493 ( 7.438 -1.477 3.079) 8.184 14.724 ( 0.510 3.384 -14.590) 14.985 15.074 ( 2.233 9.929 -1.683) 10.315 15.191 ( 6.551 15.836 3.915) 17.579 15.410 ( 18.046 11.740 -4.664) 22.029 15.741 ( -6.007 -18.681 15.356) 24.917 16.637 ( 1.158 -6.272 -0.660) 6.412 16.820 ( 0.750 -2.261 0.687) 2.479 17.791 ( -4.576 -15.362 -1.098) 16.067 ======================= Grid point 274 (124/208) ======================= q-point: ( 0.38 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( 0.178 29.558 -0.013) 29.558 2.406 ( 11.187 3.951 1.926) 12.019 2.908 ( 0.655 4.605 -6.981) 8.388 2.991 ( 9.438 9.798 11.017) 17.505 3.080 ( 1.724 12.331 -0.740) 12.473 3.459 ( 3.072 16.770 -6.075) 18.099 3.809 ( -3.427 7.898 -13.371) 15.903 3.855 ( 10.437 14.933 -3.875) 18.627 4.133 ( -7.712 13.612 2.511) 15.845 4.613 ( 2.856 5.835 -3.286) 7.281 4.845 ( 6.967 4.772 3.203) 9.031 5.043 ( 2.565 2.151 -1.479) 3.660 5.769 ( -1.826 32.340 -11.766) 34.462 6.104 ( -5.587 5.051 10.924) 13.269 6.232 ( -0.367 1.248 11.698) 11.770 6.437 ( 5.364 2.432 7.266) 9.353 6.750 ( -1.506 -10.245 0.832) 10.388 6.925 ( 4.500 -3.598 1.973) 6.090 7.378 ( -2.735 -3.036 0.820) 4.168 7.513 ( 6.974 25.938 7.201) 27.808 8.083 ( 0.523 -21.888 2.900) 22.085 8.557 ( -9.703 -13.067 -11.430) 19.888 8.680 ( -6.512 -13.063 -12.369) 19.133 8.819 ( -4.368 6.201 -5.587) 9.421 9.347 ( -6.989 6.805 2.993) 10.204 10.401 ( 2.836 -13.315 -3.753) 14.122 10.841 ( 1.801 13.319 6.023) 14.728 10.974 ( -2.977 5.939 -2.159) 6.985 11.174 ( -0.086 7.773 -0.102) 7.774 11.817 ( 0.403 -36.203 1.135) 36.223 12.243 ( -6.109 2.852 6.284) 9.216 12.468 ( -5.207 10.714 -1.418) 11.996 12.801 ( -1.414 4.509 -5.277) 7.084 12.858 ( 0.195 -3.574 -3.620) 5.091 13.304 ( -0.062 13.108 2.700) 13.383 13.421 ( 1.071 -4.891 -4.245) 6.564 13.476 ( -0.755 2.290 0.801) 2.541 13.771 ( -0.093 3.282 7.176) 7.891 14.102 ( 0.002 1.240 -0.799) 1.475 14.502 ( -4.283 -3.309 -9.640) 11.055 14.739 ( 2.602 8.519 1.483) 9.030 15.101 ( 1.247 13.174 -1.003) 13.271 15.320 ( 5.299 11.287 6.350) 13.993 15.584 ( 0.105 6.009 -6.620) 8.941 15.873 ( 15.219 -19.433 12.507) 27.671 16.636 ( -1.040 -6.531 -2.359) 7.021 16.804 ( -2.013 -0.106 1.022) 2.260 17.709 ( -3.409 -14.912 -0.258) 15.299 ======================= Grid point 275 (125/208) ======================= q-point: (-0.50 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( 0.061 29.535 -0.025) 29.535 2.552 ( 1.830 0.080 2.807) 3.352 2.711 ( -16.741 -1.468 -2.137) 16.941 3.095 ( 1.787 15.809 -5.339) 16.782 3.116 ( -1.354 10.969 1.895) 11.213 3.521 ( 5.837 8.358 -7.540) 12.680 3.682 ( -4.325 14.632 4.284) 15.848 3.979 ( -1.173 17.638 -6.127) 18.708 4.155 ( 9.385 11.485 -1.857) 14.948 4.559 ( -7.318 8.833 -0.566) 11.484 5.005 ( -1.166 0.227 1.149) 1.653 5.042 ( 5.109 7.665 -2.341) 9.505 5.688 ( -5.962 26.460 -7.812) 28.226 5.997 ( -4.235 8.906 11.269) 14.975 6.304 ( 5.072 4.010 2.454) 6.916 6.542 ( 3.630 -1.749 13.793) 14.369 6.789 ( 6.047 -8.102 -0.095) 10.110 6.974 ( 0.561 -5.448 -2.532) 6.033 7.362 ( 0.871 -0.847 2.620) 2.888 7.698 ( 10.799 22.522 13.029) 28.171 8.108 ( 1.671 -22.392 2.011) 22.544 8.397 ( -5.220 -12.081 -11.840) 17.703 8.474 ( -9.390 -9.385 -9.748) 16.470 8.775 ( -3.113 10.409 -11.403) 15.750 9.301 ( 3.678 1.016 0.921) 3.926 10.434 ( 0.409 -14.739 -3.768) 15.219 10.895 ( 1.771 7.699 0.388) 7.910 10.940 ( 1.673 17.869 0.815) 17.965 11.187 ( 1.078 7.716 1.277) 7.895 11.823 ( -0.314 -34.700 1.761) 34.746 12.192 ( -0.369 0.951 5.506) 5.600 12.385 ( -2.515 4.141 -2.254) 5.344 12.763 ( -0.886 11.465 -3.560) 12.038 12.887 ( 2.365 -6.176 -5.051) 8.322 13.315 ( 0.770 13.548 1.633) 13.668 13.434 ( 0.515 -12.370 -0.878) 12.412 13.464 ( 0.157 7.751 -1.199) 7.845 13.767 ( -0.978 4.292 6.892) 8.178 14.116 ( 1.396 0.570 1.016) 1.818 14.387 ( -5.210 -1.677 -9.978) 11.380 14.782 ( 0.789 8.384 4.098) 9.365 15.117 ( 0.342 14.049 -0.741) 14.072 15.357 ( -3.444 11.601 6.026) 13.519 15.575 ( 0.650 -0.471 -1.203) 1.447 16.107 ( 6.690 -17.905 3.521) 19.436 16.581 ( -4.790 -5.702 0.154) 7.448 16.775 ( -0.614 1.317 0.525) 1.545 17.681 ( 0.802 -15.015 -0.259) 15.039 ======================= Grid point 276 (126/208) ======================= q-point: (-0.38 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( -0.225 29.238 -0.005) 29.239 2.292 ( -21.166 4.393 2.807) 21.799 2.531 ( -8.692 1.037 7.378) 11.448 2.988 ( -12.265 16.349 7.019) 21.609 3.154 ( 6.377 13.299 -8.234) 16.891 3.609 ( -1.612 14.839 -8.052) 16.959 3.646 ( 3.887 7.082 2.650) 8.502 3.917 ( -2.937 15.762 -5.794) 17.048 4.269 ( -9.949 16.584 9.080) 21.364 4.374 ( -1.881 9.041 -7.953) 12.188 4.875 ( -7.922 1.595 0.428) 8.092 5.098 ( -2.527 -0.863 -1.912) 3.284 5.626 ( 4.453 34.952 -5.644) 35.684 6.035 ( 5.158 5.641 9.678) 12.333 6.348 ( -0.955 5.005 -3.048) 5.937 6.627 ( 2.926 -2.778 12.578) 13.209 6.911 ( 3.479 -14.869 -3.545) 15.677 7.008 ( 5.822 -2.599 -1.963) 6.671 7.381 ( 0.348 2.133 0.999) 2.380 7.891 ( 3.202 22.322 1.978) 22.637 8.147 ( 2.092 -21.299 0.275) 21.403 8.240 ( -4.031 -15.725 -5.386) 17.104 8.461 ( 6.847 -6.596 -1.960) 9.707 8.680 ( -3.093 11.916 -6.770) 14.050 9.472 ( 12.795 -5.141 -0.745) 13.809 10.401 ( -2.657 -13.137 -3.996) 13.986 10.908 ( 1.537 2.737 -1.224) 3.369 11.039 ( 6.439 20.591 -0.935) 21.594 11.200 ( -0.409 7.850 0.016) 7.860 11.804 ( -1.756 -33.621 1.503) 33.700 12.249 ( 5.331 0.537 6.672) 8.557 12.390 ( 3.475 2.117 -0.296) 4.079 12.756 ( 0.569 12.541 -2.704) 12.841 12.921 ( 2.322 -4.532 -6.514) 8.268 13.330 ( 0.405 11.125 -0.879) 11.167 13.422 ( -0.917 -10.093 -0.507) 10.148 13.508 ( 4.244 5.304 -1.662) 6.993 13.775 ( 0.716 3.679 7.858) 8.707 14.150 ( 1.449 0.580 4.298) 4.573 14.287 ( -3.510 0.827 -10.023) 10.652 14.763 ( -4.151 7.714 3.568) 9.458 15.099 ( -2.309 12.628 -1.297) 12.903 15.244 ( -7.957 15.891 7.362) 19.236 15.559 ( -3.363 -2.210 -3.402) 5.269 16.149 ( -1.429 -21.841 -0.264) 21.889 16.484 ( -4.453 -1.105 4.183) 6.209 16.767 ( -1.481 1.444 1.808) 2.747 17.734 ( 4.467 -15.723 -1.071) 16.381 ======================= Grid point 277 (127/208) ======================= q-point: (-0.25 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -0.194 28.499 0.353) 28.502 1.957 ( -14.467 9.542 13.316) 21.855 2.344 ( -11.591 6.939 12.903) 18.681 2.736 ( -13.913 22.144 5.803) 26.788 3.259 ( 4.239 14.091 -6.906) 16.255 3.487 ( -9.417 17.287 -11.546) 22.822 3.705 ( -1.951 10.323 2.638) 10.832 3.876 ( -6.659 13.763 -1.526) 15.365 3.915 ( -10.214 23.686 9.427) 27.463 4.395 ( -1.152 2.246 -7.397) 7.816 4.800 ( 1.015 1.274 1.021) 1.923 5.014 ( -3.684 -0.758 -0.183) 3.765 5.813 ( 13.404 32.601 -6.739) 35.888 6.154 ( 4.333 5.992 5.562) 9.253 6.300 ( -1.550 3.089 -1.825) 3.909 6.654 ( -2.737 2.355 4.523) 5.787 6.940 ( 1.506 -15.276 -4.808) 16.086 7.082 ( 0.420 -7.446 -4.221) 8.570 7.391 ( 0.458 1.820 2.396) 3.043 7.728 ( -13.319 16.179 -19.506) 28.629 8.176 ( 0.857 -19.354 -1.310) 19.417 8.332 ( 7.487 -7.208 9.708) 14.222 8.616 ( 8.094 -6.678 0.379) 10.500 8.741 ( 10.899 6.032 5.536) 13.632 9.718 ( 11.953 -8.432 -1.165) 14.674 10.350 ( -1.324 -11.722 -3.606) 12.336 10.961 ( 4.056 4.548 -0.771) 6.143 11.131 ( 0.667 10.758 -6.035) 12.353 11.173 ( 0.537 8.128 -0.575) 8.166 11.779 ( -0.827 -35.111 1.521) 35.153 12.391 ( 7.500 3.182 8.173) 11.540 12.509 ( 8.421 4.123 2.190) 9.629 12.782 ( 3.196 9.732 -1.440) 10.344 12.964 ( 3.790 -1.408 -7.615) 8.622 13.318 ( -1.173 1.276 -3.681) 4.068 13.416 ( 0.312 -4.407 -0.527) 4.449 13.587 ( 3.919 7.300 -4.347) 9.357 13.807 ( 0.335 0.841 6.433) 6.497 14.142 ( -3.822 -1.293 3.812) 5.551 14.256 ( 1.564 7.774 -4.649) 9.192 14.615 ( -11.541 6.024 2.719) 13.299 15.034 ( -3.597 12.350 0.269) 12.866 15.132 ( -4.919 17.611 5.196) 19.009 15.424 ( -9.410 -0.015 -7.270) 11.891 16.103 ( -1.409 -22.602 -0.984) 22.667 16.462 ( 0.801 0.231 7.963) 8.006 16.703 ( -5.964 2.098 4.147) 7.561 17.823 ( 4.666 -16.305 -2.057) 17.084 ======================= Grid point 278 (128/208) ======================= q-point: (-0.12 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( 1.167 28.352 1.445) 28.412 1.801 ( -5.716 11.509 16.859) 21.198 2.192 ( -6.186 14.819 23.851) 28.753 2.549 ( -5.503 24.289 4.413) 25.292 3.129 ( -17.792 28.808 -8.436) 34.894 3.310 ( -3.300 15.316 -7.580) 17.404 3.557 ( -8.494 25.963 11.116) 29.492 3.791 ( 0.904 10.512 -0.744) 10.577 3.976 ( 5.848 8.751 -9.236) 14.003 4.356 ( 0.164 1.652 -0.722) 1.810 4.864 ( 2.698 -1.588 3.648) 4.807 5.002 ( 3.076 1.043 0.947) 3.384 6.007 ( 6.214 15.616 -5.215) 17.597 6.153 ( -2.748 8.153 -4.828) 9.866 6.384 ( 8.958 10.905 2.998) 14.428 6.521 ( -10.062 6.395 -4.800) 12.852 6.945 ( -0.847 -15.564 -7.865) 17.459 7.025 ( -5.009 -3.425 -2.644) 6.619 7.333 ( -8.671 3.774 -9.369) 13.313 7.517 ( -2.960 14.934 -1.807) 15.331 8.171 ( -1.240 -21.722 -2.074) 21.856 8.456 ( 5.008 -4.304 3.543) 7.493 8.799 ( 9.577 -11.682 6.529) 16.456 8.997 ( 12.985 3.572 10.521) 17.090 9.848 ( 0.852 -7.003 -2.985) 7.660 10.371 ( 4.168 -15.358 -0.906) 15.940 11.029 ( -1.006 5.149 -6.126) 8.065 11.055 ( -0.550 1.409 -2.708) 3.101 11.228 ( 2.705 9.431 -1.970) 10.007 11.776 ( 0.013 -36.132 1.662) 36.170 12.530 ( 5.715 7.602 6.066) 11.281 12.664 ( 6.052 3.392 4.905) 8.496 12.901 ( 9.700 3.540 -0.381) 10.333 13.030 ( 3.468 2.362 -5.540) 6.950 13.284 ( -1.724 -8.523 -4.797) 9.931 13.411 ( -1.338 1.052 -2.981) 3.432 13.630 ( 0.859 3.332 -1.399) 3.715 13.775 ( -2.411 8.821 -2.101) 9.383 14.046 ( -9.917 4.872 2.483) 11.324 14.178 ( -8.794 6.978 3.277) 11.695 14.504 ( 3.112 2.775 -3.601) 5.509 14.986 ( -1.472 12.036 -0.296) 12.129 15.066 ( -2.754 14.119 2.217) 14.555 15.235 ( -7.932 6.884 -6.302) 12.249 16.147 ( 5.566 -18.222 3.367) 19.348 16.516 ( 3.073 -4.148 8.050) 9.563 16.564 ( -8.689 4.117 5.675) 11.165 17.889 ( 2.541 -16.463 -2.686) 16.873 ======================= Grid point 279 (129/208) ======================= q-point: ( 0.00 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( 2.232 9.460 8.423) 12.862 2.187 ( 0.714 26.847 0.967) 26.874 2.593 ( 6.850 17.815 24.088) 30.733 3.061 ( 0.352 27.832 5.957) 28.464 3.420 ( -7.784 7.462 -16.077) 19.358 3.523 ( -0.721 27.117 -9.955) 28.896 3.940 ( -7.766 24.853 4.695) 26.458 4.128 ( 5.365 16.316 1.998) 17.291 4.325 ( 7.276 15.111 -4.916) 17.477 4.505 ( 4.477 7.451 3.084) 9.224 4.840 ( -0.090 -1.859 3.340) 3.824 5.093 ( 1.921 -0.299 1.082) 2.225 6.046 ( -4.703 3.540 2.981) 6.598 6.152 ( -2.003 1.624 -8.908) 9.274 6.481 ( -6.303 -2.649 -10.319) 12.378 6.554 ( -1.513 -6.727 0.137) 6.897 6.886 ( -2.776 0.376 2.163) 3.539 7.152 ( 11.636 20.640 -0.201) 23.695 7.347 ( -5.945 12.697 -7.862) 16.074 7.805 ( -4.321 8.790 -3.897) 10.542 7.826 ( 2.314 -1.141 13.428) 13.673 8.387 ( -2.355 -3.453 -8.323) 9.314 8.670 ( 2.904 -11.467 -3.163) 12.245 9.225 ( 10.366 -9.918 15.414) 21.058 9.574 ( -8.956 -12.648 -2.409) 15.684 10.278 ( -0.568 4.804 -3.204) 5.802 10.861 ( -4.136 -5.672 -9.784) 12.042 11.002 ( 0.744 -35.738 1.592) 35.781 11.149 ( 2.067 -1.799 2.802) 3.919 11.483 ( -0.365 11.425 -2.609) 11.724 12.618 ( -0.221 -9.472 -1.165) 9.546 12.756 ( 5.889 1.997 8.521) 10.549 12.900 ( -3.660 -6.549 -3.817) 8.417 13.052 ( 7.360 -6.418 0.592) 9.783 13.139 ( -7.832 2.500 -4.864) 9.552 13.549 ( -0.414 4.933 0.334) 4.962 13.731 ( 1.482 12.883 1.198) 13.023 13.870 ( -2.470 5.237 10.847) 12.295 14.140 ( -4.045 1.185 2.782) 5.050 14.264 ( 0.873 16.680 -3.851) 17.141 14.605 ( 4.226 2.950 -11.417) 12.526 15.025 ( -0.021 2.102 -1.721) 2.716 15.294 ( 4.130 8.232 5.200) 10.576 15.424 ( 1.008 10.011 -0.948) 10.106 15.887 ( -7.022 -10.179 3.565) 12.869 16.526 ( 1.122 0.371 3.118) 3.334 16.570 ( 2.751 1.072 0.513) 2.997 17.535 ( -0.109 -20.576 -1.852) 20.660 ======================= Grid point 280 (130/208) ======================= q-point: ( 0.12 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( 2.588 11.584 4.355) 12.644 2.236 ( 4.631 23.731 0.824) 24.193 2.799 ( 10.072 17.740 23.275) 30.949 3.101 ( 3.615 24.285 5.335) 25.125 3.246 ( -7.631 3.610 -16.231) 18.295 3.620 ( 11.185 25.470 -8.767) 29.166 3.850 ( -1.882 23.442 4.932) 24.029 4.183 ( 0.362 15.456 -1.545) 15.537 4.468 ( 6.291 11.915 -3.770) 13.991 4.595 ( 5.305 10.167 -2.596) 11.758 4.848 ( 1.090 -1.386 1.938) 2.620 5.071 ( -4.723 -1.199 -1.837) 5.208 5.997 ( -0.961 6.495 11.953) 13.638 6.155 ( 4.159 5.660 -3.598) 7.892 6.364 ( -3.939 -3.624 -8.710) 10.223 6.569 ( 2.584 -8.001 1.471) 8.536 6.801 ( -7.020 3.248 3.083) 8.327 7.159 ( -10.098 32.296 -12.481) 36.067 7.306 ( 3.991 2.101 -0.138) 4.513 7.798 ( 3.200 0.161 2.968) 4.368 7.907 ( 3.043 13.670 11.050) 17.839 8.327 ( -2.345 -13.358 -9.397) 16.500 8.676 ( -1.184 -10.612 -4.834) 11.721 9.297 ( -14.237 -11.045 2.360) 18.173 9.420 ( 2.319 -11.348 7.590) 13.848 10.252 ( -0.406 5.166 -2.737) 5.860 10.823 ( 1.025 -4.158 -5.263) 6.786 11.019 ( 0.785 -34.258 0.971) 34.281 11.154 ( -1.708 -0.387 1.071) 2.053 11.475 ( -0.171 11.655 -1.926) 11.814 12.596 ( -1.303 -9.115 -0.978) 9.259 12.755 ( -9.891 -0.291 -0.289) 9.900 12.847 ( -0.123 3.827 8.095) 8.955 12.984 ( -5.356 -2.215 -5.236) 7.811 13.212 ( 8.758 -2.475 -4.952) 10.361 13.555 ( 0.482 6.317 1.566) 6.526 13.706 ( -3.895 12.934 0.592) 13.521 13.832 ( -1.869 8.106 7.518) 11.213 14.145 ( 0.890 -1.685 1.302) 2.308 14.325 ( 6.307 5.542 1.525) 8.534 14.675 ( 6.214 2.894 -12.243) 14.031 15.055 ( 3.075 2.327 -0.615) 3.905 15.372 ( 0.702 4.738 6.715) 8.249 15.465 ( 1.117 9.064 1.890) 9.326 15.707 ( -6.108 -2.572 -1.874) 6.887 16.518 ( 0.410 -2.003 0.493) 2.103 16.714 ( 7.504 -0.154 2.161) 7.810 17.507 ( -2.468 -20.049 -1.488) 20.255 ======================= Grid point 281 (131/208) ======================= q-point: ( 0.25 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( 1.992 17.618 0.966) 17.757 2.354 ( 7.103 13.937 0.212) 15.644 3.018 ( 8.739 15.429 11.158) 20.950 3.081 ( -6.790 1.031 -6.131) 9.206 3.230 ( 8.431 17.769 4.972) 20.286 3.789 ( 5.359 21.012 -4.461) 22.139 3.940 ( 10.537 19.253 -2.999) 22.151 4.131 ( -4.137 13.513 -7.795) 16.139 4.494 ( -1.745 10.620 -4.462) 11.651 4.689 ( 3.779 11.370 2.232) 12.187 4.919 ( 5.920 3.150 -3.244) 7.449 4.965 ( -3.685 0.975 0.434) 3.836 6.017 ( 0.711 -2.460 10.232) 10.548 6.266 ( 0.422 1.085 3.217) 3.421 6.343 ( 8.321 7.392 -3.068) 11.545 6.619 ( -5.542 0.569 4.983) 7.474 6.674 ( 1.892 3.370 1.600) 4.183 6.965 ( -8.324 29.845 -8.839) 32.220 7.316 ( -2.597 -6.406 -1.352) 7.043 7.871 ( 2.425 0.410 8.051) 8.419 7.971 ( 2.412 25.045 1.723) 25.220 8.279 ( -0.886 -19.017 -6.006) 19.962 8.625 ( -3.346 -9.016 -7.799) 12.382 8.990 ( -15.120 -7.117 0.195) 16.713 9.435 ( -2.829 -12.207 5.265) 13.591 10.282 ( 3.545 8.485 -3.190) 9.733 10.872 ( 4.357 -1.099 1.413) 4.710 11.031 ( 0.292 -33.173 0.281) 33.176 11.102 ( -3.266 -0.177 -0.790) 3.365 11.465 ( -0.831 12.091 -0.880) 12.151 12.528 ( -10.050 4.838 3.681) 11.745 12.592 ( -1.066 -9.232 -3.559) 9.952 12.800 ( -6.068 4.692 2.510) 8.070 12.920 ( -1.452 -3.075 -3.890) 5.167 13.338 ( 5.144 3.940 -6.318) 9.050 13.566 ( 0.238 8.122 3.221) 8.741 13.640 ( -2.583 9.512 0.518) 9.870 13.824 ( -0.166 5.884 5.240) 7.880 14.134 ( -1.570 -0.434 -0.995) 1.908 14.435 ( 3.118 -3.692 -0.789) 4.896 14.811 ( 8.423 4.962 -6.827) 11.924 15.131 ( 4.272 1.292 -0.470) 4.487 15.262 ( -8.803 -18.744 18.187) 27.560 15.492 ( 3.142 9.444 -1.790) 10.112 15.764 ( 8.092 12.386 -8.674) 17.151 16.542 ( 1.814 -1.593 -0.633) 2.496 16.816 ( 2.831 1.331 3.325) 4.565 17.444 ( -3.717 -19.071 -0.924) 19.451 ======================= Grid point 282 (132/208) ======================= q-point: ( 0.38 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( 1.400 22.154 0.134) 22.198 2.479 ( 5.824 4.933 -0.660) 7.661 2.891 ( -10.029 -3.578 -9.192) 14.067 3.221 ( 8.128 12.384 13.976) 20.366 3.396 ( 7.132 16.257 2.487) 17.926 3.796 ( -5.708 17.283 -15.714) 24.046 3.967 ( -0.109 9.870 1.123) 9.934 4.226 ( 11.150 20.351 -7.310) 24.329 4.436 ( -3.229 15.254 -2.563) 15.802 4.748 ( 1.615 7.438 1.966) 7.861 4.937 ( 2.466 3.900 3.436) 5.753 5.040 ( 4.109 -0.818 -1.164) 4.348 6.063 ( 2.519 -4.856 7.647) 9.402 6.212 ( -4.888 0.801 -0.639) 4.995 6.488 ( 0.254 10.366 -1.628) 10.496 6.550 ( 5.613 10.471 4.254) 12.620 6.782 ( -0.766 19.482 4.418) 19.991 6.837 ( 1.101 5.959 0.959) 6.135 7.222 ( -5.527 -9.126 -3.046) 11.096 7.922 ( 2.169 2.033 7.908) 8.449 7.988 ( 0.006 12.656 -3.687) 13.182 8.286 ( 1.589 -2.358 -1.100) 3.049 8.493 ( -8.406 -8.357 -7.388) 13.967 8.815 ( -3.521 -6.264 -2.053) 7.473 9.366 ( -3.911 -5.882 2.503) 7.494 10.334 ( 1.986 7.412 -6.043) 9.768 10.935 ( -0.519 -1.453 -0.154) 1.551 11.020 ( -1.288 -26.840 -1.353) 26.905 11.111 ( 6.439 -2.584 6.448) 9.472 11.444 ( -1.008 11.539 -0.357) 11.588 12.380 ( -5.509 9.045 4.852) 11.649 12.560 ( -4.866 -1.996 -2.518) 5.831 12.678 ( -3.125 -5.570 -6.229) 8.922 12.907 ( 0.467 -1.915 -1.634) 2.560 13.377 ( 0.034 7.640 -4.372) 8.802 13.572 ( -0.097 10.299 3.498) 10.877 13.611 ( -0.908 6.814 0.438) 6.888 13.838 ( 0.430 3.845 4.707) 6.093 14.101 ( -1.300 -1.459 0.034) 1.954 14.423 ( -2.882 -4.108 -7.548) 9.064 14.903 ( 1.761 8.209 6.548) 10.647 15.164 ( 2.218 -8.805 3.961) 9.906 15.281 ( 3.941 -17.999 5.003) 19.092 15.551 ( 3.241 6.982 -3.498) 8.455 15.882 ( 4.592 7.648 -4.328) 9.915 16.574 ( 1.468 2.057 -1.019) 2.725 16.844 ( 0.169 3.784 3.168) 4.938 17.377 ( -2.821 -17.942 -0.520) 18.170 ======================= Grid point 283 (133/208) ======================= q-point: (-0.50 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( -0.234 23.644 0.112) 23.646 2.555 ( 1.450 0.649 1.122) 1.945 2.664 ( -12.617 -2.568 -3.591) 13.367 3.346 ( 0.941 11.325 9.269) 14.665 3.457 ( 1.361 19.654 -8.331) 21.390 3.683 ( -0.579 9.226 -5.225) 10.619 3.997 ( 0.610 16.267 2.776) 16.513 4.339 ( -2.199 17.353 -6.735) 18.743 4.409 ( 5.017 13.319 -5.990) 15.441 4.742 ( -2.288 8.982 2.979) 9.736 5.005 ( 0.327 0.556 2.010) 2.111 5.071 ( 0.882 -1.649 0.534) 1.945 6.078 ( -2.469 10.554 -0.182) 10.841 6.175 ( 2.821 -6.443 8.697) 11.185 6.517 ( 1.189 5.093 -3.306) 6.187 6.633 ( 2.016 16.162 1.002) 16.318 6.687 ( -3.448 15.906 0.592) 16.286 6.915 ( 1.515 -1.252 5.983) 6.297 7.195 ( 3.825 -8.561 -1.488) 9.494 7.937 ( -1.994 -1.669 -2.905) 3.899 8.029 ( 4.944 2.766 4.711) 7.367 8.284 ( -0.776 2.465 -2.412) 3.535 8.401 ( 0.172 9.208 -2.490) 9.540 8.767 ( -2.390 -9.409 -5.491) 11.153 9.334 ( 0.577 0.927 3.094) 3.281 10.332 ( -0.722 4.272 -6.506) 7.817 10.890 ( -2.009 -4.279 -3.117) 5.662 11.003 ( -0.546 -30.386 -0.330) 30.393 11.277 ( 7.169 5.970 7.392) 11.903 11.437 ( 0.335 8.312 0.359) 8.327 12.313 ( -4.269 12.299 5.174) 14.009 12.446 ( -2.133 0.844 -3.590) 4.260 12.689 ( 3.907 -10.835 -8.423) 14.269 12.930 ( 1.990 -1.239 -1.457) 2.760 13.331 ( -4.247 5.874 -0.324) 7.255 13.580 ( 0.544 11.974 2.363) 12.217 13.603 ( 0.268 5.319 0.271) 5.333 13.843 ( -0.690 3.252 3.741) 5.004 14.097 ( 0.485 -2.739 2.719) 3.890 14.350 ( -2.429 -1.552 -8.294) 8.781 14.935 ( 0.090 6.397 10.751) 12.510 15.231 ( 2.981 -3.921 1.878) 5.272 15.319 ( -0.133 -16.037 -1.375) 16.096 15.587 ( 0.804 4.369 -3.977) 5.963 15.899 ( -2.608 -2.541 0.449) 3.669 16.582 ( -0.660 6.026 -0.644) 6.096 16.851 ( 0.202 5.759 2.234) 6.180 17.350 ( 0.267 -17.689 -0.464) 17.697 ======================= Grid point 284 (134/208) ======================= q-point: (-0.38 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( -3.205 19.705 0.725) 19.977 2.403 ( -12.062 8.236 0.350) 14.610 2.559 ( -2.951 1.965 6.415) 7.330 3.293 ( -5.358 15.581 5.366) 17.328 3.499 ( 3.314 19.671 -5.527) 20.699 3.720 ( 4.007 4.729 -4.033) 7.395 3.981 ( -2.506 18.360 1.768) 18.615 4.241 ( -5.520 15.974 -6.910) 18.258 4.478 ( 1.712 7.475 -7.212) 10.527 4.675 ( -5.870 15.410 5.365) 17.341 4.920 ( -7.243 4.196 2.746) 8.809 5.069 ( -2.069 -1.183 -1.326) 2.727 6.077 ( 2.035 8.339 1.285) 8.680 6.271 ( 5.944 -4.042 4.379) 8.417 6.479 ( -2.186 10.084 -4.354) 11.199 6.646 ( -0.626 2.472 -0.960) 2.725 6.690 ( 2.314 13.216 2.450) 13.639 6.972 ( 3.343 -0.299 7.100) 7.854 7.271 ( 3.263 -7.911 -4.763) 9.794 7.876 ( -3.403 -7.977 -3.186) 9.239 8.116 ( 3.347 2.818 -0.842) 4.455 8.352 ( 7.532 -1.998 1.874) 8.015 8.410 ( 0.453 24.672 -3.005) 24.859 8.709 ( -1.718 -8.322 -2.799) 8.947 9.402 ( 5.860 -1.367 2.664) 6.581 10.300 ( -1.296 3.080 -5.100) 6.097 10.883 ( 1.897 -5.716 -0.751) 6.069 10.995 ( -0.311 -31.575 0.298) 31.578 11.344 ( -1.810 2.529 -0.043) 3.110 11.446 ( 0.879 10.583 -0.420) 10.628 12.266 ( 0.650 4.584 4.056) 6.155 12.482 ( 3.731 0.467 1.129) 3.926 12.795 ( 9.272 -2.318 -7.856) 12.372 12.958 ( 0.955 0.194 -3.705) 3.831 13.234 ( -5.705 0.441 2.135) 6.107 13.596 ( 0.639 12.555 0.789) 12.596 13.643 ( 4.245 5.352 0.620) 6.859 13.824 ( -2.081 1.149 4.564) 5.146 14.110 ( -0.305 -3.869 3.679) 5.348 14.331 ( 2.182 2.697 -7.542) 8.301 14.922 ( -4.107 8.225 9.605) 13.295 15.232 ( -3.091 0.223 -2.062) 3.722 15.307 ( -0.869 -11.967 -0.113) 11.999 15.565 ( -2.714 1.314 0.744) 3.106 15.812 ( -4.774 -5.849 -2.432) 7.932 16.549 ( -2.613 6.593 0.167) 7.094 16.848 ( -1.490 6.264 2.573) 6.934 17.386 ( 3.327 -18.778 -0.771) 19.086 ======================= Grid point 285 (135/208) ======================= q-point: (-0.25 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( -5.572 11.974 4.387) 13.916 2.240 ( -5.355 20.450 4.187) 21.550 2.504 ( -3.650 9.398 11.126) 15.014 3.176 ( -7.441 21.955 6.400) 24.048 3.570 ( 4.312 16.601 -4.568) 17.749 3.767 ( -0.149 8.408 -12.840) 15.349 3.927 ( -1.759 17.224 3.837) 17.734 4.142 ( -2.929 14.004 -6.912) 15.889 4.423 ( -7.111 9.699 -0.609) 12.042 4.528 ( -9.183 22.323 6.154) 24.910 4.832 ( -1.603 1.960 2.004) 3.229 5.026 ( -1.033 2.038 -1.116) 2.543 6.115 ( 1.186 2.896 -0.137) 3.133 6.327 ( -2.190 -6.006 -7.998) 10.239 6.519 ( 6.309 0.752 1.118) 6.451 6.645 ( 2.676 0.418 -0.047) 2.709 6.746 ( 2.776 21.081 2.304) 21.388 6.995 ( -2.727 0.553 0.569) 2.841 7.317 ( 3.303 -7.377 -1.239) 8.177 7.812 ( -2.792 -7.909 -0.779) 8.423 8.124 ( -3.586 11.603 -6.226) 13.647 8.421 ( 2.827 14.482 -5.921) 15.899 8.477 ( 3.932 -4.445 1.041) 6.025 8.767 ( 8.255 -5.653 7.167) 12.308 9.539 ( 7.500 -8.357 1.238) 11.297 10.277 ( -0.307 4.631 -3.944) 6.090 10.953 ( 4.743 -8.666 2.377) 10.162 10.993 ( 0.309 -28.547 0.862) 28.562 11.213 ( -9.635 -4.478 -7.681) 13.111 11.477 ( 1.756 13.542 -1.244) 13.712 12.367 ( 8.581 -0.205 6.807) 10.955 12.546 ( 2.968 -5.767 0.461) 6.503 12.944 ( -0.145 0.604 -3.550) 3.604 12.992 ( 8.475 4.252 -1.602) 9.616 13.145 ( -2.368 -1.763 -3.305) 4.431 13.602 ( -0.279 12.183 0.582) 12.200 13.723 ( 0.692 4.755 -1.110) 4.932 13.806 ( 1.719 -0.983 7.047) 7.319 14.104 ( 0.324 -1.420 1.360) 1.993 14.398 ( 5.105 5.433 -5.423) 9.219 14.773 ( -13.487 9.894 6.358) 17.895 15.151 ( -4.424 -0.106 -3.394) 5.577 15.266 ( -2.871 -4.068 3.246) 5.944 15.501 ( -4.233 4.164 5.700) 8.231 15.781 ( 3.196 -6.113 -7.663) 10.310 16.497 ( -2.576 3.716 1.170) 4.670 16.788 ( -5.608 5.801 3.949) 8.983 17.457 ( 3.945 -20.021 -1.324) 20.449 ======================= Grid point 286 (136/208) ======================= q-point: (-0.12 0.21 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( -1.618 10.144 8.640) 13.422 2.191 ( -1.352 24.893 3.612) 25.190 2.489 ( 0.355 15.453 17.864) 23.623 3.075 ( -3.558 27.553 5.751) 28.371 3.570 ( -4.217 10.427 -10.691) 15.518 3.641 ( -7.905 22.527 -12.281) 26.848 3.992 ( 6.498 13.994 3.527) 15.827 4.088 ( -4.878 18.100 -1.983) 18.850 4.273 ( -3.723 20.135 1.969) 20.571 4.448 ( -0.260 10.964 4.303) 11.781 4.833 ( 0.326 -1.308 2.738) 3.052 5.041 ( 2.435 2.744 0.138) 3.671 6.109 ( -1.829 1.086 -0.558) 2.199 6.237 ( -4.575 -1.258 -9.778) 10.868 6.551 ( -0.781 -18.719 -4.907) 19.367 6.662 ( -6.073 7.464 -0.873) 9.661 6.891 ( 11.469 15.991 -0.362) 19.682 6.931 ( -0.028 11.717 -1.124) 11.771 7.382 ( 2.110 -3.809 1.566) 4.627 7.782 ( -0.329 -1.870 4.613) 4.989 7.971 ( -9.711 14.147 -7.441) 18.703 8.434 ( -0.952 5.398 -6.439) 8.456 8.578 ( 6.631 -10.470 -1.583) 12.494 8.986 ( 11.839 -7.345 13.092) 19.119 9.642 ( 1.914 -13.003 -0.153) 13.144 10.276 ( 0.753 6.255 -3.643) 7.278 10.984 ( -1.221 -24.268 0.208) 24.300 11.014 ( -7.542 -15.892 -9.534) 20.008 11.072 ( 5.023 -3.819 3.681) 7.306 11.492 ( 0.168 12.167 -2.238) 12.373 12.572 ( 9.842 -1.244 5.430) 11.309 12.602 ( 3.552 -7.592 2.062) 8.631 12.932 ( 0.391 -2.582 -3.645) 4.484 13.010 ( -2.938 -8.784 3.308) 9.836 13.199 ( 3.581 7.690 -8.298) 11.867 13.578 ( -2.388 7.147 1.515) 7.687 13.699 ( 0.024 7.563 1.698) 7.751 13.865 ( 1.158 0.556 6.727) 6.848 14.154 ( 4.112 3.805 -2.423) 6.104 14.401 ( -11.305 16.153 3.457) 20.016 14.556 ( -0.611 2.310 -7.208) 7.594 15.066 ( -3.629 0.637 -2.735) 4.589 15.244 ( 0.092 3.915 5.785) 6.986 15.440 ( -2.578 8.352 2.386) 9.061 15.879 ( 6.035 -8.125 -3.259) 10.633 16.472 ( 0.225 0.595 2.095) 2.190 16.660 ( -7.834 4.700 4.068) 10.001 17.516 ( 2.369 -20.611 -1.781) 20.823 ======================= Grid point 287 (137/208) ======================= q-point: ( 0.00 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 2.058 9.950 6.960) 12.316 2.659 ( 1.558 20.220 2.593) 20.445 2.895 ( 7.008 11.879 13.913) 19.590 3.507 ( -10.199 7.361 -12.967) 18.065 3.635 ( -0.702 24.376 1.654) 24.442 3.994 ( 0.789 20.574 -6.418) 21.566 4.277 ( -3.598 8.739 2.139) 9.690 4.416 ( 3.775 11.009 1.833) 11.782 4.659 ( 9.595 16.913 2.445) 19.598 4.755 ( -2.271 13.982 -2.892) 14.458 4.849 ( -0.362 7.521 2.846) 8.050 5.105 ( -0.651 1.772 -0.003) 1.888 5.933 ( -0.544 -17.648 -8.141) 19.442 6.152 ( 1.105 4.664 4.975) 6.908 6.361 ( -1.633 0.654 -4.660) 4.981 6.781 ( -5.711 16.191 -0.608) 17.180 6.888 ( 0.317 -0.097 3.116) 3.134 7.202 ( -0.082 -3.326 -1.357) 3.594 7.567 ( 8.138 -1.422 12.490) 14.975 7.826 ( 0.286 8.586 4.714) 9.799 8.225 ( -2.472 11.850 -4.918) 13.066 8.364 ( -5.421 10.038 -10.637) 15.598 8.555 ( -1.317 1.197 -16.964) 17.057 8.961 ( 8.070 -13.527 12.217) 19.934 9.294 ( -8.706 -13.596 -4.690) 16.812 10.265 ( -0.076 -34.894 -1.800) 34.940 10.453 ( -4.113 7.300 5.109) 9.814 10.821 ( 1.356 0.284 -6.489) 6.635 11.019 ( 3.267 -10.197 5.590) 12.079 11.782 ( -0.541 18.026 -1.739) 18.118 12.392 ( 0.491 -12.444 -3.024) 12.816 12.760 ( 2.121 -1.777 6.988) 7.516 12.802 ( -0.926 -2.383 -3.658) 4.463 12.905 ( 9.419 -7.381 -0.332) 11.971 13.198 ( -7.850 2.308 -5.604) 9.917 13.591 ( -0.103 0.795 1.144) 1.397 13.902 ( 5.408 -1.470 12.519) 13.716 14.030 ( 0.294 13.903 1.756) 14.017 14.175 ( -5.738 3.661 2.888) 7.394 14.444 ( -6.996 2.302 -2.647) 7.827 14.818 ( 3.657 16.365 -7.194) 18.247 15.083 ( 0.906 3.799 -0.071) 3.906 15.403 ( 5.889 4.087 7.552) 10.412 15.486 ( 0.701 -3.506 3.268) 4.844 15.786 ( -4.490 0.189 -7.720) 8.933 16.557 ( 4.040 -1.550 0.284) 4.337 16.588 ( -3.627 3.734 0.439) 5.224 17.113 ( 0.041 -21.423 -0.946) 21.444 ======================= Grid point 288 (138/208) ======================= q-point: ( 0.12 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 2.747 8.673 4.351) 10.085 2.689 ( 1.389 20.346 0.469) 20.399 3.062 ( 6.304 5.507 13.548) 15.925 3.304 ( -7.829 7.697 -10.166) 14.963 3.600 ( -2.124 23.493 3.091) 23.790 4.080 ( 8.041 21.087 -5.847) 23.314 4.192 ( -4.171 9.990 2.001) 11.009 4.489 ( 3.110 11.590 -1.853) 12.142 4.728 ( 0.188 15.707 -6.329) 16.936 4.840 ( 1.464 8.268 5.902) 10.264 4.857 ( 7.153 9.348 -2.304) 11.994 5.075 ( -2.439 1.676 0.237) 2.969 5.899 ( -1.817 -14.021 -5.787) 15.277 6.159 ( -1.958 -3.464 2.419) 4.657 6.397 ( 6.916 10.016 -0.541) 12.183 6.721 ( -0.117 16.703 3.967) 17.168 6.864 ( -3.661 2.121 2.437) 4.882 7.202 ( 0.156 -2.758 -1.182) 3.005 7.668 ( -0.313 2.070 3.878) 4.407 7.875 ( 3.285 2.842 4.872) 6.527 8.134 ( -3.983 22.379 -3.468) 22.994 8.296 ( 0.038 1.613 -5.443) 5.677 8.504 ( -1.955 -1.347 -12.644) 12.865 9.069 ( -12.696 -14.461 -6.369) 20.270 9.104 ( 3.405 -12.918 12.599) 18.364 10.273 ( 0.338 -32.556 -0.765) 32.567 10.431 ( 3.045 5.110 6.344) 8.697 10.870 ( 3.543 4.574 -5.688) 8.113 11.050 ( -0.733 -9.356 1.757) 9.548 11.776 ( 0.112 18.096 -0.937) 18.121 12.377 ( -1.124 -12.130 -3.564) 12.692 12.717 ( -6.558 -2.797 1.316) 7.250 12.794 ( 0.787 -4.423 -1.521) 4.743 13.059 ( -4.675 5.270 0.700) 7.079 13.157 ( 14.478 -3.709 -4.821) 15.704 13.606 ( 1.202 0.604 1.842) 2.281 13.940 ( -6.347 7.902 9.053) 13.589 14.033 ( -3.029 10.303 2.777) 11.092 14.075 ( 1.313 -1.746 2.165) 3.075 14.376 ( -0.479 -0.224 -3.097) 3.142 14.837 ( 0.480 11.891 -4.411) 12.692 15.112 ( 1.852 3.474 0.163) 3.940 15.336 ( -15.570 -4.190 11.045) 19.544 15.508 ( 1.936 -1.951 -0.083) 2.750 15.808 ( 9.016 7.190 -10.072) 15.311 16.525 ( 0.471 1.495 -0.426) 1.624 16.722 ( 8.332 0.775 2.158) 8.642 17.096 ( -1.526 -20.784 -0.746) 20.854 ======================= Grid point 289 (139/208) ======================= q-point: ( 0.25 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 3.867 6.453 1.315) 7.636 2.706 ( -0.071 17.907 0.200) 17.909 3.014 ( -9.334 -4.851 -9.507) 14.178 3.317 ( 6.140 13.510 13.901) 20.333 3.604 ( 2.251 18.508 3.881) 19.044 4.139 ( -1.843 7.476 0.993) 7.763 4.219 ( 5.706 19.268 -8.251) 21.723 4.533 ( 3.559 19.642 -5.818) 20.793 4.718 ( -0.363 12.051 -8.061) 14.503 4.855 ( 1.425 4.588 2.621) 5.473 4.970 ( 2.111 5.081 1.143) 5.620 5.038 ( -0.483 4.329 0.914) 4.451 5.853 ( -1.909 -12.200 -2.409) 12.581 6.138 ( 1.020 -4.341 -0.266) 4.467 6.572 ( 9.819 9.271 -0.614) 13.519 6.744 ( -4.259 10.103 5.389) 12.217 6.796 ( 1.244 8.753 6.327) 10.871 7.198 ( -0.361 1.054 -1.314) 1.723 7.589 ( -6.462 15.062 -6.283) 17.553 7.919 ( 1.522 -0.210 5.050) 5.279 8.087 ( -2.667 9.820 -2.508) 10.481 8.356 ( 5.661 5.909 2.189) 8.470 8.445 ( -1.775 -0.553 -6.201) 6.474 8.806 ( -12.378 -10.455 -4.539) 16.826 9.171 ( 2.127 -10.728 10.430) 15.112 10.270 ( -0.040 -27.403 -0.336) 27.405 10.581 ( 9.188 4.252 4.481) 11.072 10.917 ( 2.265 5.206 -3.777) 6.819 11.006 ( -3.000 -9.269 -1.022) 9.796 11.778 ( -0.003 18.344 -0.013) 18.344 12.352 ( -0.562 -12.948 -4.554) 13.737 12.575 ( -7.038 -0.146 -1.642) 7.228 12.793 ( -0.517 -3.549 -3.296) 4.871 12.986 ( -5.171 7.758 5.558) 10.855 13.419 ( 13.560 1.450 -7.275) 15.456 13.636 ( 1.274 0.627 4.395) 4.619 13.804 ( -6.980 7.088 5.117) 11.187 13.971 ( -2.525 6.108 -2.252) 6.982 14.099 ( -1.136 -1.581 1.653) 2.555 14.387 ( 0.611 -0.640 -2.486) 2.639 14.807 ( -6.061 -7.703 2.438) 10.100 15.060 ( -7.344 1.687 8.815) 11.596 15.171 ( 2.324 3.005 0.596) 3.845 15.548 ( 2.476 -2.391 -2.051) 4.007 15.943 ( 4.945 5.257 -8.320) 11.015 16.588 ( 5.734 5.151 0.004) 7.708 16.852 ( 4.725 1.193 2.818) 5.629 17.063 ( -1.553 -18.077 -0.302) 18.146 ======================= Grid point 290 (140/208) ======================= q-point: ( 0.38 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( 5.079 4.991 -0.614) 7.147 2.665 ( -5.307 9.194 1.196) 10.683 2.826 ( -7.190 0.827 -8.966) 11.523 3.451 ( 5.086 10.486 13.723) 18.004 3.685 ( 5.000 13.108 3.593) 14.482 4.060 ( -6.089 9.285 -9.112) 14.364 4.282 ( 3.025 20.339 -1.838) 20.645 4.621 ( 5.266 18.252 -7.898) 20.573 4.687 ( -1.631 9.691 -7.215) 12.192 4.891 ( 1.460 6.378 2.563) 7.027 4.979 ( 0.730 1.198 2.192) 2.602 5.042 ( -0.353 0.807 0.999) 1.332 5.842 ( 1.252 -14.606 -0.113) 14.660 6.193 ( 3.813 0.229 -0.432) 3.844 6.610 ( -7.018 6.436 0.207) 9.524 6.717 ( 4.525 3.367 -3.308) 6.538 6.882 ( 3.593 9.763 12.988) 16.640 7.185 ( -0.680 7.309 -1.090) 7.421 7.452 ( -5.999 19.788 -7.599) 22.030 7.986 ( 4.717 2.787 5.068) 7.464 8.020 ( -2.972 9.890 -3.377) 10.865 8.297 ( -7.169 -7.912 -7.461) 13.026 8.572 ( 8.806 10.254 9.878) 16.741 8.630 ( -4.595 -5.084 -2.523) 7.303 9.244 ( 3.992 -4.763 10.410) 12.124 10.279 ( 1.171 -26.492 -0.323) 26.520 10.662 ( -1.714 6.110 -6.556) 9.124 10.860 ( -6.122 -6.381 -6.108) 10.747 11.091 ( 10.554 0.217 8.371) 13.472 11.775 ( -0.140 19.255 0.365) 19.259 12.344 ( 0.242 -13.815 -4.901) 14.660 12.498 ( 0.386 1.964 -2.547) 3.239 12.749 ( -5.721 3.599 -0.917) 6.821 12.871 ( -5.265 4.513 0.934) 6.997 13.587 ( 2.689 10.135 -4.062) 11.245 13.668 ( 1.852 0.764 4.550) 4.971 13.725 ( -1.824 3.703 2.968) 5.084 13.936 ( -0.925 5.044 -1.344) 5.302 14.054 ( -3.165 -2.454 0.238) 4.013 14.344 ( -4.083 -5.040 -1.095) 6.578 14.694 ( -1.864 -22.673 2.057) 22.842 15.068 ( 3.222 6.795 5.820) 9.509 15.223 ( 2.183 1.719 0.460) 2.816 15.597 ( 3.271 -2.484 -2.813) 4.978 15.947 ( -3.218 0.407 -3.810) 5.003 16.703 ( 5.299 8.479 0.417) 10.008 16.908 ( 1.205 -2.467 1.283) 3.030 17.049 ( 0.150 -10.037 0.278) 10.042 ======================= Grid point 291 (141/208) ======================= q-point: (-0.50 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( -3.099 4.999 -1.194) 6.002 2.550 ( -1.779 -2.456 1.533) 3.398 2.733 ( -2.702 12.640 -4.039) 13.541 3.545 ( 2.473 8.697 10.745) 14.043 3.775 ( 3.703 11.190 1.944) 11.946 3.933 ( -4.393 15.003 -9.522) 18.304 4.325 ( 1.247 16.963 0.824) 17.029 4.627 ( -3.328 11.036 -7.247) 13.616 4.659 ( -0.238 11.477 -7.181) 13.540 4.904 ( -0.664 7.701 2.687) 8.184 5.022 ( 2.377 0.893 0.447) 2.578 5.039 ( 0.743 -1.157 0.964) 1.679 5.887 ( 2.867 -17.483 0.660) 17.728 6.241 ( 0.838 4.260 -1.447) 4.576 6.508 ( -3.126 3.108 0.208) 4.413 6.742 ( -1.222 2.546 -2.183) 3.569 6.952 ( 1.898 6.188 11.563) 13.251 7.173 ( -0.320 13.041 -0.599) 13.058 7.359 ( -2.709 17.008 -6.284) 18.333 7.963 ( -1.928 12.603 -3.238) 13.154 8.122 ( 7.354 5.169 5.718) 10.653 8.172 ( -3.131 -7.267 -6.583) 10.293 8.530 ( -3.384 -10.332 -4.715) 11.851 8.787 ( 8.986 18.859 10.309) 23.295 9.341 ( 3.953 -0.008 9.171) 9.987 10.312 ( 2.109 -26.662 1.296) 26.777 10.550 ( -6.873 4.821 -9.885) 12.969 10.741 ( -4.619 -10.397 -6.086) 12.902 11.285 ( 6.027 0.934 8.872) 10.766 11.780 ( 0.615 20.120 0.273) 20.132 12.335 ( -0.244 -13.074 -4.078) 13.698 12.525 ( -7.193 3.040 -6.158) 9.945 12.637 ( 6.285 10.601 3.217) 12.737 12.850 ( 2.108 -2.077 -3.821) 4.833 13.508 ( -9.393 7.047 6.116) 13.240 13.669 ( -0.356 1.491 0.821) 1.739 13.766 ( 3.309 6.729 1.982) 7.756 13.908 ( -2.750 3.896 -1.325) 4.949 14.017 ( -0.271 -4.820 2.406) 5.394 14.303 ( 0.438 -5.036 -1.059) 5.165 14.746 ( 6.514 -21.089 -4.149) 22.459 15.137 ( 2.603 4.539 4.859) 7.140 15.235 ( -0.927 0.396 -0.597) 1.171 15.653 ( 2.135 0.140 -3.635) 4.217 15.832 ( -7.612 -3.719 2.258) 8.767 16.757 ( -0.069 9.183 0.879) 9.225 16.924 ( 0.810 -7.255 -0.058) 7.300 17.060 ( 0.614 -2.797 0.016) 2.864 ======================= Grid point 292 (142/208) ======================= q-point: (-0.38 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( -8.424 2.647 1.886) 9.030 2.591 ( 1.532 1.777 3.142) 3.921 2.700 ( 0.252 17.570 -1.258) 17.616 3.576 ( -0.153 11.616 6.995) 13.560 3.835 ( 1.617 7.434 -0.985) 7.672 3.889 ( 1.925 18.161 -4.777) 18.877 4.332 ( -0.554 16.402 1.439) 16.475 4.532 ( -5.312 12.844 -6.704) 15.431 4.607 ( -3.957 6.220 -4.420) 8.596 4.880 ( -1.969 7.019 2.062) 7.576 5.034 ( -0.594 3.595 -0.384) 3.664 5.070 ( 1.162 2.610 -0.316) 2.874 5.935 ( 2.100 -19.359 -2.254) 19.602 6.220 ( -2.392 5.044 -1.847) 5.880 6.510 ( 3.323 0.332 2.595) 4.229 6.674 ( -5.360 2.638 -1.793) 6.238 7.010 ( 2.364 5.096 11.229) 12.556 7.178 ( 0.917 13.381 -0.291) 13.416 7.311 ( -1.810 11.240 -4.439) 12.219 7.929 ( -1.640 15.849 -0.602) 15.945 8.140 ( 2.256 -2.669 -4.998) 6.098 8.277 ( 4.900 -4.305 -0.718) 6.562 8.501 ( 2.666 -6.081 0.064) 6.640 8.913 ( 2.455 22.196 0.260) 22.333 9.404 ( 1.424 0.606 4.866) 5.107 10.340 ( -0.847 -31.960 1.126) 31.991 10.441 ( -1.412 8.689 -4.794) 10.024 10.694 ( 0.768 -13.100 -1.082) 13.167 11.303 ( -5.180 -1.177 2.983) 6.093 11.795 ( 0.861 19.564 -0.270) 19.585 12.319 ( -1.103 -11.845 -4.665) 12.778 12.386 ( -2.645 4.529 -1.116) 5.362 12.802 ( 4.458 -3.317 1.329) 5.714 12.965 ( 12.305 8.497 -6.525) 16.315 13.315 ( -11.098 1.886 8.656) 14.200 13.699 ( 3.303 0.468 2.123) 3.955 13.819 ( 2.205 8.086 0.397) 8.390 13.830 ( -5.131 1.124 0.621) 5.289 14.036 ( 1.677 -2.808 1.686) 3.680 14.349 ( 4.458 -1.592 -1.287) 4.906 14.896 ( 9.467 -14.869 -4.581) 18.213 15.146 ( -4.022 6.737 3.278) 8.503 15.206 ( -1.141 -1.860 -0.507) 2.240 15.585 ( -7.821 -0.150 1.024) 7.890 15.769 ( 0.621 -2.036 0.096) 2.130 16.708 ( -4.813 8.249 0.292) 9.555 16.939 ( 0.318 -6.189 -0.037) 6.197 17.060 ( -0.569 -5.208 0.023) 5.239 ======================= Grid point 293 (143/208) ======================= q-point: (-0.25 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( -4.516 5.919 5.158) 9.057 2.597 ( -0.412 10.539 6.335) 12.304 2.733 ( 2.314 15.896 1.356) 16.120 3.584 ( 0.331 17.696 4.392) 18.236 3.813 ( -2.421 7.632 -6.863) 10.546 3.982 ( 6.260 14.344 -0.791) 15.671 4.302 ( -3.013 18.030 -0.782) 18.297 4.426 ( -4.030 14.647 -4.231) 15.770 4.525 ( -3.093 5.270 0.764) 6.158 4.848 ( -1.562 4.017 1.124) 4.455 4.981 ( -5.208 13.393 0.949) 14.401 5.087 ( 0.975 3.991 -0.845) 4.194 5.955 ( 0.834 -19.690 -6.240) 20.672 6.168 ( -2.211 2.340 -2.093) 3.840 6.549 ( -6.453 2.613 -2.605) 7.433 6.633 ( 7.645 -2.085 5.987) 9.932 7.044 ( -1.652 6.763 5.051) 8.601 7.200 ( 1.089 7.464 -0.838) 7.589 7.292 ( 1.257 7.536 3.476) 8.394 7.888 ( -2.854 17.179 1.250) 17.459 8.228 ( 7.248 0.295 -6.550) 9.774 8.292 ( -0.541 -11.519 -1.944) 11.695 8.634 ( 8.520 -2.054 4.461) 9.834 8.866 ( -6.045 21.433 -11.754) 25.180 9.420 ( 0.164 -3.990 -0.310) 4.005 10.302 ( -1.569 -30.202 -1.638) 30.287 10.463 ( 1.910 7.575 2.778) 8.291 10.766 ( 5.803 -13.948 5.437) 16.056 11.130 ( -11.635 -3.419 -3.423) 12.600 11.807 ( 0.287 18.461 -1.015) 18.491 12.320 ( 2.444 -11.394 -3.870) 12.279 12.415 ( 4.894 1.047 2.617) 5.648 12.833 ( 0.371 -5.715 -3.853) 6.903 13.060 ( -7.680 0.542 7.233) 10.564 13.250 ( 6.739 6.163 -4.657) 10.251 13.722 ( -6.407 -0.332 2.463) 6.872 13.762 ( 1.280 -2.875 5.993) 6.769 13.885 ( 5.787 12.082 -0.190) 13.398 14.100 ( 5.179 0.527 -0.498) 5.230 14.462 ( 7.898 1.386 -3.673) 8.820 14.984 ( -12.957 9.089 3.117) 16.131 15.057 ( 6.380 -5.177 1.124) 8.293 15.186 ( 0.011 -1.413 0.079) 1.416 15.487 ( -2.358 -3.275 4.229) 5.845 15.791 ( 2.101 1.833 -5.575) 6.233 16.599 ( -6.012 5.864 -0.327) 8.404 16.894 ( -5.882 2.523 1.011) 6.480 17.065 ( 1.472 -17.245 -0.346) 17.311 ======================= Grid point 294 (144/208) ======================= q-point: (-0.12 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( -0.190 9.062 7.316) 11.648 2.620 ( 1.543 16.504 6.789) 17.913 2.785 ( 3.056 14.743 6.328) 16.332 3.608 ( 1.451 24.982 2.678) 25.167 3.707 ( -7.398 5.078 -11.633) 14.692 4.041 ( -1.450 16.614 -4.678) 17.321 4.267 ( 1.675 11.475 0.402) 11.603 4.388 ( -0.370 15.230 1.813) 15.342 4.526 ( 3.248 10.847 2.249) 11.544 4.822 ( -2.368 2.093 -0.672) 3.231 4.872 ( -4.603 20.671 3.302) 21.433 5.103 ( 0.706 3.531 -0.384) 3.621 5.950 ( -0.008 -19.107 -7.659) 20.585 6.141 ( -0.410 2.267 -0.337) 2.329 6.432 ( -4.961 0.158 -3.405) 6.019 6.783 ( 5.856 0.626 5.568) 8.105 6.953 ( -6.996 9.655 -1.937) 12.079 7.207 ( 0.034 0.325 -1.810) 1.839 7.392 ( 7.157 3.424 12.314) 14.649 7.840 ( -2.183 13.631 3.083) 14.145 8.256 ( -0.951 -4.402 -2.088) 4.964 8.381 ( 6.406 4.708 -8.940) 11.963 8.682 ( -8.704 16.385 -17.055) 25.201 8.796 ( 7.215 -8.468 7.392) 13.357 9.402 ( -2.399 -10.459 -3.256) 11.214 10.280 ( -0.857 -33.525 -1.261) 33.560 10.491 ( -0.050 10.804 3.805) 11.454 10.871 ( -0.786 -11.340 -0.162) 11.368 10.942 ( -1.565 -5.561 1.489) 5.966 11.799 ( -0.748 17.937 -1.771) 18.040 12.366 ( 2.520 -13.060 -3.357) 13.718 12.581 ( 11.335 0.498 5.040) 12.415 12.820 ( -0.821 -4.675 -4.791) 6.744 12.915 ( -6.626 -4.565 5.149) 9.552 13.310 ( -1.260 3.112 -6.673) 7.470 13.621 ( -3.942 0.245 2.780) 4.830 13.801 ( 2.724 -2.363 9.230) 9.910 13.988 ( 3.871 13.700 2.565) 14.466 14.194 ( 3.240 0.843 -0.862) 3.457 14.592 ( 1.013 1.926 -8.821) 9.086 14.755 ( -5.290 17.614 4.192) 18.862 15.088 ( -1.018 2.023 0.101) 2.267 15.265 ( 6.269 -0.419 5.981) 8.674 15.477 ( -0.287 -3.437 4.270) 5.489 15.827 ( 2.032 1.310 -8.556) 8.891 16.514 ( -1.833 2.639 -0.089) 3.214 16.741 ( -9.575 3.071 1.321) 10.142 17.098 ( 1.628 -20.872 -0.797) 20.951 ======================= Grid point 295 (145/208) ======================= q-point: ( 0.00 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( 1.596 10.149 6.862) 12.355 2.929 ( 4.242 5.395 7.559) 10.210 3.098 ( 1.380 10.414 -1.239) 10.577 3.595 ( -8.054 3.413 -6.353) 10.811 4.138 ( -1.985 23.366 -0.284) 23.452 4.315 ( 3.586 10.284 -1.714) 11.026 4.381 ( -0.907 4.574 2.427) 5.257 4.555 ( -0.654 4.329 -5.257) 6.841 4.872 ( 0.615 6.310 -2.096) 6.678 4.957 ( 6.512 10.469 4.971) 13.293 5.144 ( -1.269 9.263 -2.131) 9.590 5.205 ( 0.700 10.251 1.988) 10.466 5.679 ( -0.779 -6.148 -3.186) 6.968 6.213 ( -1.739 1.311 5.461) 5.880 6.347 ( 3.076 -2.323 -2.586) 4.642 6.834 ( 2.811 -5.378 3.916) 7.222 7.166 ( -3.095 21.052 3.268) 21.528 7.195 ( -0.228 3.459 0.580) 3.515 7.560 ( 3.910 3.673 8.597) 10.134 7.912 ( -3.897 -0.992 -1.020) 4.148 8.098 ( 2.484 -7.390 -4.509) 9.006 8.566 ( -7.773 -0.441 -16.318) 18.080 8.649 ( 7.318 -6.588 2.640) 10.195 9.020 ( -3.442 16.474 -7.033) 18.241 9.072 ( -7.749 1.580 -6.951) 10.529 9.617 ( -0.202 -30.380 -2.661) 30.497 10.493 ( -5.328 -2.250 9.534) 11.151 10.723 ( 2.748 -12.878 6.738) 14.792 10.954 ( 5.336 5.504 -0.088) 7.666 12.142 ( 0.777 -10.306 -1.984) 10.524 12.160 ( 0.022 16.774 -0.573) 16.784 12.672 ( -3.884 -6.568 3.505) 8.397 12.794 ( 0.409 0.639 -4.890) 4.948 12.820 ( 12.252 -0.426 -0.631) 12.276 13.220 ( -5.924 0.005 -6.572) 8.848 13.600 ( -0.335 0.256 1.969) 2.013 13.835 ( 4.918 -3.976 8.114) 10.288 14.234 ( 1.210 3.800 3.732) 5.462 14.279 ( -1.190 8.225 1.813) 8.506 14.488 ( -11.255 3.496 0.703) 11.807 15.097 ( 1.115 10.206 0.259) 10.270 15.175 ( 1.377 5.255 -0.204) 5.437 15.352 ( 0.455 -6.134 4.606) 7.684 15.535 ( 6.089 8.103 2.417) 10.420 15.811 ( -2.273 0.695 -9.692) 9.979 16.510 ( 0.408 -2.752 -0.554) 2.837 16.636 ( -0.434 -0.061 -0.460) 0.636 16.710 ( -0.979 -18.178 -0.401) 18.209 ======================= Grid point 296 (146/208) ======================= q-point: ( 0.12 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 0.148 8.509 4.872) 9.806 2.972 ( -1.566 2.839 5.088) 6.033 3.097 ( -1.827 5.849 -5.578) 8.287 3.488 ( -1.298 8.677 2.705) 9.181 4.051 ( -5.689 21.318 0.636) 22.073 4.319 ( -2.823 4.870 -0.729) 5.677 4.443 ( 6.161 12.965 -0.623) 14.368 4.566 ( 3.115 1.311 -4.317) 5.482 4.903 ( 2.690 5.271 -1.045) 6.009 5.025 ( -0.266 4.698 -1.999) 5.112 5.130 ( 0.028 8.330 0.262) 8.334 5.207 ( -0.851 16.874 -0.904) 16.920 5.679 ( 0.846 -6.093 -2.617) 6.685 6.154 ( -3.106 3.083 3.273) 5.465 6.461 ( 7.223 -4.159 -0.898) 8.383 6.840 ( -2.095 -4.028 1.063) 4.663 7.151 ( 0.613 24.852 7.080) 25.848 7.243 ( 4.704 5.637 -0.463) 7.357 7.629 ( 1.574 0.226 4.575) 4.843 7.865 ( -0.722 -1.784 0.939) 2.142 8.120 ( 0.219 -9.996 -4.993) 11.176 8.444 ( -1.442 2.790 -8.205) 8.785 8.698 ( -4.215 -7.219 -7.281) 11.086 8.919 ( -3.797 -3.611 2.067) 5.633 8.980 ( -1.459 22.555 -1.078) 22.628 9.636 ( 2.110 -30.774 -1.740) 30.896 10.505 ( 5.247 2.604 11.956) 13.314 10.763 ( 0.636 -15.551 2.633) 15.785 11.040 ( 3.476 7.189 -3.674) 8.790 12.127 ( -1.637 -5.824 -2.259) 6.458 12.164 ( 0.204 12.635 -0.879) 12.667 12.622 ( -2.838 -5.892 1.818) 6.788 12.771 ( -1.452 1.355 -2.587) 3.262 13.076 ( 14.939 -3.810 -6.668) 16.798 13.131 ( -2.151 1.993 -1.634) 3.357 13.609 ( 0.862 -0.010 2.199) 2.362 13.916 ( 2.058 -5.012 3.461) 6.429 14.164 ( -10.817 8.239 9.879) 16.807 14.239 ( -3.599 6.830 0.384) 7.730 14.366 ( 1.003 0.758 -2.544) 2.838 15.067 ( -7.679 9.636 -0.227) 12.324 15.185 ( -1.689 3.293 0.915) 3.813 15.266 ( -9.186 -1.816 7.048) 11.720 15.479 ( -3.227 0.194 -0.897) 3.355 15.899 ( 8.540 1.675 -9.285) 12.726 16.554 ( 5.084 1.596 -0.494) 5.352 16.673 ( 0.006 -14.712 -0.442) 14.719 16.760 ( 8.238 -4.307 1.200) 9.373 ======================= Grid point 297 (147/208) ======================= q-point: ( 0.25 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( 0.417 5.274 2.256) 5.751 2.855 ( -10.423 -5.328 -0.712) 11.728 3.053 ( -1.195 11.106 -5.113) 12.284 3.541 ( 4.047 9.084 10.576) 14.517 3.956 ( -3.954 16.585 0.535) 17.058 4.270 ( -1.910 6.897 -1.480) 7.308 4.549 ( 4.794 9.441 -1.320) 10.670 4.649 ( 6.117 0.656 -4.307) 7.510 4.940 ( -0.105 2.796 -0.875) 2.932 4.992 ( -0.955 7.132 -4.029) 8.247 5.107 ( -2.536 3.323 0.496) 4.210 5.170 ( -2.688 17.512 -4.654) 18.318 5.662 ( -2.168 -5.603 -3.016) 6.722 6.165 ( 3.685 6.385 2.872) 7.912 6.574 ( 3.970 -9.114 -0.675) 9.964 6.792 ( -1.888 1.033 -2.219) 3.091 7.183 ( 0.650 23.020 7.716) 24.287 7.345 ( 5.689 11.195 -0.334) 12.562 7.617 ( -2.822 -1.077 -2.946) 4.219 7.905 ( 4.644 -0.360 4.006) 6.143 8.094 ( -1.675 -9.372 -3.258) 10.062 8.457 ( -3.196 -9.284 -3.336) 10.370 8.559 ( -0.881 8.336 -3.289) 9.005 8.862 ( -2.402 21.597 -0.527) 21.736 9.032 ( 4.904 -0.964 11.264) 12.323 9.672 ( 1.798 -29.950 -0.689) 30.012 10.667 ( 4.088 -3.255 4.636) 6.986 10.794 ( 6.318 -5.362 4.761) 9.558 11.061 ( 0.274 7.252 -5.576) 9.152 12.085 ( -1.870 -9.113 -3.566) 9.963 12.166 ( 0.177 15.156 -0.463) 15.164 12.557 ( -3.428 -1.628 -1.361) 4.032 12.749 ( -0.458 -0.570 -2.709) 2.806 13.112 ( -1.008 4.398 3.874) 5.947 13.362 ( 16.137 -6.181 -7.449) 18.818 13.636 ( 1.454 -0.209 3.367) 3.673 13.920 ( -3.431 -0.714 3.799) 5.169 13.974 ( -6.621 3.457 -0.306) 7.476 14.158 ( -4.629 3.848 -1.848) 6.297 14.406 ( 0.742 2.375 -0.977) 2.673 14.678 ( -26.442 -3.751 3.607) 26.950 15.157 ( 0.013 5.715 2.684) 6.313 15.250 ( 1.954 4.747 4.656) 6.930 15.470 ( 1.091 -4.081 -1.924) 4.642 15.980 ( 1.171 -0.846 -6.147) 6.315 16.649 ( -0.281 -14.692 -0.273) 14.697 16.703 ( 8.147 2.395 -0.189) 8.494 16.936 ( 8.951 1.484 1.458) 9.189 ======================= Grid point 298 (148/208) ======================= q-point: ( 0.38 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( 2.612 1.678 0.018) 3.105 2.638 ( -11.457 -5.305 -0.918) 12.659 3.025 ( -1.045 11.808 -3.548) 12.374 3.632 ( 3.129 7.699 11.836) 14.462 3.919 ( 0.224 10.483 -0.668) 10.507 4.228 ( -2.412 8.195 -3.479) 9.224 4.613 ( 2.041 9.234 -0.860) 9.496 4.762 ( 5.364 0.651 -4.849) 7.260 4.901 ( -1.551 6.100 -3.301) 7.108 4.970 ( -2.872 1.334 0.204) 3.173 5.062 ( -1.535 3.383 -0.856) 3.812 5.103 ( -2.186 11.741 -6.044) 13.385 5.629 ( -0.399 -4.217 -1.662) 4.550 6.240 ( 2.194 2.498 0.019) 3.325 6.602 ( 0.413 -5.400 -0.657) 5.455 6.785 ( 0.864 4.117 -0.895) 4.301 7.190 ( -0.799 19.346 5.225) 20.055 7.430 ( 2.514 14.124 0.215) 14.348 7.545 ( -2.772 0.589 -6.169) 6.789 8.017 ( 4.146 -1.633 -1.760) 4.791 8.069 ( 0.946 -3.711 3.048) 4.894 8.290 ( -8.396 -7.355 -4.983) 12.224 8.665 ( 5.215 17.028 1.467) 17.869 8.871 ( 4.430 17.639 9.039) 20.309 9.170 ( 7.149 -2.923 12.878) 15.016 9.707 ( 2.099 -28.157 1.213) 28.261 10.619 ( -5.416 -13.392 -6.002) 15.643 10.859 ( -5.041 6.831 -8.747) 12.190 11.183 ( 13.267 8.708 10.815) 19.204 12.055 ( -0.612 -11.651 -4.489) 12.501 12.168 ( 0.036 16.304 -0.091) 16.304 12.530 ( 1.543 1.376 -2.081) 2.933 12.739 ( -0.136 -1.137 -3.301) 3.494 13.060 ( -5.587 9.798 4.086) 11.997 13.595 ( 4.512 -8.770 4.394) 10.797 13.680 ( 2.594 -0.147 2.081) 3.328 13.836 ( 0.525 6.705 -2.311) 7.112 13.955 ( 1.108 -1.699 -5.788) 6.133 14.061 ( -5.855 0.883 0.619) 5.954 14.149 ( -19.289 -9.406 1.738) 21.530 14.469 ( 0.446 -2.136 -6.218) 6.590 15.171 ( 0.822 4.238 2.036) 4.773 15.296 ( 1.296 4.707 5.515) 7.366 15.508 ( 3.432 -5.086 -1.002) 6.217 15.932 ( -5.337 -1.486 -1.124) 5.653 16.638 ( -0.368 -15.810 -0.160) 15.815 16.846 ( 5.709 4.642 0.569) 7.380 17.081 ( 6.086 4.839 -0.071) 7.776 ======================= Grid point 299 (149/208) ======================= q-point: (-0.50 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( -7.241 -1.440 -0.465) 7.397 2.503 ( 3.401 -1.923 0.781) 3.984 3.006 ( -0.284 12.357 -2.541) 12.619 3.693 ( 1.702 6.310 10.143) 12.066 3.953 ( 2.975 7.619 -1.945) 8.408 4.175 ( -2.073 8.795 -4.075) 9.913 4.616 ( -1.774 9.351 0.674) 9.541 4.782 ( -1.174 4.768 -3.339) 5.938 4.838 ( -5.443 6.754 -3.924) 9.521 4.972 ( 3.131 -2.944 1.566) 4.574 5.053 ( 0.649 3.499 -2.234) 4.202 5.095 ( 2.385 7.743 -5.954) 10.055 5.632 ( 0.539 -5.363 -0.730) 5.439 6.233 ( -1.622 -4.671 -2.278) 5.445 6.605 ( -0.826 4.508 -0.385) 4.600 6.791 ( -0.843 3.242 1.823) 3.814 7.182 ( -0.501 16.694 4.722) 17.356 7.418 ( -2.447 6.871 -1.773) 7.507 7.525 ( 0.405 10.278 -4.084) 11.067 8.013 ( -0.561 -5.932 -4.552) 7.498 8.138 ( -0.417 -3.082 -3.056) 4.360 8.194 ( 1.652 0.310 4.615) 4.911 8.701 ( 0.239 26.618 -2.939) 26.780 9.055 ( 10.458 7.784 14.880) 19.784 9.314 ( 5.333 -3.482 9.250) 11.231 9.759 ( 2.660 -24.404 4.337) 24.929 10.489 ( -6.363 -14.251 -8.433) 17.740 10.697 ( -7.983 5.999 -11.079) 14.915 11.401 ( 4.954 11.394 12.281) 17.469 12.043 ( -0.019 -14.211 -4.940) 15.045 12.169 ( 0.130 17.526 0.154) 17.527 12.579 ( 0.787 2.869 -3.519) 4.608 12.727 ( -0.448 -0.065 -2.887) 2.922 12.988 ( 2.082 12.099 0.240) 12.279 13.492 ( -15.515 -10.274 15.229) 24.045 13.668 ( -1.054 -0.998 1.362) 1.990 13.859 ( -1.335 0.489 2.429) 2.815 13.916 ( 0.086 -4.431 2.050) 4.883 13.997 ( -1.108 4.358 -4.452) 6.328 14.124 ( 10.478 -6.736 -8.629) 15.153 14.507 ( 6.380 -4.410 -12.846) 15.006 15.189 ( 0.681 2.196 1.279) 2.631 15.306 ( -0.943 4.352 4.678) 6.459 15.590 ( 4.781 -5.051 -0.203) 6.958 15.791 ( -9.487 -0.531 4.557) 10.538 16.635 ( 0.056 -15.295 -0.168) 15.296 16.900 ( -0.265 4.724 1.076) 4.853 17.156 ( 1.810 5.946 -1.499) 6.393 ======================= Grid point 300 (150/208) ======================= q-point: (-0.38 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( -4.572 1.961 3.072) 5.846 2.603 ( 5.715 -0.556 0.562) 5.769 3.011 ( 1.226 12.960 -1.718) 13.131 3.740 ( 1.906 5.555 7.121) 9.230 4.005 ( 2.821 8.952 -3.787) 10.122 4.156 ( 0.810 8.308 -1.656) 8.510 4.568 ( -2.654 5.107 1.486) 5.944 4.702 ( -6.007 6.485 -3.256) 9.420 4.784 ( -0.461 9.168 0.109) 9.180 4.991 ( -1.200 3.727 -0.555) 3.955 5.074 ( 1.907 1.726 -2.781) 3.788 5.155 ( 3.477 7.057 -3.784) 8.730 5.647 ( 1.607 -8.410 -2.922) 9.047 6.208 ( -0.657 -6.238 -0.524) 6.294 6.566 ( -2.609 4.524 0.909) 5.301 6.736 ( -5.250 3.705 1.045) 6.510 7.203 ( 1.722 14.862 6.553) 16.333 7.370 ( -2.381 5.347 -1.045) 5.946 7.509 ( -1.687 12.498 -2.370) 12.832 8.011 ( 1.126 -5.403 -3.896) 6.756 8.099 ( -1.540 -7.136 -0.750) 7.339 8.274 ( 3.949 4.172 1.740) 6.003 8.703 ( 1.056 24.785 -3.327) 25.029 9.230 ( 4.843 5.251 4.117) 8.245 9.380 ( 0.432 -2.281 2.594) 3.481 9.786 ( -1.327 -21.077 2.014) 21.214 10.394 ( -1.554 -16.345 -2.413) 16.595 10.591 ( -0.966 5.814 -2.807) 6.528 11.369 ( -9.809 8.549 7.839) 15.190 12.037 ( 0.473 -14.273 -4.643) 15.017 12.172 ( 0.186 17.494 0.002) 17.495 12.504 ( -4.081 6.263 -4.572) 8.763 12.740 ( 1.629 -1.846 -2.070) 3.216 13.167 ( 11.775 9.538 -2.305) 15.327 13.214 ( -14.257 -12.495 13.932) 23.526 13.677 ( 0.795 -1.920 3.376) 3.964 13.824 ( -4.876 -0.208 0.542) 4.910 13.926 ( 5.293 0.686 -1.477) 5.538 14.037 ( 4.101 2.676 -1.810) 5.221 14.290 ( 8.061 -1.959 0.713) 8.326 14.690 ( 14.651 -5.516 -16.980) 23.096 15.197 ( -0.096 1.449 0.403) 1.507 15.285 ( -2.354 5.317 6.050) 8.391 15.575 ( -9.548 -0.316 2.516) 9.879 15.704 ( 2.986 -3.946 3.675) 6.164 16.638 ( 0.345 -15.955 -0.123) 15.960 16.845 ( -5.407 5.162 0.393) 7.486 17.136 ( -3.834 4.721 -1.617) 6.293 ======================= Grid point 301 (151/208) ======================= q-point: (-0.25 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( -0.223 6.375 5.619) 8.501 2.709 ( 5.304 2.564 3.143) 6.678 3.042 ( 2.032 13.124 -1.391) 13.353 3.781 ( 0.953 3.556 1.911) 4.148 4.047 ( 2.529 14.909 -4.247) 15.707 4.193 ( 2.860 6.307 0.682) 6.958 4.535 ( -1.778 -1.026 0.229) 2.066 4.592 ( -4.278 10.972 -2.026) 11.950 4.782 ( 0.176 14.210 2.926) 14.509 4.943 ( -3.168 6.609 -1.207) 7.428 5.111 ( 2.385 1.747 -2.420) 3.821 5.192 ( 1.017 7.740 -0.928) 7.861 5.684 ( 2.570 -8.677 -4.969) 10.324 6.190 ( -1.458 -2.043 0.775) 2.627 6.517 ( -4.557 -1.899 1.753) 5.239 6.654 ( -0.511 2.740 1.919) 3.384 7.247 ( 0.948 14.157 6.501) 15.607 7.315 ( -3.656 4.637 0.380) 5.917 7.469 ( -1.672 11.643 1.227) 11.826 8.033 ( 1.544 -4.662 -3.736) 6.171 8.070 ( -2.111 -8.429 -1.067) 8.754 8.351 ( 4.749 5.750 2.127) 7.755 8.732 ( 2.119 15.152 -6.000) 16.434 9.227 ( -4.081 8.261 -10.935) 14.300 9.340 ( -4.170 -1.461 -3.394) 5.572 9.723 ( -4.143 -24.055 -2.841) 24.574 10.442 ( 5.440 -17.654 7.866) 20.078 10.638 ( 4.050 7.398 6.744) 10.799 11.114 ( -15.991 2.307 2.839) 16.404 12.056 ( 2.285 -13.143 -3.494) 13.790 12.174 ( -0.076 17.329 -0.396) 17.334 12.488 ( 3.172 5.050 -2.194) 6.354 12.766 ( 1.491 -1.433 -3.948) 4.457 12.973 ( -12.110 -8.937 9.344) 17.715 13.337 ( 4.781 2.742 -4.410) 7.058 13.672 ( -2.625 -3.470 6.288) 7.647 13.732 ( -3.374 -0.441 1.649) 3.781 14.099 ( 9.784 3.925 -2.895) 10.933 14.121 ( 5.662 6.689 0.621) 8.786 14.470 ( 11.548 -0.358 -0.967) 11.594 14.944 ( 13.305 -2.521 -10.972) 17.429 15.190 ( -1.321 3.414 2.870) 4.652 15.208 ( -6.839 7.477 9.197) 13.685 15.433 ( -3.887 -1.342 2.716) 4.928 15.775 ( 4.003 -3.353 -2.479) 5.780 16.647 ( 0.316 -15.813 -0.188) 15.817 16.715 ( -7.590 3.475 -0.553) 8.366 17.008 ( -9.245 2.162 -1.010) 9.548 ======================= Grid point 302 (152/208) ======================= q-point: (-0.12 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( 2.103 9.445 7.135) 12.023 2.819 ( 5.596 4.921 6.447) 9.854 3.074 ( 1.510 12.949 -1.266) 13.098 3.743 ( -5.190 0.993 -5.294) 7.480 4.102 ( 3.930 22.274 -1.811) 22.690 4.256 ( 3.353 5.656 0.964) 6.646 4.448 ( -5.849 4.137 0.762) 7.205 4.571 ( 0.359 6.751 -4.827) 8.307 4.827 ( 4.393 15.208 5.889) 16.890 4.891 ( -1.733 6.315 -1.057) 6.633 5.148 ( 1.557 6.583 -2.203) 7.114 5.197 ( -0.288 6.181 1.297) 6.322 5.702 ( -0.224 -6.285 -3.830) 7.363 6.184 ( 1.370 1.328 2.159) 2.881 6.399 ( -6.196 -2.407 -0.535) 6.668 6.734 ( 6.031 -3.837 4.542) 8.469 7.233 ( -3.465 16.889 3.967) 17.691 7.238 ( -3.834 3.394 0.168) 5.124 7.481 ( 2.371 8.030 7.272) 11.090 8.000 ( -4.605 -2.572 -2.157) 5.699 8.060 ( 2.058 -6.117 -3.893) 7.538 8.482 ( 8.410 -1.068 4.003) 9.375 8.716 ( -3.431 3.992 -13.185) 14.196 9.103 ( -4.874 17.882 -13.291) 22.807 9.227 ( -6.786 -4.209 -6.617) 10.371 9.652 ( -2.701 -28.548 -3.068) 28.839 10.559 ( 2.434 -15.908 9.078) 18.477 10.687 ( -1.981 5.548 10.131) 11.720 10.897 ( -3.032 0.156 0.671) 3.109 12.105 ( 3.018 -12.642 -2.368) 13.211 12.168 ( -0.432 17.958 -0.630) 17.974 12.606 ( 9.293 1.846 -1.346) 9.570 12.767 ( -3.663 -2.595 -0.261) 4.496 12.807 ( -3.654 -4.155 1.615) 5.764 13.334 ( -3.687 -0.314 -6.631) 7.594 13.620 ( -2.474 -0.262 3.617) 4.390 13.740 ( 2.883 -2.973 7.510) 8.576 14.187 ( 3.228 1.550 0.395) 3.603 14.252 ( 4.119 9.328 1.758) 10.347 14.630 ( 0.879 1.864 -5.471) 5.846 15.056 ( 0.595 11.651 4.757) 12.598 15.151 ( 1.324 4.198 2.842) 5.239 15.247 ( 7.734 -1.311 3.286) 8.505 15.422 ( 1.819 0.135 0.926) 2.046 15.838 ( 2.718 -1.152 -7.174) 7.758 16.563 ( -6.094 2.467 -0.891) 6.634 16.665 ( -0.108 -16.185 -0.199) 16.187 16.812 ( -10.072 -2.370 -0.610) 10.365 ======================= Grid point 303 (153/208) ======================= q-point: ( 0.00 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.548 ( 1.132 9.042 6.872) 11.413 2.929 ( 1.109 -3.471 3.237) 4.874 3.269 ( -0.057 5.766 -3.132) 6.562 3.654 ( -4.246 2.435 -0.298) 4.904 4.395 ( 2.224 2.708 4.630) 5.807 4.405 ( -0.101 2.072 -3.127) 3.753 4.489 ( 1.130 2.638 -1.059) 3.059 4.768 ( -1.653 18.990 -8.478) 20.862 5.039 ( 0.158 5.622 0.469) 5.643 5.068 ( 1.077 7.095 -0.699) 7.211 5.253 ( -1.254 1.406 -0.251) 1.901 5.336 ( 4.729 1.938 5.866) 7.780 5.601 ( 3.009 -5.726 -6.660) 9.284 6.249 ( 3.466 1.862 5.917) 7.106 6.313 ( -4.355 1.021 5.647) 7.204 6.693 ( 2.025 -7.574 2.050) 8.103 7.263 ( 0.857 3.223 1.033) 3.492 7.593 ( -1.330 16.534 8.836) 18.794 7.712 ( 1.572 10.900 4.031) 11.727 7.887 ( -0.277 1.219 -3.469) 3.687 7.984 ( -0.179 -2.328 -8.673) 8.981 8.463 ( 4.829 -6.770 -2.909) 8.811 8.600 ( -10.665 -0.473 -15.651) 18.945 8.867 ( -5.272 -8.945 -3.105) 10.837 9.045 ( -2.190 -24.332 -4.987) 24.934 9.599 ( -0.216 24.422 -5.230) 24.977 10.340 ( 5.314 -13.810 8.150) 16.894 10.544 ( -8.128 -3.250 6.356) 10.818 11.049 ( 6.068 3.208 8.351) 10.809 11.937 ( 1.218 -7.925 -0.784) 8.056 12.446 ( -0.239 7.415 0.844) 7.467 12.567 ( -2.575 -1.369 2.287) 3.707 12.824 ( 3.154 2.057 -7.226) 8.148 12.838 ( 7.044 1.327 -2.825) 7.705 13.208 ( -4.564 -0.978 -6.714) 8.177 13.603 ( -0.441 0.112 2.571) 2.611 13.768 ( 4.085 -2.487 5.517) 7.301 14.263 ( 2.826 0.393 -0.813) 2.967 14.414 ( -1.214 4.755 2.548) 5.530 14.572 ( -11.532 3.956 8.645) 14.945 15.214 ( 1.143 0.531 0.865) 1.529 15.258 ( -0.033 3.274 0.255) 3.284 15.296 ( 1.106 1.848 3.817) 4.383 15.699 ( 9.377 6.118 -1.075) 11.248 15.815 ( -4.718 0.927 -7.182) 8.643 16.363 ( 0.246 -12.408 -0.207) 12.412 16.489 ( -0.479 -1.854 -1.328) 2.330 16.614 ( -1.518 -2.472 -1.266) 3.165 ======================= Grid point 304 (154/208) ======================= q-point: ( 0.12 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( -2.461 7.964 5.225) 9.838 2.887 ( -6.215 -6.811 1.964) 9.427 3.253 ( -0.861 5.922 -3.475) 6.920 3.623 ( 0.768 4.752 4.297) 6.452 4.379 ( -6.385 7.707 -0.124) 10.009 4.415 ( 1.675 6.842 -0.907) 7.102 4.465 ( -0.406 -2.080 -5.016) 5.446 4.760 ( 1.684 11.020 -2.087) 11.342 5.005 ( -3.113 3.006 2.052) 4.789 5.081 ( 0.069 4.575 -1.355) 4.772 5.228 ( -0.782 3.754 -1.043) 3.974 5.436 ( 3.010 1.487 -2.075) 3.947 5.643 ( 2.359 2.382 -5.827) 6.723 6.281 ( -0.145 -9.209 3.418) 9.824 6.309 ( 2.405 9.496 6.509) 11.761 6.726 ( 1.446 -7.356 0.605) 7.521 7.341 ( 6.726 3.574 -0.101) 7.618 7.594 ( -0.349 13.360 8.289) 15.727 7.736 ( 0.120 8.118 3.612) 8.885 7.894 ( 1.985 10.726 -3.465) 11.445 7.965 ( 0.166 -3.961 -6.241) 7.394 8.398 ( -8.504 -6.981 -12.797) 16.877 8.550 ( 4.065 -3.215 -1.946) 5.536 8.804 ( 0.539 -4.745 4.275) 6.409 9.045 ( 1.670 -28.746 -1.780) 28.850 9.554 ( -3.331 27.194 -4.343) 27.739 10.420 ( -0.822 -18.369 -0.174) 18.388 10.561 ( 11.193 2.789 14.104) 18.220 11.146 ( 2.782 3.060 2.307) 4.735 11.928 ( -1.818 -8.079 -1.995) 8.518 12.448 ( 0.256 7.794 1.167) 7.885 12.534 ( -1.306 -0.752 1.520) 2.140 12.809 ( -2.270 1.888 -0.795) 3.058 13.024 ( 12.065 -1.268 -12.621) 17.506 13.149 ( -0.448 0.172 -2.624) 2.668 13.609 ( 0.532 -0.030 2.632) 2.686 13.834 ( 1.934 -2.937 1.466) 3.810 14.272 ( -2.412 0.703 -2.078) 3.260 14.324 ( -13.211 5.023 9.862) 17.235 14.431 ( 1.167 3.706 2.726) 4.746 15.129 ( -15.321 -1.446 0.948) 15.419 15.251 ( -0.386 3.160 0.619) 3.243 15.322 ( 1.171 5.385 4.480) 7.103 15.518 ( -12.558 3.116 -0.762) 12.961 15.893 ( 6.169 -1.374 -7.557) 9.852 16.358 ( -0.942 -13.415 -0.095) 13.448 16.595 ( 8.779 2.463 -0.926) 9.165 16.719 ( 11.721 -2.445 -0.073) 11.973 ======================= Grid point 305 (155/208) ======================= q-point: ( 0.25 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( -3.536 5.102 3.290) 7.025 2.726 ( -10.151 -6.604 0.808) 12.137 3.229 ( -1.077 5.949 -3.127) 6.807 3.678 ( 3.253 4.690 8.550) 10.280 4.220 ( -8.011 9.185 -4.431) 12.969 4.424 ( -1.600 5.638 -2.354) 6.315 4.496 ( 4.615 -1.788 -2.784) 5.678 4.788 ( 0.987 3.575 -1.279) 3.923 4.943 ( -3.653 -2.994 2.190) 5.206 5.077 ( -0.295 6.449 -0.281) 6.462 5.208 ( -1.119 6.168 -3.134) 7.008 5.409 ( -4.629 2.533 -7.082) 8.831 5.666 ( 0.963 6.063 -3.347) 6.992 6.261 ( -2.345 -7.130 -1.987) 7.764 6.417 ( 7.635 5.145 6.091) 11.039 6.760 ( 2.268 -4.715 -0.551) 5.261 7.484 ( 7.320 5.851 -1.446) 9.482 7.593 ( -0.381 8.847 4.474) 9.922 7.723 ( -2.171 10.294 1.686) 10.655 7.965 ( 5.889 10.699 1.958) 12.369 7.974 ( 1.122 -0.822 -5.094) 5.280 8.231 ( -7.298 -10.594 -8.613) 15.481 8.628 ( 5.163 0.266 5.135) 7.287 8.898 ( 6.458 -4.857 7.823) 11.247 9.095 ( 4.181 -26.865 1.694) 27.241 9.483 ( -3.192 27.676 -2.163) 27.943 10.380 ( -2.696 -18.563 -2.977) 18.992 10.893 ( 18.454 8.026 14.316) 24.696 11.154 ( -0.659 1.716 -3.171) 3.665 11.877 ( -2.670 -8.703 -3.230) 9.660 12.454 ( 0.066 9.684 0.911) 9.727 12.522 ( -0.130 -0.882 0.874) 1.249 12.760 ( -2.258 1.062 -1.460) 2.891 13.165 ( 2.489 1.303 0.699) 2.895 13.239 ( 11.314 -4.954 -11.195) 16.669 13.630 ( 1.128 -0.356 3.287) 3.493 13.852 ( 0.453 -2.901 -1.548) 3.319 14.099 ( -10.339 5.632 5.776) 13.114 14.199 ( -4.319 0.808 -5.561) 7.088 14.463 ( -0.051 2.656 0.752) 2.761 14.637 ( -31.780 -1.040 2.359) 31.884 15.250 ( 0.070 3.008 0.976) 3.163 15.352 ( 1.139 5.213 5.336) 7.546 15.416 ( -1.025 -1.188 -1.347) 2.068 15.946 ( 0.585 -1.775 -3.124) 3.640 16.346 ( -0.078 -12.817 0.366) 12.822 16.761 ( 8.507 1.514 -0.060) 8.641 16.966 ( 12.824 1.253 -0.657) 12.902 ======================= Grid point 306 (156/208) ======================= q-point: ( 0.38 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( -1.240 1.349 1.722) 2.514 2.540 ( -9.072 -4.181 1.358) 10.080 3.205 ( -0.817 6.124 -2.914) 6.831 3.749 ( 2.253 4.016 10.292) 11.275 4.105 ( -2.779 8.645 -5.651) 10.695 4.365 ( -3.609 3.215 -5.672) 7.452 4.589 ( 4.127 -4.132 0.977) 5.921 4.791 ( 0.414 -1.533 -1.539) 2.211 4.890 ( -2.202 -2.479 0.768) 3.403 5.062 ( -1.523 7.349 -0.113) 7.506 5.175 ( -1.461 6.044 -4.463) 7.654 5.290 ( -5.023 5.372 -8.055) 10.907 5.672 ( -0.033 5.330 -0.566) 5.361 6.190 ( -4.259 -6.675 -5.524) 9.655 6.575 ( 6.908 2.867 3.790) 8.385 6.808 ( 2.787 -1.607 0.939) 3.351 7.531 ( -1.156 10.364 2.440) 10.710 7.634 ( -0.557 10.103 -5.277) 11.412 7.695 ( 3.013 11.060 1.813) 11.606 7.956 ( -2.170 -2.494 -6.180) 7.009 8.077 ( 2.005 -0.862 -5.989) 6.374 8.138 ( 1.389 0.424 6.394) 6.557 8.772 ( 8.039 -2.740 11.041) 13.930 9.007 ( 4.325 -12.716 2.940) 13.749 9.239 ( 9.347 -11.766 12.607) 19.615 9.433 ( -1.606 25.662 -0.603) 25.719 10.304 ( -4.690 -17.786 -6.477) 19.501 10.967 ( -7.858 3.682 -9.178) 12.631 11.394 ( 20.530 11.143 16.247) 28.454 11.830 ( -1.575 -9.149 -3.492) 9.918 12.454 ( -0.173 10.233 0.418) 10.243 12.543 ( 2.615 -0.380 0.699) 2.733 12.727 ( -0.904 -0.146 -1.894) 2.104 13.206 ( 0.908 4.738 4.035) 6.289 13.364 ( 0.242 -11.360 -4.494) 12.219 13.659 ( 1.089 -1.187 3.758) 4.089 13.859 ( 0.649 -2.255 -0.627) 2.429 13.966 ( -12.426 0.618 -9.850) 15.868 14.062 ( -10.486 3.728 2.253) 11.355 14.120 ( -6.140 0.645 -4.981) 7.933 14.460 ( -1.481 -0.023 -3.250) 3.572 15.253 ( 0.056 3.746 0.906) 3.854 15.370 ( -0.322 2.195 3.348) 4.016 15.431 ( 2.467 -2.180 0.984) 3.437 15.911 ( -4.136 -0.256 3.198) 5.235 16.355 ( 0.710 -11.754 0.803) 11.803 16.896 ( 5.345 0.796 0.586) 5.436 17.164 ( 7.980 3.098 -1.875) 8.763 ======================= Grid point 307 (157/208) ======================= q-point: (-0.50 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.405 ( -4.846 -0.316 1.866) 5.203 2.465 ( 3.106 -2.025 1.558) 4.023 3.193 ( 0.130 6.384 -2.593) 6.892 3.792 ( 0.772 3.544 9.365) 10.043 4.099 ( 2.702 7.593 -6.639) 10.442 4.287 ( -3.151 2.562 -5.551) 6.878 4.615 ( -1.322 -7.812 3.355) 8.604 4.824 ( -0.093 0.423 -0.086) 0.442 4.847 ( -0.088 -1.675 -0.685) 1.812 5.034 ( -0.550 6.076 -1.148) 6.208 5.158 ( 0.995 5.788 -4.508) 7.403 5.229 ( -0.107 5.697 -7.335) 9.288 5.659 ( -1.538 4.392 1.102) 4.782 6.101 ( -3.759 -6.737 -5.454) 9.448 6.651 ( 0.666 0.109 2.089) 2.195 6.851 ( 0.391 2.307 3.054) 3.847 7.503 ( -2.070 7.438 2.660) 8.166 7.578 ( -1.734 18.222 -4.395) 18.825 7.759 ( 1.104 9.166 -1.626) 9.374 7.917 ( 0.028 -4.513 -5.355) 7.003 8.041 ( -2.439 -2.659 -3.026) 4.709 8.238 ( 4.855 3.783 3.918) 7.296 8.903 ( 3.230 -16.970 4.630) 17.885 9.127 ( 7.668 1.377 7.354) 10.714 9.364 ( 0.358 12.105 8.866) 15.009 9.490 ( 7.560 1.583 7.731) 10.928 10.186 ( -6.250 -16.214 -9.030) 19.583 10.778 ( -8.681 2.343 -10.586) 13.889 11.705 ( 6.634 15.025 15.180) 22.365 11.808 ( -0.716 -5.795 -1.222) 5.966 12.452 ( -0.070 10.043 0.329) 10.049 12.620 ( 4.135 0.169 -0.194) 4.143 12.721 ( 0.574 -0.928 -2.940) 3.136 13.105 ( -17.534 -11.460 1.896) 21.032 13.255 ( -0.857 1.693 4.353) 4.749 13.651 ( -1.388 -0.389 2.475) 2.865 13.768 ( 0.920 -5.161 1.781) 5.537 13.871 ( -0.544 -1.839 2.302) 2.997 14.038 ( -1.059 0.858 -9.672) 9.768 14.178 ( 11.703 7.106 -12.283) 18.394 14.447 ( 2.952 -2.995 -7.900) 8.950 15.255 ( 0.071 4.217 0.777) 4.289 15.360 ( -0.918 1.206 1.904) 2.434 15.490 ( 3.191 -4.650 1.044) 5.736 15.809 ( -7.624 2.039 9.679) 12.489 16.367 ( 0.183 -11.007 0.897) 11.045 16.952 ( 0.344 0.983 0.574) 1.189 17.250 ( 1.429 3.276 -2.700) 4.479 ======================= Grid point 308 (158/208) ======================= q-point: (-0.38 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.363 ( -0.178 3.544 3.806) 5.204 2.568 ( 7.177 -2.814 0.941) 7.766 3.203 ( 1.333 6.413 -2.250) 6.926 3.816 ( 0.310 2.407 7.495) 7.878 4.159 ( 4.352 6.040 -7.988) 10.919 4.252 ( 0.811 2.440 -2.544) 3.617 4.577 ( -3.078 -1.326 2.324) 4.079 4.765 ( -2.817 -0.095 -0.309) 2.835 4.890 ( 2.180 -0.726 1.588) 2.793 5.040 ( 0.951 4.740 -1.387) 5.029 5.179 ( 0.660 7.042 -1.571) 7.246 5.274 ( 6.346 2.758 -8.446) 10.918 5.611 ( -3.772 3.108 1.221) 5.038 6.051 ( -0.576 -7.445 -1.520) 7.620 6.626 ( -3.070 0.983 1.334) 3.489 6.803 ( -5.769 2.635 2.955) 6.997 7.463 ( -2.848 5.261 3.074) 6.726 7.571 ( 0.908 20.206 -0.941) 20.248 7.745 ( -1.416 8.266 -2.515) 8.755 7.919 ( 0.437 -3.550 -3.415) 4.945 7.994 ( -2.057 -2.113 -1.989) 3.557 8.317 ( 3.317 1.839 0.046) 3.793 8.931 ( 0.228 -23.701 0.008) 23.703 9.197 ( -2.475 20.765 -1.422) 20.960 9.439 ( 6.013 2.292 10.064) 11.945 9.577 ( -1.000 -2.807 0.137) 2.983 10.073 ( -3.042 -15.398 -3.988) 16.194 10.669 ( -0.718 2.230 -1.408) 2.733 11.629 ( -17.588 16.135 12.597) 26.988 11.795 ( 1.280 -9.283 -3.170) 9.892 12.452 ( 0.056 10.040 0.459) 10.051 12.621 ( -2.955 5.153 -6.377) 8.715 12.721 ( 0.939 -0.744 -3.425) 3.628 12.871 ( -7.395 -19.292 11.922) 23.854 13.315 ( 4.763 5.061 -1.327) 7.075 13.645 ( -1.254 -1.093 3.980) 4.313 13.816 ( -4.714 -0.527 1.757) 5.058 13.920 ( 14.783 -0.472 -0.853) 14.815 14.060 ( 4.577 -0.260 -6.145) 7.667 14.323 ( 5.157 4.003 -0.433) 6.543 14.622 ( 16.655 -2.363 -17.905) 24.568 15.259 ( 0.210 4.456 0.726) 4.519 15.346 ( -0.777 1.430 1.985) 2.567 15.531 ( -0.506 -4.661 -0.277) 4.696 15.680 ( -6.103 2.000 13.348) 14.812 16.363 ( -0.584 -11.044 0.568) 11.074 16.910 ( -4.685 1.659 -0.043) 4.970 17.205 ( -5.688 2.280 -2.871) 6.767 ======================= Grid point 309 (159/208) ======================= q-point: (-0.25 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 340 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.403 ( 3.255 6.518 5.712) 9.258 2.718 ( 7.996 -1.374 1.166) 8.197 3.232 ( 1.960 6.112 -2.127) 6.762 3.815 ( -1.930 0.537 4.049) 4.518 4.229 ( 4.254 2.161 -1.253) 4.933 4.312 ( 5.367 4.160 -4.938) 8.396 4.513 ( -3.473 4.085 -0.987) 5.452 4.742 ( 0.586 4.175 0.164) 4.219 4.952 ( 4.308 0.913 2.919) 5.283 5.048 ( -0.130 4.796 -1.844) 5.140 5.178 ( -0.230 7.294 -0.956) 7.360 5.381 ( 3.849 5.741 -2.987) 7.530 5.541 ( -2.302 -4.587 -1.750) 5.422 6.076 ( 2.844 -7.067 3.342) 8.318 6.552 ( -5.193 3.753 0.526) 6.429 6.686 ( -5.525 0.220 3.445) 6.515 7.395 ( -4.968 3.592 2.975) 6.814 7.593 ( 1.049 19.353 2.423) 19.532 7.709 ( -2.068 10.818 1.005) 11.060 7.936 ( 1.590 -5.657 -2.152) 6.258 7.951 ( -1.566 -1.961 -4.079) 4.789 8.366 ( 2.189 -0.648 -2.894) 3.686 8.926 ( -0.588 -23.906 -1.683) 23.972 9.076 ( -8.627 14.672 -8.560) 19.052 9.424 ( -10.206 -5.965 -9.154) 14.951 9.554 ( 2.330 10.035 -3.021) 10.736 10.100 ( 4.962 -16.231 8.207) 18.853 10.738 ( 6.028 2.822 9.723) 11.783 11.218 ( -24.454 7.052 6.898) 26.369 11.832 ( 2.937 -8.560 -1.860) 9.239 12.454 ( -0.013 9.799 0.571) 9.816 12.589 ( 1.062 4.072 -5.472) 6.904 12.751 ( 1.874 -1.811 -0.927) 2.766 12.771 ( -4.826 -7.668 5.274) 10.484 13.367 ( 0.570 0.571 -4.544) 4.615 13.616 ( -1.784 -2.027 5.865) 6.456 13.726 ( -4.226 -0.232 1.682) 4.555 14.117 ( 5.180 0.699 -3.280) 6.171 14.282 ( 14.315 6.493 -0.646) 15.732 14.450 ( 10.848 -1.603 1.359) 11.049 14.924 ( 16.838 -0.014 -12.392) 20.906 15.264 ( 0.153 4.533 0.512) 4.565 15.325 ( -3.698 3.487 6.496) 8.249 15.442 ( -5.033 1.322 5.395) 7.495 15.690 ( 4.019 -4.130 1.448) 5.942 16.354 ( -0.311 -11.831 0.123) 11.836 16.786 ( -8.092 2.473 -0.931) 8.513 17.031 ( -12.142 0.267 -2.457) 12.391 ======================= Grid point 310 (160/208) ======================= q-point: (-0.12 0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 3.825 8.344 7.051) 11.574 2.854 ( 5.848 -0.729 2.268) 6.315 3.261 ( 1.304 5.847 -2.386) 6.448 3.751 ( -4.973 0.099 -0.112) 4.975 4.319 ( 4.617 1.518 4.557) 6.663 4.398 ( 3.390 -1.627 -4.170) 5.615 4.462 ( -0.762 8.697 -2.199) 9.003 4.779 ( 2.595 13.458 -5.754) 14.864 5.025 ( -0.096 6.363 1.304) 6.496 5.045 ( 2.533 6.119 -0.040) 6.623 5.194 ( 3.061 2.209 0.980) 3.900 5.362 ( -4.417 7.087 4.843) 9.654 5.555 ( 3.075 -10.796 -6.830) 13.140 6.157 ( 4.603 -3.325 6.063) 8.307 6.426 ( -7.634 4.763 2.843) 9.436 6.653 ( 0.994 -3.999 2.670) 4.909 7.302 ( -4.552 2.899 1.910) 5.725 7.607 ( -0.750 18.275 6.190) 19.309 7.686 ( -0.206 11.299 3.883) 11.949 7.908 ( -1.463 -2.629 -2.341) 3.812 7.978 ( 2.257 -3.437 -6.990) 8.110 8.400 ( 2.490 -4.087 -3.860) 6.148 8.835 ( -10.437 -0.475 -14.770) 18.091 8.935 ( -2.301 -13.302 -1.588) 13.593 9.190 ( -10.801 -12.737 -12.429) 20.817 9.586 ( 1.910 18.684 -4.772) 19.378 10.228 ( 5.766 -16.213 9.924) 19.864 10.779 ( -15.450 3.573 8.324) 17.909 10.917 ( 3.791 1.006 9.321) 10.113 11.892 ( 3.311 -8.106 -0.847) 8.797 12.452 ( -0.341 8.752 0.595) 8.779 12.608 ( -0.595 -1.772 -0.114) 1.873 12.721 ( 2.003 1.304 -2.500) 3.459 12.798 ( 2.491 0.664 -2.570) 3.640 13.314 ( -4.644 -1.279 -6.770) 8.308 13.612 ( -0.592 -0.533 4.973) 5.036 13.695 ( 1.333 -1.438 4.838) 5.220 14.199 ( 4.052 0.411 -1.631) 4.387 14.408 ( 2.022 5.494 2.969) 6.565 14.660 ( 4.470 0.965 -0.560) 4.607 15.168 ( 7.158 0.403 -1.007) 7.240 15.241 ( -1.660 4.437 8.911) 10.092 15.268 ( 0.294 3.525 0.915) 3.653 15.481 ( 8.611 4.107 -0.716) 9.568 15.791 ( 6.147 -2.761 -5.005) 8.394 16.357 ( 0.575 -12.670 -0.092) 12.683 16.618 ( -9.288 2.986 -1.611) 9.888 16.770 ( -13.439 -2.921 -1.743) 13.862 ======================= Grid point 311 (161/208) ======================= q-point: ( 0.00 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( 1.695 -0.000 7.518) 7.707 2.865 ( -1.664 0.000 0.877) 1.881 3.324 ( 0.074 0.000 -2.886) 2.887 3.681 ( -2.728 0.000 1.427) 3.078 4.410 ( 3.022 0.000 -5.409) 6.196 4.424 ( 3.008 0.000 6.522) 7.182 4.505 ( -1.366 0.000 -2.340) 2.709 5.048 ( -2.609 -0.000 -0.095) 2.611 5.080 ( -7.906 -0.000 -2.625) 8.331 5.197 ( 3.350 0.000 -0.433) 3.378 5.251 ( 0.486 0.000 -6.710) 6.728 5.300 ( 5.496 0.000 3.024) 6.273 5.490 ( 7.985 -0.000 -2.593) 8.395 6.258 ( -0.957 0.000 6.924) 6.990 6.363 ( 0.922 0.000 8.177) 8.229 6.597 ( -0.724 -0.000 -0.041) 0.725 7.297 ( 0.842 0.000 2.088) 2.251 7.738 ( -3.031 0.000 10.697) 11.118 7.802 ( -1.441 0.000 -3.792) 4.056 7.888 ( 1.484 0.000 -3.053) 3.395 8.169 ( 9.606 0.000 -1.015) 9.660 8.377 ( 0.704 -0.000 -5.225) 5.273 8.504 ( -7.735 0.000 -12.882) 15.026 8.699 ( -6.251 0.000 -5.548) 8.358 8.839 ( -8.383 0.000 -9.560) 12.715 10.015 ( 2.009 -0.000 3.184) 3.765 10.022 ( 5.450 0.000 -1.047) 5.550 10.521 ( -8.811 0.000 8.206) 12.041 11.079 ( 5.997 0.000 11.621) 13.077 11.855 ( 1.175 0.000 -0.167) 1.187 12.464 ( -1.139 0.000 1.407) 1.810 12.607 ( -1.113 0.000 1.467) 1.841 12.845 ( 0.883 0.000 0.952) 1.299 12.858 ( 8.423 0.000 -12.976) 15.470 13.195 ( -4.064 0.000 -6.450) 7.623 13.604 ( -0.442 0.000 2.776) 2.811 13.743 ( 3.809 0.000 4.733) 6.075 14.266 ( 2.669 0.000 -2.550) 3.691 14.462 ( -0.907 0.000 2.812) 2.954 14.615 ( -11.132 0.000 12.031) 16.391 15.204 ( -0.017 0.000 -0.124) 0.125 15.297 ( -0.792 0.000 -0.491) 0.932 15.331 ( 2.942 0.000 4.473) 5.354 15.743 ( 10.184 0.000 -5.389) 11.522 15.849 ( -5.313 0.000 -2.283) 5.783 16.223 ( -0.158 0.000 -0.347) 0.381 16.475 ( -1.129 0.000 -1.847) 2.165 16.581 ( -0.900 0.000 -1.511) 1.759 ======================= Grid point 313 (162/208) ======================= q-point: ( 0.12 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.660 ( -3.270 -0.000 5.264) 6.197 2.779 ( -7.294 0.000 2.201) 7.619 3.311 ( -0.839 0.000 -3.101) 3.212 3.671 ( 1.172 0.000 4.362) 4.517 4.416 ( -1.979 0.000 -9.516) 9.719 4.441 ( -2.220 0.000 2.241) 3.154 4.521 ( 3.718 0.000 -0.039) 3.719 4.916 ( -8.578 -0.000 2.544) 8.947 4.961 ( -4.658 0.000 -0.339) 4.670 5.191 ( -0.856 0.000 1.443) 1.678 5.338 ( 4.858 -0.000 -7.910) 9.283 5.347 ( 0.324 0.000 -1.409) 1.446 5.674 ( 9.258 0.000 -6.601) 11.370 6.153 ( -5.474 0.000 7.757) 9.494 6.503 ( 7.344 0.000 4.738) 8.740 6.580 ( -0.683 -0.000 0.960) 1.178 7.374 ( 6.693 0.000 1.012) 6.769 7.711 ( -1.988 0.000 11.905) 12.070 7.767 ( -1.113 0.000 -2.775) 2.990 7.930 ( 3.395 0.000 -4.342) 5.512 8.272 ( -7.283 -0.000 -16.166) 17.731 8.370 ( 5.839 0.000 1.133) 5.948 8.385 ( 0.965 -0.000 -5.067) 5.158 8.648 ( -0.434 0.000 -0.736) 0.854 8.761 ( 1.351 0.000 3.374) 3.635 10.025 ( -1.011 -0.000 0.511) 1.133 10.036 ( -2.841 0.000 -5.408) 6.109 10.595 ( 13.927 0.000 14.524) 20.122 11.171 ( 1.914 0.000 4.807) 5.174 11.843 ( -2.193 0.000 -1.443) 2.625 12.464 ( 0.755 0.000 2.307) 2.428 12.587 ( -1.102 0.000 0.556) 1.235 12.829 ( -2.568 0.000 0.614) 2.640 13.016 ( 10.558 0.000 -16.020) 19.187 13.149 ( 0.159 0.000 -2.714) 2.718 13.608 ( 0.376 0.000 2.796) 2.821 13.804 ( 1.896 0.000 0.929) 2.111 14.272 ( -1.667 0.000 -5.170) 5.432 14.382 ( -14.343 0.000 13.152) 19.460 14.469 ( 1.303 0.000 3.581) 3.811 15.111 ( -14.029 0.000 0.359) 14.034 15.281 ( -0.767 0.000 0.384) 0.858 15.386 ( 1.818 0.000 4.329) 4.695 15.561 ( -15.767 0.000 -0.914) 15.793 15.876 ( 5.257 0.000 -6.538) 8.389 16.209 ( -0.932 0.000 0.012) 0.932 16.634 ( 6.086 0.000 -0.646) 6.120 16.678 ( 16.738 -0.000 -1.101) 16.774 ======================= Grid point 315 (163/208) ======================= q-point: ( 0.25 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.575 ( -5.806 -0.000 2.526) 6.331 2.623 ( -9.042 0.000 3.480) 9.688 3.287 ( -1.023 0.000 -3.024) 3.193 3.725 ( 2.938 0.000 7.966) 8.490 4.336 ( -3.783 -0.000 -11.366) 11.979 4.367 ( -4.786 0.000 -0.704) 4.838 4.615 ( 5.889 0.000 -0.261) 5.895 4.761 ( -8.641 0.000 1.456) 8.763 4.901 ( -1.846 0.000 -0.474) 1.905 5.180 ( -1.022 0.000 2.444) 2.649 5.327 ( -1.892 -0.000 -2.984) 3.533 5.360 ( -0.786 0.000 -8.285) 8.322 5.751 ( 0.326 0.000 -3.925) 3.938 6.125 ( 0.631 0.000 -0.859) 1.065 6.589 ( 1.356 0.000 2.138) 2.531 6.633 ( 6.568 -0.000 2.330) 6.969 7.532 ( 9.356 0.000 0.633) 9.378 7.696 ( -1.553 0.000 11.382) 11.488 7.768 ( 1.429 0.000 1.142) 1.829 7.993 ( 3.859 0.000 -5.528) 6.741 8.076 ( -8.977 -0.000 -16.688) 18.949 8.391 ( 0.420 0.000 -4.705) 4.723 8.481 ( 3.606 0.000 3.823) 5.255 8.688 ( 4.775 0.000 7.295) 8.718 8.897 ( 10.919 0.000 10.899) 15.427 9.968 ( -2.672 -0.000 -5.294) 5.930 9.987 ( -2.884 0.000 -1.068) 3.075 11.002 ( 24.904 -0.000 17.434) 30.399 11.151 ( -4.399 0.000 -3.684) 5.738 11.782 ( -3.358 0.000 -2.794) 4.368 12.492 ( 1.477 0.000 3.199) 3.524 12.569 ( -0.790 0.000 0.141) 0.803 12.772 ( -2.902 0.000 -0.914) 3.043 13.182 ( 2.936 -0.000 2.088) 3.603 13.184 ( 9.203 0.000 -16.446) 18.845 13.626 ( 0.829 0.000 3.388) 3.488 13.823 ( 0.584 0.000 -1.911) 1.998 14.160 ( -10.013 0.000 6.628) 12.008 14.205 ( -3.844 0.000 -6.658) 7.688 14.492 ( -0.100 0.000 0.844) 0.850 14.627 ( -33.258 0.000 1.984) 33.317 15.276 ( 0.271 0.000 1.810) 1.830 15.396 ( -1.184 0.000 0.680) 1.366 15.429 ( -0.997 0.000 1.554) 1.846 15.928 ( 1.123 0.000 -1.510) 1.882 16.204 ( 0.445 0.000 0.925) 1.027 16.772 ( 7.739 0.000 0.139) 7.741 16.980 ( 14.504 0.000 -1.620) 14.594 ======================= Grid point 317 (164/208) ======================= q-point: ( 0.38 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( -4.824 0.000 1.312) 4.999 2.480 ( -5.985 -0.000 3.881) 7.133 3.266 ( -0.640 0.000 -2.932) 3.001 3.789 ( 2.042 0.000 9.798) 10.008 4.263 ( -1.521 -0.000 -12.047) 12.143 4.292 ( -2.508 0.000 -2.155) 3.307 4.598 ( -8.194 0.000 0.182) 8.196 4.731 ( 6.257 -0.000 -0.177) 6.260 4.874 ( -1.396 0.000 -0.694) 1.559 5.148 ( -2.973 0.000 2.009) 3.589 5.274 ( -2.770 -0.000 -3.473) 4.442 5.313 ( -1.791 0.000 -7.936) 8.136 5.730 ( -1.311 0.000 0.363) 1.361 6.106 ( -2.211 0.000 -9.180) 9.443 6.623 ( 1.418 0.000 2.969) 3.290 6.773 ( 7.387 -0.000 2.904) 7.938 7.646 ( -1.201 0.000 11.714) 11.775 7.747 ( 8.258 0.000 -1.602) 8.412 7.810 ( 2.133 0.000 2.169) 3.042 7.889 ( -7.719 0.000 -15.016) 16.884 8.041 ( 1.768 -0.000 -5.420) 5.702 8.385 ( -0.212 0.000 -4.265) 4.270 8.530 ( 1.503 0.000 2.853) 3.225 8.856 ( 10.801 0.000 16.043) 19.340 9.156 ( 13.041 0.000 15.891) 20.557 9.909 ( -5.126 -0.000 -4.558) 6.860 9.921 ( -1.630 0.000 -4.628) 4.906 11.003 ( -9.524 0.000 -10.076) 13.865 11.537 ( 27.146 0.000 20.992) 34.316 11.723 ( -2.227 0.000 -3.328) 4.004 12.524 ( 1.354 0.000 3.506) 3.759 12.558 ( -0.365 0.000 0.079) 0.373 12.727 ( -1.676 0.000 -1.437) 2.208 13.242 ( -3.568 -0.000 -11.085) 11.645 13.252 ( 3.685 0.000 3.848) 5.328 13.646 ( 0.609 0.000 3.911) 3.958 13.834 ( 1.086 0.000 -1.368) 1.746 13.969 ( -23.329 0.000 -6.226) 24.145 14.118 ( -3.877 -0.000 -8.069) 8.952 14.123 ( -2.407 0.000 0.860) 2.556 14.458 ( -3.033 0.000 -2.221) 3.759 15.294 ( 1.057 0.000 2.487) 2.702 15.383 ( -0.452 0.000 -0.416) 0.614 15.421 ( -0.372 0.000 1.452) 1.499 15.915 ( -2.864 0.000 5.362) 6.079 16.224 ( 1.243 0.000 1.830) 2.212 16.900 ( 5.277 0.000 0.437) 5.296 17.195 ( 8.462 0.000 -2.470) 8.815 ======================= Grid point 319 (165/208) ======================= q-point: (-0.50 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( -1.746 -0.000 1.686) 2.427 2.435 ( 0.843 0.000 3.455) 3.557 3.257 ( 0.232 0.000 -2.756) 2.766 3.828 ( 0.486 0.000 9.362) 9.375 4.245 ( 1.565 -0.000 -12.114) 12.215 4.258 ( -1.244 0.000 -5.611) 5.748 4.497 ( -1.551 0.000 4.629) 4.882 4.825 ( -0.487 0.000 0.672) 0.830 4.835 ( 0.591 0.000 -1.150) 1.293 5.099 ( -1.158 -0.000 0.504) 1.263 5.231 ( -0.823 0.000 -3.147) 3.253 5.288 ( 0.412 -0.000 -6.502) 6.515 5.706 ( -1.767 0.000 1.931) 2.618 6.030 ( -3.452 0.000 -9.635) 10.235 6.641 ( -0.244 0.000 3.373) 3.382 6.875 ( 1.687 0.000 3.385) 3.782 7.610 ( -3.869 -0.000 11.114) 11.769 7.763 ( -2.371 0.000 -13.652) 13.857 7.842 ( 0.868 0.000 1.105) 1.405 7.889 ( 5.810 0.000 -3.141) 6.604 8.030 ( -2.030 0.000 -3.888) 4.386 8.378 ( 0.357 0.000 -4.380) 4.394 8.555 ( 0.789 0.000 2.524) 2.645 9.129 ( 14.466 0.000 20.730) 25.278 9.393 ( 7.953 0.000 15.740) 17.635 9.775 ( -7.780 -0.000 -10.671) 13.205 9.886 ( -1.414 0.000 -3.425) 3.706 10.799 ( -8.933 0.000 -10.538) 13.815 11.692 ( -0.407 0.000 -3.148) 3.174 11.985 ( 11.484 0.000 25.264) 27.752 12.552 ( 0.875 0.000 3.418) 3.528 12.562 ( 1.169 -0.000 1.168) 1.653 12.704 ( -0.529 0.000 -1.378) 1.476 12.939 ( -22.058 0.000 -10.765) 24.545 13.321 ( 2.908 0.000 1.906) 3.477 13.656 ( -0.485 0.000 4.181) 4.209 13.703 ( 0.037 -0.000 -0.356) 0.358 13.851 ( -0.077 0.000 2.097) 2.099 14.047 ( -1.494 0.000 -9.731) 9.845 14.279 ( 15.743 0.000 -16.709) 22.957 14.394 ( -2.579 -0.000 -2.312) 3.464 15.317 ( 0.833 0.000 1.955) 2.125 15.369 ( -0.936 0.000 0.252) 0.969 15.430 ( 1.218 0.000 0.162) 1.229 15.838 ( -6.665 0.000 11.486) 13.280 16.245 ( 0.434 0.000 1.945) 1.992 16.958 ( 0.668 0.000 0.228) 0.706 17.283 ( 1.193 0.000 -3.081) 3.304 ======================= Grid point 321 (166/208) ======================= q-point: (-0.38 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 1.822 -0.000 3.214) 3.695 2.521 ( 7.371 0.000 2.521) 7.790 3.266 ( 1.220 0.000 -2.549) 2.826 3.840 ( -0.814 0.000 7.780) 7.823 4.225 ( -0.627 0.000 -2.801) 2.870 4.271 ( 3.090 -0.000 -12.395) 12.774 4.572 ( 7.854 0.000 5.142) 9.387 4.739 ( -5.668 -0.000 -0.466) 5.687 4.864 ( 0.774 0.000 -0.429) 0.885 5.122 ( 2.403 -0.000 1.796) 3.000 5.237 ( 1.832 0.000 -2.840) 3.379 5.304 ( 2.288 0.000 -6.383) 6.781 5.656 ( -4.335 0.000 2.642) 5.076 5.972 ( -0.853 0.000 -5.009) 5.081 6.627 ( -1.564 0.000 3.085) 3.459 6.831 ( -6.419 0.000 2.466) 6.876 7.540 ( -5.384 -0.000 8.460) 10.028 7.765 ( 4.026 0.000 -9.864) 10.654 7.850 ( 0.111 -0.000 -0.155) 0.191 7.919 ( -2.589 0.000 -0.117) 2.592 7.984 ( -1.368 0.000 -3.538) 3.794 8.382 ( 0.736 0.000 -4.962) 5.017 8.571 ( 0.534 0.000 1.767) 1.846 9.433 ( 3.202 -0.000 10.355) 10.839 9.447 ( 4.996 0.000 12.308) 13.284 9.596 ( -8.313 0.000 -13.989) 16.272 9.859 ( -0.854 0.000 -1.709) 1.910 10.689 ( -0.683 0.000 -1.130) 1.320 11.699 ( 1.616 0.000 -2.367) 2.866 11.853 ( -26.405 0.000 16.472) 31.122 12.562 ( -0.592 0.000 2.863) 2.923 12.602 ( 0.353 -0.000 4.478) 4.492 12.689 ( -0.972 0.000 -7.942) 8.001 12.707 ( 1.269 0.000 -1.316) 1.828 13.365 ( 1.695 0.000 -1.302) 2.138 13.635 ( -2.454 0.000 4.008) 4.700 13.810 ( -4.476 0.000 2.262) 5.015 13.915 ( 20.504 0.000 -0.518) 20.510 14.054 ( 3.442 0.000 -7.204) 7.984 14.377 ( 1.013 0.000 0.533) 1.145 14.593 ( 19.730 0.000 -19.269) 27.579 15.329 ( 0.146 0.000 0.962) 0.973 15.357 ( -0.162 0.000 0.393) 0.426 15.461 ( 1.603 0.000 0.278) 1.627 15.712 ( -8.332 0.000 14.888) 17.061 16.244 ( -0.834 0.000 1.189) 1.452 16.924 ( -4.191 0.000 -0.348) 4.205 17.228 ( -6.477 0.000 -3.256) 7.249 ======================= Grid point 323 (167/208) ======================= q-point: (-0.25 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 4.423 -0.000 5.335) 6.930 2.689 ( 9.061 0.000 1.329) 9.158 3.291 ( 1.687 0.000 -2.452) 2.976 3.817 ( -2.839 0.000 5.136) 5.869 4.247 ( 2.905 0.000 3.386) 4.461 4.314 ( 3.370 0.000 -11.111) 11.611 4.633 ( -5.105 0.000 -1.070) 5.216 4.777 ( 12.717 0.000 1.822) 12.847 4.896 ( 3.307 0.000 -0.439) 3.336 5.157 ( 0.751 -0.000 1.882) 2.027 5.278 ( 2.478 0.000 -2.938) 3.843 5.336 ( 1.341 -0.000 -5.856) 6.008 5.549 ( -7.260 0.000 3.799) 8.194 5.996 ( 3.793 0.000 1.415) 4.048 6.603 ( -1.060 0.000 1.927) 2.199 6.677 ( -9.585 0.000 2.823) 9.992 7.438 ( -6.384 0.000 5.114) 8.180 7.827 ( 1.193 -0.000 -2.380) 2.663 7.853 ( -4.000 0.000 5.607) 6.888 7.878 ( 5.298 0.000 -4.733) 7.105 7.939 ( -2.832 0.000 -4.110) 4.991 8.384 ( 0.279 -0.000 -5.377) 5.385 8.582 ( 0.390 0.000 0.387) 0.550 9.226 ( -13.653 0.000 -12.532) 18.533 9.364 ( -13.097 0.000 -15.396) 20.214 9.729 ( 11.720 -0.000 15.062) 19.085 9.858 ( 1.155 0.000 0.053) 1.156 10.763 ( 6.553 0.000 10.452) 12.337 11.308 ( -29.892 0.000 8.127) 30.977 11.743 ( 3.252 0.000 -1.262) 3.488 12.539 ( -2.075 0.000 1.928) 2.833 12.608 ( 0.578 0.000 1.566) 1.669 12.706 ( 1.765 0.000 -4.031) 4.400 12.746 ( 2.941 0.000 -1.420) 3.266 13.371 ( -1.121 0.000 -4.697) 4.829 13.595 ( -1.593 0.000 5.594) 5.817 13.723 ( -4.272 0.000 1.813) 4.641 14.126 ( 4.617 0.000 -4.016) 6.119 14.358 ( 23.427 0.000 -1.137) 23.455 14.421 ( 2.699 -0.000 2.940) 3.991 14.926 ( 17.788 0.000 -12.886) 21.965 15.325 ( -0.561 0.000 -0.040) 0.563 15.359 ( -1.181 0.000 3.066) 3.286 15.449 ( -2.966 0.000 6.374) 7.031 15.648 ( 1.798 0.000 5.160) 5.464 16.226 ( -0.891 0.000 0.190) 0.911 16.810 ( -7.389 0.000 -1.063) 7.465 17.031 ( -13.708 0.000 -2.975) 14.027 ======================= Grid point 325 (168/208) ======================= q-point: (-0.12 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.586 ( 4.741 -0.000 7.225) 8.642 2.831 ( 5.119 0.000 0.549) 5.148 3.316 ( 1.224 0.000 -2.551) 2.830 3.752 ( -4.416 0.000 2.011) 4.853 4.333 ( 4.794 0.000 7.002) 8.486 4.360 ( 3.203 0.000 -7.257) 7.932 4.551 ( -3.202 -0.000 -1.824) 3.685 4.992 ( 6.502 -0.000 -1.390) 6.649 5.030 ( 13.110 0.000 -2.771) 13.399 5.160 ( -0.230 -0.000 0.329) 0.401 5.281 ( -3.311 0.000 0.020) 3.311 5.313 ( -2.894 -0.000 -4.891) 5.684 5.439 ( -2.640 0.000 3.211) 4.157 6.117 ( 8.080 0.000 6.130) 10.143 6.497 ( -10.059 0.000 5.410) 11.421 6.599 ( 0.212 0.000 0.418) 0.468 7.334 ( -4.715 0.000 3.039) 5.610 7.790 ( -4.066 -0.000 9.451) 10.289 7.824 ( -0.497 0.000 -1.995) 2.056 7.889 ( -1.131 0.000 -3.688) 3.857 8.004 ( 8.216 0.000 -3.880) 9.086 8.378 ( 0.173 -0.000 -5.384) 5.386 8.580 ( -0.803 0.000 -1.846) 2.013 8.932 ( -14.316 0.000 -15.175) 20.862 9.075 ( -13.551 0.000 -16.846) 21.620 9.913 ( 4.675 -0.000 1.066) 4.795 9.925 ( 6.823 0.000 8.682) 11.042 10.820 ( -22.407 0.000 5.600) 23.096 10.925 ( 7.713 0.000 14.233) 16.189 11.808 ( 3.425 0.000 -0.255) 3.435 12.497 ( -2.389 0.000 1.311) 2.725 12.618 ( -0.234 0.000 2.393) 2.404 12.751 ( 4.751 0.000 -9.073) 10.242 12.804 ( 3.075 0.000 -0.787) 3.174 13.299 ( -4.958 0.000 -6.762) 8.385 13.605 ( 0.395 0.000 5.480) 5.494 13.682 ( 0.354 0.000 3.847) 3.863 14.204 ( 4.098 0.000 -2.437) 4.768 14.463 ( 0.815 0.000 3.071) 3.178 14.669 ( 6.819 0.000 2.065) 7.125 15.168 ( 6.743 0.000 -2.573) 7.217 15.289 ( -2.586 0.000 9.930) 10.261 15.312 ( -0.745 0.000 -0.637) 0.980 15.528 ( 10.561 0.000 -0.781) 10.590 15.760 ( 8.589 0.000 -3.528) 9.285 16.219 ( 0.228 0.000 -0.357) 0.423 16.666 ( -6.913 0.000 -1.605) 7.097 16.720 ( -17.897 0.000 -2.397) 18.057 ======================= Grid point 375 (169/208) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.594 ( -0.000 0.000 0.000) 0.000 1.430 ( -0.000 0.000 0.000) 0.000 1.813 ( -0.000 0.000 0.000) 0.000 2.022 ( -0.000 0.000 0.000) 0.000 2.748 ( -0.000 0.000 0.000) 0.000 2.799 ( -0.000 0.000 -0.000) 0.000 3.016 ( 0.000 0.000 0.000) 0.000 3.498 ( -0.000 0.000 0.000) 0.000 3.544 ( -0.000 0.000 -0.000) 0.000 4.434 ( 0.000 0.000 0.000) 0.000 5.008 ( 0.000 0.000 0.000) 0.000 5.232 ( 0.000 0.000 0.000) 0.000 5.468 ( 0.000 0.000 0.000) 0.000 5.943 ( -0.000 0.000 0.000) 0.000 6.104 ( -0.000 0.000 0.000) 0.000 6.131 ( -0.000 0.000 0.000) 0.000 6.547 ( -0.000 0.000 0.000) 0.000 7.176 ( 0.000 0.000 0.000) 0.000 7.380 ( 0.000 0.000 0.000) 0.000 7.703 ( -0.000 0.000 0.000) 0.000 7.911 ( 0.000 0.000 0.000) 0.000 8.906 ( 0.000 0.000 0.000) 0.000 9.182 ( -0.000 0.000 0.000) 0.000 9.820 ( 0.000 0.000 0.000) 0.000 9.828 ( -0.000 0.000 0.000) 0.000 10.707 ( 0.000 0.000 0.000) 0.000 10.773 ( 0.000 0.000 0.000) 0.000 10.981 ( -0.000 0.000 0.000) 0.000 11.587 ( 0.000 0.000 0.000) 0.000 11.689 ( -0.000 0.000 0.000) 0.000 12.489 ( 0.000 0.000 0.000) 0.000 12.839 ( 0.000 0.000 0.000) 0.000 12.842 ( -0.000 0.000 0.000) 0.000 13.084 ( -0.000 0.000 0.000) 0.000 13.280 ( 0.000 0.000 0.000) 0.000 13.385 ( 0.000 0.000 0.000) 0.000 13.598 ( -0.000 0.000 0.000) 0.000 13.603 ( 0.000 0.000 0.000) 0.000 13.777 ( 0.000 0.000 0.000) 0.000 14.066 ( 0.000 0.000 0.000) 0.000 14.213 ( 0.000 0.000 0.000) 0.000 14.446 ( 0.000 0.000 0.000) 0.000 14.664 ( 0.000 0.000 0.000) 0.000 14.951 ( -0.000 0.000 0.000) 0.000 16.378 ( 0.000 0.000 0.000) 0.000 16.778 ( -0.000 0.000 0.000) 0.000 16.986 ( -0.000 0.000 0.000) 0.000 18.214 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 377 (170/208) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.593 ( 0.217 0.000 0.759) 0.789 1.630 ( 19.766 0.000 -2.578) 19.933 1.915 ( 9.818 0.000 0.751) 9.847 2.229 ( 19.856 0.000 -0.678) 19.867 2.595 ( -6.678 0.000 0.074) 6.679 2.818 ( 1.792 0.000 2.275) 2.897 3.291 ( 20.263 0.000 -13.234) 24.202 3.514 ( 1.611 0.000 -0.505) 1.688 3.603 ( 6.097 0.000 -1.709) 6.332 4.394 ( -3.618 0.000 -4.166) 5.517 4.928 ( -10.930 0.000 -0.348) 10.935 5.103 ( -3.818 0.000 -5.896) 7.024 5.246 ( -19.608 0.000 0.376) 19.612 5.989 ( 4.071 0.000 1.122) 4.223 6.254 ( 12.090 0.000 -2.060) 12.264 6.375 ( 18.756 0.000 23.435) 30.016 6.495 ( -5.056 0.000 -2.210) 5.518 7.171 ( -0.659 0.000 3.870) 3.926 7.379 ( -1.379 0.000 8.466) 8.578 7.699 ( -0.260 0.000 -2.468) 2.482 7.910 ( -0.211 0.000 -3.504) 3.510 8.794 ( -9.296 0.000 -4.435) 10.300 9.218 ( 2.026 0.000 6.625) 6.928 9.660 ( -14.959 0.000 -9.438) 17.688 9.812 ( -0.843 0.000 0.205) 0.868 10.556 ( -21.753 0.000 6.013) 22.569 10.712 ( 0.553 0.000 -0.705) 0.895 10.978 ( -0.327 0.000 0.668) 0.743 11.521 ( -6.785 0.000 -5.313) 8.618 11.691 ( 0.143 0.000 -0.062) 0.156 12.480 ( -0.880 0.000 -0.096) 0.885 12.757 ( -8.406 0.000 13.915) 16.257 12.840 ( 0.033 0.000 0.150) 0.153 12.953 ( -5.250 0.000 1.917) 5.589 13.257 ( -3.272 0.000 -3.697) 4.937 13.396 ( 2.902 0.000 -1.599) 3.314 13.702 ( 8.143 0.000 -0.105) 8.143 13.770 ( -0.698 0.000 0.011) 0.698 13.808 ( 5.230 0.000 -1.220) 5.371 14.185 ( 12.276 0.000 0.833) 12.304 14.289 ( 11.282 0.000 -3.739) 11.885 14.460 ( 1.406 0.000 -0.047) 1.407 14.624 ( -1.749 0.000 -8.346) 8.527 15.043 ( 8.335 0.000 6.287) 10.440 16.440 ( 6.285 0.000 3.771) 7.330 16.762 ( -1.426 0.000 0.048) 1.427 16.915 ( -5.840 0.000 -7.112) 9.203 18.190 ( -2.554 0.000 1.175) 2.811 ======================= Grid point 378 (171/208) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.611 ( 1.420 0.000 0.572) 1.531 2.084 ( 27.141 0.000 -4.418) 27.498 2.126 ( 11.841 0.000 -2.346) 12.071 2.581 ( 10.759 0.000 -16.183) 19.433 2.682 ( 20.346 0.000 9.903) 22.629 2.866 ( 2.452 0.000 4.862) 5.445 3.469 ( -4.031 0.000 3.498) 5.337 3.551 ( 2.261 0.000 -1.020) 2.481 3.838 ( 21.248 0.000 -25.238) 32.991 4.280 ( -8.102 0.000 -1.092) 8.175 4.776 ( -0.138 0.000 4.249) 4.251 4.827 ( -23.706 0.000 0.133) 23.706 5.123 ( 5.298 0.000 -1.472) 5.499 6.079 ( 4.531 0.000 0.983) 4.636 6.359 ( -8.821 0.000 -2.525) 9.175 6.457 ( 8.989 0.000 -3.079) 9.501 6.777 ( 17.485 0.000 28.182) 33.166 7.175 ( 0.436 0.000 6.409) 6.424 7.335 ( -5.136 0.000 10.828) 11.984 7.683 ( -0.842 0.000 -3.934) 4.023 7.876 ( -2.459 0.000 -6.828) 7.257 8.614 ( -7.694 0.000 -5.481) 9.447 9.237 ( -5.369 0.000 -5.764) 7.877 9.348 ( -10.036 0.000 -2.441) 10.329 9.792 ( -1.153 0.000 0.318) 1.196 10.067 ( -29.256 0.000 11.248) 31.343 10.724 ( 0.828 0.000 -1.043) 1.331 10.972 ( -0.503 0.000 1.009) 1.127 11.333 ( -10.805 0.000 -8.494) 13.744 11.694 ( 0.166 0.000 -0.109) 0.198 12.460 ( -1.197 0.000 -0.152) 1.207 12.669 ( -2.402 0.000 12.034) 12.271 12.840 ( -0.033 0.000 0.226) 0.228 12.919 ( -0.411 0.000 2.510) 2.544 13.172 ( -3.832 0.000 -6.007) 7.125 13.456 ( 2.334 0.000 0.798) 2.466 13.755 ( -0.806 0.000 0.017) 0.806 13.782 ( -2.984 0.000 -4.514) 5.411 13.812 ( 2.437 0.000 1.337) 2.779 14.286 ( 1.146 0.000 3.451) 3.637 14.493 ( 1.844 0.000 -0.065) 1.845 14.536 ( 3.650 0.000 -2.682) 4.529 14.711 ( 16.226 0.000 -12.451) 20.453 15.260 ( 12.899 0.000 7.463) 14.902 16.591 ( 5.584 0.000 7.804) 9.596 16.755 ( 2.633 0.000 -0.956) 2.801 16.789 ( -4.825 0.000 -8.647) 9.902 18.126 ( -4.291 0.000 1.812) 4.658 ======================= Grid point 379 (172/208) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.638 ( 1.204 0.000 0.251) 1.230 2.365 ( 14.252 0.000 -0.496) 14.260 2.564 ( 22.442 0.000 -7.092) 23.536 2.762 ( 8.386 0.000 -12.569) 15.110 2.923 ( 2.649 0.000 8.347) 8.757 3.031 ( 13.255 0.000 -4.981) 14.160 3.276 ( -12.756 0.000 5.512) 13.896 3.583 ( 0.922 0.000 -1.440) 1.710 4.046 ( -4.373 0.000 9.441) 10.405 4.239 ( 10.806 0.000 -18.340) 21.287 4.401 ( -19.982 0.000 -0.033) 19.982 4.917 ( 10.783 0.000 3.917) 11.472 5.297 ( 12.655 0.000 -2.054) 12.821 6.120 ( -2.081 0.000 -6.271) 6.607 6.178 ( -8.144 0.000 6.073) 10.160 6.569 ( 3.562 0.000 -2.349) 4.267 6.997 ( -2.101 0.000 13.789) 13.948 7.209 ( 1.760 0.000 5.371) 5.652 7.320 ( 6.222 0.000 16.085) 17.247 7.657 ( -1.120 0.000 -3.391) 3.571 7.814 ( -2.702 0.000 -6.142) 6.710 8.515 ( -1.753 0.000 -5.614) 5.881 8.966 ( -12.304 0.000 -18.081) 21.870 9.344 ( -0.017 0.000 7.779) 7.779 9.589 ( -20.382 0.000 11.357) 23.333 9.773 ( -0.787 0.000 0.247) 0.824 10.737 ( 0.626 0.000 -0.784) 1.004 10.964 ( -0.392 0.000 0.773) 0.867 11.136 ( -7.635 0.000 -6.695) 10.155 11.696 ( 0.089 0.000 -0.094) 0.129 12.440 ( -0.817 0.000 -0.117) 0.825 12.686 ( 1.498 0.000 8.404) 8.536 12.839 ( -0.072 0.000 0.168) 0.183 12.908 ( -1.149 0.000 -1.319) 1.749 13.119 ( -0.788 0.000 -3.180) 3.276 13.460 ( -1.725 0.000 -0.539) 1.807 13.739 ( 0.025 0.000 -2.773) 2.774 13.742 ( -0.463 0.000 0.014) 0.463 13.825 ( -1.017 0.000 1.865) 2.124 14.290 ( -0.487 0.000 1.050) 1.158 14.523 ( 1.221 0.000 -0.046) 1.222 14.559 ( 0.687 0.000 -1.782) 1.910 14.949 ( 8.965 0.000 -6.374) 11.000 15.506 ( 10.537 0.000 5.930) 12.091 16.587 ( -3.536 0.000 -3.622) 5.062 16.720 ( -1.090 0.000 -1.555) 1.899 16.899 ( 8.061 0.000 3.417) 8.755 18.048 ( -3.845 0.000 1.399) 4.091 ======================= Grid point 380 (173/208) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.650 ( -0.000 0.000 0.000) 0.000 2.589 ( 0.000 0.000 0.000) 0.000 2.751 ( -0.000 0.000 0.000) 0.000 2.781 ( -0.000 0.000 0.000) 0.000 2.984 ( -0.000 0.000 0.000) 0.000 3.136 ( 0.000 0.000 -0.000) 0.000 3.173 ( -0.000 0.000 0.000) 0.000 3.582 ( -0.000 0.000 0.000) 0.000 3.985 ( -0.000 0.000 0.000) 0.000 4.183 ( -0.000 0.000 0.000) 0.000 4.346 ( -0.000 0.000 0.000) 0.000 5.054 ( -0.000 0.000 0.000) 0.000 5.462 ( 0.000 0.000 0.000) 0.000 6.031 ( -0.000 0.000 0.000) 0.000 6.123 ( -0.000 0.000 0.000) 0.000 6.598 ( -0.000 0.000 0.000) 0.000 6.936 ( -0.000 0.000 0.000) 0.000 7.235 ( -0.000 0.000 -0.000) 0.000 7.451 ( -0.000 0.000 0.000) 0.000 7.641 ( -0.000 0.000 0.000) 0.000 7.772 ( 0.000 0.000 0.000) 0.000 8.502 ( -0.000 0.000 0.000) 0.000 8.825 ( -0.000 0.000 -0.000) 0.000 9.290 ( -0.000 0.000 0.000) 0.000 9.449 ( 0.000 0.000 0.000) 0.000 9.766 ( -0.000 0.000 0.000) 0.000 10.742 ( -0.000 0.000 0.000) 0.000 10.961 ( -0.000 0.000 0.000) 0.000 11.055 ( -0.000 0.000 0.000) 0.000 11.697 ( -0.000 0.000 0.000) 0.000 12.431 ( -0.000 0.000 0.000) 0.000 12.715 ( -0.000 0.000 0.000) 0.000 12.838 ( -0.000 0.000 0.000) 0.000 12.889 ( -0.000 0.000 0.000) 0.000 13.115 ( -0.000 0.000 0.000) 0.000 13.433 ( -0.000 0.000 0.000) 0.000 13.738 ( -0.000 0.000 0.000) 0.000 13.750 ( -0.000 0.000 0.000) 0.000 13.807 ( -0.000 0.000 -0.000) 0.000 14.285 ( -0.000 0.000 0.000) 0.000 14.535 ( -0.000 0.000 0.000) 0.000 14.564 ( -0.000 0.000 0.000) 0.000 15.026 ( -0.000 0.000 -0.000) 0.000 15.620 ( -0.000 0.000 0.000) 0.000 16.540 ( -0.000 0.000 -0.000) 0.000 16.713 ( -0.000 0.000 0.000) 0.000 16.986 ( -0.000 0.000 0.000) 0.000 18.008 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 385 (174/208) ======================= q-point: ( 0.00 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.978 ( -0.000 30.334 0.000) 30.334 1.788 ( -0.000 13.154 0.000) 13.154 1.925 ( 0.000 27.043 0.000) 27.043 2.191 ( -0.000 16.312 0.000) 16.312 2.692 ( -0.000 -3.762 0.000) 3.762 2.845 ( 0.000 9.172 0.000) 9.172 3.269 ( 0.000 18.651 0.000) 18.651 3.553 ( -0.000 1.751 -0.000) 1.751 3.631 ( 0.000 12.411 -0.000) 12.411 4.419 ( 0.000 -0.570 0.000) 0.570 4.986 ( 0.000 -1.893 0.000) 1.893 5.209 ( 0.000 -2.162 0.000) 2.162 5.682 ( 0.000 19.465 0.000) 19.465 5.967 ( -0.000 1.326 0.000) 1.326 6.029 ( -0.000 -0.577 0.000) 0.577 6.367 ( -0.000 17.822 0.000) 17.822 6.528 ( -0.000 -1.510 0.000) 1.510 7.207 ( 0.000 -1.688 0.000) 1.688 7.283 ( 0.000 -21.113 -0.000) 21.113 7.377 ( -0.000 4.026 0.000) 4.026 8.349 ( -0.000 21.738 0.000) 21.738 8.616 ( 0.000 -24.215 -0.000) 24.215 9.178 ( 0.000 1.447 0.000) 1.447 9.508 ( -0.000 -26.219 0.000) 26.219 9.821 ( -0.000 -2.177 0.000) 2.177 10.783 ( 0.000 2.910 0.000) 2.910 10.831 ( 0.000 3.301 0.000) 3.301 11.050 ( 0.000 7.169 0.000) 7.169 11.129 ( -0.000 -22.188 0.000) 22.188 12.194 ( 0.000 28.590 0.000) 28.590 12.462 ( -0.000 -26.204 0.000) 26.204 12.695 ( 0.000 13.141 0.000) 13.141 12.981 ( 0.000 -5.267 0.000) 5.267 13.108 ( -0.000 3.890 0.000) 3.890 13.207 ( 0.000 1.790 0.000) 1.790 13.342 ( 0.000 -5.586 0.000) 5.586 13.485 ( -0.000 5.094 0.000) 5.094 13.605 ( 0.000 0.815 0.000) 0.815 13.869 ( -0.000 -10.296 0.000) 10.296 13.987 ( 0.000 8.109 0.000) 8.109 14.534 ( 0.000 25.884 0.000) 25.884 14.633 ( 0.000 -2.483 0.000) 2.483 14.705 ( -0.000 17.440 -0.000) 17.440 14.970 ( -0.000 2.226 0.000) 2.226 16.425 ( 0.000 4.246 0.000) 4.246 16.652 ( -0.000 -14.097 0.000) 14.097 16.843 ( -0.000 -10.463 0.000) 10.463 18.125 ( 0.000 -8.795 0.000) 8.795 ======================= Grid point 387 (175/208) ======================= q-point: ( 0.12 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( -0.204 29.904 0.250) 29.906 1.896 ( 10.595 7.986 -4.239) 13.929 2.032 ( 11.857 24.836 1.076) 27.542 2.387 ( 17.421 15.442 -4.466) 23.704 2.583 ( -3.553 1.489 1.141) 4.018 2.942 ( 5.048 10.464 1.959) 11.782 3.403 ( 10.198 10.164 3.187) 14.747 3.624 ( 7.507 3.605 -5.785) 10.140 3.656 ( 4.500 13.012 -8.218) 16.034 4.376 ( -3.901 -0.934 -3.742) 5.485 4.919 ( -9.345 -0.508 -0.532) 9.373 5.073 ( -5.614 -1.968 -4.814) 7.653 5.484 ( -16.747 21.352 -0.225) 27.137 6.015 ( 4.121 2.614 0.911) 4.964 6.243 ( 16.005 -1.192 13.009) 20.659 6.476 ( -4.247 -1.612 -2.576) 5.222 6.536 ( 13.162 15.534 9.629) 22.523 7.222 ( 0.770 0.724 6.092) 6.183 7.239 ( -3.941 -16.184 5.867) 17.660 7.409 ( 2.326 -3.122 -3.575) 5.286 8.327 ( -1.902 20.278 -2.149) 20.480 8.587 ( -2.812 -19.325 -2.284) 19.661 9.118 ( -5.922 -3.891 -1.183) 7.184 9.368 ( -12.618 -23.440 -8.082) 27.820 9.813 ( -2.368 -2.719 6.549) 7.476 10.640 ( -13.603 2.235 0.073) 13.786 10.817 ( -1.241 8.378 0.908) 8.518 11.036 ( -0.664 5.808 0.020) 5.846 11.115 ( -2.306 -19.321 0.256) 19.460 12.161 ( -3.402 28.002 -1.449) 28.245 12.460 ( -0.450 -24.653 1.306) 24.691 12.647 ( -4.851 8.827 -4.452) 11.012 12.855 ( -9.511 -3.648 10.351) 14.523 12.953 ( -6.417 0.148 2.102) 6.754 13.231 ( -1.254 -0.366 0.183) 1.319 13.320 ( -1.138 5.341 -1.952) 5.800 13.624 ( 10.802 -8.184 4.382) 14.243 13.694 ( 1.664 -2.974 -1.580) 3.757 13.963 ( 4.497 6.211 -1.605) 7.834 14.178 ( 21.163 -0.511 -2.982) 21.378 14.485 ( -4.592 15.453 -4.856) 16.836 14.621 ( 2.080 9.964 -2.371) 10.451 14.768 ( 4.772 17.666 -2.219) 18.433 15.046 ( 7.507 0.642 5.648) 9.417 16.395 ( -1.713 -6.968 7.067) 10.071 16.686 ( 2.767 -5.958 -1.738) 6.795 16.811 ( -2.451 -7.892 -8.618) 11.940 18.102 ( -2.554 -8.801 1.050) 9.224 ======================= Grid point 388 (176/208) ======================= q-point: ( 0.25 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( 0.348 28.918 0.347) 28.922 2.111 ( 12.410 1.409 -5.849) 13.791 2.357 ( 21.249 21.554 -1.651) 30.312 2.559 ( 7.971 0.375 -15.877) 17.770 2.811 ( 18.468 12.936 9.597) 24.505 3.024 ( 3.753 12.488 3.423) 13.482 3.496 ( -2.561 3.831 7.224) 8.569 3.650 ( -0.610 8.146 -1.575) 8.319 3.929 ( 20.923 9.916 -24.862) 33.973 4.276 ( -5.989 0.043 0.175) 5.992 4.758 ( -3.724 1.109 2.160) 4.446 5.004 ( -7.492 5.881 1.591) 9.657 5.201 ( -6.316 16.200 -2.561) 17.575 6.105 ( 4.593 2.762 0.710) 5.406 6.347 ( -8.039 -1.147 -2.919) 8.629 6.533 ( 11.256 3.788 6.151) 13.374 6.827 ( 12.903 7.154 19.039) 24.086 7.168 ( -4.679 -14.902 8.070) 17.580 7.261 ( 2.731 4.864 9.666) 11.160 7.419 ( -0.918 -5.949 -4.109) 7.288 8.284 ( -1.722 21.036 -6.206) 22.000 8.517 ( -3.507 -11.609 -3.430) 12.602 8.973 ( -8.917 -19.885 0.744) 21.806 9.077 ( -14.524 -17.225 -15.820) 27.531 9.701 ( -12.339 -4.699 10.682) 16.983 10.398 ( -8.838 15.866 3.505) 18.497 10.800 ( -0.544 5.850 -0.229) 5.879 11.010 ( -4.162 -5.861 -1.707) 7.388 11.049 ( -2.538 -3.648 -0.034) 4.444 12.070 ( -5.282 25.343 -2.620) 26.019 12.448 ( -0.975 -18.954 2.684) 19.168 12.548 ( -3.394 -3.457 -1.676) 5.126 12.747 ( -3.822 -3.511 3.356) 6.180 12.907 ( -0.354 -2.322 3.001) 3.811 13.189 ( -2.475 1.081 -0.832) 2.826 13.294 ( -1.628 5.277 -0.122) 5.524 13.669 ( -0.756 -10.127 -0.428) 10.165 13.805 ( 4.191 1.627 3.800) 5.887 14.032 ( 3.499 3.759 1.872) 5.466 14.321 ( -4.445 9.381 -11.934) 15.817 14.533 ( 7.131 1.278 0.570) 7.267 14.707 ( 5.339 16.666 1.112) 17.536 14.891 ( 10.547 16.719 -9.094) 21.759 15.251 ( 12.212 -0.644 7.309) 14.247 16.432 ( 3.582 -16.295 11.322) 20.163 16.712 ( -1.241 -5.483 -6.031) 8.245 16.760 ( 1.001 -0.098 -6.800) 6.874 18.037 ( -4.282 -8.806 1.618) 9.925 ======================= Grid point 389 (177/208) ======================= q-point: ( 0.38 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( 0.477 28.003 0.208) 28.008 2.355 ( 14.853 0.304 -3.567) 15.278 2.696 ( 9.407 3.115 -12.770) 16.164 2.765 ( 16.821 9.018 1.094) 19.117 2.972 ( -2.857 7.358 -9.535) 12.378 3.165 ( 7.129 7.631 12.723) 16.460 3.396 ( -2.810 13.612 1.124) 13.944 3.648 ( 0.185 6.237 -1.220) 6.358 4.085 ( -5.730 4.163 8.901) 11.375 4.301 ( 11.545 6.490 -16.386) 21.069 4.635 ( -12.739 19.709 0.094) 23.468 4.941 ( 6.374 3.610 3.524) 8.129 5.295 ( 11.643 1.629 -3.052) 12.146 6.140 ( -3.679 1.892 -7.423) 8.498 6.193 ( -5.016 1.956 6.642) 8.550 6.678 ( 3.982 7.695 0.694) 8.692 6.943 ( -4.981 -2.714 9.747) 11.278 7.147 ( 2.926 -16.109 9.824) 19.094 7.356 ( -0.734 2.907 -4.629) 5.515 7.417 ( 7.353 4.553 14.371) 16.773 8.241 ( -1.926 22.671 -5.929) 23.513 8.476 ( 0.419 -5.229 -4.491) 6.906 8.765 ( -11.181 -20.605 -11.612) 26.161 8.855 ( -7.057 -29.209 -2.601) 30.161 9.433 ( -14.500 -1.698 9.482) 17.408 10.351 ( 1.409 26.973 4.805) 27.434 10.792 ( -0.356 2.036 -0.613) 2.156 10.879 ( -6.932 -12.918 -4.025) 15.203 11.034 ( -0.302 6.370 0.754) 6.421 11.984 ( -2.997 20.917 -1.830) 21.210 12.439 ( -0.368 -18.451 1.973) 18.560 12.518 ( -0.279 -0.208 -0.033) 0.350 12.699 ( -1.786 -15.692 0.435) 15.799 12.914 ( 0.287 -1.205 0.875) 1.517 13.149 ( -1.455 3.503 -0.089) 3.795 13.263 ( -1.385 6.016 -0.087) 6.174 13.664 ( 0.263 -8.840 0.091) 8.844 13.821 ( -1.572 2.875 0.952) 3.412 14.098 ( 2.601 0.267 4.648) 5.333 14.227 ( -2.944 10.078 -9.621) 14.241 14.603 ( 1.657 6.097 0.183) 6.321 14.772 ( 1.875 16.789 1.715) 16.981 15.069 ( 7.597 13.014 -6.988) 16.610 15.482 ( 9.749 -2.273 5.641) 11.490 16.489 ( -0.621 -11.660 3.127) 12.088 16.694 ( 2.228 -4.493 -4.175) 6.525 16.799 ( 2.434 -5.254 -0.076) 5.790 17.959 ( -3.801 -8.765 1.250) 9.635 ======================= Grid point 390 (178/208) ======================= q-point: ( 0.50 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.991 ( -0.000 27.647 0.000) 27.647 2.599 ( 0.000 0.515 0.000) 0.515 2.704 ( -0.000 -0.744 0.000) 0.744 2.861 ( -0.000 -2.031 0.000) 2.031 2.972 ( -0.000 12.595 0.000) 12.595 3.219 ( 0.000 4.880 -0.000) 4.880 3.425 ( 0.000 20.348 0.000) 20.348 3.645 ( -0.000 6.061 0.000) 6.061 4.012 ( -0.000 3.908 0.000) 3.908 4.404 ( -0.000 5.906 0.000) 5.906 4.487 ( -0.000 26.966 0.000) 26.966 5.042 ( -0.000 -0.994 0.000) 0.994 5.450 ( 0.000 -0.046 0.000) 0.046 6.052 ( -0.000 2.304 0.000) 2.304 6.157 ( -0.000 3.669 0.000) 3.669 6.710 ( -0.000 8.774 0.000) 8.774 6.870 ( -0.000 -4.548 0.000) 4.548 7.207 ( -0.000 -22.610 0.000) 22.610 7.317 ( -0.000 5.745 0.000) 5.745 7.544 ( -0.000 10.513 0.000) 10.513 8.210 ( -0.000 21.548 0.000) 21.548 8.488 ( -0.000 -0.445 0.000) 0.445 8.636 ( -0.000 -16.969 -0.000) 16.969 8.776 ( 0.000 -38.943 0.000) 38.943 9.291 ( -0.000 0.285 0.000) 0.285 10.386 ( -0.000 34.097 0.000) 34.097 10.774 ( -0.000 -15.015 0.000) 15.015 10.810 ( -0.000 -0.822 0.000) 0.822 11.032 ( -0.000 6.982 0.000) 6.982 11.955 ( -0.000 19.080 0.000) 19.080 12.438 ( -0.000 -20.880 0.000) 20.880 12.519 ( -0.000 7.800 0.000) 7.800 12.682 ( -0.000 -25.745 0.000) 25.745 12.917 ( -0.000 0.432 0.000) 0.432 13.136 ( -0.000 4.437 0.000) 4.437 13.249 ( -0.000 6.756 -0.000) 6.756 13.671 ( -0.000 -9.127 0.000) 9.127 13.798 ( -0.000 3.291 0.000) 3.291 14.133 ( 0.000 -5.583 0.000) 5.583 14.185 ( -0.000 15.352 -0.000) 15.352 14.617 ( -0.000 7.336 0.000) 7.336 14.791 ( -0.000 17.162 0.000) 17.162 15.134 ( -0.000 11.848 -0.000) 11.848 15.587 ( -0.000 -3.172 0.000) 3.172 16.468 ( -0.000 -7.998 -0.000) 7.998 16.726 ( 0.000 1.435 0.000) 1.435 16.828 ( -0.000 -14.140 0.000) 14.140 17.920 ( -0.000 -8.706 0.000) 8.706 ======================= Grid point 395 (179/208) ======================= q-point: ( 0.00 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 0.000 31.587 0.000) 31.587 1.907 ( -0.000 5.806 0.000) 5.806 2.617 ( 0.000 24.686 0.000) 24.686 2.671 ( -0.000 37.148 0.000) 37.148 2.734 ( -0.000 8.852 -0.000) 8.852 3.053 ( 0.000 10.094 0.000) 10.094 3.674 ( -0.000 12.068 0.000) 12.068 3.678 ( 0.000 22.239 -0.000) 22.239 3.933 ( -0.000 16.681 0.000) 16.681 4.439 ( 0.000 2.867 0.000) 2.867 4.939 ( 0.000 -2.856 0.000) 2.856 5.154 ( 0.000 -3.114 0.000) 3.114 5.992 ( 0.000 3.241 -0.000) 3.241 6.088 ( -0.000 14.107 -0.000) 14.107 6.115 ( -0.000 7.506 0.000) 7.506 6.586 ( 0.000 14.484 0.000) 14.484 6.710 ( -0.000 7.874 0.000) 7.874 6.993 ( 0.000 -7.995 -0.000) 7.995 7.085 ( -0.000 -2.493 0.000) 2.493 7.585 ( -0.000 13.766 0.000) 13.766 8.142 ( -0.000 -19.348 0.000) 19.348 8.525 ( 0.000 -6.189 0.000) 6.189 8.989 ( -0.000 -22.738 0.000) 22.738 9.346 ( 0.000 14.445 0.000) 14.445 9.702 ( -0.000 -9.497 0.000) 9.497 10.468 ( 0.000 -23.686 0.000) 23.686 10.844 ( -0.000 -2.026 0.000) 2.026 11.088 ( 0.000 7.676 0.000) 7.676 11.224 ( -0.000 9.198 0.000) 9.198 11.801 ( 0.000 -37.773 0.000) 37.773 12.653 ( -0.000 14.083 0.000) 14.083 12.796 ( 0.000 -1.161 0.000) 1.161 12.939 ( 0.000 2.642 0.000) 2.642 13.113 ( 0.000 -12.223 0.000) 12.223 13.192 ( -0.000 -4.161 0.000) 4.161 13.326 ( 0.000 13.303 0.000) 13.303 13.637 ( -0.000 1.516 0.000) 1.516 13.782 ( 0.000 21.289 -0.000) 21.289 13.823 ( -0.000 6.037 0.000) 6.037 14.116 ( 0.000 4.836 0.000) 4.836 14.541 ( 0.000 -5.251 0.000) 5.251 14.945 ( -0.000 4.827 0.000) 4.827 15.052 ( 0.000 22.506 0.000) 22.506 15.116 ( -0.000 13.746 0.000) 13.746 16.278 ( 0.000 -20.077 0.000) 20.077 16.518 ( -0.000 4.347 0.000) 4.347 16.658 ( -0.000 -8.093 0.000) 8.093 17.877 ( 0.000 -15.883 0.000) 15.883 ======================= Grid point 397 (180/208) ======================= q-point: ( 0.12 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.589 ( -1.330 30.172 -0.263) 30.203 1.991 ( 8.102 5.802 -3.030) 10.416 2.622 ( 5.426 28.320 -1.865) 28.895 2.651 ( -2.517 9.251 -19.600) 21.820 2.876 ( 14.069 27.491 13.081) 33.538 3.172 ( 7.880 11.645 5.098) 14.956 3.621 ( -1.320 12.656 14.071) 18.972 3.822 ( 7.101 15.403 -9.101) 19.248 3.979 ( 8.380 18.805 -11.660) 23.660 4.388 ( -4.406 2.800 -3.713) 6.407 4.908 ( -4.351 -0.988 -0.504) 4.490 5.040 ( -6.434 -0.923 -3.175) 7.234 5.980 ( -8.233 22.513 0.280) 23.973 6.092 ( 4.430 4.984 1.130) 6.764 6.253 ( 12.121 3.281 13.975) 18.788 6.480 ( -6.495 7.067 -1.296) 9.686 6.784 ( 3.726 -0.171 5.174) 6.378 6.975 ( -1.654 -9.886 4.639) 11.044 7.188 ( 9.068 6.637 1.815) 11.383 7.558 ( -2.497 12.457 -0.939) 12.740 8.142 ( -0.137 -17.550 3.131) 17.828 8.519 ( -0.446 -6.343 -5.115) 8.161 8.887 ( -9.856 -19.830 -3.678) 22.448 9.203 ( -11.991 8.266 -10.076) 17.710 9.724 ( -1.009 -4.842 9.850) 11.022 10.391 ( -5.670 -20.107 -2.840) 21.083 10.890 ( 3.081 -0.629 6.518) 7.237 11.062 ( -2.357 6.735 -1.159) 7.229 11.203 ( -1.885 10.004 0.156) 10.181 11.802 ( 0.168 -37.542 -0.743) 37.550 12.619 ( -3.456 13.200 -3.688) 14.134 12.739 ( -6.813 1.185 -2.619) 7.395 12.817 ( -9.323 3.299 9.432) 13.667 12.988 ( -7.136 -1.262 -2.583) 7.694 13.267 ( 3.375 -7.017 -2.638) 8.221 13.357 ( 2.288 5.702 2.939) 6.810 13.556 ( -3.602 8.425 4.259) 10.104 13.771 ( 3.417 7.012 1.195) 7.891 14.063 ( 4.654 4.847 -1.143) 6.816 14.257 ( 20.324 7.449 -1.479) 21.697 14.497 ( -3.741 -3.815 -5.888) 7.951 14.987 ( 3.632 8.049 -0.480) 8.844 15.104 ( 5.682 16.264 -0.688) 17.242 15.158 ( 4.651 15.862 1.124) 16.568 16.113 ( -11.079 -18.365 6.869) 22.521 16.599 ( 1.813 -5.235 -2.091) 5.921 16.697 ( 5.676 -1.283 -6.183) 8.491 17.854 ( -2.489 -15.831 0.716) 16.042 ======================= Grid point 398 (181/208) ======================= q-point: ( 0.25 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -0.296 29.445 -0.076) 29.447 2.166 ( 10.975 4.356 -6.235) 13.353 2.631 ( 3.999 6.626 -16.666) 18.376 2.819 ( 13.839 22.866 -1.192) 26.754 3.164 ( 12.563 20.074 10.987) 26.106 3.268 ( 0.481 11.946 0.488) 11.966 3.651 ( 2.219 12.590 6.902) 14.528 3.837 ( -1.983 10.055 -2.257) 10.495 4.234 ( 16.343 19.982 -16.372) 30.568 4.306 ( -2.348 3.613 0.850) 4.392 4.811 ( -2.151 3.729 0.154) 4.307 5.005 ( 1.506 -1.640 0.969) 2.428 5.771 ( -11.816 34.455 -2.661) 36.522 6.189 ( 4.893 5.191 1.407) 7.271 6.318 ( -5.627 -0.498 -2.889) 6.345 6.557 ( 10.229 0.069 16.791) 19.661 6.827 ( -0.147 -8.626 3.952) 9.489 6.963 ( -0.446 -8.082 7.725) 11.189 7.366 ( 6.309 5.827 3.806) 9.393 7.523 ( 1.584 15.364 2.647) 15.671 8.149 ( 0.159 -15.667 3.673) 16.093 8.478 ( -3.353 -9.310 -9.662) 13.830 8.661 ( -11.168 -10.688 -4.761) 16.175 8.925 ( -14.710 3.929 -10.804) 18.670 9.631 ( -10.426 -2.738 7.798) 13.304 10.325 ( -0.114 -14.244 -1.225) 14.297 10.933 ( -0.574 6.235 5.385) 8.259 11.020 ( -1.483 6.443 2.102) 6.937 11.171 ( -0.872 8.797 -0.530) 8.856 11.806 ( 0.548 -36.936 -1.047) 36.955 12.508 ( -9.716 0.203 1.503) 9.833 12.528 ( -8.595 17.473 -3.848) 19.849 12.760 ( -1.088 -1.064 1.174) 1.923 12.875 ( -4.242 0.565 -0.179) 4.284 13.305 ( 1.657 2.504 -1.984) 3.598 13.383 ( 0.193 -0.461 2.556) 2.604 13.521 ( -1.679 6.483 2.698) 7.220 13.853 ( 3.353 2.588 3.357) 5.405 14.093 ( 0.576 2.935 1.648) 3.415 14.390 ( -4.626 -1.112 -12.738) 13.597 14.616 ( 13.493 7.246 1.541) 15.393 15.048 ( 2.662 11.371 -1.185) 11.739 15.254 ( 10.078 9.825 -5.230) 15.015 15.299 ( 9.025 15.762 3.340) 18.467 16.004 ( -0.900 -24.560 10.374) 26.676 16.589 ( -0.988 -5.955 -4.950) 7.807 16.781 ( 2.994 2.071 -3.950) 5.371 17.791 ( -4.131 -15.660 1.093) 16.233 ======================= Grid point 399 (182/208) ======================= q-point: ( 0.38 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( 0.179 29.507 0.056) 29.507 2.386 ( 13.406 2.273 -4.646) 14.369 2.703 ( 4.293 0.866 -11.535) 12.338 3.028 ( 1.674 13.825 -1.165) 13.975 3.206 ( 0.508 14.828 -5.411) 15.792 3.335 ( 3.180 10.795 10.916) 15.678 3.747 ( 7.517 19.123 -1.470) 20.600 3.814 ( -0.360 10.424 2.024) 10.625 4.213 ( -5.694 8.514 5.629) 11.687 4.497 ( 9.512 12.822 -9.417) 18.535 4.875 ( 7.487 4.747 0.387) 8.873 5.055 ( 1.480 1.729 2.270) 3.215 5.606 ( -3.063 32.830 -4.249) 33.245 6.193 ( -4.511 4.211 -6.462) 8.935 6.267 ( 0.742 4.892 5.245) 7.211 6.700 ( 2.591 -5.237 8.370) 10.208 6.814 ( -0.802 -12.923 5.701) 14.147 6.954 ( -2.681 1.212 2.013) 3.565 7.384 ( -0.537 -2.940 0.496) 3.029 7.700 ( 11.887 19.205 13.238) 26.180 8.151 ( -0.537 -16.991 2.515) 17.184 8.333 ( -8.578 -14.816 -10.940) 20.316 8.503 ( -7.771 -6.157 -6.026) 11.602 8.687 ( -5.725 10.048 -6.740) 13.385 9.420 ( -10.803 0.043 4.190) 11.587 10.361 ( 2.879 -13.550 -0.080) 13.853 10.904 ( -1.802 4.473 -0.050) 4.822 10.989 ( -2.708 17.860 3.898) 18.480 11.183 ( 1.553 6.564 1.129) 6.839 11.823 ( 1.357 -35.549 -0.444) 35.578 12.338 ( -7.051 11.186 2.215) 13.407 12.396 ( -5.250 -2.876 -4.866) 7.715 12.738 ( -1.109 7.475 -1.173) 7.647 12.839 ( -0.321 -3.922 1.861) 4.353 13.326 ( 0.682 9.936 -0.446) 9.969 13.396 ( 1.166 -3.797 1.586) 4.277 13.486 ( -2.377 4.170 0.664) 4.845 13.878 ( -0.656 2.223 0.489) 2.369 14.111 ( 0.864 2.689 4.335) 5.174 14.298 ( -2.720 -1.804 -9.959) 10.480 14.779 ( 4.594 9.768 1.435) 10.890 15.088 ( 1.834 12.882 -0.196) 13.013 15.411 ( 6.519 11.302 -9.920) 16.390 15.449 ( 5.410 6.066 7.182) 10.847 16.088 ( 5.775 -26.144 7.849) 27.901 16.571 ( 0.456 -4.887 -4.688) 6.787 16.795 ( -0.739 2.661 -1.300) 3.053 17.715 ( -3.569 -15.353 0.834) 15.784 ======================= Grid point 400 (183/208) ======================= q-point: ( 0.50 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -0.000 29.594 0.000) 29.594 2.592 ( 0.000 -1.282 0.000) 1.282 2.687 ( -0.000 -1.979 0.000) 1.979 2.950 ( -0.000 12.435 0.000) 12.435 3.273 ( -0.000 15.883 0.000) 15.883 3.365 ( 0.000 9.216 -0.000) 9.216 3.811 ( -0.000 10.685 0.000) 10.685 3.847 ( 0.000 21.153 -0.000) 21.153 4.143 ( -0.000 8.991 0.000) 8.991 4.572 ( -0.000 10.462 0.000) 10.462 5.001 ( -0.000 14.785 0.000) 14.785 5.025 ( 0.000 -0.481 0.000) 0.481 5.608 ( -0.000 22.445 0.000) 22.445 6.142 ( -0.000 8.169 0.000) 8.169 6.264 ( -0.000 6.290 0.000) 6.290 6.719 ( -0.000 -6.288 0.000) 6.288 6.830 ( -0.000 -14.844 -0.000) 14.844 6.899 ( 0.000 4.380 0.000) 4.380 7.387 ( -0.000 -2.786 0.000) 2.786 7.874 ( -0.000 22.340 0.000) 22.340 8.149 ( -0.000 -18.747 0.000) 18.747 8.206 ( -0.000 -19.247 -0.000) 19.247 8.384 ( -0.000 -5.002 0.000) 5.002 8.658 ( -0.000 11.760 0.000) 11.760 9.310 ( -0.000 1.817 0.000) 1.817 10.395 ( -0.000 -15.300 0.000) 15.300 10.886 ( -0.000 2.196 0.000) 2.196 10.959 ( -0.000 23.479 0.000) 23.479 11.203 ( -0.000 7.515 0.000) 7.515 11.841 ( -0.000 -34.304 0.000) 34.304 12.267 ( -0.000 10.148 0.000) 10.148 12.341 ( -0.000 -6.922 0.000) 6.922 12.725 ( -0.000 10.798 0.000) 10.798 12.841 ( -0.000 -5.476 0.000) 5.476 13.331 ( -0.000 12.438 0.000) 12.438 13.426 ( 0.000 -11.800 0.000) 11.800 13.445 ( -0.000 9.882 -0.000) 9.882 13.865 ( -0.000 2.842 0.000) 2.842 14.126 ( -0.000 3.243 0.000) 3.243 14.263 ( -0.000 -2.954 -0.000) 2.954 14.820 ( -0.000 10.657 0.000) 10.657 15.108 ( -0.000 13.417 0.000) 13.417 15.458 ( -0.000 15.472 -0.000) 15.472 15.513 ( -0.000 -3.311 0.000) 3.311 16.158 ( -0.000 -22.477 0.000) 22.477 16.582 ( -0.000 -7.201 0.000) 7.201 16.776 ( -0.000 3.768 0.000) 3.768 17.679 ( -0.000 -15.140 0.000) 15.140 ======================= Grid point 405 (184/208) ======================= q-point: ( 0.00 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 0.000 8.125 0.000) 8.125 2.194 ( -0.000 27.145 0.000) 27.145 2.975 ( 0.000 16.461 0.000) 16.461 3.106 ( -0.000 4.311 -0.000) 4.311 3.157 ( 0.000 26.375 0.000) 26.375 3.404 ( -0.000 28.171 -0.000) 28.171 4.012 ( -0.000 19.214 0.000) 19.214 4.130 ( 0.000 22.187 0.000) 22.187 4.263 ( -0.000 17.210 0.000) 17.210 4.531 ( 0.000 6.347 0.000) 6.347 4.880 ( 0.000 -2.489 0.000) 2.489 5.103 ( 0.000 -1.586 0.000) 1.586 6.064 ( -0.000 -0.169 0.000) 0.169 6.176 ( 0.000 1.060 -0.000) 1.060 6.280 ( 0.000 5.933 0.000) 5.933 6.554 ( -0.000 -7.153 0.000) 7.153 6.914 ( 0.000 -0.111 0.000) 0.111 7.179 ( -0.000 36.845 0.000) 36.845 7.209 ( 0.000 3.910 0.000) 3.910 7.776 ( -0.000 4.844 0.000) 4.844 8.051 ( -0.000 10.865 0.000) 10.865 8.231 ( 0.000 -17.566 0.000) 17.566 8.635 ( -0.000 -15.290 0.000) 15.290 9.459 ( 0.000 -9.980 0.000) 9.980 9.470 ( -0.000 -13.198 -0.000) 13.198 10.249 ( -0.000 7.257 0.000) 7.257 10.759 ( -0.000 -7.206 0.000) 7.206 11.018 ( -0.000 -35.931 0.000) 35.931 11.181 ( 0.000 0.168 0.000) 0.168 11.454 ( -0.000 11.974 0.000) 11.974 12.604 ( -0.000 -11.255 0.000) 11.255 12.831 ( 0.000 -1.512 0.000) 1.512 12.916 ( 0.000 -4.647 0.000) 4.647 13.016 ( -0.000 1.736 -0.000) 1.736 13.084 ( -0.000 -4.348 -0.000) 4.348 13.564 ( -0.000 5.467 0.000) 5.467 13.742 ( -0.000 13.011 0.000) 13.011 14.016 ( 0.000 11.359 0.000) 11.359 14.147 ( -0.000 -1.460 0.000) 1.460 14.235 ( -0.000 20.176 0.000) 20.176 14.460 ( 0.000 -0.026 0.000) 0.026 15.013 ( -0.000 3.161 0.000) 3.161 15.370 ( 0.000 9.356 0.000) 9.356 15.384 ( -0.000 11.981 -0.000) 11.981 15.927 ( -0.000 -15.219 0.000) 15.219 16.557 ( -0.000 -1.262 0.000) 1.262 16.574 ( 0.000 1.060 0.000) 1.060 17.515 ( -0.000 -20.076 0.000) 20.076 ======================= Grid point 407 (185/208) ======================= q-point: ( 0.12 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( 0.349 11.586 -2.332) 11.823 2.235 ( 3.888 22.251 -1.347) 22.628 2.859 ( -5.057 10.165 -19.392) 22.471 3.152 ( 2.608 25.069 -0.694) 25.214 3.267 ( 8.196 10.151 19.681) 23.612 3.521 ( 9.337 25.257 0.201) 26.929 3.961 ( -2.774 20.432 6.364) 21.579 4.111 ( -3.751 12.626 -5.226) 14.170 4.357 ( 8.270 16.284 -6.456) 19.371 4.531 ( 2.169 13.771 -4.022) 14.510 4.873 ( -0.624 -2.165 -0.487) 2.305 5.046 ( -4.348 1.332 -0.584) 4.585 6.104 ( 2.384 -4.851 3.236) 6.300 6.172 ( 1.121 1.153 -5.954) 6.168 6.363 ( 5.552 2.109 14.890) 16.031 6.609 ( 6.063 -2.066 3.035) 7.088 6.858 ( -7.637 1.976 2.800) 8.371 6.978 ( -8.583 29.071 -6.521) 31.005 7.331 ( 2.632 2.680 3.432) 5.088 7.839 ( 5.290 14.879 2.089) 15.929 8.004 ( -2.340 0.071 -7.806) 8.149 8.263 ( 1.325 -9.310 8.464) 12.652 8.594 ( -3.572 -12.734 -3.156) 13.597 9.205 ( -14.619 -9.428 -9.588) 19.863 9.580 ( 0.057 -13.280 6.626) 14.842 10.236 ( -0.484 8.829 0.709) 8.871 10.831 ( 6.508 -5.723 6.219) 10.667 11.018 ( 0.074 -35.364 -1.045) 35.380 11.140 ( -3.725 -0.259 -2.727) 4.624 11.461 ( 0.377 12.380 0.650) 12.403 12.581 ( -2.044 -11.029 -0.285) 11.221 12.728 ( -10.236 -0.003 -4.924) 11.359 12.880 ( -0.964 -7.397 -0.628) 7.486 13.028 ( -3.272 8.185 8.184) 12.028 13.112 ( 4.682 -2.957 -5.044) 7.490 13.590 ( 1.795 7.959 0.901) 8.208 13.709 ( -2.556 10.715 0.109) 11.017 13.937 ( -4.084 8.073 1.197) 9.126 14.140 ( -1.291 1.803 -0.651) 2.312 14.403 ( 3.896 -0.947 6.417) 7.566 14.487 ( 11.628 12.161 -6.530) 18.048 15.049 ( 3.460 2.277 -0.039) 4.142 15.361 ( 0.961 6.978 -5.588) 8.991 15.467 ( 6.990 12.932 -1.013) 14.735 15.782 ( -12.846 -13.744 6.880) 20.031 16.508 ( -0.356 -2.034 -1.505) 2.556 16.717 ( 8.444 1.783 -1.720) 8.800 17.494 ( -2.205 -19.880 0.305) 20.005 ======================= Grid point 408 (186/208) ======================= q-point: ( 0.25 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( 1.989 16.399 -1.862) 16.624 2.321 ( 5.759 14.167 -3.723) 15.739 2.767 ( -1.889 5.474 -16.267) 17.266 3.256 ( 7.933 21.285 -0.428) 22.719 3.420 ( 3.838 9.358 17.348) 20.081 3.635 ( 0.643 21.658 -6.316) 22.570 3.984 ( 5.044 20.234 1.389) 20.899 4.029 ( -1.877 9.554 0.676) 9.760 4.426 ( 0.507 8.074 -2.358) 8.427 4.657 ( 8.941 20.512 -5.397) 23.017 4.876 ( 2.421 1.986 -2.128) 3.786 4.996 ( -0.387 1.513 2.133) 2.644 6.120 ( -0.523 -3.097 0.988) 3.292 6.214 ( 2.590 -5.419 1.087) 6.104 6.469 ( 2.803 0.991 6.588) 7.227 6.650 ( -8.337 14.650 -0.593) 16.867 6.792 ( 6.251 7.892 3.333) 10.605 6.882 ( -0.754 13.513 4.482) 14.257 7.308 ( -5.044 -6.190 0.563) 8.005 7.886 ( -0.039 7.493 -6.738) 10.077 8.018 ( 3.057 1.623 4.776) 5.898 8.288 ( 0.513 3.297 6.753) 7.533 8.515 ( -3.958 -7.590 -3.748) 9.344 8.919 ( -13.235 -7.001 -7.336) 16.673 9.516 ( -6.190 -9.518 3.346) 11.837 10.245 ( 0.994 7.949 -0.485) 8.025 10.966 ( 2.143 -2.016 5.377) 6.129 11.013 ( -1.069 -29.689 -2.109) 29.783 11.088 ( 3.534 -6.001 1.758) 7.182 11.459 ( -0.784 13.109 0.409) 13.138 12.502 ( -8.168 -2.377 -6.139) 10.491 12.561 ( -2.782 -8.695 -0.985) 9.182 12.856 ( -6.252 1.638 5.640) 8.578 12.910 ( -5.189 6.311 2.197) 8.461 13.213 ( 5.978 1.111 -6.685) 9.037 13.606 ( -0.115 12.477 0.452) 12.486 13.676 ( -1.745 6.632 3.316) 7.617 13.896 ( -0.519 1.782 -0.215) 1.868 14.119 ( -0.456 -0.549 0.077) 0.717 14.363 ( -3.989 -0.475 -3.639) 5.421 14.789 ( 14.512 9.057 2.146) 17.241 15.125 ( 4.267 0.721 0.003) 4.328 15.373 ( 0.940 -3.969 -5.830) 7.115 15.579 ( -7.472 -8.842 6.497) 13.274 15.628 ( 9.427 10.239 -1.115) 13.962 16.523 ( 1.777 0.300 -1.358) 2.256 16.837 ( 4.112 3.343 -1.020) 5.397 17.439 ( -3.544 -19.260 0.425) 19.588 ======================= Grid point 409 (187/208) ======================= q-point: ( 0.38 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( 1.796 21.443 -0.515) 21.524 2.444 ( 7.836 5.176 -2.901) 9.829 2.710 ( -2.740 -0.789 -9.672) 10.084 3.358 ( -0.376 19.256 -4.052) 19.682 3.491 ( 3.940 12.720 11.040) 17.297 3.575 ( -2.377 13.407 -4.395) 14.308 4.048 ( 2.026 13.880 1.575) 14.116 4.126 ( 8.052 18.309 0.148) 20.002 4.402 ( -2.796 9.865 0.392) 10.261 4.756 ( 2.913 11.466 -2.073) 12.010 4.963 ( 5.521 5.103 -1.234) 7.618 5.038 ( 3.334 -1.612 1.558) 4.017 6.095 ( -2.177 6.847 -1.641) 7.370 6.253 ( 1.088 -11.359 4.734) 12.353 6.456 ( -1.128 15.855 -1.534) 15.969 6.613 ( 2.218 2.015 2.446) 3.868 6.763 ( -3.298 16.984 -3.208) 17.596 6.990 ( 1.832 4.143 6.423) 7.860 7.196 ( -3.715 -9.059 1.826) 9.960 7.878 ( 0.424 -6.292 -4.453) 7.720 8.056 ( 0.794 2.663 5.070) 5.782 8.316 ( 0.041 12.860 3.473) 13.321 8.415 ( -5.523 2.283 -1.779) 6.236 8.737 ( -4.296 -6.213 -4.731) 8.913 9.411 ( -4.524 -0.997 1.584) 4.896 10.260 ( 0.717 4.395 -1.172) 4.604 10.903 ( -4.175 -4.286 -2.413) 6.452 11.004 ( -0.245 -29.749 -0.542) 29.755 11.259 ( 8.646 1.269 8.012) 11.856 11.440 ( -0.674 11.160 0.049) 11.180 12.377 ( -2.911 1.760 -6.040) 6.932 12.512 ( -4.396 -1.210 -2.182) 5.054 12.660 ( -9.196 0.609 5.433) 10.698 12.905 ( 0.738 -2.194 1.462) 2.738 13.296 ( 3.500 5.681 -4.204) 7.886 13.603 ( -0.110 12.060 0.166) 12.062 13.636 ( -2.611 6.851 1.545) 7.492 13.896 ( 0.066 -0.382 -0.952) 1.028 14.131 ( 1.433 -2.477 3.605) 4.602 14.273 ( -4.189 1.418 -5.824) 7.313 14.981 ( 5.640 10.371 2.045) 11.982 15.200 ( 3.578 -1.676 1.036) 4.085 15.369 ( -0.935 -21.771 -2.189) 21.901 15.518 ( -0.657 1.654 3.413) 3.849 15.811 ( 8.946 3.413 -2.535) 9.905 16.558 ( 1.845 4.491 -0.740) 4.911 16.873 ( 0.340 4.883 -0.024) 4.895 17.375 ( -2.890 -18.305 0.279) 18.534 ======================= Grid point 410 (188/208) ======================= q-point: ( 0.50 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( -0.000 23.727 0.000) 23.727 2.566 ( 0.000 -0.154 0.000) 0.154 2.633 ( -0.000 -3.262 -0.000) 3.262 3.319 ( -0.000 23.100 0.000) 23.100 3.548 ( -0.000 8.679 0.000) 8.679 3.564 ( -0.000 13.115 -0.000) 13.115 4.070 ( -0.000 15.195 0.000) 15.195 4.228 ( 0.000 16.699 0.000) 16.699 4.352 ( -0.000 11.692 0.000) 11.692 4.781 ( -0.000 9.578 0.000) 9.578 5.030 ( -0.000 1.006 0.000) 1.006 5.069 ( -0.000 -1.853 0.000) 1.853 6.061 ( -0.000 13.255 0.000) 13.255 6.267 ( -0.000 -11.627 0.000) 11.627 6.470 ( -0.000 12.534 0.000) 12.534 6.642 ( -0.000 2.104 0.000) 2.104 6.723 ( -0.000 17.698 -0.000) 17.698 6.956 ( -0.000 3.044 0.000) 3.044 7.197 ( -0.000 -8.287 0.000) 8.287 7.880 ( -0.000 -10.840 -0.000) 10.840 8.081 ( 0.000 5.090 0.000) 5.090 8.267 ( 0.000 -6.863 0.000) 6.863 8.385 ( -0.000 27.338 -0.000) 27.338 8.704 ( -0.000 -7.400 0.000) 7.400 9.368 ( -0.000 3.864 0.000) 3.864 10.266 ( -0.000 2.573 0.000) 2.573 10.858 ( -0.000 -5.346 0.000) 5.346 11.000 ( -0.000 -30.496 0.000) 30.496 11.347 ( -0.000 12.296 0.000) 12.296 11.447 ( -0.000 2.508 -0.000) 2.508 12.384 ( 0.000 3.270 -0.000) 3.270 12.397 ( -0.000 11.382 0.000) 11.382 12.597 ( -0.000 -13.201 0.000) 13.201 12.915 ( -0.000 -2.073 0.000) 2.073 13.326 ( -0.000 7.351 0.000) 7.351 13.604 ( -0.000 12.450 0.000) 12.450 13.605 ( 0.000 6.043 -0.000) 6.043 13.894 ( -0.000 -0.035 0.000) 0.035 14.165 ( -0.000 -6.033 0.000) 6.033 14.212 ( -0.000 4.728 0.000) 4.728 15.031 ( -0.000 10.775 0.000) 10.775 15.247 ( -0.000 0.068 0.000) 0.068 15.345 ( -0.000 -28.533 0.000) 28.533 15.522 ( -0.000 4.691 0.000) 4.691 15.903 ( -0.000 -1.494 0.000) 1.494 16.577 ( -0.000 6.654 0.000) 6.654 16.872 ( -0.000 5.575 0.000) 5.575 17.346 ( -0.000 -17.755 0.000) 17.755 ======================= Grid point 415 (189/208) ======================= q-point: ( 0.00 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( -0.000 9.798 0.000) 9.798 2.676 ( -0.000 21.345 0.000) 21.345 3.121 ( 0.000 -1.394 0.000) 1.394 3.299 ( -0.000 14.687 -0.000) 14.687 3.658 ( 0.000 24.413 0.000) 24.413 3.924 ( -0.000 23.202 -0.000) 23.202 4.307 ( 0.000 8.868 0.000) 8.868 4.433 ( -0.000 8.221 0.000) 8.221 4.694 ( 0.000 9.128 0.000) 9.128 4.698 ( -0.000 24.895 -0.000) 24.895 4.887 ( 0.000 4.700 0.000) 4.700 5.105 ( 0.000 2.289 0.000) 2.289 5.848 ( -0.000 -15.582 0.000) 15.582 6.226 ( -0.000 3.758 -0.000) 3.758 6.316 ( 0.000 1.085 0.000) 1.085 6.759 ( -0.000 19.697 0.000) 19.697 6.921 ( -0.000 0.000 0.000) 0.000 7.188 ( -0.000 -2.208 -0.000) 2.208 7.700 ( 0.000 1.842 0.000) 1.842 7.897 ( -0.000 5.354 0.000) 5.354 8.166 ( -0.000 20.516 0.000) 20.516 8.279 ( -0.000 8.630 0.000) 8.630 8.341 ( 0.000 -10.561 -0.000) 10.561 9.118 ( -0.000 -18.776 0.000) 18.776 9.208 ( 0.000 -12.561 0.000) 12.561 10.244 ( 0.000 -34.908 0.000) 34.908 10.565 ( 0.000 18.841 0.000) 18.841 10.700 ( -0.000 -4.746 0.000) 4.746 11.073 ( 0.000 -10.723 0.000) 10.723 11.764 ( -0.000 18.754 0.000) 18.754 12.361 ( -0.000 -12.486 0.000) 12.486 12.758 ( -0.000 -3.108 0.000) 3.108 12.874 ( 0.000 -1.633 0.000) 1.633 12.894 ( 0.000 -8.896 -0.000) 8.896 13.114 ( -0.000 2.264 -0.000) 2.264 13.607 ( -0.000 1.018 0.000) 1.018 14.045 ( 0.000 14.764 0.000) 14.764 14.050 ( -0.000 -6.767 0.000) 6.767 14.242 ( -0.000 11.352 -0.000) 11.352 14.341 ( -0.000 -2.086 -0.000) 2.086 14.762 ( 0.000 21.302 0.000) 21.302 15.083 ( -0.000 4.033 0.000) 4.033 15.469 ( 0.000 2.154 0.000) 2.154 15.572 ( -0.000 6.801 0.000) 6.801 15.663 ( -0.000 -10.992 -0.000) 10.992 16.561 ( -0.000 -2.138 0.000) 2.138 16.592 ( 0.000 3.225 0.000) 3.225 17.103 ( -0.000 -20.984 0.000) 20.984 ======================= Grid point 417 (190/208) ======================= q-point: ( 0.12 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( 0.481 8.823 -2.907) 9.302 2.682 ( 0.616 20.510 -1.227) 20.556 2.985 ( -8.018 2.311 -13.087) 15.521 3.445 ( 8.393 9.541 16.044) 20.467 3.635 ( -1.098 22.739 0.186) 22.767 3.999 ( 5.844 21.293 -1.146) 22.110 4.250 ( -3.924 8.423 2.737) 9.687 4.437 ( -0.958 17.148 -3.458) 17.519 4.602 ( -1.631 12.167 -6.059) 13.689 4.823 ( 4.661 5.204 -0.777) 7.030 4.905 ( 3.176 12.344 0.428) 12.753 5.089 ( -1.563 3.389 1.005) 3.865 5.854 ( 0.304 -15.291 1.659) 15.384 6.158 ( -3.479 0.383 -1.510) 3.812 6.406 ( 6.685 3.082 0.223) 7.365 6.834 ( 5.263 16.761 5.508) 18.411 6.873 ( -3.692 1.243 0.387) 3.915 7.189 ( -0.001 -0.158 0.046) 0.164 7.595 ( -7.559 7.170 -8.884) 13.692 7.923 ( 1.259 2.291 -3.201) 4.133 8.161 ( -1.717 18.273 5.508) 19.162 8.317 ( -0.707 -10.506 0.657) 10.550 8.385 ( 8.251 10.457 8.850) 15.992 8.941 ( -11.484 -14.153 -7.448) 19.688 9.295 ( 2.843 -13.053 8.173) 15.660 10.263 ( 1.072 -33.348 0.160) 33.365 10.559 ( 0.599 15.727 1.850) 15.846 10.779 ( 7.069 -2.328 0.703) 7.476 11.032 ( -3.794 -10.351 -3.750) 11.645 11.773 ( 0.776 18.529 0.717) 18.559 12.338 ( -2.087 -12.737 -0.398) 12.913 12.694 ( -10.982 -2.884 -5.046) 12.425 12.760 ( 0.163 -3.857 0.343) 3.876 13.022 ( 8.918 -3.827 -5.834) 11.323 13.172 ( 2.691 3.200 7.087) 8.228 13.639 ( 3.106 0.399 0.895) 3.257 13.954 ( -4.678 3.892 -5.030) 7.896 14.039 ( -5.058 7.955 -2.856) 9.850 14.178 ( -4.675 3.638 2.673) 6.499 14.381 ( 1.112 0.301 8.752) 8.827 14.799 ( 4.457 16.442 -0.773) 17.053 15.107 ( 2.368 3.687 -0.873) 4.468 15.398 ( -8.240 -0.994 -5.690) 10.063 15.545 ( -4.114 -8.716 -0.164) 9.640 15.683 ( 5.276 6.666 2.511) 8.864 16.517 ( 1.109 1.766 -0.350) 2.115 16.748 ( 9.469 1.076 0.576) 9.548 17.089 ( -1.400 -20.367 0.037) 20.415 ======================= Grid point 418 (191/208) ======================= q-point: ( 0.25 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( 2.865 6.308 -4.076) 8.039 2.690 ( 0.458 18.446 -2.295) 18.594 2.823 ( -7.411 0.916 -9.087) 11.761 3.594 ( 4.528 8.050 11.800) 14.985 3.649 ( 2.562 18.034 2.439) 18.377 4.022 ( -4.234 15.118 -6.195) 16.878 4.251 ( 3.844 14.420 4.938) 15.719 4.425 ( 2.120 22.590 -4.353) 23.103 4.589 ( 0.225 7.549 -5.719) 9.473 4.869 ( 2.055 1.360 -0.628) 2.543 4.989 ( 3.436 8.134 0.416) 8.840 5.063 ( -0.914 5.135 1.524) 5.433 5.858 ( -0.142 -16.256 3.200) 16.568 6.140 ( 1.649 0.412 0.718) 1.845 6.541 ( 7.317 4.427 -1.369) 8.661 6.734 ( -7.896 -0.785 -4.056) 8.912 6.986 ( 6.034 13.495 9.233) 17.429 7.186 ( -0.280 4.713 0.121) 4.723 7.438 ( -7.064 10.402 -9.197) 15.579 7.937 ( 1.130 11.604 -3.876) 12.286 8.106 ( -4.209 7.060 6.179) 10.283 8.297 ( -1.192 -12.060 -2.828) 12.444 8.599 ( 10.534 15.086 14.897) 23.674 8.717 ( -10.492 -8.253 -4.568) 14.109 9.342 ( 1.700 -7.191 7.457) 10.497 10.272 ( 0.317 -27.409 0.883) 27.425 10.571 ( -0.455 8.936 -6.149) 10.857 10.874 ( -3.985 -8.592 -3.973) 10.271 11.016 ( 9.461 -2.200 5.578) 11.201 11.787 ( 0.254 18.640 0.941) 18.665 12.297 ( -1.639 -13.341 -1.092) 13.485 12.504 ( -7.265 -0.514 -5.788) 9.303 12.768 ( 0.483 -4.449 1.776) 4.815 13.092 ( -6.001 7.465 4.616) 10.632 13.272 ( 10.997 1.385 -7.430) 13.344 13.711 ( 3.534 0.323 2.950) 4.615 13.867 ( -5.926 10.393 0.934) 12.001 13.906 ( -4.309 -1.143 -5.692) 7.230 14.104 ( -3.492 0.053 -0.561) 3.538 14.380 ( -2.066 1.856 3.117) 4.175 14.875 ( -0.581 -3.358 5.679) 6.623 15.163 ( 3.057 1.869 0.125) 3.586 15.196 ( -7.012 -0.299 0.038) 7.019 15.519 ( 0.800 -3.353 -0.180) 3.452 15.790 ( 5.231 4.935 -6.248) 9.526 16.592 ( 6.002 5.443 0.371) 8.111 16.892 ( 4.904 0.359 1.223) 5.067 17.061 ( -1.189 -16.798 0.061) 16.840 ======================= Grid point 419 (192/208) ======================= q-point: ( 0.38 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 5.603 3.792 -3.083) 7.435 2.670 ( -7.542 0.181 -2.845) 8.063 2.694 ( 0.337 14.397 -2.859) 14.682 3.668 ( 2.761 9.256 2.196) 9.906 3.714 ( 2.543 11.537 5.881) 13.197 3.896 ( -6.056 17.476 -5.538) 19.307 4.344 ( 4.062 15.960 5.006) 17.213 4.483 ( 3.138 16.764 -5.415) 17.894 4.584 ( 0.255 8.852 -2.712) 9.262 4.910 ( 2.051 4.653 -0.586) 5.119 5.017 ( 0.388 -0.334 1.731) 1.805 5.060 ( -0.348 3.305 0.719) 3.400 5.875 ( 1.389 -18.874 3.359) 19.221 6.193 ( 2.860 3.194 0.669) 4.339 6.574 ( -5.987 2.430 -3.559) 7.377 6.670 ( 4.622 2.519 -1.424) 5.453 7.067 ( 1.280 8.263 5.095) 9.791 7.191 ( 0.856 9.291 1.745) 9.492 7.311 ( -4.753 13.515 -7.054) 15.969 7.937 ( -0.877 19.656 -2.380) 19.819 8.077 ( 1.038 -1.889 2.811) 3.542 8.249 ( -4.008 -6.978 1.157) 8.129 8.538 ( -6.143 -9.304 -3.506) 11.688 8.806 ( 7.488 20.925 10.608) 24.627 9.398 ( 2.774 -0.848 5.280) 6.024 10.298 ( 2.480 -23.244 2.654) 23.527 10.506 ( -4.709 2.669 -8.544) 10.114 10.745 ( -6.044 -11.633 -5.699) 14.294 11.255 ( 11.136 1.564 7.488) 13.510 11.785 ( -0.313 19.600 0.653) 19.613 12.286 ( 0.521 -14.355 -1.022) 14.401 12.422 ( -0.156 2.448 -4.534) 5.155 12.780 ( -0.192 -4.041 3.685) 5.472 12.887 ( -13.544 11.832 1.160) 18.022 13.470 ( 9.715 7.618 -7.785) 14.595 13.724 ( -3.630 2.718 0.900) 4.623 13.793 ( 0.582 4.997 3.181) 5.952 13.876 ( -0.185 -0.484 -4.283) 4.315 14.054 ( -1.406 -3.587 -0.161) 3.856 14.331 ( -2.849 3.293 0.001) 4.354 14.764 ( -8.100 -27.570 6.369) 29.433 15.172 ( 2.121 2.428 3.246) 4.574 15.229 ( 1.937 6.006 -1.233) 6.430 15.562 ( 3.326 -0.405 0.367) 3.370 15.845 ( 1.827 0.056 -6.325) 6.584 16.709 ( 5.442 8.615 0.155) 10.191 16.930 ( -0.258 -6.479 0.939) 6.552 17.057 ( 0.365 -6.416 0.400) 6.439 ======================= Grid point 420 (193/208) ======================= q-point: ( 0.50 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.403 ( -0.000 3.870 -0.000) 3.870 2.566 ( -0.000 -3.256 0.000) 3.256 2.696 ( -0.000 14.530 -0.000) 14.530 3.706 ( -0.000 7.350 0.000) 7.350 3.738 ( -0.000 12.334 -0.000) 12.334 3.828 ( -0.000 17.937 0.000) 17.937 4.392 ( -0.000 16.774 0.000) 16.774 4.503 ( 0.000 11.345 -0.000) 11.345 4.588 ( -0.000 11.660 0.000) 11.660 4.931 ( -0.000 5.762 0.000) 5.762 5.026 ( 0.000 -1.572 0.000) 1.572 5.051 ( -0.000 0.224 0.000) 0.224 5.898 ( -0.000 -20.173 0.000) 20.173 6.223 ( -0.000 3.944 0.000) 3.944 6.506 ( -0.000 2.277 0.000) 2.277 6.718 ( -0.000 3.793 0.000) 3.793 7.077 ( 0.000 7.710 0.000) 7.710 7.207 ( -0.000 9.388 0.000) 9.388 7.254 ( -0.000 15.588 -0.000) 15.588 7.922 ( -0.000 18.382 -0.000) 18.382 8.116 ( -0.000 -8.065 0.000) 8.065 8.183 ( 0.000 4.219 0.000) 4.219 8.480 ( -0.000 -10.447 0.000) 10.447 8.890 ( -0.000 22.393 0.000) 22.393 9.434 ( -0.000 1.729 0.000) 1.729 10.360 ( -0.000 -31.401 -0.000) 31.401 10.412 ( 0.000 9.493 0.000) 9.493 10.677 ( -0.000 -12.490 0.000) 12.490 11.378 ( -0.000 2.240 0.000) 2.240 11.783 ( -0.000 20.311 0.000) 20.311 12.292 ( -0.000 -15.100 0.000) 15.100 12.457 ( 0.000 2.840 0.000) 2.840 12.689 ( -0.000 15.969 0.000) 15.969 12.797 ( -0.000 -6.261 -0.000) 6.261 13.565 ( -0.000 12.982 0.000) 12.982 13.683 ( -0.000 1.846 0.000) 1.846 13.809 ( -0.000 8.046 -0.000) 8.046 13.865 ( -0.000 -2.926 0.000) 2.926 14.045 ( -0.000 -5.796 0.000) 5.796 14.299 ( -0.000 3.891 0.000) 3.891 14.686 ( 0.000 -34.559 -0.000) 34.559 15.208 ( -0.000 -2.017 -0.000) 2.017 15.234 ( 0.000 8.962 0.000) 8.962 15.605 ( -0.000 1.991 0.000) 1.991 15.852 ( -0.000 -3.214 0.000) 3.214 16.765 ( -0.000 9.770 0.000) 9.770 16.923 ( -0.000 -8.839 0.000) 8.839 17.061 ( -0.000 -2.405 0.000) 2.405 ======================= Grid point 425 (194/208) ======================= q-point: ( 0.00 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( -0.000 10.233 0.000) 10.233 3.030 ( 0.000 14.174 0.000) 14.174 3.066 ( -0.000 -4.015 -0.000) 4.015 3.526 ( -0.000 8.446 0.000) 8.446 4.134 ( 0.000 22.855 0.000) 22.855 4.296 ( -0.000 13.407 0.000) 13.407 4.408 ( 0.000 3.422 0.000) 3.422 4.498 ( -0.000 0.067 0.000) 0.067 4.847 ( 0.000 8.048 -0.000) 8.048 5.013 ( -0.000 4.182 0.000) 4.182 5.113 ( -0.000 14.216 0.000) 14.216 5.241 ( -0.000 11.620 0.000) 11.620 5.633 ( -0.000 -6.029 0.000) 6.029 6.291 ( -0.000 2.039 0.000) 2.039 6.315 ( 0.000 0.032 0.000) 0.032 6.874 ( -0.000 -5.471 0.000) 5.471 7.178 ( -0.000 11.452 0.000) 11.452 7.220 ( -0.000 15.907 0.000) 15.907 7.654 ( 0.000 0.775 0.000) 0.775 7.923 ( 0.000 -2.776 0.000) 2.776 8.028 ( -0.000 -11.504 0.000) 11.504 8.384 ( -0.000 2.972 0.000) 2.972 8.676 ( -0.000 -4.545 0.000) 4.545 8.969 ( -0.000 23.429 -0.000) 23.429 8.990 ( 0.000 -9.420 0.000) 9.420 9.591 ( 0.000 -30.981 0.000) 30.981 10.633 ( 0.000 -2.214 0.000) 2.214 10.780 ( -0.000 -15.869 0.000) 15.869 10.911 ( 0.000 13.251 0.000) 13.251 12.121 ( 0.000 -11.390 0.000) 11.390 12.157 ( -0.000 19.459 0.000) 19.459 12.717 ( -0.000 -8.425 0.000) 8.425 12.720 ( 0.000 -1.046 -0.000) 1.046 12.852 ( 0.000 -0.386 0.000) 0.386 13.136 ( -0.000 0.153 -0.000) 0.153 13.623 ( -0.000 0.634 0.000) 0.634 13.917 ( 0.000 -6.048 0.000) 6.048 14.292 ( -0.000 -2.508 -0.000) 2.508 14.292 ( 0.000 9.971 0.000) 9.971 14.463 ( -0.000 10.756 0.000) 10.756 15.115 ( 0.000 12.905 0.000) 12.905 15.172 ( -0.000 4.816 0.000) 4.816 15.410 ( -0.000 -6.592 -0.000) 6.592 15.608 ( 0.000 5.186 0.000) 5.186 15.652 ( -0.000 1.448 -0.000) 1.448 16.505 ( -0.000 -3.201 0.000) 3.201 16.632 ( 0.000 0.181 0.000) 0.181 16.705 ( -0.000 -18.583 0.000) 18.583 ======================= Grid point 427 (195/208) ======================= q-point: ( 0.12 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( -1.745 9.199 -2.557) 9.706 2.955 ( -7.182 -0.097 -7.920) 10.692 3.043 ( -1.099 11.180 2.136) 11.436 3.607 ( 6.007 6.578 8.386) 12.234 4.069 ( -5.318 20.623 1.405) 21.344 4.284 ( -2.261 7.299 -1.982) 7.894 4.454 ( 4.956 8.941 0.570) 10.239 4.521 ( 2.192 0.264 0.009) 2.208 4.875 ( 2.832 8.610 -1.129) 9.134 4.952 ( -4.264 8.435 -5.488) 10.930 5.126 ( -0.183 9.088 0.271) 9.094 5.216 ( -2.241 9.850 -0.127) 10.103 5.650 ( 0.586 -6.304 0.680) 6.367 6.201 ( -3.503 4.359 1.002) 5.681 6.425 ( 7.060 -1.562 -2.745) 7.734 6.815 ( -5.059 -4.630 -3.506) 7.702 7.238 ( 4.768 5.586 0.038) 7.345 7.252 ( 2.899 21.392 2.690) 21.754 7.608 ( -3.685 2.388 -5.704) 7.199 7.936 ( 1.087 -2.848 5.344) 6.152 8.037 ( 1.090 -11.192 -2.775) 11.583 8.472 ( 7.028 2.353 10.303) 12.692 8.569 ( -8.409 -2.349 -5.737) 10.447 8.935 ( -1.310 20.298 4.167) 20.763 9.089 ( 6.107 -4.651 7.858) 10.985 9.620 ( 2.553 -30.681 0.288) 30.788 10.683 ( 1.446 -8.048 0.317) 8.183 10.796 ( 4.415 -7.582 4.796) 9.999 10.896 ( -0.533 12.327 -9.456) 15.545 12.092 ( -2.707 -11.253 -0.915) 11.610 12.161 ( 0.263 18.695 0.158) 18.698 12.619 ( -6.434 -3.987 -1.693) 7.756 12.739 ( -0.999 0.824 -0.143) 1.303 12.924 ( 9.299 -5.539 -8.051) 13.490 13.199 ( 4.083 -0.061 6.891) 8.010 13.644 ( 2.163 0.262 0.848) 2.338 13.884 ( -2.376 -5.134 -6.106) 8.324 14.206 ( -4.635 1.191 -2.225) 5.277 14.287 ( -7.129 9.931 -1.029) 12.268 14.436 ( -1.423 4.947 12.444) 13.467 15.077 ( -6.435 10.130 0.692) 12.021 15.191 ( 1.068 4.192 -0.397) 4.344 15.354 ( -8.454 -2.722 -1.480) 9.004 15.440 ( -2.946 -0.223 -2.328) 3.761 15.766 ( 5.125 1.424 -1.925) 5.657 16.551 ( 5.559 1.763 0.299) 5.839 16.666 ( 0.167 -15.607 -0.262) 15.610 16.789 ( 9.469 -3.671 1.673) 10.293 ======================= Grid point 428 (196/208) ======================= q-point: ( 0.25 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( -0.807 6.315 -3.958) 7.497 2.788 ( -8.843 -2.228 -5.021) 10.410 3.021 ( -1.499 12.812 0.579) 12.912 3.728 ( 4.860 5.590 7.973) 10.883 3.972 ( -4.924 13.933 2.072) 14.923 4.228 ( -3.034 7.722 -2.623) 8.701 4.555 ( 4.993 5.646 0.854) 7.585 4.578 ( 4.151 4.081 -2.653) 6.397 4.869 ( -2.920 12.728 -5.917) 14.337 4.937 ( 3.149 6.219 -0.796) 7.016 5.095 ( -2.520 4.944 -0.647) 5.587 5.163 ( -3.655 7.073 1.892) 8.183 5.629 ( -2.106 -7.165 0.319) 7.475 6.198 ( 2.112 3.945 0.436) 4.496 6.547 ( 5.038 -4.441 -1.683) 6.924 6.721 ( -2.233 1.437 -4.639) 5.346 7.276 ( 0.117 13.016 2.096) 13.184 7.351 ( 5.406 12.127 -0.378) 13.283 7.521 ( -4.156 5.576 -5.425) 8.820 7.972 ( 1.166 -4.716 2.870) 5.642 8.061 ( 1.925 -8.401 -0.288) 8.623 8.397 ( -7.885 -2.398 -2.797) 8.703 8.616 ( 4.674 14.076 6.176) 16.066 8.970 ( 4.639 16.238 12.666) 21.110 9.222 ( 6.450 -3.574 8.838) 11.511 9.676 ( 3.330 -28.731 1.460) 28.960 10.613 ( -6.214 -15.541 -8.241) 18.656 10.809 ( -4.986 9.768 -8.629) 13.955 11.051 ( 16.419 5.324 7.165) 18.688 12.036 ( -2.580 -11.863 -1.244) 12.204 12.166 ( 0.271 17.933 0.306) 17.937 12.508 ( -3.959 0.819 -3.255) 5.190 12.720 ( -0.807 -0.577 0.466) 1.096 13.139 ( 12.532 -5.147 -6.505) 15.029 13.256 ( 1.510 -0.157 2.067) 2.565 13.703 ( 3.647 -0.517 2.834) 4.648 13.836 ( -1.126 -3.989 -8.076) 9.077 14.060 ( -13.391 7.185 3.088) 15.507 14.120 ( -5.389 2.156 -0.550) 5.830 14.427 ( -1.879 2.604 2.832) 4.282 14.771 ( -23.301 -4.069 7.086) 24.692 15.188 ( -0.097 2.997 0.832) 3.112 15.327 ( 2.893 6.871 -0.168) 7.457 15.444 ( 2.425 -2.965 0.426) 3.854 15.832 ( 2.772 -0.113 -8.101) 8.563 16.646 ( -0.077 -14.938 -0.061) 14.938 16.705 ( 7.975 2.614 0.412) 8.403 16.976 ( 8.646 0.902 2.334) 9.001 ======================= Grid point 429 (197/208) ======================= q-point: ( 0.38 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( 2.371 2.537 -3.705) 5.078 2.619 ( -8.257 -2.759 -1.045) 8.769 2.995 ( -1.131 12.631 -0.094) 12.682 3.809 ( 2.748 5.860 3.427) 7.323 3.902 ( -2.711 7.350 2.466) 8.213 4.164 ( -2.917 9.044 -2.568) 9.843 4.638 ( 3.649 5.504 1.335) 6.737 4.659 ( 4.592 8.175 -4.475) 10.390 4.821 ( -1.636 11.098 -3.961) 11.897 4.979 ( 1.206 2.440 0.650) 2.798 5.048 ( -2.034 4.684 -0.195) 5.111 5.086 ( -4.510 0.894 3.020) 5.501 5.613 ( 0.480 -5.475 0.383) 5.510 6.220 ( -0.454 -2.573 -1.593) 3.060 6.586 ( 1.201 0.858 -1.064) 1.819 6.758 ( 4.321 5.106 -1.515) 6.858 7.263 ( -1.358 11.851 1.781) 12.061 7.414 ( -0.216 5.530 -6.497) 8.534 7.462 ( 0.236 13.677 2.277) 13.867 7.974 ( -0.797 -6.474 -0.445) 6.538 8.099 ( 1.628 -5.634 -0.248) 5.869 8.282 ( -4.029 0.910 1.241) 4.313 8.664 ( 0.842 25.448 0.626) 25.469 9.125 ( 7.368 8.969 13.580) 17.865 9.344 ( 4.580 -4.155 5.792) 8.473 9.758 ( 4.783 -23.663 3.837) 24.444 10.467 ( -6.636 -15.700 -8.781) 19.174 10.670 ( -7.073 7.419 -9.512) 13.983 11.376 ( 14.534 10.884 7.096) 19.495 12.001 ( -0.956 -13.097 -0.864) 13.160 12.170 ( 0.054 17.686 0.205) 17.688 12.483 ( 1.986 3.532 -2.068) 4.549 12.710 ( -0.301 -1.968 0.616) 2.084 13.121 ( -9.515 10.122 2.619) 14.136 13.470 ( 17.568 -10.007 -13.046) 24.062 13.771 ( -1.779 2.772 -0.503) 3.332 13.783 ( -0.731 -2.850 -0.017) 2.942 13.894 ( -1.406 0.296 1.112) 1.816 14.025 ( -4.695 0.040 -1.230) 4.853 14.326 ( -18.577 -11.364 3.294) 22.025 14.398 ( -6.346 0.710 7.826) 10.100 15.195 ( 0.454 2.179 0.643) 2.317 15.355 ( 0.361 3.563 -0.872) 3.686 15.529 ( 4.962 -1.740 3.872) 6.530 15.844 ( 0.138 0.464 -7.858) 7.873 16.636 ( -0.400 -15.696 0.046) 15.701 16.850 ( 6.175 4.947 -0.121) 7.913 17.101 ( 4.178 3.739 1.891) 5.917 ======================= Grid point 430 (198/208) ======================= q-point: ( 0.50 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( 0.000 0.181 -0.000) 0.181 2.510 ( -0.000 -2.277 0.000) 2.277 2.984 ( -0.000 12.493 0.000) 12.493 3.839 ( -0.000 6.004 0.000) 6.004 3.878 ( -0.000 4.716 -0.000) 4.716 4.130 ( -0.000 9.686 0.000) 9.686 4.681 ( -0.000 5.823 0.000) 5.823 4.707 ( -0.000 13.020 -0.000) 13.020 4.796 ( 0.000 9.894 0.000) 9.894 4.989 ( 0.000 -6.410 -0.000) 6.410 5.027 ( 0.000 2.934 -0.000) 2.934 5.038 ( -0.000 3.650 0.000) 3.650 5.624 ( -0.000 -4.636 0.000) 4.636 6.204 ( -0.000 -5.531 0.000) 5.531 6.604 ( -0.000 5.744 0.000) 5.744 6.804 ( -0.000 4.787 0.000) 4.787 7.249 ( -0.000 11.133 0.000) 11.133 7.387 ( -0.000 4.234 -0.000) 4.234 7.482 ( -0.000 15.510 -0.000) 15.510 7.962 ( -0.000 -6.331 0.000) 6.331 8.114 ( 0.000 -5.265 0.000) 5.265 8.246 ( -0.000 2.315 0.000) 2.315 8.671 ( -0.000 28.662 0.000) 28.662 9.216 ( -0.000 6.488 0.000) 6.488 9.394 ( -0.000 -4.655 0.000) 4.655 9.822 ( -0.000 -20.187 0.000) 20.187 10.386 ( -0.000 -15.951 0.000) 15.951 10.579 ( -0.000 6.436 0.000) 6.436 11.534 ( -0.000 13.977 0.000) 13.977 11.992 ( -0.000 -14.343 0.000) 14.343 12.171 ( -0.000 17.861 0.000) 17.861 12.529 ( -0.000 4.032 0.000) 4.032 12.709 ( -0.000 -2.601 0.000) 2.601 12.984 ( -0.000 13.220 0.000) 13.220 13.674 ( -0.000 -5.151 0.000) 5.151 13.755 ( -0.000 -8.967 0.000) 8.967 13.791 ( 0.000 9.253 -0.000) 9.253 13.930 ( -0.000 4.823 0.000) 4.823 13.940 ( 0.000 -5.262 -0.000) 5.262 14.067 ( 0.000 -23.080 -0.000) 23.080 14.361 ( -0.000 2.205 -0.000) 2.205 15.200 ( -0.000 1.460 0.000) 1.460 15.356 ( -0.000 3.010 0.000) 3.010 15.589 ( -0.000 -3.204 -0.000) 3.204 15.832 ( -0.000 1.866 0.000) 1.866 16.633 ( -0.000 -15.037 0.000) 15.037 16.911 ( -0.000 4.655 0.000) 4.655 17.141 ( -0.000 5.044 0.000) 5.044 ======================= Grid point 435 (199/208) ======================= q-point: ( 0.00 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.620 ( -0.000 9.117 0.000) 9.117 2.967 ( 0.000 -5.788 0.000) 5.788 3.233 ( -0.000 6.422 0.000) 6.422 3.650 ( -0.000 4.239 0.000) 4.239 4.363 ( -0.000 -0.628 0.000) 0.628 4.438 ( 0.000 3.342 0.000) 3.342 4.483 ( 0.000 2.609 0.000) 2.609 4.687 ( -0.000 20.952 0.000) 20.952 5.044 ( 0.000 4.704 -0.000) 4.704 5.063 ( -0.000 7.899 0.000) 7.899 5.248 ( -0.000 1.217 0.000) 1.217 5.446 ( -0.000 6.274 0.000) 6.274 5.491 ( 0.000 -10.698 -0.000) 10.698 6.311 ( -0.000 0.908 0.000) 0.908 6.373 ( -0.000 5.003 0.000) 5.003 6.716 ( 0.000 -9.157 0.000) 9.157 7.274 ( -0.000 4.142 0.000) 4.142 7.691 ( 0.000 19.963 -0.000) 19.963 7.750 ( -0.000 6.781 0.000) 6.781 7.858 ( 0.000 2.317 0.000) 2.317 7.882 ( -0.000 -2.797 0.000) 2.797 8.416 ( 0.000 -0.026 0.000) 0.026 8.444 ( -0.000 -11.732 -0.000) 11.732 8.837 ( 0.000 -5.779 0.000) 5.779 9.010 ( 0.000 -27.476 0.000) 27.476 9.545 ( -0.000 27.426 0.000) 27.426 10.423 ( -0.000 -19.039 0.000) 19.039 10.608 ( 0.000 -0.509 0.000) 0.509 11.123 ( 0.000 7.217 0.000) 7.217 11.930 ( 0.000 -7.334 0.000) 7.334 12.458 ( -0.000 7.651 0.000) 7.651 12.599 ( -0.000 -0.971 0.000) 0.971 12.707 ( 0.000 -0.318 -0.000) 0.318 12.856 ( 0.000 0.543 0.000) 0.543 13.130 ( -0.000 -0.543 -0.000) 0.543 13.633 ( 0.000 0.346 0.000) 0.346 13.823 ( 0.000 -3.339 0.000) 3.339 14.251 ( -0.000 -1.435 0.000) 1.435 14.440 ( -0.000 5.026 0.000) 5.026 14.651 ( 0.000 7.610 0.000) 7.610 15.222 ( 0.000 -1.057 0.000) 1.057 15.259 ( -0.000 3.411 0.000) 3.411 15.367 ( -0.000 2.379 0.000) 2.379 15.654 ( 0.000 -0.243 0.000) 0.243 15.750 ( -0.000 7.346 -0.000) 7.346 16.361 ( -0.000 -12.310 0.000) 12.310 16.476 ( -0.000 -2.496 0.000) 2.496 16.601 ( 0.000 -2.669 0.000) 2.669 ======================= Grid point 437 (200/208) ======================= q-point: ( 0.12 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.579 ( -3.762 8.202 -1.939) 9.230 2.891 ( -7.068 -4.520 -1.370) 8.501 3.228 ( -0.734 6.045 0.740) 6.134 3.707 ( 4.954 3.584 4.218) 7.429 4.330 ( -7.130 -0.840 -1.071) 7.259 4.413 ( -1.040 0.619 -1.835) 2.198 4.428 ( -0.821 10.185 0.729) 10.244 4.733 ( 2.545 12.226 -0.285) 12.491 5.029 ( -1.730 3.833 0.583) 4.245 5.058 ( -0.141 6.960 -1.082) 7.045 5.212 ( -2.720 2.003 -0.866) 3.487 5.432 ( -2.603 3.346 0.459) 4.264 5.519 ( 3.395 -3.940 -5.692) 7.711 6.266 ( -3.777 -2.353 -4.495) 6.326 6.417 ( 3.975 5.222 3.808) 7.587 6.706 ( -0.053 -6.091 -2.524) 6.593 7.331 ( 5.497 4.120 -1.042) 6.948 7.672 ( -1.882 15.168 0.186) 15.286 7.751 ( -0.223 10.907 -2.666) 11.230 7.882 ( 0.671 -0.947 0.552) 1.285 7.899 ( 3.317 0.616 0.778) 3.462 8.313 ( -4.882 -9.681 3.029) 11.258 8.599 ( 9.455 0.769 8.363) 12.647 8.893 ( 4.261 -7.645 4.177) 9.698 9.043 ( 4.395 -25.152 2.768) 25.683 9.523 ( -2.044 25.818 1.241) 25.929 10.372 ( -3.575 -18.416 -5.240) 19.478 10.784 ( 15.789 1.747 7.963) 17.769 11.084 ( -3.511 6.119 -7.992) 10.660 11.896 ( -3.085 -7.567 -1.208) 8.260 12.462 ( 0.325 8.890 -0.008) 8.896 12.564 ( -2.608 -0.036 2.124) 3.364 12.759 ( 2.277 0.617 -3.992) 4.637 12.836 ( 1.777 -2.621 -6.511) 7.241 13.186 ( 4.241 -0.875 5.771) 7.215 13.649 ( 1.617 0.168 0.861) 1.840 13.800 ( -1.592 -3.044 -4.862) 5.953 14.202 ( -4.174 -0.578 -2.530) 4.915 14.446 ( -2.023 5.409 -0.733) 5.821 14.542 ( -9.725 4.894 10.529) 15.146 15.145 ( -12.757 -1.412 0.945) 12.869 15.261 ( 0.136 3.394 0.369) 3.417 15.390 ( 2.479 4.166 -0.180) 4.851 15.480 ( -10.590 3.286 -2.751) 11.425 15.763 ( 2.491 -0.774 -3.728) 4.550 16.357 ( -0.672 -13.043 -0.062) 13.061 16.594 ( 9.231 2.542 0.749) 9.604 16.736 ( 12.520 -3.206 1.715) 13.037 ======================= Grid point 438 (201/208) ======================= q-point: ( 0.25 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( -4.292 5.914 -2.982) 7.892 2.730 ( -9.207 -3.341 -0.212) 9.796 3.207 ( -1.496 5.941 0.423) 6.142 3.816 ( 5.175 3.212 4.749) 7.723 4.159 ( -8.998 4.572 0.498) 10.105 4.349 ( -4.142 0.914 -4.887) 6.471 4.494 ( 5.575 4.017 1.154) 6.967 4.759 ( 0.657 4.193 -1.496) 4.500 4.970 ( -4.049 -2.472 0.771) 4.807 5.061 ( 0.319 8.201 -1.919) 8.429 5.174 ( -1.303 5.520 -0.394) 5.685 5.333 ( -7.531 2.243 -0.361) 7.866 5.583 ( 3.975 3.582 -4.608) 7.062 6.174 ( -4.691 -7.174 -6.374) 10.682 6.520 ( 5.865 4.045 4.137) 8.239 6.734 ( 3.677 -1.477 -1.916) 4.401 7.446 ( 6.151 5.973 -2.515) 8.935 7.630 ( -2.534 13.889 -0.633) 14.132 7.725 ( -1.785 10.776 -0.732) 10.947 7.900 ( 0.660 -0.207 -1.204) 1.389 7.960 ( 2.699 -2.769 -2.118) 4.409 8.262 ( -1.379 -4.985 7.443) 9.064 8.802 ( 9.216 -2.121 11.960) 15.247 8.964 ( 3.775 -9.987 1.630) 10.801 9.218 ( 12.027 -13.395 10.703) 20.944 9.488 ( -1.848 22.289 2.594) 22.515 10.276 ( -5.502 -17.804 -8.429) 20.452 10.950 ( -7.479 4.477 -10.376) 13.551 11.191 ( 23.503 7.432 8.383) 26.036 11.830 ( -3.170 -8.090 -1.526) 8.822 12.464 ( -0.141 10.600 0.018) 10.601 12.533 ( -0.617 1.739 0.707) 1.976 12.729 ( -2.361 1.007 -0.736) 2.670 12.962 ( 10.643 -9.387 -13.297) 19.448 13.265 ( 2.269 0.198 5.911) 6.335 13.692 ( 2.538 -0.605 1.822) 3.182 13.771 ( 0.181 -2.227 -5.968) 6.372 14.105 ( -5.674 0.300 -2.553) 6.229 14.232 ( -16.752 5.879 5.439) 18.569 14.467 ( -2.767 1.145 -0.376) 3.018 14.726 ( -27.653 -0.942 7.968) 28.794 15.264 ( 0.086 4.026 0.452) 4.052 15.383 ( -1.141 0.046 -1.865) 2.187 15.450 ( 2.404 2.153 4.063) 5.188 15.821 ( 4.317 -0.273 -9.588) 10.519 16.352 ( 0.333 -12.084 0.230) 12.090 16.768 ( 8.742 2.037 0.800) 9.012 16.983 ( 11.847 -0.021 2.234) 12.056 ======================= Grid point 439 (202/208) ======================= q-point: ( 0.38 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -1.454 2.840 -2.815) 4.255 2.567 ( -7.649 -2.478 1.058) 8.110 3.181 ( -1.112 6.142 0.101) 6.242 3.902 ( 3.143 3.404 2.052) 5.067 4.023 ( -5.305 5.438 1.705) 7.786 4.264 ( -3.435 0.810 -4.034) 5.360 4.610 ( 5.821 -1.724 -0.063) 6.071 4.769 ( 1.311 -0.009 -0.740) 1.505 4.905 ( -3.038 -4.027 0.452) 5.065 5.052 ( -0.930 9.645 -2.009) 9.896 5.146 ( -3.264 4.319 3.218) 6.298 5.189 ( -4.978 5.841 -2.495) 8.070 5.643 ( 2.719 5.270 -2.035) 6.270 6.083 ( -3.586 -9.118 -4.765) 10.895 6.628 ( 4.471 2.390 1.441) 5.271 6.824 ( 5.172 1.235 0.470) 5.338 7.517 ( 1.423 10.676 -3.403) 11.295 7.571 ( -3.394 13.272 -0.838) 13.725 7.722 ( 2.084 9.297 0.857) 9.566 7.888 ( -1.478 -1.889 -0.471) 2.445 7.997 ( 1.547 -3.880 -2.318) 4.777 8.269 ( 0.417 0.267 5.384) 5.407 8.914 ( 1.856 -21.187 2.560) 21.421 9.102 ( 8.633 11.597 8.044) 16.544 9.465 ( -1.061 14.521 3.751) 15.036 9.471 ( 11.357 -6.537 10.459) 16.766 10.146 ( -6.023 -16.361 -9.424) 19.819 10.769 ( -8.516 2.813 -10.361) 13.704 11.651 ( 20.176 13.824 9.060) 26.082 11.789 ( 0.081 -6.226 -1.174) 6.336 12.460 ( -0.233 10.646 0.093) 10.649 12.551 ( 2.619 2.905 0.618) 3.959 12.694 ( -1.202 -0.082 -0.431) 1.280 13.134 ( 7.526 -18.954 -16.082) 25.972 13.275 ( -0.771 4.573 2.921) 5.481 13.731 ( 0.710 -2.005 -0.949) 2.330 13.803 ( 3.067 0.264 -0.417) 3.106 13.903 ( -13.023 0.744 0.778) 13.068 14.014 ( -6.057 -0.883 -2.023) 6.447 14.248 ( -20.754 1.560 11.073) 23.575 14.417 ( -3.683 0.019 0.559) 3.725 15.265 ( -0.102 4.462 0.206) 4.468 15.374 ( 0.070 -0.338 -1.199) 1.248 15.490 ( 1.061 -2.621 3.570) 4.554 15.879 ( 3.006 2.622 -6.794) 7.878 16.366 ( 0.807 -10.811 0.282) 10.845 16.906 ( 5.361 1.049 0.410) 5.478 17.160 ( 6.329 2.121 1.510) 6.844 ======================= Grid point 440 (203/208) ======================= q-point: ( 0.50 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( 0.000 0.235 -0.000) 0.235 2.478 ( -0.000 -0.986 0.000) 0.986 3.170 ( -0.000 6.246 0.000) 6.246 3.935 ( -0.000 3.461 0.000) 3.461 3.973 ( -0.000 5.581 -0.000) 5.581 4.226 ( -0.000 0.747 0.000) 0.747 4.669 ( -0.000 -7.816 0.000) 7.816 4.822 ( -0.000 1.495 0.000) 1.495 4.843 ( 0.000 -3.349 -0.000) 3.349 5.036 ( 0.000 11.906 -0.000) 11.906 5.086 ( -0.000 2.353 0.000) 2.353 5.164 ( -0.000 6.914 0.000) 6.914 5.669 ( -0.000 5.142 0.000) 5.142 6.042 ( -0.000 -9.161 0.000) 9.161 6.673 ( -0.000 0.959 0.000) 0.959 6.884 ( 0.000 2.825 0.000) 2.825 7.508 ( 0.000 7.826 -0.000) 7.826 7.540 ( -0.000 17.460 0.000) 17.460 7.759 ( -0.000 11.112 -0.000) 11.112 7.866 ( -0.000 -4.328 0.000) 4.328 8.009 ( -0.000 -3.510 0.000) 3.510 8.279 ( 0.000 1.444 0.000) 1.444 8.929 ( -0.000 -24.056 0.000) 24.056 9.208 ( -0.000 22.957 -0.000) 22.957 9.458 ( 0.000 4.471 0.000) 4.471 9.604 ( -0.000 -4.730 0.000) 4.730 10.069 ( -0.000 -15.420 0.000) 15.420 10.665 ( -0.000 2.406 0.000) 2.406 11.754 ( -0.000 -8.979 0.000) 8.979 11.916 ( 0.000 23.317 0.000) 23.317 12.458 ( -0.000 10.584 0.000) 10.584 12.604 ( -0.000 3.135 0.000) 3.135 12.682 ( -0.000 -0.482 0.000) 0.482 13.120 ( -0.000 -12.515 0.000) 12.515 13.313 ( -0.000 -8.933 0.000) 8.933 13.692 ( -0.000 -0.529 0.000) 0.529 13.803 ( -0.000 -5.761 0.000) 5.761 13.900 ( -0.000 2.134 -0.000) 2.134 13.901 ( 0.000 -2.208 0.000) 2.208 14.042 ( 0.000 6.206 -0.000) 6.206 14.380 ( -0.000 -0.214 0.000) 0.214 15.263 ( -0.000 4.513 0.000) 4.513 15.375 ( -0.000 -0.175 0.000) 0.175 15.503 ( -0.000 -4.840 0.000) 4.840 15.903 ( -0.000 3.995 0.000) 3.995 16.375 ( -0.000 -10.246 0.000) 10.246 16.958 ( -0.000 0.634 0.000) 0.634 17.221 ( -0.000 2.866 -0.000) 2.866 ======================= Grid point 445 (204/208) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.746 ( -0.000 -0.000 0.000) 0.000 2.874 ( 0.000 0.000 0.000) 0.000 3.294 ( -0.000 0.000 0.000) 0.000 3.693 ( 0.000 0.000 0.000) 0.000 4.344 ( 0.000 0.000 0.000) 0.000 4.486 ( -0.000 -0.000 0.000) 0.000 4.489 ( 0.000 0.000 0.000) 0.000 5.048 ( 0.000 -0.000 0.000) 0.000 5.054 ( 0.000 0.000 -0.000) 0.000 5.159 ( -0.000 0.000 0.000) 0.000 5.217 ( 0.000 -0.000 0.000) 0.000 5.331 ( 0.000 0.000 0.000) 0.000 5.479 ( -0.000 0.000 0.000) 0.000 6.337 ( -0.000 0.000 0.000) 0.000 6.434 ( 0.000 0.000 -0.000) 0.000 6.596 ( -0.000 -0.000 0.000) 0.000 7.321 ( -0.000 0.000 0.000) 0.000 7.752 ( 0.000 0.000 0.000) 0.000 7.805 ( -0.000 0.000 -0.000) 0.000 7.908 ( -0.000 0.000 0.000) 0.000 8.212 ( 0.000 -0.000 0.000) 0.000 8.300 ( -0.000 0.000 -0.000) 0.000 8.310 ( -0.000 0.000 0.000) 0.000 8.646 ( -0.000 0.000 0.000) 0.000 8.778 ( 0.000 0.000 0.000) 0.000 10.013 ( -0.000 -0.000 0.000) 0.000 10.038 ( 0.000 0.000 0.000) 0.000 10.604 ( 0.000 0.000 0.000) 0.000 11.194 ( 0.000 0.000 0.000) 0.000 11.854 ( 0.000 0.000 0.000) 0.000 12.477 ( -0.000 0.000 0.000) 0.000 12.647 ( -0.000 0.000 0.000) 0.000 12.705 ( 0.000 0.000 -0.000) 0.000 12.863 ( 0.000 0.000 0.000) 0.000 13.123 ( -0.000 0.000 0.000) 0.000 13.636 ( 0.000 0.000 0.000) 0.000 13.789 ( 0.000 0.000 0.000) 0.000 14.237 ( -0.000 0.000 0.000) 0.000 14.490 ( 0.000 0.000 0.000) 0.000 14.733 ( -0.000 0.000 0.000) 0.000 15.202 ( -0.000 0.000 0.000) 0.000 15.292 ( -0.000 0.000 0.000) 0.000 15.399 ( -0.000 0.000 0.000) 0.000 15.657 ( 0.000 0.000 0.000) 0.000 15.834 ( -0.000 0.000 0.000) 0.000 16.220 ( -0.000 0.000 0.000) 0.000 16.457 ( 0.000 0.000 0.000) 0.000 16.565 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 449 (205/208) ======================= q-point: ( 0.12 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.689 ( -5.201 -0.000 -2.613) 5.820 2.818 ( -5.799 0.000 1.711) 6.046 3.286 ( -0.914 0.000 0.397) 0.997 3.744 ( 4.635 0.000 2.871) 5.453 4.294 ( -4.477 0.000 -1.811) 4.830 4.436 ( -4.814 0.000 -3.161) 5.759 4.527 ( 3.741 -0.000 0.817) 3.829 4.962 ( -8.675 -0.000 3.049) 9.195 4.968 ( -5.465 0.000 0.967) 5.550 5.191 ( 1.487 -0.000 -2.340) 2.772 5.261 ( 2.673 -0.000 0.534) 2.726 5.314 ( -1.174 0.000 -2.101) 2.407 5.545 ( 6.170 0.000 -7.282) 9.545 6.213 ( -8.164 0.000 -2.137) 8.439 6.539 ( 6.849 -0.000 0.088) 6.849 6.595 ( 0.166 0.000 0.674) 0.694 7.377 ( 5.719 0.000 -1.109) 5.826 7.769 ( 1.417 0.000 2.669) 3.022 7.831 ( 2.393 -0.000 1.146) 2.654 7.904 ( -0.249 0.000 0.119) 0.276 8.038 ( -9.088 0.000 -7.472) 11.765 8.316 ( 0.621 -0.000 -0.548) 0.828 8.476 ( 7.338 0.000 8.095) 10.926 8.709 ( 6.753 0.000 7.836) 10.345 8.855 ( 8.327 0.000 7.257) 11.045 9.955 ( -4.085 -0.000 -3.404) 5.317 10.014 ( -2.544 0.000 -1.907) 3.179 10.808 ( 19.001 0.000 7.073) 20.274 11.142 ( -4.803 0.000 -7.738) 9.108 11.817 ( -3.408 0.000 -1.155) 3.599 12.499 ( 1.925 0.000 1.162) 2.249 12.612 ( -2.335 0.000 2.477) 3.405 12.763 ( 5.471 0.000 -9.924) 11.332 12.817 ( -3.851 0.000 -1.585) 4.164 13.176 ( 4.177 0.000 5.194) 6.665 13.650 ( 1.410 0.000 0.828) 1.635 13.769 ( -1.347 0.000 -4.450) 4.649 14.196 ( -3.697 0.000 -2.168) 4.285 14.499 ( 0.194 0.000 -0.371) 0.419 14.597 ( -13.653 0.000 8.949) 16.325 15.125 ( -11.876 0.000 1.488) 11.969 15.295 ( 0.364 0.000 1.018) 1.082 15.436 ( 2.321 0.000 -1.591) 2.814 15.527 ( -11.819 0.000 -2.041) 11.994 15.755 ( 0.758 0.000 -4.138) 4.207 16.212 ( -0.364 0.000 0.325) 0.487 16.638 ( 6.805 -0.000 1.053) 6.887 16.682 ( 17.105 0.000 1.430) 17.165 ======================= Grid point 451 (206/208) ======================= q-point: ( 0.25 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.571 ( -6.135 -0.000 -3.010) 6.834 2.680 ( -8.612 0.000 2.159) 8.878 3.264 ( -1.360 0.000 0.318) 1.397 3.849 ( 5.314 0.000 3.452) 6.337 4.193 ( -5.483 0.000 -1.209) 5.615 4.327 ( -5.507 0.000 -3.994) 6.803 4.617 ( 5.593 -0.000 0.518) 5.616 4.777 ( -10.206 0.000 0.890) 10.245 4.894 ( -2.479 0.000 -0.216) 2.489 5.209 ( 0.832 -0.000 -2.061) 2.223 5.263 ( -2.687 -0.000 0.615) 2.756 5.276 ( -2.604 0.000 -2.113) 3.353 5.646 ( 5.090 0.000 -6.275) 8.080 6.069 ( -6.236 0.000 -5.027) 8.011 6.615 ( 1.820 0.000 0.560) 1.904 6.675 ( 7.676 0.000 2.241) 7.997 7.514 ( 8.665 0.000 -2.643) 9.059 7.795 ( -0.161 0.000 0.437) 0.466 7.869 ( -0.121 0.000 5.248) 5.249 7.878 ( -6.247 0.000 -4.104) 7.475 7.916 ( 2.467 0.000 -2.067) 3.218 8.328 ( 0.576 -0.000 -0.711) 0.915 8.553 ( 1.420 0.000 3.286) 3.579 8.918 ( 12.254 0.000 16.744) 20.749 9.110 ( 15.492 0.000 12.636) 19.992 9.889 ( -2.136 -0.000 -3.124) 3.785 9.927 ( -6.256 0.000 -6.361) 8.922 10.993 ( -8.927 0.000 -12.272) 15.176 11.280 ( 28.697 0.000 10.509) 30.561 11.743 ( -3.793 0.000 -1.225) 3.986 12.542 ( 2.159 0.000 1.745) 2.776 12.582 ( -1.260 0.000 1.484) 1.946 12.743 ( -3.264 0.000 -1.413) 3.557 12.855 ( 6.025 0.000 -16.202) 17.286 13.265 ( 3.748 0.000 6.051) 7.118 13.685 ( 1.660 0.000 0.619) 1.772 13.750 ( 0.971 0.000 -4.284) 4.392 14.107 ( -5.002 0.000 -2.697) 5.683 14.297 ( -19.166 0.000 6.068) 20.104 14.475 ( -2.561 -0.000 -2.382) 3.498 14.719 ( -27.634 0.000 8.503) 28.913 15.310 ( 0.921 0.000 1.530) 1.785 15.386 ( -2.224 0.000 -1.026) 2.449 15.471 ( -0.614 0.000 1.903) 2.000 15.822 ( 6.028 0.000 -9.576) 11.315 16.221 ( 1.156 0.000 0.723) 1.364 16.786 ( 7.847 0.000 1.255) 7.946 16.982 ( 13.611 0.000 1.806) 13.730 ======================= Grid point 453 (207/208) ======================= q-point: ( 0.38 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( -3.845 -0.000 -1.843) 4.264 2.533 ( -6.464 0.000 1.345) 6.602 3.241 ( -0.967 0.000 0.124) 0.975 3.937 ( 3.263 0.000 1.851) 3.751 4.103 ( -3.542 0.000 -0.025) 3.542 4.234 ( -3.423 0.000 -3.067) 4.596 4.616 ( -6.327 0.000 0.491) 6.346 4.732 ( 6.157 -0.000 0.217) 6.161 4.863 ( -1.129 0.000 -0.352) 1.183 5.174 ( -4.954 -0.000 -2.350) 5.483 5.221 ( -2.011 -2.725 -0.964) 3.521 5.221 ( -0.608 2.725 0.742) 2.889 5.708 ( 2.363 0.000 -2.516) 3.452 5.969 ( -3.443 0.000 -4.503) 5.669 6.654 ( 1.822 0.000 0.199) 1.833 6.828 ( 7.395 0.000 2.417) 7.780 7.674 ( 8.454 -0.000 -5.264) 9.959 7.701 ( -6.384 0.000 -3.640) 7.349 7.847 ( 0.505 0.000 0.717) 0.877 7.853 ( -2.412 -0.000 7.648) 8.019 7.963 ( 2.099 0.000 -1.864) 2.807 8.332 ( 0.018 0.000 -0.440) 0.440 8.574 ( 0.630 0.000 1.411) 1.545 9.202 ( 14.246 0.000 19.979) 24.538 9.412 ( 12.858 0.000 11.049) 16.953 9.754 ( -10.438 -0.000 -12.786) 16.506 9.861 ( -0.585 0.000 -1.778) 1.872 10.795 ( -8.968 0.000 -10.742) 13.994 11.683 ( -2.200 0.000 -0.736) 2.320 11.876 ( 30.891 0.000 12.787) 33.433 12.572 ( 0.240 0.000 1.955) 1.970 12.580 ( 1.459 -0.000 1.687) 2.230 12.695 ( -1.663 0.000 -1.112) 2.001 12.892 ( -1.096 -0.000 -21.947) 21.975 13.322 ( 1.446 0.000 3.272) 3.578 13.711 ( 1.489 0.000 -0.987) 1.786 13.803 ( 4.234 0.000 0.971) 4.344 13.911 ( -20.088 0.000 -0.417) 20.092 14.005 ( -5.310 0.000 -2.873) 6.038 14.281 ( -18.214 0.000 13.847) 22.879 14.409 ( -3.299 -0.000 -2.675) 4.247 15.329 ( 0.648 0.000 1.021) 1.210 15.369 ( 0.020 0.000 -0.814) 0.814 15.449 ( -1.587 0.000 1.259) 2.026 15.912 ( 4.250 0.000 -5.890) 7.264 16.249 ( 1.444 0.000 0.628) 1.575 16.912 ( 4.891 0.000 0.795) 4.955 17.182 ( 7.126 0.000 1.174) 7.222 ======================= Grid point 455 (208/208) ======================= q-point: ( 0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.83e-04 5.83e-04 5.83e-04 5.83e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.84e-05 1.84e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -0.000 0.000 -0.000) 0.000 2.469 ( -0.000 0.000 0.000) 0.000 3.232 ( -0.000 0.000 0.000) 0.000 3.970 ( 0.000 0.000 -0.000) 0.000 4.069 ( -0.000 0.000 0.000) 0.000 4.198 ( -0.000 0.000 0.000) 0.000 4.555 ( -0.000 0.000 0.000) 0.000 4.823 ( -0.000 0.000 0.000) 0.000 4.832 ( 0.000 0.000 0.000) 0.000 5.111 ( 0.000 -0.000 -0.000) 0.000 5.194 ( -0.000 0.000 0.000) 0.000 5.220 ( -0.000 -0.000 0.000) 0.000 5.729 ( 0.000 0.000 -0.000) 0.000 5.931 ( -0.000 0.000 0.000) 0.000 6.673 ( -0.000 0.000 0.000) 0.000 6.912 ( 0.000 0.000 0.000) 0.000 7.627 ( -0.000 -0.000 0.000) 0.000 7.790 ( 0.000 0.000 -0.000) 0.000 7.801 ( -0.000 0.000 0.000) 0.000 7.853 ( -0.000 -0.000 0.000) 0.000 7.981 ( -0.000 0.000 0.000) 0.000 8.331 ( -0.000 0.000 0.000) 0.000 8.582 ( -0.000 0.000 0.000) 0.000 9.494 ( -0.000 -0.000 -0.000) 0.000 9.500 ( 0.000 0.000 0.000) 0.000 9.562 ( -0.000 0.000 -0.000) 0.000 9.855 ( -0.000 0.000 0.000) 0.000 10.686 ( -0.000 0.000 0.000) 0.000 11.661 ( -0.000 0.000 0.000) 0.000 12.286 ( -0.000 0.000 0.000) 0.000 12.597 ( -0.000 0.000 0.000) 0.000 12.639 ( -0.000 0.000 -0.000) 0.000 12.677 ( -0.000 0.000 0.000) 0.000 12.718 ( 0.000 -0.000 0.000) 0.000 13.336 ( -0.000 0.000 0.000) 0.000 13.700 ( -0.000 0.000 0.000) 0.000 13.728 ( -0.000 0.000 0.000) 0.000 13.880 ( -0.000 0.000 0.000) 0.000 13.917 ( 0.000 0.000 0.000) 0.000 14.116 ( -0.000 0.000 0.000) 0.000 14.371 ( -0.000 -0.000 0.000) 0.000 15.336 ( -0.000 0.000 0.000) 0.000 15.371 ( 0.000 0.000 0.000) 0.000 15.431 ( -0.000 0.000 0.000) 0.000 15.948 ( -0.000 0.000 0.000) 0.000 16.265 ( -0.000 0.000 0.000) 0.000 16.960 ( -0.000 0.000 0.000) 0.000 17.250 ( -0.000 0.000 -0.000) 0.000 =================== 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 3/32256 10.0 15.030 213.962 15.750 0.000 -3.778 0.000 3/32256 20.0 21.715 69.510 19.986 0.000 -2.755 0.000 3/32256 30.0 17.408 36.718 13.979 0.000 -0.970 0.000 3/32256 40.0 13.324 26.401 9.888 0.000 -0.366 0.000 3/32256 50.0 10.316 20.936 7.496 0.000 -0.112 0.000 3/32256 60.0 8.173 17.144 5.968 0.000 0.018 0.000 3/32256 70.0 6.638 14.312 4.910 0.000 0.087 0.000 3/32256 80.0 5.517 12.152 4.138 0.000 0.124 0.000 3/32256 90.0 4.680 10.480 3.556 0.000 0.141 0.000 3/32256 100.0 4.041 9.168 3.104 0.000 0.148 0.000 3/32256 110.0 3.543 8.124 2.747 0.000 0.150 0.000 3/32256 120.0 3.147 7.280 2.460 0.000 0.147 0.000 3/32256 130.0 2.827 6.588 2.224 0.000 0.143 0.000 3/32256 140.0 2.564 6.014 2.029 0.000 0.138 0.000 3/32256 150.0 2.346 5.530 1.865 0.000 0.132 0.000 3/32256 160.0 2.162 5.119 1.725 0.000 0.126 0.000 3/32256 170.0 2.004 4.765 1.605 0.000 0.121 0.000 3/32256 180.0 1.869 4.458 1.501 0.000 0.116 0.000 3/32256 190.0 1.751 4.189 1.409 0.000 0.111 0.000 3/32256 200.0 1.647 3.952 1.329 0.000 0.106 0.000 3/32256 210.0 1.556 3.740 1.257 0.000 0.101 0.000 3/32256 220.0 1.474 3.551 1.193 0.000 0.097 0.000 3/32256 230.0 1.401 3.381 1.135 0.000 0.093 0.000 3/32256 240.0 1.335 3.227 1.083 0.000 0.090 0.000 3/32256 250.0 1.276 3.087 1.036 0.000 0.086 0.000 3/32256 260.0 1.221 2.959 0.993 0.000 0.083 0.000 3/32256 270.0 1.171 2.842 0.953 0.000 0.080 0.000 3/32256 280.0 1.126 2.733 0.916 0.000 0.077 0.000 3/32256 290.0 1.083 2.633 0.883 0.000 0.075 0.000 3/32256 300.0 1.044 2.541 0.851 0.000 0.072 0.000 3/32256 310.0 1.008 2.455 0.822 0.000 0.070 0.000 3/32256 320.0 0.975 2.374 0.795 0.000 0.068 0.000 3/32256 330.0 0.943 2.299 0.770 0.000 0.066 0.000 3/32256 340.0 0.914 2.229 0.746 0.000 0.064 0.000 3/32256 350.0 0.886 2.163 0.724 0.000 0.062 0.000 3/32256 360.0 0.860 2.100 0.703 0.000 0.060 0.000 3/32256 370.0 0.836 2.042 0.683 0.000 0.059 0.000 3/32256 380.0 0.813 1.986 0.665 0.000 0.057 0.000 3/32256 390.0 0.791 1.934 0.647 0.000 0.056 0.000 3/32256 400.0 0.771 1.884 0.630 0.000 0.054 0.000 3/32256 410.0 0.751 1.837 0.615 0.000 0.053 0.000 3/32256 420.0 0.733 1.793 0.600 0.000 0.052 0.000 3/32256 430.0 0.715 1.750 0.585 0.000 0.050 0.000 3/32256 440.0 0.698 1.709 0.572 0.000 0.049 0.000 3/32256 450.0 0.682 1.671 0.559 0.000 0.048 0.000 3/32256 460.0 0.667 1.634 0.546 0.000 0.047 0.000 3/32256 470.0 0.653 1.598 0.534 0.000 0.046 0.000 3/32256 480.0 0.639 1.565 0.523 0.000 0.045 0.000 3/32256 490.0 0.625 1.532 0.512 0.000 0.044 0.000 3/32256 500.0 0.613 1.501 0.502 0.000 0.043 0.000 3/32256 510.0 0.600 1.471 0.492 0.000 0.042 0.000 3/32256 520.0 0.589 1.443 0.482 0.000 0.042 0.000 3/32256 530.0 0.577 1.415 0.473 0.000 0.041 0.000 3/32256 540.0 0.566 1.389 0.464 0.000 0.040 0.000 3/32256 550.0 0.556 1.363 0.455 0.000 0.039 0.000 3/32256 560.0 0.546 1.339 0.447 0.000 0.039 0.000 3/32256 570.0 0.536 1.315 0.439 0.000 0.038 0.000 3/32256 580.0 0.527 1.292 0.432 0.000 0.037 0.000 3/32256 590.0 0.518 1.270 0.424 0.000 0.037 0.000 3/32256 600.0 0.509 1.249 0.417 0.000 0.036 0.000 3/32256 610.0 0.500 1.228 0.410 0.000 0.035 0.000 3/32256 620.0 0.492 1.208 0.403 0.000 0.035 0.000 3/32256 630.0 0.484 1.189 0.397 0.000 0.034 0.000 3/32256 640.0 0.477 1.170 0.391 0.000 0.034 0.000 3/32256 650.0 0.469 1.152 0.385 0.000 0.033 0.000 3/32256 660.0 0.462 1.134 0.379 0.000 0.033 0.000 3/32256 670.0 0.455 1.117 0.373 0.000 0.032 0.000 3/32256 680.0 0.448 1.101 0.368 0.000 0.032 0.000 3/32256 690.0 0.442 1.085 0.362 0.000 0.031 0.000 3/32256 700.0 0.435 1.069 0.357 0.000 0.031 0.000 3/32256 710.0 0.429 1.054 0.352 0.000 0.030 0.000 3/32256 720.0 0.423 1.040 0.347 0.000 0.030 0.000 3/32256 730.0 0.417 1.025 0.342 0.000 0.030 0.000 3/32256 740.0 0.412 1.011 0.338 0.000 0.029 0.000 3/32256 750.0 0.406 0.998 0.333 0.000 0.029 0.000 3/32256 760.0 0.401 0.985 0.329 0.000 0.028 0.000 3/32256 770.0 0.396 0.972 0.324 0.000 0.028 0.000 3/32256 780.0 0.391 0.959 0.320 0.000 0.028 0.000 3/32256 790.0 0.386 0.947 0.316 0.000 0.027 0.000 3/32256 800.0 0.381 0.935 0.312 0.000 0.027 0.000 3/32256 810.0 0.376 0.924 0.308 0.000 0.027 0.000 3/32256 820.0 0.371 0.912 0.305 0.000 0.026 0.000 3/32256 830.0 0.367 0.901 0.301 0.000 0.026 0.000 3/32256 840.0 0.362 0.891 0.297 0.000 0.026 0.000 3/32256 850.0 0.358 0.880 0.294 0.000 0.025 0.000 3/32256 860.0 0.354 0.870 0.290 0.000 0.025 0.000 3/32256 870.0 0.350 0.860 0.287 0.000 0.025 0.000 3/32256 880.0 0.346 0.850 0.284 0.000 0.025 0.000 3/32256 890.0 0.342 0.841 0.281 0.000 0.024 0.000 3/32256 900.0 0.338 0.831 0.277 0.000 0.024 0.000 3/32256 910.0 0.335 0.822 0.274 0.000 0.024 0.000 3/32256 920.0 0.331 0.813 0.271 0.000 0.024 0.000 3/32256 930.0 0.327 0.804 0.268 0.000 0.023 0.000 3/32256 940.0 0.324 0.796 0.266 0.000 0.023 0.000 3/32256 950.0 0.320 0.787 0.263 0.000 0.023 0.000 3/32256 960.0 0.317 0.779 0.260 0.000 0.023 0.000 3/32256 970.0 0.314 0.771 0.257 0.000 0.022 0.000 3/32256 980.0 0.311 0.763 0.255 0.000 0.022 0.000 3/32256 990.0 0.307 0.756 0.252 0.000 0.022 0.000 3/32256 1000.0 0.304 0.748 0.250 0.000 0.022 0.000 3/32256 Thermal conductivity related properties were written into "kappa-m8146.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 09:34:46]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|