----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 23:45:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pbam (55) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.768765980000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.821168889999999 0.000000000000000 c 0.000000000000000 0.000000000000000 3.502396230000000 Atomic positions (fractional): *1 Ca 0.05993336402614 0.67832413516087 0.50000000000000 40.078 2 Ca 0.44006663597386 0.17832413516087 0.50000000000000 40.078 3 Ca 0.55993336402614 0.82167586483913 0.50000000000000 40.078 4 Ca 0.94006663597386 0.32167586483913 0.50000000000000 40.078 *5 Ce 0.00000000000000 0.00000000000000 0.00000000000000 140.116 6 Ce 0.50000000000000 0.50000000000000 0.00000000000000 140.116 *7 O 0.15646806308719 0.20407260916331 0.00000000000000 15.999 *8 O 0.24107289049924 0.96133779480894 0.50000000000000 15.999 9 O 0.25892710950076 0.46133779480894 0.50000000000000 15.999 10 O 0.34353193691281 0.70407260916331 0.00000000000000 15.999 11 O 0.65646806308719 0.29592739083669 0.00000000000000 15.999 12 O 0.74107289049924 0.53866220519106 0.50000000000000 15.999 13 O 0.75892710950076 0.03866220519106 0.50000000000000 15.999 14 O 0.84353193691281 0.79592739083669 0.00000000000000 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.768765980000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.821168889999999 0.000000000000000 c 0.000000000000000 0.000000000000000 3.502396230000000 Atomic positions (fractional): *1 Ca 0.05993336402614 0.67832413516087 0.50000000000000 40.078 > 1 2 Ca 0.44006663597386 0.17832413516087 0.50000000000000 40.078 > 2 3 Ca 0.55993336402614 0.82167586483913 0.50000000000000 40.078 > 3 4 Ca 0.94006663597386 0.32167586483913 0.50000000000000 40.078 > 4 *5 Ce 0.00000000000000 0.00000000000000 0.00000000000000 140.116 > 5 6 Ce 0.50000000000000 0.50000000000000 0.00000000000000 140.116 > 6 *7 O 0.15646806308719 0.20407260916331 0.00000000000000 15.999 > 7 *8 O 0.24107289049924 0.96133779480894 0.50000000000000 15.999 > 8 9 O 0.25892710950076 0.46133779480894 0.50000000000000 15.999 > 9 10 O 0.34353193691281 0.70407260916331 0.00000000000000 15.999 > 10 11 O 0.65646806308719 0.29592739083669 0.00000000000000 15.999 > 11 12 O 0.74107289049924 0.53866220519106 0.50000000000000 15.999 > 12 13 O 0.75892710950076 0.03866220519106 0.50000000000000 15.999 > 13 14 O 0.84353193691281 0.79592739083669 0.00000000000000 15.999 > 14 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.537531960000001 0.000000000000000 0.000000000000000 b 0.000000000000000 9.821168889999999 0.000000000000000 c 0.000000000000000 0.000000000000000 10.507188690000000 Atomic positions (fractional): *1 Ca 0.02996668201307 0.67832413516087 0.16666666666667 40.078 > 1 2 Ca 0.52996668201307 0.67832413516087 0.16666666666667 40.078 > 1 3 Ca 0.02996668201307 0.67832413516087 0.50000000000000 40.078 > 1 4 Ca 0.52996668201307 0.67832413516087 0.50000000000000 40.078 > 1 5 Ca 0.02996668201307 0.67832413516087 0.83333333333333 40.078 > 1 6 Ca 0.52996668201307 0.67832413516087 0.83333333333333 40.078 > 1 7 Ca 0.22003331798693 0.17832413516087 0.16666666666667 40.078 > 2 8 Ca 0.72003331798693 0.17832413516087 0.16666666666667 40.078 > 2 9 Ca 0.22003331798693 0.17832413516087 0.50000000000000 40.078 > 2 10 Ca 0.72003331798693 0.17832413516087 0.50000000000000 40.078 > 2 11 Ca 0.22003331798693 0.17832413516087 0.83333333333333 40.078 > 2 12 Ca 0.72003331798693 0.17832413516087 0.83333333333333 40.078 > 2 13 Ca 0.27996668201307 0.82167586483913 0.16666666666667 40.078 > 3 14 Ca 0.77996668201307 0.82167586483913 0.16666666666667 40.078 > 3 15 Ca 0.27996668201307 0.82167586483913 0.50000000000000 40.078 > 3 16 Ca 0.77996668201307 0.82167586483913 0.50000000000000 40.078 > 3 17 Ca 0.27996668201307 0.82167586483913 0.83333333333333 40.078 > 3 18 Ca 0.77996668201307 0.82167586483913 0.83333333333333 40.078 > 3 19 Ca 0.47003331798693 0.32167586483913 0.16666666666667 40.078 > 4 20 Ca 0.97003331798693 0.32167586483913 0.16666666666667 40.078 > 4 21 Ca 0.47003331798693 0.32167586483913 0.50000000000000 40.078 > 4 22 Ca 0.97003331798693 0.32167586483913 0.50000000000000 40.078 > 4 23 Ca 0.47003331798693 0.32167586483913 0.83333333333333 40.078 > 4 24 Ca 0.97003331798693 0.32167586483913 0.83333333333333 40.078 > 4 *25 Ce 0.00000000000000 0.00000000000000 0.00000000000000 140.116 > 5 26 Ce 0.50000000000000 0.00000000000000 0.00000000000000 140.116 > 5 27 Ce 0.00000000000000 0.00000000000000 0.33333333333333 140.116 > 5 28 Ce 0.50000000000000 0.00000000000000 0.33333333333333 140.116 > 5 29 Ce 0.00000000000000 0.00000000000000 0.66666666666667 140.116 > 5 30 Ce 0.50000000000000 0.00000000000000 0.66666666666667 140.116 > 5 31 Ce 0.25000000000000 0.50000000000000 0.00000000000000 140.116 > 6 32 Ce 0.75000000000000 0.50000000000000 0.00000000000000 140.116 > 6 33 Ce 0.25000000000000 0.50000000000000 0.33333333333333 140.116 > 6 34 Ce 0.75000000000000 0.50000000000000 0.33333333333333 140.116 > 6 35 Ce 0.25000000000000 0.50000000000000 0.66666666666667 140.116 > 6 36 Ce 0.75000000000000 0.50000000000000 0.66666666666667 140.116 > 6 *37 O 0.07823403154359 0.20407260916331 0.00000000000000 15.999 > 7 38 O 0.57823403154359 0.20407260916331 0.00000000000000 15.999 > 7 39 O 0.07823403154359 0.20407260916331 0.33333333333333 15.999 > 7 40 O 0.57823403154359 0.20407260916331 0.33333333333333 15.999 > 7 41 O 0.07823403154359 0.20407260916331 0.66666666666667 15.999 > 7 42 O 0.57823403154359 0.20407260916331 0.66666666666667 15.999 > 7 *43 O 0.12053644524962 0.96133779480894 0.16666666666667 15.999 > 8 44 O 0.62053644524962 0.96133779480894 0.16666666666667 15.999 > 8 45 O 0.12053644524962 0.96133779480894 0.50000000000000 15.999 > 8 46 O 0.62053644524962 0.96133779480894 0.50000000000000 15.999 > 8 47 O 0.12053644524962 0.96133779480894 0.83333333333333 15.999 > 8 48 O 0.62053644524962 0.96133779480894 0.83333333333333 15.999 > 8 49 O 0.12946355475038 0.46133779480894 0.16666666666667 15.999 > 9 50 O 0.62946355475038 0.46133779480894 0.16666666666667 15.999 > 9 51 O 0.12946355475038 0.46133779480894 0.50000000000000 15.999 > 9 52 O 0.62946355475038 0.46133779480894 0.50000000000000 15.999 > 9 53 O 0.12946355475038 0.46133779480894 0.83333333333333 15.999 > 9 54 O 0.62946355475038 0.46133779480894 0.83333333333333 15.999 > 9 55 O 0.17176596845641 0.70407260916331 0.00000000000000 15.999 > 10 56 O 0.67176596845641 0.70407260916331 0.00000000000000 15.999 > 10 57 O 0.17176596845641 0.70407260916331 0.33333333333333 15.999 > 10 58 O 0.67176596845641 0.70407260916331 0.33333333333333 15.999 > 10 59 O 0.17176596845641 0.70407260916331 0.66666666666667 15.999 > 10 60 O 0.67176596845641 0.70407260916331 0.66666666666667 15.999 > 10 61 O 0.32823403154359 0.29592739083669 0.00000000000000 15.999 > 11 62 O 0.82823403154359 0.29592739083669 0.00000000000000 15.999 > 11 63 O 0.32823403154359 0.29592739083669 0.33333333333333 15.999 > 11 64 O 0.82823403154359 0.29592739083669 0.33333333333333 15.999 > 11 65 O 0.32823403154359 0.29592739083669 0.66666666666667 15.999 > 11 66 O 0.82823403154359 0.29592739083669 0.66666666666667 15.999 > 11 67 O 0.37053644524962 0.53866220519106 0.16666666666667 15.999 > 12 68 O 0.87053644524962 0.53866220519106 0.16666666666667 15.999 > 12 69 O 0.37053644524962 0.53866220519106 0.50000000000000 15.999 > 12 70 O 0.87053644524962 0.53866220519106 0.50000000000000 15.999 > 12 71 O 0.37053644524962 0.53866220519106 0.83333333333333 15.999 > 12 72 O 0.87053644524962 0.53866220519106 0.83333333333333 15.999 > 12 73 O 0.37946355475038 0.03866220519106 0.16666666666667 15.999 > 13 74 O 0.87946355475038 0.03866220519106 0.16666666666667 15.999 > 13 75 O 0.37946355475038 0.03866220519106 0.50000000000000 15.999 > 13 76 O 0.87946355475038 0.03866220519106 0.50000000000000 15.999 > 13 77 O 0.37946355475038 0.03866220519106 0.83333333333333 15.999 > 13 78 O 0.87946355475038 0.03866220519106 0.83333333333333 15.999 > 13 79 O 0.42176596845641 0.79592739083669 0.00000000000000 15.999 > 14 80 O 0.92176596845641 0.79592739083669 0.00000000000000 15.999 > 14 81 O 0.42176596845641 0.79592739083669 0.33333333333333 15.999 > 14 82 O 0.92176596845641 0.79592739083669 0.33333333333333 15.999 > 14 83 O 0.42176596845641 0.79592739083669 0.66666666666667 15.999 > 14 84 O 0.92176596845641 0.79592739083669 0.66666666666667 15.999 > 14 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.3890928 0.0000000 0.0000000 0.0000000 4.7029491 0.0000000 0.0000000 0.0000000 4.8192108 -------------------------- Born effective charges -------------------------- 1 Ca 2.6780728 -0.0221930 0.0000000 -0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 2 Ca 2.6780728 0.0221930 0.0000000 0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 3 Ca 2.6780728 0.0221930 0.0000000 0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 4 Ca 2.6780728 -0.0221930 0.0000000 -0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 5 Ce 3.9054138 0.3488949 0.0000000 0.4109095 4.9702112 0.0000000 0.0000000 0.0000000 6.1300403 6 Ce 3.9054138 -0.3488949 0.0000000 -0.4109095 4.9702112 0.0000000 0.0000000 0.0000000 6.1300403 7 O -2.0970052 -0.4719890 0.0000000 -0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 8 O -2.5337745 0.4094633 0.0000000 0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 9 O -2.5337745 -0.4094633 0.0000000 -0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 10 O -2.0970052 0.4719890 0.0000000 0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 11 O -2.0970052 0.4719890 0.0000000 0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 12 O -2.5337745 -0.4094633 0.0000000 -0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 13 O -2.5337745 0.4094633 0.0000000 0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 14 O -2.0970052 -0.4719890 0.0000000 -0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 ---------------------------------------------------------------------------- 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: 252/252 Permutation basis: 5586/5586 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 752 Number of blocks in projector: 752 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: 198 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 120 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 120 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 120 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 97 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 97 Use standard eigh solver. Tree of FC basis block matrices: - (752, 732), data: False |-- (97, 97), data: True |-- (97, 97), data: True |-- (120, 116), data: True |-- (120, 116), data: True |-- (120, 116), data: True |-- (198, 190), data: True ----- Solver_atoms: 1 -- 84 / 84 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 240 - Time: 0.523 Solver_block: 200 / 240 - Time: 0.526 Solver_block: 240 / 240 - Time: 0.264 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 1.327 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 252/252 Permutation basis: 5586/5586 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 752 Number of blocks in projector: 752 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: 198 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 120 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 120 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 120 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 97 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 97 Use standard eigh solver. Tree of FC basis block matrices: - (752, 732), data: False |-- (97, 97), data: True |-- (97, 97), data: True |-- (120, 116), data: True |-- (120, 116), data: True |-- (120, 116), data: True |-- (198, 190), 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 23:45:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:45:58]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pbam (55) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.768765980000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.821168889999999 0.000000000000000 c 0.000000000000000 0.000000000000000 3.502396230000000 Atomic positions (fractional): 1 Ca 0.05993336402614 0.67832413516087 0.50000000000000 40.078 2 Ca 0.44006663597386 0.17832413516087 0.50000000000000 40.078 3 Ca 0.55993336402614 0.82167586483913 0.50000000000000 40.078 4 Ca 0.94006663597386 0.32167586483913 0.50000000000000 40.078 5 Ce 0.00000000000000 0.00000000000000 0.00000000000000 140.116 6 Ce 0.50000000000000 0.50000000000000 0.00000000000000 140.116 7 O 0.15646806308719 0.20407260916331 0.00000000000000 15.999 8 O 0.24107289049924 0.96133779480894 0.50000000000000 15.999 9 O 0.25892710950076 0.46133779480894 0.50000000000000 15.999 10 O 0.34353193691281 0.70407260916331 0.00000000000000 15.999 11 O 0.65646806308719 0.29592739083669 0.00000000000000 15.999 12 O 0.74107289049924 0.53866220519106 0.50000000000000 15.999 13 O 0.75892710950076 0.03866220519106 0.50000000000000 15.999 14 O 0.84353193691281 0.79592739083669 0.00000000000000 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.537531960000001 0.000000000000000 0.000000000000000 b 0.000000000000000 9.821168889999999 0.000000000000000 c 0.000000000000000 0.000000000000000 10.507188690000000 Atomic positions (fractional): 1 Ca 0.02996668201307 0.67832413516087 0.16666666666667 40.078 > 1 2 Ca 0.52996668201307 0.67832413516087 0.16666666666667 40.078 > 1 3 Ca 0.02996668201307 0.67832413516087 0.50000000000000 40.078 > 1 4 Ca 0.52996668201307 0.67832413516087 0.50000000000000 40.078 > 1 5 Ca 0.02996668201307 0.67832413516087 0.83333333333333 40.078 > 1 6 Ca 0.52996668201307 0.67832413516087 0.83333333333333 40.078 > 1 7 Ca 0.22003331798693 0.17832413516087 0.16666666666667 40.078 > 7 8 Ca 0.72003331798693 0.17832413516087 0.16666666666667 40.078 > 7 9 Ca 0.22003331798693 0.17832413516087 0.50000000000000 40.078 > 7 10 Ca 0.72003331798693 0.17832413516087 0.50000000000000 40.078 > 7 11 Ca 0.22003331798693 0.17832413516087 0.83333333333333 40.078 > 7 12 Ca 0.72003331798693 0.17832413516087 0.83333333333333 40.078 > 7 13 Ca 0.27996668201307 0.82167586483913 0.16666666666667 40.078 > 13 14 Ca 0.77996668201307 0.82167586483913 0.16666666666667 40.078 > 13 15 Ca 0.27996668201307 0.82167586483913 0.50000000000000 40.078 > 13 16 Ca 0.77996668201307 0.82167586483913 0.50000000000000 40.078 > 13 17 Ca 0.27996668201307 0.82167586483913 0.83333333333333 40.078 > 13 18 Ca 0.77996668201307 0.82167586483913 0.83333333333333 40.078 > 13 19 Ca 0.47003331798693 0.32167586483913 0.16666666666667 40.078 > 19 20 Ca 0.97003331798693 0.32167586483913 0.16666666666667 40.078 > 19 21 Ca 0.47003331798693 0.32167586483913 0.50000000000000 40.078 > 19 22 Ca 0.97003331798693 0.32167586483913 0.50000000000000 40.078 > 19 23 Ca 0.47003331798693 0.32167586483913 0.83333333333333 40.078 > 19 24 Ca 0.97003331798693 0.32167586483913 0.83333333333333 40.078 > 19 25 Ce 0.00000000000000 0.00000000000000 0.00000000000000 140.116 > 25 26 Ce 0.50000000000000 0.00000000000000 0.00000000000000 140.116 > 25 27 Ce 0.00000000000000 0.00000000000000 0.33333333333333 140.116 > 25 28 Ce 0.50000000000000 0.00000000000000 0.33333333333333 140.116 > 25 29 Ce 0.00000000000000 0.00000000000000 0.66666666666667 140.116 > 25 30 Ce 0.50000000000000 0.00000000000000 0.66666666666667 140.116 > 25 31 Ce 0.25000000000000 0.50000000000000 0.00000000000000 140.116 > 31 32 Ce 0.75000000000000 0.50000000000000 0.00000000000000 140.116 > 31 33 Ce 0.25000000000000 0.50000000000000 0.33333333333333 140.116 > 31 34 Ce 0.75000000000000 0.50000000000000 0.33333333333333 140.116 > 31 35 Ce 0.25000000000000 0.50000000000000 0.66666666666667 140.116 > 31 36 Ce 0.75000000000000 0.50000000000000 0.66666666666667 140.116 > 31 37 O 0.07823403154359 0.20407260916331 0.00000000000000 15.999 > 37 38 O 0.57823403154359 0.20407260916331 0.00000000000000 15.999 > 37 39 O 0.07823403154359 0.20407260916331 0.33333333333333 15.999 > 37 40 O 0.57823403154359 0.20407260916331 0.33333333333333 15.999 > 37 41 O 0.07823403154359 0.20407260916331 0.66666666666667 15.999 > 37 42 O 0.57823403154359 0.20407260916331 0.66666666666667 15.999 > 37 43 O 0.12053644524962 0.96133779480894 0.16666666666667 15.999 > 43 44 O 0.62053644524962 0.96133779480894 0.16666666666667 15.999 > 43 45 O 0.12053644524962 0.96133779480894 0.50000000000000 15.999 > 43 46 O 0.62053644524962 0.96133779480894 0.50000000000000 15.999 > 43 47 O 0.12053644524962 0.96133779480894 0.83333333333333 15.999 > 43 48 O 0.62053644524962 0.96133779480894 0.83333333333333 15.999 > 43 49 O 0.12946355475038 0.46133779480894 0.16666666666667 15.999 > 49 50 O 0.62946355475038 0.46133779480894 0.16666666666667 15.999 > 49 51 O 0.12946355475038 0.46133779480894 0.50000000000000 15.999 > 49 52 O 0.62946355475038 0.46133779480894 0.50000000000000 15.999 > 49 53 O 0.12946355475038 0.46133779480894 0.83333333333333 15.999 > 49 54 O 0.62946355475038 0.46133779480894 0.83333333333333 15.999 > 49 55 O 0.17176596845641 0.70407260916331 0.00000000000000 15.999 > 55 56 O 0.67176596845641 0.70407260916331 0.00000000000000 15.999 > 55 57 O 0.17176596845641 0.70407260916331 0.33333333333333 15.999 > 55 58 O 0.67176596845641 0.70407260916331 0.33333333333333 15.999 > 55 59 O 0.17176596845641 0.70407260916331 0.66666666666667 15.999 > 55 60 O 0.67176596845641 0.70407260916331 0.66666666666667 15.999 > 55 61 O 0.32823403154359 0.29592739083669 0.00000000000000 15.999 > 61 62 O 0.82823403154359 0.29592739083669 0.00000000000000 15.999 > 61 63 O 0.32823403154359 0.29592739083669 0.33333333333333 15.999 > 61 64 O 0.82823403154359 0.29592739083669 0.33333333333333 15.999 > 61 65 O 0.32823403154359 0.29592739083669 0.66666666666667 15.999 > 61 66 O 0.82823403154359 0.29592739083669 0.66666666666667 15.999 > 61 67 O 0.37053644524962 0.53866220519106 0.16666666666667 15.999 > 67 68 O 0.87053644524962 0.53866220519106 0.16666666666667 15.999 > 67 69 O 0.37053644524962 0.53866220519106 0.50000000000000 15.999 > 67 70 O 0.87053644524962 0.53866220519106 0.50000000000000 15.999 > 67 71 O 0.37053644524962 0.53866220519106 0.83333333333333 15.999 > 67 72 O 0.87053644524962 0.53866220519106 0.83333333333333 15.999 > 67 73 O 0.37946355475038 0.03866220519106 0.16666666666667 15.999 > 73 74 O 0.87946355475038 0.03866220519106 0.16666666666667 15.999 > 73 75 O 0.37946355475038 0.03866220519106 0.50000000000000 15.999 > 73 76 O 0.87946355475038 0.03866220519106 0.50000000000000 15.999 > 73 77 O 0.37946355475038 0.03866220519106 0.83333333333333 15.999 > 73 78 O 0.87946355475038 0.03866220519106 0.83333333333333 15.999 > 73 79 O 0.42176596845641 0.79592739083669 0.00000000000000 15.999 > 79 80 O 0.92176596845641 0.79592739083669 0.00000000000000 15.999 > 79 81 O 0.42176596845641 0.79592739083669 0.33333333333333 15.999 > 79 82 O 0.92176596845641 0.79592739083669 0.33333333333333 15.999 > 79 83 O 0.42176596845641 0.79592739083669 0.66666666666667 15.999 > 79 84 O 0.92176596845641 0.79592739083669 0.66666666666667 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.3890928 0.0000000 0.0000000 0.0000000 4.7029491 0.0000000 0.0000000 0.0000000 4.8192108 -------------------------- Born effective charges -------------------------- 1 Ca 2.6780728 -0.0221930 0.0000000 -0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 2 Ca 2.6780728 0.0221930 0.0000000 0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 3 Ca 2.6780728 0.0221930 0.0000000 0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 4 Ca 2.6780728 -0.0221930 0.0000000 -0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 5 Ce 3.9054138 0.3488949 0.0000000 0.4109095 4.9702112 0.0000000 0.0000000 0.0000000 6.1300403 6 Ce 3.9054138 -0.3488949 0.0000000 -0.4109095 4.9702112 0.0000000 0.0000000 0.0000000 6.1300403 7 O -2.0970052 -0.4719890 0.0000000 -0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 8 O -2.5337745 0.4094633 0.0000000 0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 9 O -2.5337745 -0.4094633 0.0000000 -0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 10 O -2.0970052 0.4719890 0.0000000 0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 11 O -2.0970052 0.4719890 0.0000000 0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 12 O -2.5337745 -0.4094633 0.0000000 -0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 13 O -2.5337745 0.4094633 0.0000000 0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 14 O -2.0970052 -0.4719890 0.0000000 -0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (yx) 0.00000000 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:46:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:46:07]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pbam (55) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.768765980000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.821168889999999 0.000000000000000 c 0.000000000000000 0.000000000000000 3.502396230000000 Atomic positions (fractional): 1 Ca 0.05993336402614 0.67832413516087 0.50000000000000 40.078 2 Ca 0.44006663597386 0.17832413516087 0.50000000000000 40.078 3 Ca 0.55993336402614 0.82167586483913 0.50000000000000 40.078 4 Ca 0.94006663597386 0.32167586483913 0.50000000000000 40.078 5 Ce 0.00000000000000 0.00000000000000 0.00000000000000 140.116 6 Ce 0.50000000000000 0.50000000000000 0.00000000000000 140.116 7 O 0.15646806308719 0.20407260916331 0.00000000000000 15.999 8 O 0.24107289049924 0.96133779480894 0.50000000000000 15.999 9 O 0.25892710950076 0.46133779480894 0.50000000000000 15.999 10 O 0.34353193691281 0.70407260916331 0.00000000000000 15.999 11 O 0.65646806308719 0.29592739083669 0.00000000000000 15.999 12 O 0.74107289049924 0.53866220519106 0.50000000000000 15.999 13 O 0.75892710950076 0.03866220519106 0.50000000000000 15.999 14 O 0.84353193691281 0.79592739083669 0.00000000000000 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.537531960000001 0.000000000000000 0.000000000000000 b 0.000000000000000 9.821168889999999 0.000000000000000 c 0.000000000000000 0.000000000000000 10.507188690000000 Atomic positions (fractional): 1 Ca 0.02996668201307 0.67832413516087 0.16666666666667 40.078 > 1 2 Ca 0.52996668201307 0.67832413516087 0.16666666666667 40.078 > 1 3 Ca 0.02996668201307 0.67832413516087 0.50000000000000 40.078 > 1 4 Ca 0.52996668201307 0.67832413516087 0.50000000000000 40.078 > 1 5 Ca 0.02996668201307 0.67832413516087 0.83333333333333 40.078 > 1 6 Ca 0.52996668201307 0.67832413516087 0.83333333333333 40.078 > 1 7 Ca 0.22003331798693 0.17832413516087 0.16666666666667 40.078 > 7 8 Ca 0.72003331798693 0.17832413516087 0.16666666666667 40.078 > 7 9 Ca 0.22003331798693 0.17832413516087 0.50000000000000 40.078 > 7 10 Ca 0.72003331798693 0.17832413516087 0.50000000000000 40.078 > 7 11 Ca 0.22003331798693 0.17832413516087 0.83333333333333 40.078 > 7 12 Ca 0.72003331798693 0.17832413516087 0.83333333333333 40.078 > 7 13 Ca 0.27996668201307 0.82167586483913 0.16666666666667 40.078 > 13 14 Ca 0.77996668201307 0.82167586483913 0.16666666666667 40.078 > 13 15 Ca 0.27996668201307 0.82167586483913 0.50000000000000 40.078 > 13 16 Ca 0.77996668201307 0.82167586483913 0.50000000000000 40.078 > 13 17 Ca 0.27996668201307 0.82167586483913 0.83333333333333 40.078 > 13 18 Ca 0.77996668201307 0.82167586483913 0.83333333333333 40.078 > 13 19 Ca 0.47003331798693 0.32167586483913 0.16666666666667 40.078 > 19 20 Ca 0.97003331798693 0.32167586483913 0.16666666666667 40.078 > 19 21 Ca 0.47003331798693 0.32167586483913 0.50000000000000 40.078 > 19 22 Ca 0.97003331798693 0.32167586483913 0.50000000000000 40.078 > 19 23 Ca 0.47003331798693 0.32167586483913 0.83333333333333 40.078 > 19 24 Ca 0.97003331798693 0.32167586483913 0.83333333333333 40.078 > 19 25 Ce 0.00000000000000 0.00000000000000 0.00000000000000 140.116 > 25 26 Ce 0.50000000000000 0.00000000000000 0.00000000000000 140.116 > 25 27 Ce 0.00000000000000 0.00000000000000 0.33333333333333 140.116 > 25 28 Ce 0.50000000000000 0.00000000000000 0.33333333333333 140.116 > 25 29 Ce 0.00000000000000 0.00000000000000 0.66666666666667 140.116 > 25 30 Ce 0.50000000000000 0.00000000000000 0.66666666666667 140.116 > 25 31 Ce 0.25000000000000 0.50000000000000 0.00000000000000 140.116 > 31 32 Ce 0.75000000000000 0.50000000000000 0.00000000000000 140.116 > 31 33 Ce 0.25000000000000 0.50000000000000 0.33333333333333 140.116 > 31 34 Ce 0.75000000000000 0.50000000000000 0.33333333333333 140.116 > 31 35 Ce 0.25000000000000 0.50000000000000 0.66666666666667 140.116 > 31 36 Ce 0.75000000000000 0.50000000000000 0.66666666666667 140.116 > 31 37 O 0.07823403154359 0.20407260916331 0.00000000000000 15.999 > 37 38 O 0.57823403154359 0.20407260916331 0.00000000000000 15.999 > 37 39 O 0.07823403154359 0.20407260916331 0.33333333333333 15.999 > 37 40 O 0.57823403154359 0.20407260916331 0.33333333333333 15.999 > 37 41 O 0.07823403154359 0.20407260916331 0.66666666666667 15.999 > 37 42 O 0.57823403154359 0.20407260916331 0.66666666666667 15.999 > 37 43 O 0.12053644524962 0.96133779480894 0.16666666666667 15.999 > 43 44 O 0.62053644524962 0.96133779480894 0.16666666666667 15.999 > 43 45 O 0.12053644524962 0.96133779480894 0.50000000000000 15.999 > 43 46 O 0.62053644524962 0.96133779480894 0.50000000000000 15.999 > 43 47 O 0.12053644524962 0.96133779480894 0.83333333333333 15.999 > 43 48 O 0.62053644524962 0.96133779480894 0.83333333333333 15.999 > 43 49 O 0.12946355475038 0.46133779480894 0.16666666666667 15.999 > 49 50 O 0.62946355475038 0.46133779480894 0.16666666666667 15.999 > 49 51 O 0.12946355475038 0.46133779480894 0.50000000000000 15.999 > 49 52 O 0.62946355475038 0.46133779480894 0.50000000000000 15.999 > 49 53 O 0.12946355475038 0.46133779480894 0.83333333333333 15.999 > 49 54 O 0.62946355475038 0.46133779480894 0.83333333333333 15.999 > 49 55 O 0.17176596845641 0.70407260916331 0.00000000000000 15.999 > 55 56 O 0.67176596845641 0.70407260916331 0.00000000000000 15.999 > 55 57 O 0.17176596845641 0.70407260916331 0.33333333333333 15.999 > 55 58 O 0.67176596845641 0.70407260916331 0.33333333333333 15.999 > 55 59 O 0.17176596845641 0.70407260916331 0.66666666666667 15.999 > 55 60 O 0.67176596845641 0.70407260916331 0.66666666666667 15.999 > 55 61 O 0.32823403154359 0.29592739083669 0.00000000000000 15.999 > 61 62 O 0.82823403154359 0.29592739083669 0.00000000000000 15.999 > 61 63 O 0.32823403154359 0.29592739083669 0.33333333333333 15.999 > 61 64 O 0.82823403154359 0.29592739083669 0.33333333333333 15.999 > 61 65 O 0.32823403154359 0.29592739083669 0.66666666666667 15.999 > 61 66 O 0.82823403154359 0.29592739083669 0.66666666666667 15.999 > 61 67 O 0.37053644524962 0.53866220519106 0.16666666666667 15.999 > 67 68 O 0.87053644524962 0.53866220519106 0.16666666666667 15.999 > 67 69 O 0.37053644524962 0.53866220519106 0.50000000000000 15.999 > 67 70 O 0.87053644524962 0.53866220519106 0.50000000000000 15.999 > 67 71 O 0.37053644524962 0.53866220519106 0.83333333333333 15.999 > 67 72 O 0.87053644524962 0.53866220519106 0.83333333333333 15.999 > 67 73 O 0.37946355475038 0.03866220519106 0.16666666666667 15.999 > 73 74 O 0.87946355475038 0.03866220519106 0.16666666666667 15.999 > 73 75 O 0.37946355475038 0.03866220519106 0.50000000000000 15.999 > 73 76 O 0.87946355475038 0.03866220519106 0.50000000000000 15.999 > 73 77 O 0.37946355475038 0.03866220519106 0.83333333333333 15.999 > 73 78 O 0.87946355475038 0.03866220519106 0.83333333333333 15.999 > 73 79 O 0.42176596845641 0.79592739083669 0.00000000000000 15.999 > 79 80 O 0.92176596845641 0.79592739083669 0.00000000000000 15.999 > 79 81 O 0.42176596845641 0.79592739083669 0.33333333333333 15.999 > 79 82 O 0.92176596845641 0.79592739083669 0.33333333333333 15.999 > 79 83 O 0.42176596845641 0.79592739083669 0.66666666666667 15.999 > 79 84 O 0.92176596845641 0.79592739083669 0.66666666666667 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.3890928 0.0000000 0.0000000 0.0000000 4.7029491 0.0000000 0.0000000 0.0000000 4.8192108 -------------------------- Born effective charges -------------------------- 1 Ca 2.6780728 -0.0221930 0.0000000 -0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 2 Ca 2.6780728 0.0221930 0.0000000 0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 3 Ca 2.6780728 0.0221930 0.0000000 0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 4 Ca 2.6780728 -0.0221930 0.0000000 -0.4683805 2.2351814 0.0000000 0.0000000 0.0000000 2.1077906 5 Ce 3.9054138 0.3488949 0.0000000 0.4109095 4.9702112 0.0000000 0.0000000 0.0000000 6.1300403 6 Ce 3.9054138 -0.3488949 0.0000000 -0.4109095 4.9702112 0.0000000 0.0000000 0.0000000 6.1300403 7 O -2.0970052 -0.4719890 0.0000000 -0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 8 O -2.5337745 0.4094633 0.0000000 0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 9 O -2.5337745 -0.4094633 0.0000000 -0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 10 O -2.0970052 0.4719890 0.0000000 0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 11 O -2.0970052 0.4719890 0.0000000 0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 12 O -2.5337745 -0.4094633 0.0000000 -0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 13 O -2.5337745 0.4094633 0.0000000 0.3269607 -1.8841150 0.0000000 0.0000000 0.0000000 -3.1122117 14 O -2.0970052 -0.4719890 0.0000000 -0.4628447 -2.8361720 0.0000000 0.0000000 0.0000000 -2.0605990 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) 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 ... [ 9 5 14 ] 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: 0.71, Number of G-points: 305, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/120) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.312 ( 0.000 0.000 0.000) 0.000 2.990 ( 0.000 0.000 0.000) 0.000 3.318 ( 0.000 0.000 0.000) 0.000 3.982 ( 0.000 0.000 0.000) 0.000 4.084 ( 0.000 0.000 0.000) 0.000 4.465 ( 0.000 0.000 0.000) 0.000 4.635 ( 0.000 0.000 0.000) 0.000 4.708 ( 0.000 0.000 0.000) 0.000 4.914 ( 0.000 0.000 0.000) 0.000 5.892 ( 0.000 0.000 0.000) 0.000 6.379 ( 0.000 0.000 0.000) 0.000 6.588 ( 0.000 0.000 0.000) 0.000 6.648 ( 0.000 0.000 0.000) 0.000 6.944 ( 0.000 0.000 0.000) 0.000 7.217 ( 0.000 0.000 0.000) 0.000 7.256 ( 0.000 0.000 0.000) 0.000 7.724 ( 0.000 0.000 0.000) 0.000 7.742 ( 0.000 0.000 0.000) 0.000 8.274 ( 0.000 0.000 0.000) 0.000 8.540 ( 0.000 0.000 0.000) 0.000 8.661 ( 0.000 0.000 0.000) 0.000 8.918 ( 0.000 0.000 0.000) 0.000 9.107 ( 0.000 0.000 0.000) 0.000 9.195 ( 0.000 0.000 0.000) 0.000 9.416 ( 0.000 0.000 0.000) 0.000 9.871 ( 0.000 0.000 0.000) 0.000 9.882 ( 0.000 0.000 0.000) 0.000 9.898 ( 0.000 0.000 0.000) 0.000 10.084 ( 0.000 0.000 0.000) 0.000 10.906 ( 0.000 0.000 0.000) 0.000 11.333 ( 0.000 0.000 0.000) 0.000 11.933 ( 0.000 0.000 0.000) 0.000 12.290 ( 0.000 0.000 0.000) 0.000 12.451 ( 0.000 0.000 0.000) 0.000 13.359 ( 0.000 0.000 0.000) 0.000 14.598 ( 0.000 0.000 0.000) 0.000 15.810 ( 0.000 0.000 0.000) 0.000 16.568 ( 0.000 0.000 0.000) 0.000 17.209 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/120) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.529 ( 27.351 0.000 0.000) 27.351 0.643 ( 32.552 0.000 0.000) 32.552 1.315 ( 65.835 0.000 0.000) 65.835 2.415 ( 10.055 0.000 0.000) 10.055 2.975 ( -1.802 0.000 0.000) 1.802 3.238 ( -11.409 0.000 0.000) 11.409 3.747 ( -14.923 0.000 0.000) 14.923 4.098 ( 1.422 0.000 0.000) 1.422 4.446 ( -1.953 0.000 0.000) 1.953 4.675 ( -3.192 0.000 0.000) 3.192 4.887 ( -2.766 0.000 0.000) 2.766 5.064 ( 31.894 0.000 0.000) 31.894 5.943 ( 3.280 0.000 0.000) 3.280 6.253 ( -10.885 0.000 0.000) 10.885 6.516 ( -14.101 0.000 0.000) 14.101 6.531 ( -2.963 0.000 0.000) 2.963 7.037 ( 8.222 0.000 0.000) 8.222 7.324 ( 10.842 0.000 0.000) 10.842 7.754 ( 1.983 0.000 0.000) 1.983 7.781 ( 3.903 0.000 0.000) 3.903 8.287 ( 1.384 0.000 0.000) 1.384 8.302 ( 6.459 0.000 0.000) 6.459 8.521 ( -1.943 0.000 0.000) 1.943 8.651 ( -1.037 0.000 0.000) 1.037 8.924 ( 0.204 0.000 0.000) 0.204 9.016 ( -8.871 0.000 0.000) 8.871 9.436 ( 2.065 0.000 0.000) 2.065 9.573 ( 3.173 0.000 0.000) 3.173 9.820 ( -9.325 0.000 0.000) 9.325 9.867 ( -0.838 0.000 0.000) 0.838 9.881 ( 0.257 0.000 0.000) 0.257 10.077 ( -0.775 0.000 0.000) 0.775 10.867 ( -3.632 0.000 0.000) 3.632 11.954 ( 1.956 0.000 0.000) 1.956 11.955 ( -24.276 0.000 0.000) 24.276 12.423 ( -10.949 0.000 0.000) 10.949 13.515 ( 16.396 0.000 0.000) 16.396 14.765 ( 15.245 0.000 0.000) 15.245 15.714 ( -4.713 0.000 0.000) 4.713 16.535 ( -3.474 0.000 0.000) 3.474 17.209 ( -0.040 0.000 0.000) 0.040 17.236 ( -1.000 0.000 0.000) 1.000 ======================= Grid point 2 (3/120) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.051 ( 26.791 0.000 0.000) 26.791 1.236 ( 28.551 0.000 0.000) 28.551 2.412 ( 39.338 0.000 0.000) 39.338 2.668 ( 15.426 0.000 0.000) 15.426 2.906 ( -5.827 0.000 0.000) 5.827 3.036 ( -2.996 0.000 0.000) 2.996 3.630 ( 6.092 0.000 0.000) 6.092 4.138 ( 2.680 0.000 0.000) 2.680 4.400 ( -2.413 0.000 0.000) 2.413 4.598 ( -4.338 0.000 0.000) 4.338 4.811 ( -5.015 0.000 0.000) 5.015 5.555 ( 9.391 0.000 0.000) 9.391 5.957 ( -22.133 0.000 0.000) 22.133 6.040 ( 15.325 0.000 0.000) 15.325 6.221 ( -11.723 0.000 0.000) 11.723 6.597 ( 9.466 0.000 0.000) 9.466 7.244 ( 13.562 0.000 0.000) 13.562 7.573 ( 12.820 0.000 0.000) 12.820 7.763 ( -1.279 0.000 0.000) 1.279 7.883 ( 6.429 0.000 0.000) 6.429 8.326 ( 2.527 0.000 0.000) 2.527 8.467 ( -3.555 0.000 0.000) 3.555 8.475 ( 11.108 0.000 0.000) 11.108 8.622 ( -2.001 0.000 0.000) 2.001 8.787 ( -14.644 0.000 0.000) 14.644 8.913 ( -1.095 0.000 0.000) 1.095 9.491 ( 3.506 0.000 0.000) 3.506 9.505 ( -22.821 0.000 0.000) 22.821 9.678 ( 7.810 0.000 0.000) 7.810 9.838 ( -2.059 0.000 0.000) 2.059 9.894 ( 0.955 0.000 0.000) 0.955 10.055 ( -1.428 0.000 0.000) 1.428 10.759 ( -8.769 0.000 0.000) 8.769 11.437 ( -29.346 0.000 0.000) 29.346 11.998 ( 2.302 0.000 0.000) 2.302 12.146 ( -13.190 0.000 0.000) 13.190 13.914 ( 22.905 0.000 0.000) 22.905 15.106 ( 18.824 0.000 0.000) 18.824 15.581 ( -8.975 0.000 0.000) 8.975 16.436 ( -6.793 0.000 0.000) 6.793 17.204 ( -0.503 0.000 0.000) 0.503 17.211 ( -1.482 0.000 0.000) 1.482 ======================= Grid point 3 (4/120) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( 25.532 0.000 0.000) 25.532 1.724 ( 21.785 0.000 0.000) 21.785 2.553 ( -9.497 0.000 0.000) 9.497 2.734 ( -12.319 0.000 0.000) 12.319 2.985 ( 17.073 0.000 0.000) 17.073 3.257 ( 13.516 0.000 0.000) 13.516 4.062 ( 31.450 0.000 0.000) 31.450 4.199 ( 3.605 0.000 0.000) 3.605 4.367 ( -0.982 0.000 0.000) 0.982 4.521 ( -3.269 0.000 0.000) 3.269 4.700 ( -6.217 0.000 0.000) 6.217 5.442 ( -28.902 0.000 0.000) 28.902 5.534 ( -0.326 0.000 0.000) 0.326 6.082 ( -4.599 0.000 0.000) 4.599 6.504 ( 25.244 0.000 0.000) 25.244 6.834 ( 14.383 0.000 0.000) 14.383 7.570 ( 20.296 0.000 0.000) 20.296 7.632 ( -7.175 0.000 0.000) 7.175 7.799 ( 1.554 0.000 0.000) 1.554 8.017 ( 7.279 0.000 0.000) 7.279 8.382 ( 3.263 0.000 0.000) 3.263 8.386 ( -4.863 0.000 0.000) 4.863 8.466 ( -16.450 0.000 0.000) 16.450 8.575 ( -2.805 0.000 0.000) 2.805 8.663 ( 4.275 0.000 0.000) 4.275 8.953 ( 9.771 0.000 0.000) 9.771 9.020 ( -24.859 0.000 0.000) 24.859 9.566 ( 4.160 0.000 0.000) 4.160 9.789 ( -2.993 0.000 0.000) 2.993 9.869 ( 11.801 0.000 0.000) 11.801 9.917 ( 1.449 0.000 0.000) 1.449 10.023 ( -1.853 0.000 0.000) 1.853 10.468 ( -23.032 0.000 0.000) 23.032 10.870 ( -26.839 0.000 0.000) 26.839 11.997 ( -2.615 0.000 0.000) 2.615 12.031 ( 0.921 0.000 0.000) 0.921 14.353 ( 22.154 0.000 0.000) 22.154 15.372 ( -12.649 0.000 0.000) 12.649 15.462 ( 17.745 0.000 0.000) 17.745 16.274 ( -9.909 0.000 0.000) 9.909 17.184 ( -1.188 0.000 0.000) 1.188 17.190 ( -0.915 0.000 0.000) 0.915 ======================= Grid point 4 (5/120) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( 23.058 0.000 0.000) 23.058 2.077 ( 15.239 0.000 0.000) 15.239 2.336 ( -12.245 0.000 0.000) 12.245 2.432 ( -18.698 0.000 0.000) 18.698 3.294 ( 13.407 0.000 0.000) 13.407 3.420 ( 1.823 0.000 0.000) 1.823 4.273 ( 3.916 0.000 0.000) 3.916 4.340 ( -2.548 0.000 0.000) 2.548 4.502 ( 1.939 0.000 0.000) 1.939 4.519 ( 17.269 0.000 0.000) 17.269 4.582 ( -5.684 0.000 0.000) 5.684 4.910 ( -24.827 0.000 0.000) 24.827 5.724 ( 16.898 0.000 0.000) 16.898 5.979 ( -7.979 0.000 0.000) 7.979 6.961 ( 24.718 0.000 0.000) 24.718 7.141 ( 16.636 0.000 0.000) 16.636 7.424 ( -14.288 0.000 0.000) 14.288 7.515 ( -27.514 0.000 0.000) 27.514 7.992 ( 21.797 0.000 0.000) 21.797 8.156 ( 6.940 0.000 0.000) 6.940 8.281 ( -6.012 0.000 0.000) 6.012 8.296 ( -6.262 0.000 0.000) 6.262 8.448 ( 3.528 0.000 0.000) 3.528 8.515 ( -3.348 0.000 0.000) 3.348 8.627 ( -4.618 0.000 0.000) 4.618 8.638 ( -11.396 0.000 0.000) 11.396 9.325 ( 26.227 0.000 0.000) 26.227 9.647 ( 4.171 0.000 0.000) 4.171 9.724 ( -3.730 0.000 0.000) 3.730 9.903 ( -32.255 0.000 0.000) 32.255 9.949 ( 1.824 0.000 0.000) 1.824 9.986 ( -1.984 0.000 0.000) 1.984 10.128 ( 15.010 0.000 0.000) 15.010 10.447 ( -18.383 0.000 0.000) 18.383 11.999 ( 1.636 0.000 0.000) 1.636 12.029 ( -1.046 0.000 0.000) 1.046 14.755 ( 19.349 0.000 0.000) 19.349 15.096 ( -16.030 0.000 0.000) 16.030 15.783 ( 15.465 0.000 0.000) 15.465 16.055 ( -12.809 0.000 0.000) 12.809 17.170 ( -0.285 0.000 0.000) 0.285 17.174 ( -0.632 0.000 0.000) 0.632 ======================= Grid point 9 (6/120) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.663 ( 0.000 31.975 0.000) 31.975 0.790 ( 0.000 38.168 0.000) 38.168 1.074 ( 0.000 51.645 0.000) 51.645 2.299 ( 0.000 -16.602 0.000) 16.602 2.752 ( 0.000 -21.004 0.000) 21.004 3.371 ( 0.000 -3.472 0.000) 3.472 3.913 ( 0.000 1.488 0.000) 1.488 4.211 ( 0.000 10.042 0.000) 10.042 4.473 ( 0.000 0.656 0.000) 0.656 4.703 ( 0.000 -0.289 0.000) 0.289 4.760 ( 0.000 9.871 0.000) 9.871 4.879 ( 0.000 -3.367 0.000) 3.367 5.690 ( 0.000 -16.830 0.000) 16.830 6.231 ( 0.000 -20.456 0.000) 20.456 6.588 ( 0.000 5.458 0.000) 5.458 6.882 ( 0.000 8.763 0.000) 8.763 6.968 ( 0.000 1.868 0.000) 1.868 7.151 ( 0.000 -8.965 0.000) 8.965 7.782 ( 0.000 3.897 0.000) 3.897 7.880 ( 0.000 13.743 0.000) 13.743 8.206 ( 0.000 -6.153 0.000) 6.153 8.550 ( 0.000 0.998 0.000) 0.998 8.649 ( 0.000 -1.183 0.000) 1.183 8.742 ( 0.000 -7.821 0.000) 7.821 8.977 ( 0.000 3.278 0.000) 3.278 9.060 ( 0.000 -1.761 0.000) 1.761 9.345 ( 0.000 11.045 0.000) 11.045 9.475 ( 0.000 5.371 0.000) 5.371 9.838 ( 0.000 -3.246 0.000) 3.246 9.904 ( 0.000 2.014 0.000) 2.014 9.956 ( 0.000 -4.677 0.000) 4.677 10.067 ( 0.000 -1.671 0.000) 1.671 11.350 ( 0.000 1.700 0.000) 1.700 11.758 ( 0.000 -12.087 0.000) 12.087 12.272 ( 0.000 2.911 0.000) 2.911 12.292 ( 0.000 0.176 0.000) 0.176 13.143 ( 0.000 16.423 0.000) 16.423 14.419 ( 0.000 -15.950 0.000) 15.950 15.928 ( 0.000 10.016 0.000) 10.016 16.512 ( 0.000 -5.269 0.000) 5.269 16.980 ( 0.000 2.922 0.000) 2.922 17.188 ( 0.000 -2.025 0.000) 2.025 ======================= Grid point 10 (7/120) ======================= q-point: ( 0.11 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.941 ( 14.406 31.126 0.000) 34.298 1.030 ( 22.931 26.328 0.000) 34.914 1.602 ( 48.712 27.484 0.000) 55.930 2.365 ( 8.475 -10.961 0.000) 13.855 2.752 ( -0.187 -19.808 0.000) 19.808 3.261 ( -9.435 -1.859 0.000) 9.616 3.770 ( -9.724 9.577 0.000) 13.648 4.214 ( 0.140 9.213 0.000) 9.214 4.455 ( -1.775 0.797 0.000) 1.946 4.670 ( -3.221 -0.290 0.000) 3.234 4.852 ( -2.646 -3.297 0.000) 4.227 5.034 ( 23.404 -3.054 0.000) 23.602 5.667 ( -2.629 -18.218 0.000) 18.407 6.162 ( -6.661 -17.352 0.000) 18.586 6.560 ( -3.868 10.322 0.000) 11.023 6.781 ( -9.423 10.617 0.000) 14.195 6.998 ( 3.641 -1.928 0.000) 4.120 7.272 ( 14.163 -3.617 0.000) 14.618 7.819 ( 3.674 3.676 0.000) 5.198 7.901 ( 1.887 13.233 0.000) 13.367 8.221 ( 1.582 -5.923 0.000) 6.131 8.534 ( -1.679 1.178 0.000) 2.051 8.569 ( -8.456 12.000 0.000) 14.680 8.638 ( -1.087 -1.226 0.000) 1.638 8.854 ( -1.170 -4.341 0.000) 4.496 9.001 ( -9.211 -1.731 0.000) 9.372 9.492 ( 6.610 -0.634 0.000) 6.641 9.493 ( 1.775 5.123 0.000) 5.422 9.811 ( -11.705 -2.361 0.000) 11.941 9.842 ( 0.484 -3.075 0.000) 3.113 9.895 ( -0.948 1.954 0.000) 2.172 10.059 ( -0.798 -1.692 0.000) 1.871 11.167 ( -9.911 17.378 0.000) 20.006 11.735 ( -6.297 -9.221 0.000) 11.166 12.062 ( -15.154 2.017 0.000) 15.288 12.411 ( -1.265 -6.390 0.000) 6.515 13.415 ( 22.300 4.445 0.000) 22.739 14.568 ( 13.768 -16.869 0.000) 21.774 15.866 ( -4.521 12.029 0.000) 12.850 16.489 ( -2.787 -4.702 0.000) 5.466 17.097 ( 5.901 -4.729 0.000) 7.562 17.190 ( 0.260 -2.031 0.000) 2.048 ======================= Grid point 11 (8/120) ======================= q-point: ( 0.22 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.287 ( 20.285 20.632 0.000) 28.934 1.482 ( 23.621 20.599 0.000) 31.341 2.503 ( 31.899 5.947 0.000) 32.449 2.630 ( 20.966 -3.110 0.000) 21.195 2.731 ( -2.495 -15.982 0.000) 16.176 3.113 ( -2.562 4.511 0.000) 5.188 3.691 ( 5.351 10.607 0.000) 11.880 4.211 ( -0.490 6.042 0.000) 6.061 4.415 ( -2.057 1.129 0.000) 2.346 4.593 ( -4.245 -0.128 0.000) 4.246 4.783 ( -4.403 -2.703 0.000) 5.166 5.334 ( -3.262 -22.063 0.000) 22.303 5.682 ( 7.907 -10.090 0.000) 12.819 6.016 ( -5.005 -12.232 0.000) 13.217 6.427 ( -3.246 13.674 0.000) 14.054 6.754 ( 4.745 15.573 0.000) 16.280 7.126 ( 10.094 -8.751 0.000) 13.360 7.545 ( 10.621 -4.135 0.000) 11.398 7.915 ( 6.071 3.118 0.000) 6.825 7.948 ( 3.246 15.225 0.000) 15.567 8.263 ( 2.663 -5.365 0.000) 5.990 8.488 ( -2.988 1.647 0.000) 3.412 8.530 ( 1.711 3.468 0.000) 3.867 8.607 ( -2.094 -1.349 0.000) 2.491 8.768 ( -14.049 -2.005 0.000) 14.191 8.852 ( 0.451 -4.890 0.000) 4.911 9.464 ( -16.573 -2.356 0.000) 16.739 9.540 ( 3.081 4.513 0.000) 5.465 9.646 ( 3.153 -2.350 0.000) 3.932 9.850 ( -0.405 -0.733 0.000) 0.838 9.874 ( -0.477 -0.070 0.000) 0.482 10.037 ( -1.480 -1.761 0.000) 2.300 10.940 ( -15.035 13.695 0.000) 20.337 11.406 ( -26.588 -2.795 0.000) 26.735 11.915 ( 0.297 -0.800 0.000) 0.853 12.304 ( -6.092 5.498 0.000) 8.206 13.867 ( 23.497 -0.439 0.000) 23.501 14.852 ( 13.471 -19.466 0.000) 23.672 15.783 ( -3.546 14.426 0.000) 14.855 16.406 ( -5.777 -3.224 0.000) 6.616 17.148 ( 0.410 -3.505 0.000) 3.529 17.193 ( -0.212 -2.055 0.000) 2.066 ======================= Grid point 12 (9/120) ======================= q-point: ( 0.33 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 21.247 12.461 0.000) 24.631 1.914 ( 20.635 16.896 0.000) 26.670 2.635 ( -7.960 -9.460 0.000) 12.363 2.684 ( -4.608 9.346 0.000) 10.420 3.010 ( 17.233 2.273 0.000) 17.382 3.249 ( 10.835 -0.214 0.000) 10.837 4.033 ( 22.979 -0.560 0.000) 22.986 4.201 ( -0.036 0.787 0.000) 0.788 4.375 ( -2.664 -0.570 0.000) 2.725 4.529 ( -1.716 1.605 0.000) 2.349 4.692 ( -4.812 -0.969 0.000) 4.909 5.064 ( -19.940 -24.495 0.000) 31.585 5.677 ( 0.202 4.135 0.000) 4.139 6.079 ( 4.088 -2.871 0.000) 4.996 6.619 ( 20.681 9.326 0.000) 22.686 6.885 ( 8.698 7.588 0.000) 11.543 7.377 ( 15.059 -11.895 0.000) 19.191 7.607 ( -3.552 -5.198 0.000) 6.296 7.985 ( -4.537 12.516 0.000) 13.313 8.042 ( 6.868 2.400 0.000) 7.276 8.313 ( 1.715 -4.414 0.000) 4.736 8.428 ( -2.590 1.954 0.000) 3.244 8.452 ( -13.794 -3.038 0.000) 14.124 8.559 ( -2.925 -1.531 0.000) 3.301 8.563 ( -2.762 -4.692 0.000) 5.444 8.887 ( 1.290 -4.380 0.000) 4.566 9.146 ( -7.893 8.559 0.000) 11.643 9.607 ( 3.748 3.795 0.000) 5.334 9.765 ( 6.775 -8.769 0.000) 11.081 9.813 ( -2.756 2.192 0.000) 3.522 9.890 ( 1.522 -2.503 0.000) 2.930 10.004 ( -1.939 -1.889 0.000) 2.707 10.577 ( -22.348 8.429 0.000) 23.885 10.865 ( -26.022 -0.652 0.000) 26.030 11.981 ( 5.045 4.404 0.000) 6.697 12.216 ( -3.405 9.716 0.000) 10.296 14.298 ( 20.935 -3.346 0.000) 21.201 15.015 ( 2.012 -20.301 0.000) 20.401 15.769 ( 3.195 15.527 0.000) 15.852 16.270 ( -8.180 -0.816 0.000) 8.221 17.144 ( -0.434 -2.593 0.000) 2.629 17.179 ( -1.192 -1.807 0.000) 2.165 ======================= Grid point 13 (10/120) ======================= q-point: ( 0.44 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( 19.275 5.482 0.000) 20.040 2.262 ( 15.445 16.627 0.000) 22.694 2.417 ( -14.565 -1.738 0.000) 14.668 2.516 ( -11.199 15.735 0.000) 19.313 3.311 ( 12.145 1.522 0.000) 12.240 3.406 ( 3.301 -1.089 0.000) 3.476 4.227 ( 2.830 -3.037 0.000) 4.151 4.302 ( -4.463 -3.561 0.000) 5.709 4.338 ( 11.669 -15.078 0.000) 19.066 4.539 ( 2.381 3.034 0.000) 3.857 4.604 ( -4.131 1.460 0.000) 4.381 4.650 ( -20.868 -21.291 0.000) 29.812 5.884 ( 16.352 11.965 0.000) 20.262 6.091 ( -3.880 8.621 0.000) 9.454 7.033 ( 21.738 6.645 0.000) 22.732 7.128 ( 16.546 -0.839 0.000) 16.568 7.417 ( -12.835 -2.879 0.000) 13.154 7.519 ( -20.736 0.920 0.000) 20.757 7.832 ( 11.301 -10.988 0.000) 15.762 8.165 ( -17.360 -12.537 0.000) 21.413 8.172 ( 6.418 1.542 0.000) 6.600 8.281 ( -4.605 -0.138 0.000) 4.607 8.434 ( 2.777 -1.102 0.000) 2.988 8.497 ( -3.410 -1.679 0.000) 3.801 8.609 ( 7.554 5.137 0.000) 9.135 8.776 ( -8.790 4.756 0.000) 9.994 9.333 ( 20.550 1.075 0.000) 20.578 9.681 ( 3.840 3.153 0.000) 4.969 9.746 ( -15.542 -10.855 0.000) 18.957 9.752 ( -3.485 2.650 0.000) 4.379 9.924 ( 1.965 -2.329 0.000) 3.047 9.964 ( -2.105 -2.082 0.000) 2.961 10.263 ( -0.896 8.597 0.000) 8.643 10.460 ( -16.541 0.973 0.000) 16.570 12.078 ( 4.657 7.975 0.000) 9.235 12.155 ( -3.376 9.503 0.000) 10.085 14.663 ( 16.664 -7.397 0.000) 18.232 14.926 ( -10.107 -13.605 0.000) 16.948 15.902 ( 9.487 9.104 0.000) 13.148 16.095 ( -9.890 3.062 0.000) 10.353 17.141 ( 0.239 -2.230 0.000) 2.243 17.155 ( -1.109 -1.945 0.000) 2.239 ======================= Grid point 18 (11/120) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( 0.000 29.592 0.000) 29.592 1.542 ( 0.000 35.404 0.000) 35.404 1.854 ( 0.000 -24.029 0.000) 24.029 2.086 ( 0.000 45.089 0.000) 45.089 2.217 ( 0.000 -30.408 0.000) 30.408 2.928 ( 0.000 -35.054 0.000) 35.054 4.266 ( 0.000 27.151 0.000) 27.151 4.403 ( 0.000 7.224 0.000) 7.224 4.479 ( 0.000 -0.794 0.000) 0.794 4.712 ( 0.000 1.783 0.000) 1.783 4.779 ( 0.000 -16.126 0.000) 16.126 4.788 ( 0.000 -5.010 0.000) 5.010 5.487 ( 0.000 5.757 0.000) 5.757 5.807 ( 0.000 -20.372 0.000) 20.372 6.734 ( 0.000 8.810 0.000) 8.810 6.937 ( 0.000 -10.270 0.000) 10.270 6.992 ( 0.000 1.798 0.000) 1.798 7.001 ( 0.000 0.960 0.000) 0.960 7.895 ( 0.000 6.951 0.000) 6.951 8.053 ( 0.000 -8.175 0.000) 8.175 8.211 ( 0.000 17.168 0.000) 17.168 8.529 ( 0.000 -13.285 0.000) 13.285 8.579 ( 0.000 1.722 0.000) 1.722 8.616 ( 0.000 -1.858 0.000) 1.858 9.025 ( 0.000 1.398 0.000) 1.398 9.041 ( 0.000 -0.462 0.000) 0.462 9.590 ( 0.000 12.185 0.000) 12.185 9.608 ( 0.000 7.048 0.000) 7.048 9.743 ( 0.000 -5.878 0.000) 5.878 9.813 ( 0.000 -9.260 0.000) 9.260 9.958 ( 0.000 3.053 0.000) 3.053 10.020 ( 0.000 -2.845 0.000) 2.845 11.409 ( 0.000 4.334 0.000) 4.334 11.539 ( 0.000 -8.674 0.000) 8.674 12.297 ( 0.000 0.286 0.000) 0.286 12.299 ( 0.000 0.265 0.000) 0.265 13.555 ( 0.000 22.524 0.000) 22.524 14.018 ( 0.000 -22.157 0.000) 22.157 16.155 ( 0.000 11.293 0.000) 11.293 16.365 ( 0.000 -8.987 0.000) 8.987 17.053 ( 0.000 3.910 0.000) 3.910 17.130 ( 0.000 -3.478 0.000) 3.478 ======================= Grid point 19 (12/120) ======================= q-point: ( 0.11 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( 20.100 23.687 0.000) 31.066 1.609 ( 6.722 32.872 0.000) 33.553 1.995 ( 13.711 -20.010 0.000) 24.257 2.244 ( 2.724 -28.866 0.000) 28.994 2.317 ( 22.869 35.399 0.000) 42.143 2.975 ( 4.564 -25.673 0.000) 26.076 4.195 ( -5.815 28.606 0.000) 29.191 4.390 ( -1.496 6.715 0.000) 6.880 4.462 ( -1.654 -0.779 0.000) 1.829 4.681 ( -2.881 2.109 0.000) 3.571 4.762 ( -2.435 -5.062 0.000) 5.617 4.782 ( 0.660 -24.759 0.000) 24.768 5.502 ( 1.798 6.459 0.000) 6.704 5.787 ( -2.434 -18.084 0.000) 18.247 6.714 ( -2.848 6.031 0.000) 6.670 6.825 ( -2.189 -4.315 0.000) 4.838 7.064 ( 4.506 6.826 0.000) 8.180 7.187 ( 12.696 -4.977 0.000) 13.636 7.925 ( 3.060 6.580 0.000) 7.256 8.075 ( 2.254 -7.779 0.000) 8.099 8.226 ( 1.608 16.948 0.000) 17.025 8.532 ( 0.318 -11.805 0.000) 11.809 8.565 ( -1.381 1.834 0.000) 2.296 8.605 ( -1.203 -1.927 0.000) 2.272 8.881 ( -9.738 4.441 0.000) 10.703 8.954 ( -9.302 -2.823 0.000) 9.721 9.574 ( -2.245 7.022 0.000) 7.372 9.620 ( 1.247 6.801 0.000) 6.915 9.721 ( -8.350 -6.355 0.000) 10.493 9.751 ( 0.818 -5.706 0.000) 5.765 9.948 ( -0.947 3.089 0.000) 3.231 10.011 ( -0.864 -2.882 0.000) 3.009 11.433 ( -1.148 9.493 0.000) 9.563 11.587 ( -1.582 -6.381 0.000) 6.574 12.104 ( -13.437 3.220 0.000) 13.817 12.223 ( -4.389 -8.691 0.000) 9.736 13.716 ( 14.248 20.645 0.000) 25.085 14.161 ( 12.738 -21.897 0.000) 25.332 16.123 ( -2.766 12.291 0.000) 12.599 16.345 ( -2.033 -9.225 0.000) 9.447 17.082 ( 2.177 1.831 0.000) 2.845 17.136 ( 0.490 -3.027 0.000) 3.066 ======================= Grid point 20 (13/120) ======================= q-point: ( 0.22 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.785 ( 11.059 26.440 0.000) 28.660 1.932 ( 20.347 21.509 0.000) 29.608 2.311 ( 3.733 -24.183 0.000) 24.470 2.325 ( 18.997 -16.712 0.000) 25.302 2.829 ( 24.948 15.563 0.000) 29.404 3.091 ( 7.296 -7.816 0.000) 10.692 4.122 ( -0.280 29.109 0.000) 29.110 4.336 ( -4.241 5.393 0.000) 6.861 4.414 ( -3.563 -1.970 0.000) 4.072 4.621 ( -2.754 3.231 0.000) 4.246 4.707 ( -2.975 -4.474 0.000) 5.373 4.763 ( -5.051 -31.674 0.000) 32.074 5.586 ( 7.565 0.987 0.000) 7.629 5.731 ( -0.751 -12.449 0.000) 12.471 6.679 ( 2.525 11.545 0.000) 11.818 6.902 ( 8.418 -9.700 0.000) 12.844 7.127 ( 2.088 15.305 0.000) 15.447 7.397 ( 7.164 -10.362 0.000) 12.598 8.006 ( 5.090 5.624 0.000) 7.586 8.135 ( 3.766 -6.740 0.000) 7.721 8.275 ( 2.825 15.284 0.000) 15.543 8.516 ( -3.835 -6.900 0.000) 7.894 8.527 ( -2.562 2.106 0.000) 3.316 8.571 ( -2.299 -2.110 0.000) 3.120 8.723 ( -9.059 -0.079 0.000) 9.060 8.769 ( -5.392 -3.389 0.000) 6.369 9.475 ( -8.984 3.625 0.000) 9.688 9.574 ( -3.801 -4.856 0.000) 6.167 9.654 ( 2.258 6.159 0.000) 6.560 9.774 ( 1.535 -5.231 0.000) 5.452 9.922 ( -1.800 3.195 0.000) 3.667 9.987 ( -1.623 -3.002 0.000) 3.413 11.189 ( -21.768 9.552 0.000) 23.771 11.330 ( -23.939 -4.851 0.000) 24.425 12.014 ( 4.947 9.840 0.000) 11.013 12.244 ( 3.953 -10.033 0.000) 10.784 14.025 ( 16.634 15.576 0.000) 22.788 14.422 ( 12.668 -21.580 0.000) 25.023 16.070 ( -2.317 12.961 0.000) 13.166 16.290 ( -3.532 -8.321 0.000) 9.039 17.110 ( 0.540 0.071 0.000) 0.545 17.142 ( -0.084 -2.560 0.000) 2.562 ======================= Grid point 21 (14/120) ======================= q-point: ( 0.33 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 11.991 17.748 0.000) 21.419 2.318 ( 19.383 20.550 0.000) 28.249 2.368 ( 1.599 -16.101 0.000) 16.180 2.671 ( 14.953 -11.986 0.000) 19.164 3.149 ( 10.093 9.486 0.000) 13.851 3.253 ( 8.839 -0.765 0.000) 8.872 4.141 ( -1.221 12.795 0.000) 12.853 4.244 ( -4.496 3.326 0.000) 5.593 4.323 ( -5.531 -3.894 0.000) 6.764 4.544 ( -16.751 -24.804 0.000) 29.931 4.590 ( -0.425 3.674 0.000) 3.698 4.656 ( -2.213 -2.565 0.000) 3.387 5.755 ( 13.954 5.442 0.000) 14.977 5.925 ( 17.591 -10.242 0.000) 20.355 6.849 ( 14.560 12.962 0.000) 19.494 7.120 ( 12.804 -12.027 0.000) 17.567 7.145 ( 0.981 14.090 0.000) 14.124 7.432 ( -3.372 -11.894 0.000) 12.363 8.112 ( 5.694 4.340 0.000) 7.159 8.190 ( -16.254 7.077 0.000) 17.728 8.212 ( 3.903 -5.214 0.000) 6.513 8.319 ( -17.090 -6.879 0.000) 18.422 8.470 ( -3.123 2.256 0.000) 3.852 8.518 ( -3.124 -2.315 0.000) 3.888 8.614 ( 2.749 7.260 0.000) 7.763 8.772 ( 3.073 -7.039 0.000) 7.681 9.336 ( -2.923 10.088 0.000) 10.503 9.555 ( 0.523 -11.116 0.000) 11.128 9.705 ( 2.891 5.338 0.000) 6.071 9.808 ( 1.955 -4.399 0.000) 4.814 9.881 ( -2.362 3.221 0.000) 3.994 9.950 ( -2.176 -3.223 0.000) 3.889 10.738 ( -22.912 6.511 0.000) 23.819 10.832 ( -24.313 -2.878 0.000) 24.483 12.151 ( 7.138 10.352 0.000) 12.574 12.304 ( 1.866 -2.436 0.000) 3.068 14.326 ( 14.075 7.871 0.000) 16.126 14.610 ( 6.291 -18.400 0.000) 19.446 16.046 ( -0.031 11.278 0.000) 11.278 16.215 ( -4.130 -5.241 0.000) 6.672 17.108 ( -0.466 -0.435 0.000) 0.637 17.131 ( -0.998 -2.309 0.000) 2.515 ======================= Grid point 22 (15/120) ======================= q-point: ( 0.44 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( 9.269 7.183 0.000) 11.727 2.351 ( -3.694 -4.880 0.000) 6.120 2.647 ( 13.684 17.727 0.000) 22.394 2.805 ( -1.722 6.065 0.000) 6.305 3.352 ( 10.101 3.279 0.000) 10.619 3.399 ( 5.195 0.106 0.000) 5.197 4.057 ( -3.191 -7.679 0.000) 8.315 4.190 ( -0.623 -0.127 0.000) 0.636 4.195 ( -16.520 -19.493 0.000) 25.552 4.225 ( -3.974 -3.272 0.000) 5.148 4.597 ( 0.894 2.194 0.000) 2.369 4.620 ( -1.544 -0.107 0.000) 1.548 6.115 ( 17.351 9.452 0.000) 19.759 6.214 ( 8.090 1.059 0.000) 8.159 7.139 ( 4.365 4.276 0.000) 6.111 7.218 ( 20.576 10.081 0.000) 22.912 7.290 ( -9.745 -8.615 0.000) 13.007 7.433 ( 15.137 -10.004 0.000) 18.144 7.754 ( -22.545 4.270 0.000) 22.946 7.911 ( -22.761 -10.610 0.000) 25.113 8.215 ( 4.601 2.509 0.000) 5.240 8.263 ( 0.422 -1.856 0.000) 1.903 8.425 ( -0.681 0.617 0.000) 0.919 8.456 ( -3.057 -2.088 0.000) 3.702 8.735 ( 6.703 5.847 0.000) 8.895 8.812 ( -0.547 -1.196 0.000) 1.315 9.386 ( 7.321 4.584 0.000) 8.638 9.531 ( -4.859 -9.443 0.000) 10.619 9.763 ( 3.090 4.512 0.000) 5.469 9.819 ( -2.325 2.970 0.000) 3.772 9.861 ( 1.778 -3.118 0.000) 3.589 9.905 ( -2.426 -3.537 0.000) 4.289 10.408 ( -8.048 5.107 0.000) 9.531 10.467 ( -12.586 -0.887 0.000) 12.617 12.261 ( 4.205 7.754 0.000) 8.821 12.312 ( -1.097 3.615 0.000) 3.778 14.550 ( 8.807 -1.337 0.000) 8.908 14.654 ( -1.704 -10.941 0.000) 11.073 16.071 ( 2.558 6.334 0.000) 6.831 16.136 ( -3.937 -0.015 0.000) 3.937 17.101 ( -0.012 -1.066 0.000) 1.066 17.110 ( -0.895 -1.797 0.000) 2.008 ======================= Grid point 45 (16/120) ======================= q-point: ( 0.00 0.00 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.515 ( 0.000 0.000 26.566) 26.566 0.783 ( 0.000 0.000 37.717) 37.717 1.430 ( 0.000 0.000 69.209) 69.209 2.310 ( 0.000 0.000 0.483) 0.483 3.160 ( 0.000 0.000 -12.890) 12.890 3.223 ( 0.000 0.000 21.257) 21.257 3.688 ( 0.000 0.000 -13.407) 13.407 4.605 ( 0.000 0.000 32.769) 32.769 4.622 ( 0.000 0.000 14.660) 14.660 4.683 ( 0.000 0.000 4.585) 4.585 4.852 ( 0.000 0.000 13.726) 13.726 5.144 ( 0.000 0.000 19.449) 19.449 5.903 ( 0.000 0.000 1.143) 1.143 6.345 ( 0.000 0.000 -3.341) 3.341 6.593 ( 0.000 0.000 0.567) 0.567 6.679 ( 0.000 0.000 3.123) 3.123 6.945 ( 0.000 0.000 0.169) 0.169 7.207 ( 0.000 0.000 -0.725) 0.725 7.227 ( 0.000 0.000 -2.681) 2.681 7.668 ( 0.000 0.000 -4.305) 4.305 7.811 ( 0.000 0.000 6.364) 6.364 8.358 ( 0.000 0.000 6.838) 6.838 8.368 ( 0.000 0.000 -20.722) 20.722 8.892 ( 0.000 0.000 -2.153) 2.153 9.031 ( 0.000 0.000 -6.157) 6.157 9.261 ( 0.000 0.000 2.258) 2.258 9.576 ( 0.000 0.000 10.455) 10.455 9.662 ( 0.000 0.000 20.080) 20.080 9.813 ( 0.000 0.000 -5.174) 5.174 9.893 ( 0.000 0.000 0.217) 0.217 9.904 ( 0.000 0.000 0.137) 0.137 10.884 ( 0.000 0.000 -2.176) 2.176 11.357 ( 0.000 0.000 2.503) 2.503 11.928 ( 0.000 0.000 -0.395) 0.395 12.232 ( 0.000 0.000 -5.603) 5.603 12.397 ( 0.000 0.000 -5.221) 5.221 13.324 ( 0.000 0.000 -3.427) 3.427 14.578 ( 0.000 0.000 -2.223) 2.223 15.763 ( 0.000 0.000 -4.617) 4.617 16.489 ( 0.000 0.000 -7.653) 7.653 17.035 ( 0.000 0.000 -3.064) 3.064 17.197 ( 0.000 0.000 -0.991) 0.991 ======================= Grid point 46 (17/120) ======================= q-point: ( 0.11 0.00 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.996 ( 19.158 0.000 27.940) 33.877 1.152 ( 33.255 0.000 23.400) 40.662 1.716 ( 35.052 0.000 48.545) 59.877 2.406 ( 9.477 0.000 0.164) 9.478 3.082 ( -8.426 0.000 -12.118) 14.760 3.221 ( -0.384 0.000 22.263) 22.266 3.582 ( -7.445 0.000 -10.011) 12.476 4.450 ( -3.829 0.000 24.779) 25.073 4.606 ( -1.600 0.000 15.029) 15.114 4.821 ( -2.979 0.000 13.929) 14.244 5.089 ( 2.735 0.000 16.671) 16.894 5.137 ( 22.818 0.000 10.697) 25.201 5.923 ( 1.674 0.000 -0.604) 1.780 6.230 ( -10.635 0.000 -2.461) 10.916 6.519 ( -15.060 0.000 0.567) 15.071 6.538 ( -2.809 0.000 0.726) 2.901 6.979 ( 7.576 0.000 -2.448) 7.962 7.341 ( 12.073 0.000 1.723) 12.195 7.618 ( 25.381 0.000 -14.888) 29.426 7.670 ( 0.313 0.000 -5.404) 5.414 7.863 ( 4.446 0.000 6.009) 7.475 8.366 ( -0.112 0.000 -19.884) 19.884 8.370 ( 1.093 0.000 6.568) 6.658 8.919 ( 2.296 0.000 -1.554) 2.773 8.958 ( -7.179 0.000 -4.659) 8.558 9.209 ( -6.998 0.000 12.422) 14.258 9.400 ( -5.913 0.000 9.272) 10.997 9.727 ( -9.461 0.000 -6.362) 11.401 9.828 ( 8.305 0.000 16.780) 18.723 9.870 ( -0.456 0.000 0.000) 0.456 9.923 ( -0.314 0.000 1.328) 1.365 10.846 ( -30.452 0.000 34.076) 45.700 10.847 ( -3.528 0.000 -2.040) 4.076 11.909 ( -23.241 0.000 -4.348) 23.644 11.961 ( 1.919 0.000 0.327) 1.946 12.390 ( -8.876 0.000 -3.297) 9.469 13.474 ( 15.688 0.000 -4.079) 16.210 14.729 ( 13.926 0.000 -3.718) 14.414 15.689 ( -6.122 0.000 -3.397) 7.001 16.456 ( -3.468 0.000 -7.615) 8.368 17.073 ( 1.580 0.000 -9.529) 9.660 17.192 ( -0.638 0.000 -1.543) 1.670 ======================= Grid point 47 (18/120) ======================= q-point: ( 0.22 0.00 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( 22.097 0.000 15.843) 27.190 1.597 ( 19.276 0.000 38.171) 42.762 2.528 ( 30.083 0.000 13.961) 33.165 2.643 ( 14.156 0.000 -0.195) 14.157 2.936 ( 1.011 0.000 -7.122) 7.193 3.196 ( -2.609 0.000 25.018) 25.153 3.563 ( 10.349 0.000 -4.950) 11.471 4.431 ( 1.065 0.000 24.150) 24.173 4.567 ( -2.116 0.000 15.688) 15.830 4.752 ( -3.841 0.000 14.517) 15.016 5.009 ( -5.435 0.000 18.447) 19.231 5.559 ( 6.188 0.000 1.470) 6.360 5.925 ( -22.512 0.000 -3.177) 22.735 6.030 ( 17.429 0.000 -0.353) 17.432 6.228 ( -11.398 0.000 0.878) 11.432 6.597 ( 8.759 0.000 0.121) 8.760 7.194 ( 14.319 0.000 -3.105) 14.652 7.589 ( 10.139 0.000 1.275) 10.219 7.674 ( 1.358 0.000 -5.924) 6.078 7.957 ( 5.153 0.000 5.303) 7.394 8.026 ( 16.770 0.000 -14.253) 22.009 8.371 ( 0.814 0.000 -17.098) 17.118 8.392 ( 0.988 0.000 4.815) 4.916 8.775 ( -11.366 0.000 -0.304) 11.370 8.946 ( -0.911 0.000 2.486) 2.648 9.058 ( -5.178 0.000 19.506) 20.181 9.383 ( 2.314 0.000 -0.159) 2.319 9.432 ( -20.849 0.000 -5.533) 21.570 9.835 ( -3.945 0.000 -1.055) 4.084 9.920 ( 0.865 0.000 2.013) 2.191 9.967 ( 6.615 0.000 18.179) 19.345 10.448 ( -12.740 0.000 30.237) 32.811 10.745 ( -7.909 0.000 -1.537) 8.057 11.425 ( -26.698 0.000 -1.100) 26.721 11.996 ( 1.648 0.000 -0.188) 1.658 12.143 ( -12.585 0.000 -0.394) 12.591 13.860 ( 22.509 0.000 -5.218) 23.106 15.046 ( 17.800 0.000 -5.924) 18.760 15.541 ( -9.405 0.000 -4.040) 10.236 16.356 ( -6.896 0.000 -7.750) 10.374 17.080 ( -0.439 0.000 -10.920) 10.928 17.171 ( -1.472 0.000 -2.973) 3.317 ======================= Grid point 48 (19/120) ======================= q-point: ( 0.33 0.00 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( 17.282 0.000 7.251) 18.742 1.962 ( 18.095 0.000 30.550) 35.506 2.576 ( -7.272 0.000 5.015) 8.834 2.890 ( 6.951 0.000 6.747) 9.687 3.140 ( 0.456 0.000 21.980) 21.985 3.204 ( 13.763 0.000 -2.532) 13.993 4.049 ( 31.264 0.000 -0.860) 31.276 4.473 ( 2.939 0.000 23.798) 23.979 4.540 ( -0.436 0.000 16.237) 16.243 4.686 ( -2.629 0.000 15.536) 15.757 4.893 ( -6.377 0.000 17.933) 19.033 5.411 ( -28.610 0.000 -2.906) 28.757 5.517 ( -0.597 0.000 -1.107) 1.258 6.084 ( -5.167 0.000 0.348) 5.179 6.503 ( 25.045 0.000 -0.002) 25.045 6.821 ( 13.685 0.000 -1.070) 13.727 7.530 ( 20.310 0.000 -3.076) 20.541 7.563 ( -7.018 0.000 -5.831) 9.124 7.785 ( -0.248 0.000 -1.137) 1.164 8.052 ( 4.715 0.000 2.350) 5.268 8.250 ( 5.417 0.000 -7.700) 9.415 8.403 ( 0.620 0.000 1.056) 1.224 8.418 ( 4.797 0.000 -11.927) 12.855 8.541 ( -11.571 0.000 6.932) 13.489 8.866 ( -5.915 0.000 9.922) 11.552 9.000 ( -20.837 0.000 -0.485) 20.843 9.059 ( 4.624 0.000 9.002) 10.120 9.473 ( 7.085 0.000 -2.411) 7.484 9.724 ( -7.686 0.000 -6.023) 9.765 9.944 ( 1.036 0.000 2.873) 3.054 10.097 ( 7.130 0.000 17.028) 18.461 10.281 ( -5.671 0.000 21.815) 22.540 10.511 ( -16.433 0.000 2.756) 16.663 10.911 ( -24.867 0.000 4.293) 25.235 11.990 ( -3.180 0.000 -0.588) 3.234 12.018 ( 0.450 0.000 -1.218) 1.299 14.296 ( 22.136 0.000 -5.595) 22.832 15.326 ( -12.889 0.000 -4.536) 13.664 15.387 ( 17.177 0.000 -7.388) 18.699 16.192 ( -10.046 0.000 -8.050) 12.874 17.070 ( -0.316 0.000 -10.241) 10.246 17.137 ( -2.034 0.000 -4.856) 5.265 ======================= Grid point 49 (20/120) ======================= q-point: ( 0.44 0.00 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( 10.968 0.000 1.255) 11.040 2.195 ( 1.276 0.000 5.432) 5.580 2.534 ( 7.622 0.000 26.865) 27.925 2.779 ( -13.093 0.000 28.768) 31.607 3.310 ( 10.788 0.000 3.250) 11.267 3.391 ( 3.924 0.000 -1.050) 4.062 4.488 ( 16.426 0.000 -2.133) 16.564 4.517 ( 1.235 0.000 21.452) 21.488 4.536 ( -0.643 0.000 18.079) 18.090 4.671 ( 1.138 0.000 14.995) 15.038 4.775 ( -5.420 0.000 17.671) 18.483 4.891 ( -23.371 0.000 -0.940) 23.390 5.704 ( 16.927 0.000 -1.796) 17.022 5.967 ( -8.769 0.000 -0.992) 8.825 6.953 ( 23.714 0.000 -0.772) 23.726 7.113 ( 16.039 0.000 -2.339) 16.209 7.367 ( -13.772 0.000 -5.004) 14.653 7.491 ( -25.509 0.000 -2.029) 25.590 7.938 ( 20.453 0.000 -4.718) 20.991 8.148 ( 3.402 0.000 -1.063) 3.564 8.264 ( -2.105 0.000 -1.189) 2.418 8.316 ( -11.581 0.000 -1.588) 11.690 8.482 ( 5.111 0.000 6.545) 8.304 8.511 ( 2.980 0.000 -1.119) 3.183 8.727 ( -6.609 0.000 7.664) 10.120 8.742 ( -6.092 0.000 9.164) 11.005 9.243 ( 13.968 0.000 -4.305) 14.616 9.526 ( -13.224 0.000 -11.879) 17.776 9.657 ( 12.020 0.000 0.782) 12.045 9.897 ( -9.067 0.000 1.855) 9.254 10.176 ( -1.523 0.000 17.487) 17.553 10.208 ( -9.097 0.000 14.734) 17.316 10.284 ( 8.947 0.000 12.684) 15.523 10.522 ( -15.678 0.000 7.730) 17.480 11.983 ( 1.299 0.000 -1.490) 1.977 12.011 ( -1.125 0.000 -1.734) 2.067 14.699 ( 19.540 0.000 -5.418) 20.277 15.045 ( -16.277 0.000 -4.989) 17.025 15.700 ( 15.253 0.000 -8.108) 17.274 15.971 ( -12.841 0.000 -8.258) 15.267 17.073 ( 0.748 0.000 -8.778) 8.809 17.098 ( -1.768 0.000 -6.876) 7.100 ======================= Grid point 54 (21/120) ======================= q-point: ( 0.00 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( 0.000 16.766 22.829) 28.324 0.834 ( 0.000 24.866 15.866) 29.496 1.911 ( 0.000 34.506 53.964) 64.053 2.269 ( 0.000 -9.081 0.440) 9.092 2.778 ( 0.000 -27.705 -1.512) 27.746 3.396 ( 0.000 8.615 6.749) 10.944 3.820 ( 0.000 8.908 -4.368) 9.921 4.568 ( 0.000 -1.338 27.969) 28.001 4.605 ( 0.000 -0.374 10.497) 10.504 4.747 ( 0.000 6.232 4.357) 7.604 4.857 ( 0.000 0.433 14.830) 14.836 5.088 ( 0.000 -4.209 18.899) 19.362 5.687 ( 0.000 -16.918 -0.041) 16.918 6.250 ( 0.000 -20.262 1.945) 20.355 6.547 ( 0.000 11.252 -3.418) 11.759 6.877 ( 0.000 0.632 -5.571) 5.606 6.889 ( 0.000 7.414 0.676) 7.444 7.131 ( 0.000 -8.176 -1.656) 8.342 7.599 ( 0.000 21.613 -20.425) 29.737 7.804 ( 0.000 11.618 -5.675) 12.930 7.858 ( 0.000 4.781 5.274) 7.118 8.304 ( 0.000 -4.609 -6.008) 7.573 8.317 ( 0.000 -4.132 -7.933) 8.944 8.813 ( 0.000 -7.823 -1.834) 8.035 9.134 ( 0.000 8.659 -3.172) 9.222 9.336 ( 0.000 6.895 1.678) 7.096 9.536 ( 0.000 -3.356 15.332) 15.695 9.676 ( 0.000 1.286 17.706) 17.752 9.791 ( 0.000 -2.083 -4.793) 5.226 9.860 ( 0.000 -4.229 -0.077) 4.230 9.928 ( 0.000 3.400 1.486) 3.710 10.542 ( 0.000 -21.670 14.477) 26.061 11.382 ( 0.000 2.488 3.078) 3.958 11.779 ( 0.000 -8.966 -0.595) 8.986 12.236 ( 0.000 0.519 -5.308) 5.333 12.476 ( 0.000 -4.420 8.730) 9.785 13.154 ( 0.000 5.929 -0.179) 5.932 14.396 ( 0.000 -16.185 -2.455) 16.370 15.882 ( 0.000 10.067 -4.579) 11.059 16.447 ( 0.000 -4.419 -6.929) 8.218 17.023 ( 0.000 0.652 0.891) 1.104 17.178 ( 0.000 -1.813 -0.810) 1.986 ======================= Grid point 55 (22/120) ======================= q-point: ( 0.11 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( 17.703 11.517 19.368) 28.656 1.359 ( 36.273 15.756 13.163) 41.681 2.084 ( 19.956 28.015 43.588) 55.525 2.356 ( 9.112 -7.667 1.987) 12.073 2.798 ( 2.212 -23.244 -1.301) 23.385 3.307 ( -8.003 6.417 9.982) 14.313 3.713 ( -7.484 11.611 -3.077) 14.152 4.498 ( -1.742 4.672 22.004) 22.561 4.616 ( -1.247 0.675 15.396) 15.462 4.822 ( -2.818 0.304 14.169) 14.450 5.022 ( 9.008 -5.570 11.719) 15.796 5.090 ( 11.243 -5.189 11.920) 17.188 5.660 ( -2.621 -17.018 -0.404) 17.223 6.176 ( -7.095 -15.987 1.554) 17.560 6.530 ( -2.845 12.668 -2.598) 13.241 6.756 ( -10.379 10.175 -2.259) 14.709 6.903 ( 4.680 -4.418 -5.317) 8.348 7.274 ( 14.597 -4.792 0.254) 15.365 7.790 ( 6.676 10.121 -8.764) 14.960 7.804 ( 7.854 11.181 -12.693) 18.649 7.918 ( 5.060 6.019 1.717) 8.048 8.307 ( 0.328 -4.584 -10.724) 11.667 8.335 ( 1.782 -3.185 -2.058) 4.190 8.823 ( 0.756 -7.837 -1.763) 8.068 9.043 ( -8.493 6.094 -1.394) 10.545 9.249 ( -9.926 2.928 14.997) 18.221 9.431 ( -3.100 3.068 4.844) 6.518 9.728 ( -7.375 -0.117 -4.023) 8.401 9.797 ( 6.633 -2.484 16.487) 17.944 9.855 ( 0.657 -2.593 1.747) 3.195 9.929 ( -1.058 1.874 1.291) 2.509 10.412 ( -9.827 -17.338 18.760) 27.370 11.227 ( -11.666 14.281 5.416) 19.219 11.716 ( -8.196 -8.717 -2.077) 12.144 12.052 ( -12.491 2.633 -1.237) 12.825 12.449 ( -5.634 -2.032 2.138) 6.359 13.391 ( 20.292 2.297 -2.797) 20.613 14.530 ( 12.436 -17.075 -3.827) 21.468 15.829 ( -4.602 11.396 -4.013) 12.929 16.417 ( -3.156 -4.088 -7.174) 8.840 17.051 ( 1.679 -0.630 -4.088) 4.464 17.173 ( -0.628 -1.828 -1.507) 2.451 ======================= Grid point 56 (23/120) ======================= q-point: ( 0.22 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 22.299 7.793 13.369) 27.143 1.878 ( 19.063 18.809 27.331) 38.264 2.543 ( 14.681 -7.204 2.255) 16.508 2.681 ( 25.004 8.913 13.900) 29.964 2.874 ( 6.837 -9.859 -0.769) 12.022 3.160 ( -5.047 1.994 16.356) 17.232 3.672 ( 7.317 12.057 -0.705) 14.121 4.485 ( -0.339 4.491 23.015) 23.451 4.583 ( -1.659 1.282 15.690) 15.829 4.754 ( -3.705 0.489 15.054) 15.511 4.973 ( -4.783 -3.472 17.634) 18.598 5.319 ( -5.069 -22.558 -0.759) 23.133 5.702 ( 8.056 -8.258 2.416) 11.787 6.025 ( -4.538 -10.451 1.072) 11.444 6.410 ( -3.149 13.288 -1.442) 13.732 6.727 ( 5.335 13.514 -2.239) 14.700 7.061 ( 11.360 -9.531 -4.304) 15.440 7.531 ( 8.551 -5.824 -1.268) 10.424 7.847 ( 5.435 12.390 -5.245) 14.511 7.986 ( 5.924 2.988 2.664) 7.150 8.076 ( 10.054 4.294 -12.991) 16.979 8.319 ( 1.143 -4.119 -9.301) 10.236 8.374 ( 2.003 -1.635 -1.510) 2.994 8.779 ( -8.807 -0.619 -1.047) 8.891 8.893 ( -3.734 -3.926 4.194) 6.852 9.041 ( -10.163 -1.966 16.593) 19.557 9.379 ( -6.823 2.368 -2.784) 7.740 9.535 ( -7.571 6.377 2.040) 10.107 9.856 ( -3.994 0.939 0.878) 4.196 9.871 ( 1.812 -3.798 3.653) 5.572 9.939 ( 5.152 -1.900 14.998) 15.972 10.263 ( -5.548 -10.346 17.201) 20.825 10.971 ( -15.426 13.670 3.500) 20.906 11.392 ( -23.921 -2.885 -1.326) 24.131 11.934 ( -0.139 0.446 1.776) 1.836 12.305 ( -7.143 6.457 -0.101) 9.629 13.820 ( 22.913 -0.303 -4.643) 23.381 14.794 ( 12.931 -19.409 -5.672) 24.002 15.736 ( -4.330 13.971 -4.703) 15.364 16.327 ( -6.041 -3.041 -7.619) 10.187 17.064 ( -0.207 -0.933 -7.756) 7.814 17.153 ( -1.463 -1.819 -3.220) 3.977 ======================= Grid point 57 (24/120) ======================= q-point: ( 0.33 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 20.694 7.470 8.362) 23.537 2.191 ( 14.004 17.350 25.455) 33.839 2.676 ( -1.577 4.689 2.765) 5.667 2.872 ( -0.123 -1.628 14.547) 14.638 3.072 ( 11.903 -2.995 7.539) 14.404 3.208 ( 8.546 -0.397 3.391) 9.203 4.021 ( 21.116 -0.928 -0.239) 21.138 4.474 ( -0.616 0.888 23.012) 23.037 4.566 ( -0.587 0.788 17.764) 17.791 4.699 ( -1.435 1.706 15.761) 15.918 4.872 ( -5.575 -2.785 16.199) 17.357 5.052 ( -18.544 -21.981 -0.215) 28.759 5.675 ( -0.747 5.436 0.128) 5.489 6.085 ( 2.943 -2.193 0.705) 3.737 6.603 ( 20.513 8.370 -1.393) 22.198 6.871 ( 9.202 6.737 -1.187) 11.466 7.323 ( 14.776 -12.095 -4.249) 19.561 7.562 ( -3.581 -5.085 -4.006) 7.398 7.913 ( -4.869 8.128 -4.405) 10.448 8.100 ( 6.211 5.071 2.653) 8.445 8.203 ( 2.289 -4.137 -7.735) 9.066 8.375 ( 4.587 -2.382 -1.506) 5.383 8.408 ( 1.575 -0.108 -7.099) 7.273 8.567 ( -10.393 1.656 4.607) 11.488 8.755 ( -10.566 -6.970 10.735) 16.597 8.925 ( -2.629 -4.808 2.558) 6.048 9.193 ( -5.202 8.067 4.413) 10.564 9.534 ( 3.723 4.112 -0.230) 5.552 9.745 ( -6.975 1.934 -4.817) 8.695 9.900 ( 0.861 -3.609 3.825) 5.329 10.055 ( 6.399 -3.559 16.785) 18.313 10.178 ( -3.514 -6.243 14.525) 16.196 10.640 ( -18.230 8.340 5.624) 20.821 10.904 ( -24.095 -0.853 3.972) 24.435 11.982 ( 4.033 4.832 0.213) 6.298 12.201 ( -3.922 9.803 -1.379) 10.648 14.246 ( 20.867 -3.008 -5.132) 21.699 14.958 ( 2.467 -20.249 -5.624) 21.160 15.702 ( 2.013 15.234 -6.554) 16.706 16.187 ( -8.429 -0.901 -8.146) 11.756 17.055 ( -0.409 -1.103 -8.466) 8.547 17.118 ( -2.047 -1.787 -5.088) 5.767 ======================= Grid point 58 (25/120) ======================= q-point: ( 0.44 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 15.159 11.053 2.208) 18.890 2.366 ( 0.141 14.853 6.936) 16.393 2.625 ( 2.117 8.262 21.153) 22.807 2.770 ( -8.752 -1.455 28.866) 30.199 3.312 ( 10.043 0.289 1.014) 10.098 3.369 ( 4.963 -1.930 -1.023) 5.422 4.294 ( 10.048 -14.479 -1.214) 17.666 4.466 ( -2.222 -4.301 18.767) 19.381 4.520 ( -2.328 -5.123 15.536) 16.524 4.645 ( -13.117 -11.971 6.012) 18.748 4.730 ( -0.042 0.022 15.930) 15.930 4.794 ( -5.216 0.561 17.176) 17.959 5.866 ( 15.895 12.415 -1.585) 20.231 6.077 ( -4.656 8.551 -1.206) 9.811 7.016 ( 21.937 5.922 -1.688) 22.785 7.103 ( 14.798 -0.685 -1.930) 14.939 7.369 ( -10.936 -1.487 -4.681) 11.988 7.476 ( -20.053 -1.373 -3.254) 20.362 7.784 ( 11.411 -10.469 -3.585) 15.895 8.083 ( -13.098 -10.528 -4.577) 17.417 8.234 ( 5.436 2.417 3.053) 6.686 8.346 ( -6.204 1.948 0.189) 6.505 8.468 ( 2.945 -2.341 5.902) 6.999 8.491 ( 0.995 -1.780 -0.172) 2.047 8.693 ( 4.670 1.835 7.405) 8.945 8.831 ( -7.200 2.995 4.779) 9.146 9.262 ( 10.762 1.876 -3.657) 11.520 9.504 ( -11.040 -2.391 -9.942) 15.048 9.709 ( 6.994 4.464 0.891) 8.345 9.864 ( -5.950 -2.176 2.901) 6.968 10.131 ( 0.090 -3.526 14.714) 15.131 10.156 ( 0.738 -3.069 17.940) 18.216 10.377 ( -3.101 5.808 9.198) 11.312 10.528 ( -14.638 0.393 6.907) 16.191 12.064 ( 4.113 8.066 -1.246) 9.140 12.135 ( -3.345 9.497 -1.789) 10.227 14.611 ( 16.765 -7.085 -5.048) 18.888 14.876 ( -10.005 -13.507 -4.980) 17.531 15.819 ( 9.023 8.911 -8.198) 15.100 16.008 ( -9.952 2.822 -8.502) 13.390 17.056 ( 0.623 -1.441 -7.907) 8.061 17.080 ( -1.734 -1.692 -6.692) 7.117 ======================= Grid point 63 (26/120) ======================= q-point: ( 0.00 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( 0.000 27.047 8.579) 28.375 1.410 ( 0.000 34.790 -0.998) 34.805 1.896 ( 0.000 -22.892 4.342) 23.300 2.132 ( 0.000 -34.616 -4.962) 34.970 2.663 ( 0.000 34.756 43.330) 55.548 3.267 ( 0.000 -21.823 28.751) 36.095 4.178 ( 0.000 25.810 -7.361) 26.839 4.586 ( 0.000 -4.467 4.627) 6.432 4.601 ( 0.000 3.334 17.734) 18.045 4.734 ( 0.000 -12.595 2.694) 12.880 4.882 ( 0.000 2.572 16.087) 16.291 4.969 ( 0.000 -6.042 16.556) 17.624 5.514 ( 0.000 6.630 3.152) 7.341 5.831 ( 0.000 -20.001 2.720) 20.185 6.737 ( 0.000 8.648 0.378) 8.656 6.916 ( 0.000 -7.560 -2.234) 7.883 6.936 ( 0.000 3.401 -5.969) 6.869 6.983 ( 0.000 -2.053 -0.472) 2.106 7.891 ( 0.000 8.410 -10.550) 13.492 7.990 ( 0.000 1.235 -6.439) 6.557 8.014 ( 0.000 9.526 -11.286) 14.769 8.185 ( 0.000 -7.025 -17.318) 18.688 8.316 ( 0.000 8.495 2.269) 8.793 8.584 ( 0.000 -13.904 -0.767) 13.925 9.318 ( 0.000 8.232 6.249) 10.335 9.452 ( 0.000 -5.071 15.360) 16.175 9.517 ( 0.000 10.113 -1.388) 10.208 9.709 ( 0.000 -7.499 -3.686) 8.356 9.711 ( 0.000 2.082 10.974) 11.169 9.763 ( 0.000 -3.402 2.940) 4.496 10.030 ( 0.000 6.645 5.105) 8.380 10.209 ( 0.000 -11.589 11.071) 16.027 11.461 ( 0.000 5.417 4.322) 6.930 11.602 ( 0.000 -8.170 3.752) 8.990 12.259 ( 0.000 1.961 -3.560) 4.064 12.332 ( 0.000 -5.704 2.710) 6.314 13.515 ( 0.000 22.964 -3.825) 23.280 13.989 ( 0.000 -22.563 -2.975) 22.758 16.109 ( 0.000 11.150 -4.813) 12.145 16.313 ( 0.000 -8.559 -5.569) 10.212 17.064 ( 0.000 2.948 0.582) 3.005 17.128 ( 0.000 -3.005 -0.271) 3.017 ======================= Grid point 64 (27/120) ======================= q-point: ( 0.11 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( 10.868 27.045 2.644) 29.266 1.757 ( 26.750 22.603 6.718) 35.659 1.987 ( 8.855 -22.954 1.381) 24.642 2.270 ( 13.510 -26.454 0.666) 29.712 2.745 ( 8.485 29.640 36.932) 48.109 3.232 ( -3.291 -15.573 24.099) 28.882 4.132 ( -3.527 28.193 -5.174) 28.880 4.590 ( -0.587 3.205 16.481) 16.800 4.614 ( 1.039 -2.179 13.596) 13.809 4.740 ( 0.931 -23.662 -0.841) 23.695 4.857 ( -2.274 2.148 16.375) 16.671 4.942 ( -2.518 -5.437 16.381) 17.443 5.533 ( 2.196 7.017 3.542) 8.161 5.814 ( -2.095 -17.686 3.035) 18.067 6.707 ( -4.440 5.523 -0.687) 7.120 6.802 ( -1.906 -4.131 -2.271) 5.085 6.985 ( 3.028 9.949 -6.494) 12.260 7.157 ( 12.101 -6.890 -2.490) 14.145 7.942 ( 4.334 5.792 -3.077) 7.861 8.002 ( 1.695 3.921 -8.132) 9.186 8.061 ( 4.496 6.054 -13.035) 15.059 8.197 ( 1.159 -6.206 -15.052) 16.323 8.346 ( 2.838 8.144 2.036) 8.862 8.601 ( 1.770 -13.373 -0.563) 13.501 9.176 ( -12.690 6.174 5.703) 15.220 9.267 ( -13.811 -2.083 13.793) 19.630 9.537 ( -0.776 7.269 -0.474) 7.326 9.684 ( -2.530 -5.643 0.182) 6.187 9.763 ( 2.097 0.130 9.414) 9.645 9.790 ( 2.870 -2.428 7.152) 8.080 10.007 ( -2.183 5.527 4.208) 7.282 10.153 ( -4.208 -9.140 10.252) 14.365 11.451 ( -4.275 8.230 1.196) 9.351 11.583 ( -5.153 -5.442 -0.867) 7.544 12.116 ( -10.124 4.854 0.912) 11.264 12.275 ( -3.201 -10.484 4.358) 11.796 13.668 ( 13.755 20.590 -4.686) 25.201 14.117 ( 11.677 -22.230 -4.280) 25.473 16.076 ( -3.002 11.831 -4.875) 13.143 16.287 ( -2.584 -8.566 -5.968) 10.755 17.069 ( 0.204 2.118 -1.369) 2.530 17.123 ( -0.554 -2.833 -1.245) 3.144 ======================= Grid point 65 (28/120) ======================= q-point: ( 0.22 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.740 ( 18.000 21.736 3.110) 28.393 2.206 ( 14.874 -20.024 -0.124) 24.944 2.254 ( 20.380 15.317 17.361) 30.844 2.590 ( 17.713 -15.515 10.109) 25.625 2.961 ( 11.778 14.141 16.526) 24.734 3.166 ( -2.571 -4.498 13.256) 14.233 4.100 ( 0.811 28.270 -1.183) 28.306 4.567 ( -2.303 2.400 19.459) 19.742 4.594 ( -2.640 -1.553 16.254) 16.540 4.725 ( -3.993 -22.468 1.378) 22.861 4.812 ( -2.687 -1.579 15.618) 15.926 4.898 ( -1.762 -6.375 16.540) 17.813 5.623 ( 7.326 1.185 4.046) 8.453 5.764 ( -0.554 -11.854 3.505) 12.374 6.651 ( 1.766 10.726 -2.613) 11.180 6.861 ( 6.908 -10.023 -4.417) 12.949 7.061 ( 4.143 16.624 -4.539) 17.723 7.353 ( 6.599 -11.686 -3.831) 13.957 8.026 ( 3.938 4.954 0.240) 6.333 8.065 ( 4.478 2.315 -6.641) 8.337 8.168 ( 5.478 2.889 -11.802) 13.328 8.229 ( 2.431 -4.122 -8.863) 10.073 8.412 ( 3.572 8.302 0.321) 9.044 8.644 ( 1.760 -11.378 -0.546) 11.526 8.899 ( -14.613 3.445 6.636) 16.414 8.978 ( -15.392 -3.860 10.727) 19.154 9.481 ( -5.371 6.897 0.903) 8.788 9.602 ( -4.523 -2.307 3.734) 6.303 9.793 ( 1.287 -0.111 7.889) 7.994 9.844 ( 1.985 -3.112 8.708) 9.458 9.966 ( -1.010 4.756 5.058) 7.016 10.090 ( -2.284 -7.076 8.681) 11.430 11.196 ( -20.094 8.217 0.721) 21.721 11.319 ( -21.503 -4.378 -0.980) 21.966 12.050 ( 3.391 10.021 3.165) 11.042 12.270 ( 1.606 -8.956 2.167) 9.353 13.973 ( 16.672 15.194 -5.112) 23.129 14.365 ( 12.455 -21.491 -5.532) 25.448 16.012 ( -3.124 12.352 -5.753) 13.979 16.220 ( -4.195 -7.753 -6.918) 11.205 17.064 ( -0.789 1.107 -4.329) 4.538 17.105 ( -1.359 -2.572 -3.327) 4.420 ======================= Grid point 66 (29/120) ======================= q-point: ( 0.33 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( 19.447 17.811 5.655) 26.970 2.491 ( 13.873 -17.756 5.848) 23.280 2.561 ( 11.541 17.370 22.157) 30.427 2.842 ( 4.499 -8.457 18.583) 20.907 3.122 ( 8.231 7.151 -0.771) 10.931 3.203 ( 6.235 -0.678 0.876) 6.333 4.108 ( -1.990 11.377 -0.662) 11.568 4.452 ( -10.536 -15.408 6.162) 19.657 4.530 ( -5.249 1.173 20.541) 21.234 4.606 ( -6.285 -7.865 14.169) 17.382 4.775 ( -0.677 3.629 17.308) 17.698 4.849 ( -2.965 -3.339 17.637) 18.193 5.775 ( 12.805 6.208 2.181) 14.397 5.948 ( 16.087 -9.710 2.393) 18.943 6.810 ( 14.236 11.752 -3.412) 18.773 7.045 ( 10.218 -5.900 -6.525) 13.483 7.130 ( 4.701 7.511 -1.057) 8.924 7.387 ( -2.867 -11.618 -3.886) 12.582 8.028 ( -7.791 3.978 -5.608) 10.391 8.108 ( -3.729 -4.287 -6.748) 8.822 8.228 ( 2.817 5.298 0.650) 6.035 8.313 ( 5.167 -3.597 -0.241) 6.300 8.455 ( -0.443 4.870 -3.962) 6.294 8.555 ( -11.161 -3.766 2.622) 12.068 8.698 ( -3.210 2.562 8.151) 9.127 8.805 ( 0.606 -6.519 3.578) 7.461 9.364 ( -5.199 8.740 2.313) 10.429 9.528 ( -3.994 -5.825 0.137) 7.064 9.802 ( -0.520 3.696 4.230) 5.641 9.857 ( -0.020 -0.955 3.175) 3.316 9.999 ( 3.919 -0.380 13.009) 13.592 10.062 ( -0.433 -5.194 10.364) 11.601 10.786 ( -20.603 5.672 4.434) 21.825 10.870 ( -22.421 -2.706 3.697) 22.884 12.153 ( 5.768 10.055 0.322) 11.597 12.297 ( 0.800 -1.860 -0.689) 2.138 14.277 ( 14.280 7.758 -4.865) 16.964 14.555 ( 6.670 -18.163 -5.292) 20.060 15.970 ( -0.951 10.805 -7.365) 13.111 16.132 ( -4.719 -5.046 -8.070) 10.624 17.044 ( -1.052 0.355 -6.016) 6.118 17.073 ( -1.798 -2.235 -5.167) 5.909 ======================= Grid point 67 (30/120) ======================= q-point: ( 0.44 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( 15.848 13.409 11.562) 23.762 2.658 ( -1.254 1.429 25.635) 25.705 2.713 ( 5.892 4.465 6.646) 9.941 2.794 ( -4.606 4.468 7.943) 10.211 3.324 ( 8.344 0.668 -1.428) 8.492 3.336 ( 6.191 -0.679 -2.253) 6.623 4.043 ( -1.415 -5.723 0.237) 5.900 4.178 ( -14.365 -16.895 0.224) 22.177 4.459 ( -0.891 0.227 22.919) 22.937 4.500 ( -4.591 -3.540 22.166) 22.911 4.776 ( 0.689 2.122 16.856) 17.003 4.801 ( -1.911 -0.302 16.935) 17.045 6.107 ( 15.939 9.761 -0.714) 18.704 6.204 ( 6.717 1.457 -0.961) 6.940 7.121 ( 7.306 3.836 -1.915) 8.472 7.173 ( 17.423 8.542 -3.770) 19.767 7.266 ( -8.323 -7.564 -2.079) 11.437 7.368 ( 13.113 -9.224 -5.500) 16.949 7.703 ( -18.487 3.538 -3.333) 19.115 7.851 ( -19.754 -10.169 -3.864) 22.551 8.305 ( 4.393 4.050 5.244) 7.950 8.385 ( -2.671 -0.910 8.560) 9.013 8.400 ( 1.647 -0.921 -2.036) 2.776 8.446 ( -1.663 -2.536 0.100) 3.034 8.770 ( 6.426 4.507 3.419) 8.561 8.841 ( 0.200 -1.861 2.625) 3.224 9.322 ( 1.699 4.036 -3.152) 5.396 9.422 ( -6.838 -5.225 -5.579) 10.256 9.804 ( 1.312 3.847 1.195) 4.237 9.841 ( -1.832 -0.389 1.797) 2.596 10.073 ( 2.925 -1.606 15.602) 15.955 10.089 ( 2.315 -2.910 17.440) 17.832 10.478 ( -8.571 3.807 6.225) 11.256 10.526 ( -12.030 -0.966 5.732) 13.361 12.246 ( 3.672 7.574 -1.363) 8.527 12.293 ( -1.260 3.727 -1.711) 4.290 14.504 ( 8.913 -1.205 -4.518) 10.065 14.607 ( -1.465 -10.752 -4.621) 11.795 15.982 ( 2.117 6.060 -8.707) 10.818 16.045 ( -4.154 -0.129 -8.889) 9.813 17.031 ( -0.104 -0.585 -6.535) 6.562 17.042 ( -1.208 -1.561 -6.224) 6.530 ======================= Grid point 90 (31/120) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( 0.000 0.000 29.430) 29.430 1.511 ( 0.000 0.000 32.463) 32.463 2.384 ( 0.000 0.000 8.565) 8.565 2.805 ( 0.000 0.000 65.209) 65.209 2.888 ( 0.000 0.000 -12.483) 12.483 3.420 ( 0.000 0.000 -13.150) 13.150 3.763 ( 0.000 0.000 29.291) 29.291 4.809 ( 0.000 0.000 7.277) 7.277 5.020 ( 0.000 0.000 23.242) 23.242 5.232 ( 0.000 0.000 22.352) 22.352 5.327 ( 0.000 0.000 36.578) 36.578 5.653 ( 0.000 0.000 27.398) 27.398 5.950 ( 0.000 0.000 4.745) 4.745 6.243 ( 0.000 0.000 -6.595) 6.595 6.615 ( 0.000 0.000 1.837) 1.837 6.773 ( 0.000 0.000 5.866) 5.866 6.955 ( 0.000 0.000 0.937) 0.937 7.154 ( 0.000 0.000 -4.262) 4.262 7.196 ( 0.000 0.000 -0.222) 0.222 7.601 ( 0.000 0.000 -1.162) 1.162 7.950 ( 0.000 0.000 -19.518) 19.518 7.977 ( 0.000 0.000 9.266) 9.266 8.465 ( 0.000 0.000 0.949) 0.949 8.842 ( 0.000 0.000 -2.697) 2.697 8.946 ( 0.000 0.000 0.741) 0.741 9.296 ( 0.000 0.000 1.541) 1.541 9.668 ( 0.000 0.000 -8.710) 8.710 9.856 ( 0.000 0.000 -4.450) 4.450 9.861 ( 0.000 0.000 16.797) 16.797 9.900 ( 0.000 0.000 -0.507) 0.507 10.065 ( 0.000 0.000 17.474) 17.474 10.814 ( 0.000 0.000 -4.837) 4.837 11.450 ( 0.000 0.000 7.133) 7.133 11.925 ( 0.000 0.000 0.294) 0.294 12.071 ( 0.000 0.000 -9.830) 9.830 12.250 ( 0.000 0.000 -8.712) 8.712 13.223 ( 0.000 0.000 -6.341) 6.341 14.493 ( 0.000 0.000 -6.477) 6.477 15.622 ( 0.000 0.000 -9.240) 9.240 16.266 ( 0.000 0.000 -13.988) 13.988 16.944 ( 0.000 0.000 -5.742) 5.742 17.175 ( 0.000 0.000 -1.039) 1.039 ======================= Grid point 91 (32/120) ======================= q-point: ( 0.11 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( 35.639 0.000 18.936) 40.357 1.600 ( 8.536 0.000 28.663) 29.907 2.475 ( 9.083 0.000 8.237) 12.262 2.837 ( -3.973 0.000 -8.965) 9.806 2.918 ( 10.952 0.000 59.627) 60.625 3.371 ( -2.639 0.000 -10.300) 10.633 3.781 ( 1.720 0.000 30.211) 30.260 4.872 ( 4.558 0.000 13.930) 14.656 5.015 ( -0.625 0.000 23.847) 23.855 5.208 ( -2.377 0.000 22.815) 22.939 5.476 ( 14.218 0.000 27.318) 30.796 5.606 ( -3.700 0.000 26.848) 27.102 5.939 ( -1.309 0.000 3.252) 3.505 6.143 ( -10.314 0.000 -6.117) 11.992 6.557 ( -16.688 0.000 3.487) 17.048 6.566 ( -2.408 0.000 2.240) 3.289 6.966 ( 5.792 0.000 0.811) 5.848 7.385 ( 14.290 0.000 1.800) 14.403 7.429 ( 20.267 0.000 -6.652) 21.330 7.581 ( -1.763 0.000 -1.925) 2.610 7.962 ( 1.434 0.000 -18.824) 18.879 8.011 ( 2.929 0.000 7.922) 8.446 8.459 ( -0.979 0.000 -0.576) 1.136 8.872 ( 2.791 0.000 -2.810) 3.961 8.913 ( -3.044 0.000 3.046) 4.306 9.301 ( 0.277 0.000 2.305) 2.322 9.586 ( -8.639 0.000 -7.160) 11.220 9.717 ( -9.555 0.000 17.576) 20.005 9.837 ( -1.509 0.000 -4.455) 4.704 9.923 ( 1.444 0.000 -0.466) 1.517 10.199 ( 8.938 0.000 17.666) 19.798 10.780 ( -3.336 0.000 -4.733) 5.791 11.283 ( -14.112 0.000 14.722) 20.393 11.788 ( -20.133 0.000 -7.242) 21.396 11.963 ( 2.443 0.000 0.191) 2.451 12.291 ( -3.803 0.000 -6.215) 7.286 13.352 ( 13.627 0.000 -7.670) 15.637 14.606 ( 10.769 0.000 -8.497) 13.718 15.564 ( -5.731 0.000 -8.816) 10.515 16.232 ( -3.568 0.000 -14.091) 14.536 16.903 ( -3.389 0.000 -7.649) 8.366 17.156 ( -2.013 0.000 -1.747) 2.666 ======================= Grid point 92 (33/120) ======================= q-point: ( 0.22 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( 11.343 0.000 20.289) 23.245 2.133 ( 21.745 0.000 13.421) 25.553 2.709 ( 14.527 0.000 7.768) 16.473 2.778 ( 0.522 0.000 -1.373) 1.468 3.142 ( 7.263 0.000 28.974) 29.870 3.519 ( 23.644 0.000 10.216) 25.757 3.813 ( 1.028 0.000 33.068) 33.084 4.949 ( 3.846 0.000 22.428) 22.755 4.995 ( -1.325 0.000 25.068) 25.103 5.153 ( -2.892 0.000 23.624) 23.801 5.483 ( -6.646 0.000 24.665) 25.544 5.682 ( -3.882 0.000 13.330) 13.883 5.828 ( -22.528 0.000 -6.166) 23.357 6.055 ( 20.310 0.000 3.791) 20.661 6.269 ( -11.421 0.000 3.440) 11.927 6.612 ( 7.248 0.000 1.749) 7.455 7.160 ( 13.621 0.000 -0.112) 13.622 7.527 ( -3.174 0.000 -5.922) 6.718 7.658 ( 11.654 0.000 3.124) 12.066 7.816 ( 18.825 0.000 -7.812) 20.382 8.015 ( 4.419 0.000 -16.638) 17.215 8.064 ( 2.055 0.000 4.565) 5.006 8.418 ( -3.146 0.000 -3.820) 4.948 8.842 ( -4.361 0.000 7.792) 8.929 8.932 ( 2.899 0.000 -2.378) 3.750 9.290 ( -1.810 0.000 5.128) 5.438 9.345 ( -15.368 0.000 -1.697) 15.462 9.575 ( -4.219 0.000 16.345) 16.881 9.762 ( -7.086 0.000 -6.556) 9.654 9.964 ( 3.068 0.000 2.296) 3.832 10.353 ( 6.893 0.000 18.376) 19.627 10.687 ( -6.517 0.000 -4.368) 7.845 11.003 ( -13.803 0.000 22.620) 26.498 11.395 ( -19.897 0.000 -1.779) 19.977 11.992 ( 0.529 0.000 -0.086) 0.536 12.127 ( -10.256 0.000 -1.200) 10.326 13.704 ( 21.245 0.000 -9.979) 23.472 14.864 ( 15.051 0.000 -11.959) 19.224 15.412 ( -9.894 0.000 -8.729) 13.194 16.126 ( -7.471 0.000 -14.627) 16.424 16.844 ( -2.253 0.000 -11.053) 11.280 17.100 ( -3.728 0.000 -3.615) 5.192 ======================= Grid point 93 (34/120) ======================= q-point: ( 0.33 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.002 ( 8.978 0.000 11.914) 14.918 2.310 ( -0.334 0.000 3.581) 3.596 2.926 ( 13.304 0.000 19.011) 23.204 3.007 ( 15.412 0.000 7.619) 17.193 3.289 ( 10.353 0.000 15.854) 18.935 3.793 ( -3.717 0.000 37.047) 37.233 4.079 ( 26.653 0.000 6.893) 27.529 4.979 ( 0.336 0.000 25.451) 25.453 5.041 ( 5.330 0.000 28.490) 28.984 5.099 ( -4.175 0.000 21.782) 22.179 5.339 ( -24.901 0.000 -2.269) 25.004 5.358 ( -5.208 0.000 23.904) 24.465 5.536 ( -5.639 0.000 6.483) 8.592 6.106 ( -6.817 0.000 2.169) 7.154 6.514 ( 23.414 0.000 1.363) 23.454 6.808 ( 12.254 0.000 0.465) 12.262 7.431 ( -6.942 0.000 -6.535) 9.533 7.472 ( 18.076 0.000 -2.532) 18.253 7.750 ( -5.890 0.000 -2.503) 6.400 8.097 ( 2.705 0.000 2.356) 3.587 8.111 ( 10.003 0.000 -6.474) 11.915 8.165 ( 12.705 0.000 -11.324) 17.019 8.348 ( -4.749 0.000 -7.445) 8.831 8.732 ( -6.016 0.000 11.425) 12.912 8.963 ( -0.129 0.000 0.725) 0.736 9.074 ( -10.953 0.000 8.220) 13.694 9.241 ( -2.329 0.000 7.450) 7.806 9.568 ( -12.397 0.000 -8.829) 15.220 9.570 ( 3.786 0.000 11.458) 12.067 10.020 ( 1.415 0.000 4.025) 4.267 10.470 ( 5.552 0.000 17.866) 18.708 10.535 ( -8.085 0.000 -0.504) 8.101 10.766 ( -10.862 0.000 23.484) 25.874 11.035 ( -17.075 0.000 6.921) 18.424 11.978 ( -4.401 0.000 -0.431) 4.422 11.989 ( -0.733 0.000 -1.336) 1.524 14.127 ( 21.980 0.000 -10.927) 24.546 15.162 ( 15.529 0.000 -14.581) 21.301 15.186 ( -13.524 0.000 -9.261) 16.391 15.949 ( -10.684 0.000 -15.618) 18.923 16.825 ( 0.355 0.000 -12.291) 12.296 17.017 ( -4.663 0.000 -6.124) 7.697 ======================= Grid point 94 (35/120) ======================= q-point: ( 0.44 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 6.050 0.000 5.818) 8.394 2.247 ( -4.728 0.000 2.279) 5.249 3.183 ( 10.882 0.000 22.282) 24.797 3.241 ( 6.326 0.000 10.392) 12.167 3.511 ( 10.515 0.000 21.327) 23.778 3.674 ( -7.661 0.000 36.167) 36.970 4.434 ( 13.585 0.000 -1.993) 13.731 4.773 ( -22.516 0.000 -3.852) 22.844 5.018 ( 3.090 0.000 26.770) 26.948 5.071 ( -1.920 0.000 30.720) 30.780 5.160 ( 1.508 0.000 25.540) 25.584 5.250 ( -6.661 0.000 27.187) 27.991 5.665 ( 16.741 0.000 -1.549) 16.812 5.951 ( -10.815 0.000 -0.118) 10.815 6.929 ( 20.180 0.000 -1.651) 20.248 7.074 ( 15.511 0.000 -0.627) 15.524 7.250 ( -12.281 0.000 -5.939) 13.642 7.444 ( -21.805 0.000 -2.306) 21.926 7.816 ( 16.558 0.000 -7.149) 18.036 8.082 ( -9.284 0.000 -6.323) 11.232 8.245 ( 3.455 0.000 -0.539) 3.496 8.259 ( -0.422 0.000 -1.822) 1.870 8.445 ( 15.763 0.000 -4.969) 16.528 8.669 ( -3.992 0.000 9.243) 10.069 8.911 ( -5.498 0.000 9.411) 10.899 8.921 ( -3.610 0.000 7.011) 7.886 9.233 ( 1.995 0.000 3.293) 3.850 9.339 ( -9.468 0.000 -5.498) 10.948 9.719 ( 11.138 0.000 5.924) 12.615 9.945 ( -9.886 0.000 2.672) 10.240 10.463 ( 1.989 0.000 10.262) 10.453 10.559 ( -2.387 0.000 14.097) 14.298 10.605 ( 0.886 0.000 21.428) 21.446 10.759 ( -11.289 0.000 14.043) 18.018 11.947 ( 0.366 0.000 -1.745) 1.783 11.968 ( -1.343 0.000 -2.172) 2.554 14.534 ( 20.032 0.000 -10.772) 22.745 14.892 ( -16.983 0.000 -10.058) 19.738 15.453 ( 14.602 0.000 -15.992) 21.656 15.720 ( -12.992 0.000 -16.264) 20.816 16.857 ( 2.810 0.000 -11.169) 11.517 16.928 ( -4.380 0.000 -8.818) 9.846 ======================= Grid point 99 (36/120) ======================= q-point: ( 0.00 0.20 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( 0.000 15.317 24.601) 28.979 1.442 ( 0.000 -2.072 31.631) 31.699 2.301 ( 0.000 -7.670 7.278) 10.573 2.668 ( 0.000 -23.388 -6.689) 24.326 3.115 ( 0.000 24.540 58.760) 63.679 3.450 ( 0.000 13.816 -6.236) 15.158 3.989 ( 0.000 11.816 22.612) 25.513 4.764 ( 0.000 -4.242 6.782) 7.999 5.054 ( 0.000 2.339 22.087) 22.210 5.166 ( 0.000 -5.966 27.166) 27.814 5.313 ( 0.000 -0.912 30.013) 30.027 5.570 ( 0.000 -9.220 24.623) 26.293 5.697 ( 0.000 -13.465 2.237) 13.649 6.320 ( 0.000 -18.588 5.348) 19.342 6.484 ( 0.000 15.700 -1.770) 15.800 6.812 ( 0.000 -5.745 -0.986) 5.829 6.897 ( 0.000 1.685 -0.469) 1.749 7.110 ( 0.000 -3.789 0.520) 3.825 7.407 ( 0.000 12.163 -3.607) 12.687 7.689 ( 0.000 8.234 -5.473) 9.887 7.902 ( 0.000 -3.360 -16.730) 17.064 8.007 ( 0.000 2.615 8.177) 8.585 8.458 ( 0.000 -1.103 4.306) 4.445 8.767 ( 0.000 -7.215 -2.515) 7.641 9.037 ( 0.000 8.540 -2.535) 8.909 9.367 ( 0.000 6.361 1.039) 6.446 9.608 ( 0.000 -5.409 -7.014) 8.857 9.832 ( 0.000 -4.220 2.005) 4.672 9.917 ( 0.000 2.537 12.825) 13.073 9.920 ( 0.000 6.096 -2.045) 6.430 10.060 ( 0.000 -0.452 16.836) 16.842 10.654 ( 0.000 -13.561 -0.146) 13.561 11.477 ( 0.000 2.591 6.484) 6.983 11.738 ( 0.000 -8.273 -2.640) 8.684 12.086 ( 0.000 1.731 -9.048) 9.212 12.515 ( 0.000 8.268 -2.806) 8.731 13.103 ( 0.000 -1.595 -4.767) 5.027 14.308 ( 0.000 -16.448 -6.443) 17.665 15.737 ( 0.000 9.663 -9.679) 13.677 16.234 ( 0.000 -3.260 -13.632) 14.016 16.984 ( 0.000 3.256 -4.225) 5.334 17.159 ( 0.000 -1.528 -0.981) 1.816 ======================= Grid point 100 (37/120) ======================= q-point: ( 0.11 0.20 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( 9.558 -1.104 27.252) 28.901 1.650 ( 32.740 10.011 16.909) 38.184 2.395 ( 9.343 -7.864 7.444) 14.302 2.682 ( 1.866 -17.424 -6.263) 18.610 3.177 ( 5.205 20.187 51.548) 55.604 3.440 ( 0.808 14.796 -0.226) 14.820 3.911 ( -5.441 7.342 24.832) 26.460 4.867 ( 6.965 -0.831 12.056) 13.948 5.041 ( -1.096 1.776 23.479) 23.572 5.188 ( -0.169 -2.839 21.862) 22.046 5.386 ( 8.217 -8.654 27.092) 29.604 5.523 ( -4.894 -10.856 22.000) 25.016 5.675 ( -0.274 -8.862 4.520) 9.952 6.235 ( -8.006 -10.624 4.701) 14.109 6.488 ( -0.946 11.867 -0.398) 11.911 6.715 ( -11.123 4.411 -1.188) 12.024 6.850 ( 4.647 -6.564 -0.521) 8.060 7.281 ( 14.295 -6.373 0.331) 15.654 7.602 ( 14.899 8.411 -4.459) 17.681 7.676 ( -0.629 9.296 -6.049) 11.108 7.925 ( 2.623 -2.461 -15.686) 16.093 8.037 ( 2.512 2.150 6.261) 7.081 8.458 ( -0.481 -0.446 2.600) 2.682 8.778 ( 0.939 -7.367 -2.130) 7.726 8.996 ( -3.459 6.577 -0.027) 7.431 9.367 ( -0.417 5.740 2.228) 6.171 9.504 ( -9.893 -5.773 -3.281) 11.915 9.792 ( -4.734 2.779 9.814) 11.245 9.875 ( 0.513 1.007 2.247) 2.515 9.910 ( -2.537 3.620 -1.841) 4.788 10.174 ( 7.882 -2.535 17.431) 19.298 10.603 ( -4.629 -14.006 1.940) 14.879 11.360 ( -10.737 5.684 7.464) 14.259 11.648 ( -10.661 -7.309 -4.242) 13.604 12.012 ( -3.994 3.426 -2.427) 5.795 12.450 ( -6.793 5.953 -2.070) 9.267 13.290 ( 17.113 0.199 -7.071) 18.517 14.407 ( 9.455 -17.199 -8.324) 21.319 15.692 ( -4.418 10.438 -9.468) 14.769 16.201 ( -3.469 -3.199 -13.751) 14.538 16.946 ( -3.367 3.476 -6.017) 7.722 17.138 ( -2.198 -1.720 -1.752) 3.295 ======================= Grid point 101 (38/120) ======================= q-point: ( 0.22 0.20 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( 13.548 0.270 19.122) 23.437 2.246 ( 23.337 8.375 9.031) 26.387 2.625 ( 13.127 -9.394 6.685) 17.471 2.781 ( 10.416 -2.743 -2.075) 10.969 3.224 ( 0.277 9.918 24.400) 26.340 3.597 ( 13.662 8.243 23.887) 28.726 3.863 ( 2.610 5.205 26.093) 26.735 4.972 ( 4.749 1.419 19.878) 20.487 5.014 ( -1.726 1.385 25.001) 25.099 5.144 ( -3.907 -2.736 20.539) 21.085 5.345 ( -11.775 -19.498 8.387) 24.273 5.443 ( -4.758 -3.917 23.931) 24.711 5.825 ( 7.392 -3.095 11.502) 14.019 6.074 ( -3.197 -5.334 4.463) 7.655 6.386 ( -3.575 10.992 -0.153) 11.560 6.687 ( 6.113 7.514 -1.221) 9.763 7.005 ( 10.877 -9.829 -1.074) 14.700 7.494 ( 3.504 -8.235 -2.336) 9.249 7.736 ( 8.835 9.864 -5.591) 14.374 7.877 ( 12.347 3.541 -5.495) 13.971 8.011 ( 6.745 0.470 -13.647) 15.230 8.084 ( 2.142 1.757 3.664) 4.593 8.418 ( -3.818 0.075 -2.140) 4.378 8.781 ( -1.513 -5.849 1.256) 6.171 8.942 ( -1.408 1.311 3.322) 3.839 9.241 ( -13.777 -6.023 4.753) 15.769 9.365 ( -2.739 5.378 1.652) 6.258 9.692 ( -4.682 6.556 11.592) 14.117 9.802 ( -7.694 4.390 -4.905) 10.126 9.929 ( 3.489 -2.050 3.320) 5.234 10.312 ( 6.272 -4.065 18.079) 19.563 10.505 ( -4.989 -12.902 4.565) 14.567 11.108 ( -14.637 6.590 9.775) 18.794 11.359 ( -17.557 -2.764 -1.535) 17.839 11.978 ( -0.125 3.055 2.336) 3.848 12.293 ( -8.150 8.253 -1.127) 11.654 13.677 ( 21.605 0.037 -9.399) 23.561 14.622 ( 11.398 -18.966 -11.138) 24.772 15.586 ( -5.890 12.618 -10.054) 17.176 16.101 ( -6.857 -2.604 -14.410) 16.170 16.880 ( -2.933 3.069 -9.295) 10.218 17.078 ( -3.831 -2.013 -3.713) 5.702 ======================= Grid point 102 (39/120) ======================= q-point: ( 0.33 0.20 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( 12.634 4.257 10.311) 16.854 2.454 ( 0.749 11.002 -0.077) 11.028 2.915 ( 16.985 -2.897 12.330) 21.188 3.060 ( 15.276 2.742 4.831) 16.254 3.283 ( 6.874 2.586 24.305) 25.391 3.708 ( -1.420 -5.977 33.303) 33.864 4.090 ( 14.550 0.524 10.624) 18.023 4.935 ( -16.694 -19.279 2.495) 25.623 4.993 ( -2.381 0.364 24.453) 24.571 5.078 ( 4.366 2.177 27.955) 28.378 5.178 ( -2.131 0.010 23.697) 23.792 5.345 ( -3.889 -0.993 24.005) 24.339 5.716 ( -6.017 8.356 5.862) 11.849 6.118 ( -0.562 -0.562 2.877) 2.985 6.577 ( 19.855 5.847 -0.703) 20.710 6.850 ( 10.078 4.574 -0.481) 11.078 7.242 ( 11.928 -11.720 -3.290) 17.043 7.468 ( -2.913 -5.104 -4.661) 7.501 7.817 ( -6.491 5.265 -5.100) 9.791 8.071 ( 8.315 -3.461 -5.067) 10.334 8.132 ( 3.421 2.914 -0.181) 4.497 8.194 ( 10.660 4.031 -8.478) 14.205 8.339 ( -2.902 -1.147 -6.012) 6.774 8.698 ( -5.845 -3.755 6.828) 9.741 8.928 ( -1.620 -2.778 5.410) 6.294 9.015 ( -7.004 -4.057 8.698) 11.881 9.300 ( -3.599 5.128 5.828) 8.556 9.573 ( -10.754 0.531 -3.840) 11.431 9.690 ( 0.065 9.004 6.436) 11.068 9.986 ( 1.148 -2.632 4.388) 5.244 10.395 ( -0.071 -7.748 10.953) 13.417 10.451 ( 2.822 -4.812 13.262) 14.387 10.825 ( -14.059 4.161 13.258) 19.768 11.018 ( -16.959 -1.594 6.410) 18.199 11.994 ( 1.628 5.907 1.092) 6.223 12.166 ( -4.987 9.928 -1.851) 11.263 14.089 ( 20.709 -2.124 -10.204) 23.184 14.785 ( 3.703 -19.829 -11.353) 23.147 15.504 ( -1.252 14.295 -12.776) 19.213 15.943 ( -9.334 -0.951 -15.617) 18.219 16.844 ( -0.615 1.725 -10.896) 11.049 16.997 ( -4.459 -1.917 -6.160) 7.843 ======================= Grid point 103 (40/120) ======================= q-point: ( 0.44 0.20 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 9.351 9.377 3.329) 13.654 2.388 ( -6.082 12.295 -0.594) 13.730 3.209 ( 11.704 1.821 18.116) 21.645 3.285 ( 5.533 3.639 9.586) 11.651 3.459 ( 9.772 -4.809 26.188) 28.362 3.622 ( -6.837 -4.950 31.519) 32.630 4.285 ( 8.712 -11.365 2.089) 14.472 4.551 ( -19.013 -17.015 -1.061) 25.537 5.010 ( 2.935 -0.551 27.959) 28.118 5.077 ( -3.045 -0.871 28.879) 29.052 5.186 ( 1.918 2.562 26.920) 27.110 5.262 ( -5.450 0.514 27.120) 27.667 5.829 ( 14.292 13.087 -1.743) 19.456 6.051 ( -6.998 8.025 -0.899) 10.686 6.965 ( 19.446 3.347 -2.964) 19.953 7.075 ( 13.688 0.445 -0.277) 13.698 7.251 ( -9.477 -0.446 -6.092) 11.275 7.412 ( -16.399 -3.890 -2.868) 17.097 7.714 ( 10.700 -7.164 -3.197) 13.268 7.995 ( -13.639 -8.400 -4.318) 16.590 8.241 ( 5.185 1.318 -2.111) 5.752 8.286 ( 0.475 1.907 -3.965) 4.425 8.467 ( 12.329 1.304 -2.349) 12.618 8.632 ( -3.229 -3.299 7.624) 8.913 8.877 ( -1.001 -1.346 9.510) 9.657 8.932 ( -4.492 -0.348 4.286) 6.219 9.264 ( 0.969 2.778 4.076) 5.027 9.360 ( -9.019 1.617 -3.518) 9.815 9.770 ( 7.221 4.108 5.483) 9.954 9.926 ( -7.222 -1.677 3.363) 8.141 10.424 ( 5.201 -2.757 12.192) 13.539 10.559 ( 6.674 -3.431 17.399) 18.948 10.584 ( -10.187 1.566 13.453) 16.947 10.738 ( -11.697 -1.832 12.481) 17.203 12.036 ( 2.573 8.338 -1.189) 8.807 12.091 ( -3.176 9.497 -2.250) 10.264 14.457 ( 17.054 -6.166 -10.069) 20.742 14.723 ( -9.619 -13.171 -10.014) 19.138 15.571 ( 7.590 8.532 -15.965) 19.629 15.751 ( -10.219 2.356 -16.518) 19.567 16.858 ( 1.945 0.123 -10.359) 10.541 16.915 ( -3.812 -1.188 -8.535) 9.422 ======================= Grid point 108 (41/120) ======================= q-point: ( 0.00 0.40 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( 0.000 16.945 16.078) 23.359 1.637 ( 0.000 19.631 15.809) 25.205 2.049 ( 0.000 -16.530 11.257) 19.999 2.103 ( 0.000 -28.136 3.396) 28.340 3.633 ( 0.000 23.345 49.255) 54.507 3.855 ( 0.000 13.735 12.306) 18.441 4.116 ( 0.000 7.231 16.229) 17.767 4.543 ( 0.000 -20.562 -2.223) 20.682 5.047 ( 0.000 -2.518 21.121) 21.271 5.052 ( 0.000 -3.499 25.077) 25.320 5.306 ( 0.000 0.534 22.982) 22.989 5.348 ( 0.000 -4.959 16.296) 17.034 5.669 ( 0.000 7.736 14.362) 16.313 5.945 ( 0.000 -17.392 9.373) 19.757 6.758 ( 0.000 6.054 1.525) 6.243 6.797 ( 0.000 8.135 -5.784) 9.982 6.842 ( 0.000 -4.643 -4.776) 6.661 6.995 ( 0.000 -7.909 2.033) 8.166 7.612 ( 0.000 8.126 -8.391) 11.681 7.746 ( 0.000 -4.729 -12.663) 13.517 7.966 ( 0.000 8.954 -5.502) 10.510 8.053 ( 0.000 0.609 3.432) 3.486 8.445 ( 0.000 1.556 6.376) 6.564 8.575 ( 0.000 -10.081 0.226) 10.084 9.251 ( 0.000 11.249 -5.664) 12.594 9.461 ( 0.000 -8.962 -6.385) 11.004 9.526 ( 0.000 8.695 -0.082) 8.696 9.702 ( 0.000 -8.037 -0.570) 8.057 9.979 ( 0.000 3.004 15.465) 15.754 10.024 ( 0.000 -0.816 15.515) 15.536 10.110 ( 0.000 9.862 2.680) 10.219 10.360 ( 0.000 -13.929 3.552) 14.375 11.548 ( 0.000 3.998 3.767) 5.493 11.627 ( 0.000 -3.895 -0.932) 4.004 12.163 ( 0.000 6.545 -5.537) 8.573 12.371 ( 0.000 -13.289 0.325) 13.293 13.403 ( 0.000 23.557 -7.056) 24.591 13.892 ( 0.000 -23.184 -6.578) 24.099 15.950 ( 0.000 10.165 -10.840) 14.861 16.128 ( 0.000 -7.109 -12.373) 14.270 17.053 ( 0.000 3.348 -1.940) 3.870 17.116 ( 0.000 -2.685 -1.041) 2.880 ======================= Grid point 109 (42/120) ======================= q-point: ( 0.11 0.40 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( 8.938 14.361 16.033) 23.307 1.908 ( 22.097 10.567 8.173) 25.821 2.109 ( 9.547 -15.989 11.069) 21.663 2.294 ( 16.535 -17.343 3.882) 24.275 3.594 ( -3.961 18.427 38.218) 42.613 3.798 ( -5.940 4.775 24.919) 26.058 4.094 ( 0.869 20.871 9.624) 22.999 4.663 ( 7.823 -25.153 1.162) 26.367 5.035 ( -0.920 -1.603 22.316) 22.393 5.060 ( 0.873 -2.889 25.615) 25.792 5.285 ( -2.133 0.271 22.069) 22.174 5.331 ( -0.757 -4.982 19.362) 20.007 5.693 ( 2.667 7.614 13.789) 15.975 5.938 ( -1.120 -15.045 10.114) 18.164 6.687 ( -7.739 3.744 -1.191) 8.680 6.733 ( -2.633 -2.019 -3.892) 5.114 6.880 ( 4.802 10.750 -2.572) 12.051 7.111 ( 9.424 -10.303 -1.354) 14.028 7.726 ( 9.625 4.543 -8.057) 13.349 7.795 ( 4.649 -1.454 -11.384) 12.383 7.976 ( 1.928 8.351 -5.321) 10.088 8.070 ( 1.606 -0.170 2.213) 2.740 8.459 ( 0.938 2.116 4.982) 5.494 8.591 ( 1.399 -9.766 -0.206) 9.868 9.166 ( -7.762 9.367 -2.202) 12.362 9.349 ( -10.266 -7.979 -1.877) 13.137 9.531 ( -0.057 8.287 -0.188) 8.290 9.703 ( -0.179 -7.928 0.168) 7.932 9.969 ( 0.037 6.319 12.789) 14.264 10.060 ( -4.110 5.664 5.249) 8.748 10.105 ( 5.066 -0.584 13.007) 13.971 10.315 ( -3.704 -13.159 4.644) 14.438 11.468 ( -8.751 4.460 0.712) 9.848 11.545 ( -8.705 -3.627 -2.413) 9.735 12.128 ( -2.109 8.530 -0.070) 8.787 12.351 ( -1.880 -11.778 2.073) 12.106 13.531 ( 12.193 20.449 -8.519) 25.287 13.988 ( 9.135 -22.694 -8.332) 25.843 15.915 ( -3.362 10.488 -10.935) 15.520 16.097 ( -3.212 -7.081 -12.579) 14.788 17.021 ( -3.079 3.635 -3.335) 5.815 17.089 ( -2.632 -2.965 -2.025) 4.452 ======================= Grid point 110 (43/120) ======================= q-point: ( 0.22 0.40 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( 15.115 13.184 11.226) 22.985 2.244 ( 14.405 -16.563 2.511) 22.094 2.496 ( 24.888 7.103 9.382) 27.529 2.670 ( 20.995 -7.705 2.724) 22.529 3.502 ( -4.725 13.492 27.886) 31.336 3.674 ( -5.626 -2.768 31.029) 31.657 4.150 ( 3.023 23.006 10.175) 25.337 4.691 ( -6.111 -27.435 0.453) 28.111 5.046 ( 1.996 2.572 25.383) 25.591 5.073 ( 0.219 0.277 26.520) 26.522 5.242 ( -1.258 2.766 22.012) 22.221 5.343 ( 0.773 -5.913 25.601) 26.286 5.783 ( 6.348 1.066 12.481) 14.043 5.896 ( -1.587 -9.133 10.530) 14.029 6.589 ( 0.162 8.528 -2.792) 8.975 6.745 ( 4.743 -6.152 -5.444) 9.486 7.000 ( 6.453 11.997 -1.522) 13.707 7.271 ( 5.577 -12.835 -3.555) 14.439 7.886 ( 6.066 3.442 -8.553) 11.036 7.914 ( 6.566 0.071 -7.988) 10.340 8.078 ( 8.779 5.036 -4.655) 11.140 8.119 ( 3.786 0.904 0.799) 3.974 8.448 ( -3.053 4.304 -0.383) 5.290 8.611 ( -0.164 -9.984 -2.154) 10.215 9.003 ( -7.834 4.598 5.443) 10.590 9.115 ( -12.542 -6.063 5.078) 14.827 9.510 ( -2.538 8.174 1.740) 8.734 9.671 ( -3.834 -6.701 2.071) 7.993 9.947 ( -5.222 6.446 1.125) 8.372 9.972 ( -1.345 5.460 9.910) 11.394 10.202 ( 4.211 -4.784 14.042) 15.421 10.268 ( 0.168 -9.423 8.367) 12.603 11.222 ( -15.712 4.557 1.940) 16.474 11.299 ( -15.975 -3.212 -0.603) 16.306 12.122 ( 1.456 9.912 3.391) 10.577 12.312 ( -1.903 -6.366 1.581) 6.829 13.819 ( 16.476 14.399 -9.833) 23.989 14.200 ( 11.657 -21.129 -10.505) 26.319 15.833 ( -4.801 10.783 -11.879) 16.746 16.010 ( -5.589 -6.508 -13.517) 16.010 16.951 ( -3.758 3.647 -6.158) 8.083 17.023 ( -3.974 -3.281 -4.298) 6.710 ======================= Grid point 111 (44/120) ======================= q-point: ( 0.33 0.40 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( 16.354 13.843 4.833) 21.965 2.512 ( 11.820 -10.877 -2.556) 16.265 2.900 ( 17.203 7.169 8.696) 20.566 3.048 ( 16.857 -4.228 3.006) 17.637 3.441 ( -1.293 9.519 30.252) 31.741 3.593 ( -3.438 -5.749 31.653) 32.354 4.156 ( -2.432 8.647 7.444) 11.666 4.481 ( -13.840 -21.570 1.170) 25.655 5.034 ( -1.989 2.663 26.564) 26.771 5.082 ( -0.924 -1.606 27.459) 27.521 5.253 ( 0.224 4.747 27.838) 28.241 5.321 ( -2.466 -1.784 26.807) 26.979 5.861 ( 7.243 7.298 7.003) 12.440 6.028 ( 10.949 -7.885 5.663) 14.633 6.732 ( 13.901 8.949 -3.651) 16.931 6.909 ( 11.419 -5.485 -5.795) 13.930 7.107 ( 5.058 4.970 -1.112) 7.178 7.301 ( -2.135 -10.261 -4.012) 11.223 7.913 ( -6.740 4.019 -5.484) 9.573 7.992 ( -0.292 -3.938 -4.499) 5.986 8.202 ( 4.676 3.758 -2.852) 6.643 8.271 ( 7.686 -1.913 -3.638) 8.716 8.366 ( -0.960 8.459 -4.916) 9.831 8.564 ( -3.153 -9.125 -1.250) 9.735 8.899 ( -3.161 0.478 10.371) 10.852 8.939 ( -4.311 -3.155 9.629) 11.011 9.428 ( -5.644 6.809 4.128) 9.760 9.546 ( -8.827 -3.881 0.677) 9.667 9.859 ( -2.749 6.447 2.608) 7.478 9.944 ( -2.244 -1.964 4.382) 5.301 10.272 ( 4.617 -1.639 11.633) 12.623 10.338 ( 5.827 -5.930 15.257) 17.376 10.908 ( -15.967 3.737 7.283) 17.943 10.974 ( -16.662 -2.713 5.923) 17.890 12.166 ( 2.661 9.057 0.939) 9.486 12.280 ( -1.489 -0.354 -0.871) 1.761 14.128 ( 14.837 7.510 -9.710) 19.257 14.395 ( 7.637 -17.442 -10.452) 21.721 15.749 ( -3.362 9.614 -14.180) 17.459 15.892 ( -6.357 -4.482 -15.280) 17.146 16.889 ( -2.402 2.582 -8.237) 8.960 16.946 ( -3.761 -2.839 -6.597) 8.107 ======================= Grid point 112 (45/120) ======================= q-point: ( 0.44 0.40 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( 11.545 13.564 -2.419) 17.976 2.624 ( -1.033 5.363 -6.791) 8.714 3.209 ( 15.045 0.053 16.323) 22.199 3.308 ( 10.909 -4.556 9.593) 15.224 3.409 ( -4.501 2.531 28.500) 28.964 3.495 ( -7.820 -6.067 21.482) 23.653 4.115 ( 0.554 -2.401 9.321) 9.641 4.227 ( -10.726 -12.403 6.298) 17.565 5.010 ( 0.173 0.854 29.195) 29.208 5.042 ( -2.579 -2.006 29.318) 29.500 5.236 ( -0.373 1.944 26.828) 26.901 5.262 ( -2.910 -0.583 26.747) 26.911 6.087 ( 11.544 10.190 -1.103) 15.437 6.177 ( 2.708 2.004 -1.425) 3.658 7.052 ( 15.379 5.223 -4.245) 16.787 7.109 ( 9.633 2.497 -2.055) 10.161 7.211 ( -5.001 -3.270 -3.484) 6.917 7.258 ( 6.925 -8.996 -3.976) 12.029 7.664 ( -11.675 3.110 -0.045) 12.082 7.800 ( -16.546 -9.243 -0.799) 18.970 8.285 ( 3.491 2.320 -5.414) 6.847 8.313 ( 0.590 0.050 -5.848) 5.878 8.495 ( 7.072 1.974 2.549) 7.772 8.555 ( 0.434 -3.715 5.622) 6.753 8.874 ( 0.892 1.008 6.310) 6.452 8.907 ( -1.177 -1.830 3.543) 4.157 9.330 ( -2.776 3.257 4.590) 6.276 9.375 ( -7.133 -0.711 1.529) 7.329 9.846 ( 1.097 2.849 3.278) 4.479 9.889 ( -3.033 -1.753 2.897) 4.546 10.399 ( 8.347 1.113 14.521) 16.786 10.467 ( 6.649 -4.736 17.253) 19.087 10.635 ( -11.060 2.875 9.138) 14.631 10.692 ( -12.014 -2.604 9.972) 15.829 12.214 ( 2.248 7.011 -1.476) 7.509 12.251 ( -1.611 4.024 -2.129) 4.829 14.366 ( 9.273 -0.801 -9.048) 12.981 14.465 ( -0.726 -10.177 -9.242) 13.766 15.722 ( 0.829 5.465 -16.563) 17.461 15.780 ( -4.855 -0.295 -16.853) 17.541 16.865 ( -0.077 0.656 -8.827) 8.852 16.886 ( -2.248 -1.403 -8.185) 8.604 ======================= Grid point 135 (46/120) ======================= q-point: ( 0.00 0.00 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 0.000 0.000 26.646) 26.646 2.042 ( 0.000 0.000 19.254) 19.254 2.691 ( 0.000 0.000 -5.313) 5.313 2.735 ( 0.000 0.000 26.079) 26.079 3.164 ( 0.000 0.000 -11.439) 11.439 4.070 ( 0.000 0.000 58.321) 58.321 4.343 ( 0.000 0.000 26.418) 26.418 4.964 ( 0.000 0.000 7.657) 7.657 5.526 ( 0.000 0.000 25.412) 25.412 5.713 ( 0.000 0.000 23.679) 23.679 5.949 ( 0.000 0.000 4.312) 4.312 6.013 ( 0.000 0.000 27.261) 27.261 6.079 ( 0.000 0.000 -9.399) 9.399 6.332 ( 0.000 0.000 28.330) 28.330 6.698 ( 0.000 0.000 8.179) 8.179 6.899 ( 0.000 0.000 5.785) 5.785 6.991 ( 0.000 0.000 2.772) 2.772 7.060 ( 0.000 0.000 -4.890) 4.890 7.197 ( 0.000 0.000 0.132) 0.132 7.585 ( 0.000 0.000 -16.025) 16.025 7.662 ( 0.000 0.000 7.877) 7.877 8.160 ( 0.000 0.000 8.013) 8.013 8.370 ( 0.000 0.000 -8.300) 8.300 8.779 ( 0.000 0.000 -3.666) 3.666 9.096 ( 0.000 0.000 12.178) 12.178 9.333 ( 0.000 0.000 2.331) 2.331 9.477 ( 0.000 0.000 -9.340) 9.340 9.703 ( 0.000 0.000 -10.403) 10.403 9.881 ( 0.000 0.000 -1.436) 1.436 10.238 ( 0.000 0.000 19.699) 19.699 10.337 ( 0.000 0.000 9.019) 9.019 10.681 ( 0.000 0.000 -8.303) 8.303 11.664 ( 0.000 0.000 13.911) 13.911 11.847 ( 0.000 0.000 -11.749) 11.749 11.953 ( 0.000 0.000 2.790) 2.790 12.064 ( 0.000 0.000 -8.969) 8.969 13.071 ( 0.000 0.000 -8.397) 8.397 14.310 ( 0.000 0.000 -11.294) 11.294 15.387 ( 0.000 0.000 -13.751) 13.751 15.930 ( 0.000 0.000 -18.632) 18.632 16.809 ( 0.000 0.000 -7.180) 7.180 17.157 ( 0.000 0.000 -0.846) 0.846 ======================= Grid point 136 (47/120) ======================= q-point: ( 0.11 0.00 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( 21.487 0.000 17.685) 27.829 2.083 ( 3.896 0.000 18.155) 18.568 2.699 ( 1.790 0.000 -1.435) 2.294 2.805 ( 7.067 0.000 24.225) 25.235 3.151 ( -0.200 0.000 -9.646) 9.648 4.138 ( 6.921 0.000 56.460) 56.883 4.377 ( 3.334 0.000 26.908) 27.114 5.069 ( 9.220 0.000 7.082) 11.626 5.533 ( 0.602 0.000 25.956) 25.963 5.701 ( -1.298 0.000 24.370) 24.405 5.899 ( -2.855 0.000 3.382) 4.426 5.985 ( -9.971 0.000 -9.057) 13.471 6.086 ( 5.706 0.000 27.195) 27.787 6.273 ( -5.205 0.000 26.293) 26.804 6.658 ( -1.853 0.000 8.559) 8.757 6.662 ( -16.540 0.000 6.566) 17.796 7.003 ( 5.848 0.000 2.876) 6.517 7.311 ( 18.116 0.000 -5.039) 18.804 7.374 ( 9.684 0.000 -2.329) 9.960 7.614 ( 3.129 0.000 -15.054) 15.376 7.647 ( 0.032 0.000 7.860) 7.860 8.154 ( -0.933 0.000 5.100) 5.185 8.347 ( -2.364 0.000 -7.838) 8.187 8.805 ( 2.537 0.000 -3.903) 4.655 9.086 ( -1.072 0.000 11.726) 11.775 9.350 ( 1.542 0.000 2.766) 3.167 9.460 ( -2.129 0.000 -4.254) 4.757 9.675 ( -2.970 0.000 -11.051) 11.443 9.915 ( 3.397 0.000 -0.598) 3.450 10.077 ( -9.394 0.000 16.966) 19.393 10.504 ( 9.899 0.000 12.141) 15.665 10.647 ( -3.396 0.000 -8.416) 9.076 11.579 ( -7.576 0.000 15.596) 17.338 11.629 ( -15.339 0.000 -7.920) 17.263 11.984 ( 2.081 0.000 2.301) 3.102 12.147 ( 1.750 0.000 -7.623) 7.821 13.169 ( 10.489 0.000 -10.103) 14.564 14.383 ( 7.165 0.000 -13.164) 14.988 15.333 ( -5.478 0.000 -13.735) 14.787 15.892 ( -4.028 0.000 -18.947) 19.370 16.752 ( -5.184 0.000 -7.163) 8.842 17.125 ( -3.194 0.000 -1.228) 3.422 ======================= Grid point 137 (48/120) ======================= q-point: ( 0.22 0.00 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 4.691 0.000 15.181) 15.890 2.273 ( 9.708 0.000 1.930) 9.898 2.837 ( 13.349 0.000 7.950) 15.537 2.993 ( 11.891 0.000 19.925) 23.204 3.236 ( 11.509 0.000 -3.724) 12.096 4.321 ( 11.134 0.000 48.733) 49.989 4.461 ( 4.886 0.000 28.873) 29.283 5.236 ( 7.063 0.000 6.819) 9.818 5.540 ( -0.427 0.000 26.976) 26.980 5.627 ( -13.377 0.000 8.457) 15.826 5.720 ( -9.824 0.000 9.374) 13.578 5.848 ( -2.952 0.000 10.106) 10.528 6.123 ( -6.934 0.000 23.231) 24.244 6.280 ( 11.975 0.000 20.641) 23.863 6.381 ( -11.787 0.000 7.684) 14.071 6.698 ( 6.335 0.000 7.957) 10.171 7.178 ( 11.342 0.000 1.473) 11.438 7.422 ( -3.471 0.000 -4.013) 5.306 7.677 ( 18.399 0.000 -6.727) 19.590 7.720 ( 8.973 0.000 -11.116) 14.285 7.721 ( 4.818 0.000 2.203) 5.298 8.123 ( -1.417 0.000 0.536) 1.515 8.277 ( -5.163 0.000 -7.639) 9.220 8.867 ( 3.635 0.000 -3.993) 5.400 9.051 ( -2.712 0.000 11.542) 11.856 9.377 ( 0.862 0.000 4.079) 4.169 9.394 ( -4.215 0.000 6.355) 7.626 9.573 ( -8.178 0.000 -11.362) 13.999 9.926 ( -5.895 0.000 17.018) 18.011 10.006 ( 5.645 0.000 1.507) 5.842 10.562 ( -4.872 0.000 -7.807) 9.202 10.671 ( 7.244 0.000 12.305) 14.279 11.354 ( -12.434 0.000 -2.249) 12.636 11.406 ( -9.977 0.000 18.269) 20.815 12.003 ( -0.325 0.000 1.557) 1.590 12.092 ( -5.922 0.000 -2.156) 6.302 13.461 ( 18.852 0.000 -13.544) 23.213 14.565 ( 11.291 0.000 -16.941) 20.359 15.181 ( -10.209 0.000 -13.937) 17.276 15.770 ( -8.650 0.000 -19.907) 21.705 16.652 ( -4.187 0.000 -7.592) 8.670 17.038 ( -5.724 0.000 -2.263) 6.155 ======================= Grid point 138 (49/120) ======================= q-point: ( 0.33 0.00 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( 2.957 0.000 11.339) 11.718 2.333 ( -0.511 0.000 0.402) 0.650 3.126 ( 15.702 0.000 6.329) 16.929 3.239 ( 12.818 0.000 15.105) 19.811 3.599 ( 23.055 0.000 6.989) 24.091 4.504 ( 5.979 0.000 32.816) 33.356 4.533 ( 1.376 0.000 33.468) 33.496 5.165 ( -27.381 0.000 -6.581) 28.161 5.389 ( 10.978 0.000 5.670) 12.356 5.523 ( -1.132 0.000 26.293) 26.317 5.681 ( 0.748 0.000 26.205) 26.216 5.780 ( -4.008 0.000 23.848) 24.182 5.962 ( -8.687 0.000 24.895) 26.367 6.197 ( -8.325 0.000 7.576) 11.256 6.578 ( 17.014 0.000 6.093) 18.072 6.876 ( 11.311 0.000 7.283) 13.453 7.313 ( -7.346 0.000 -4.796) 8.773 7.414 ( 12.588 0.000 -3.513) 13.069 7.679 ( -9.864 0.000 -4.355) 10.783 7.952 ( 16.954 0.000 -7.093) 18.378 8.022 ( 15.186 0.000 -4.113) 15.733 8.128 ( -9.024 0.000 -12.637) 15.528 8.166 ( 4.199 0.000 4.356) 6.050 8.937 ( 3.535 0.000 -2.888) 4.565 8.988 ( -3.807 0.000 13.109) 13.651 9.280 ( -11.129 0.000 7.893) 13.643 9.375 ( -1.109 0.000 6.038) 6.139 9.386 ( -6.904 0.000 -6.064) 9.189 9.859 ( -0.927 0.000 15.241) 15.269 10.086 ( 0.623 0.000 2.004) 2.098 10.511 ( 1.731 0.000 -1.182) 2.096 10.779 ( 3.944 0.000 11.764) 12.408 11.155 ( -8.481 0.000 4.302) 9.510 11.202 ( -11.029 0.000 19.373) 22.292 11.977 ( -2.005 0.000 0.616) 2.097 11.979 ( -4.744 0.000 0.589) 4.780 13.856 ( 21.325 0.000 -15.469) 26.345 14.802 ( 12.996 0.000 -20.282) 24.089 14.944 ( -14.321 0.000 -14.559) 20.422 15.568 ( -12.037 0.000 -21.394) 24.548 16.614 ( 0.439 0.000 -7.783) 7.795 16.913 ( -7.055 0.000 -3.726) 7.978 ======================= Grid point 139 (50/120) ======================= q-point: ( 0.44 0.00 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.286 ( 1.390 0.000 7.512) 7.639 2.311 ( -1.309 0.000 3.801) 4.020 3.400 ( 10.174 0.000 7.670) 12.742 3.438 ( 6.011 0.000 10.923) 12.467 4.040 ( 22.533 0.000 12.557) 25.795 4.439 ( -14.431 0.000 29.672) 32.995 4.558 ( 2.171 0.000 21.742) 21.850 4.697 ( -16.153 0.000 2.415) 16.332 5.544 ( 3.854 0.000 20.649) 21.006 5.614 ( 3.580 0.000 2.539) 4.390 5.712 ( 2.180 0.000 27.111) 27.199 5.720 ( 1.829 0.000 28.382) 28.441 5.841 ( -0.456 0.000 26.725) 26.729 6.017 ( -11.142 0.000 9.648) 14.739 6.893 ( 15.050 0.000 -1.222) 15.100 7.115 ( 13.646 0.000 5.009) 14.537 7.141 ( -10.667 0.000 -4.476) 11.568 7.409 ( -16.185 0.000 -0.804) 16.205 7.655 ( 12.610 0.000 -8.229) 15.057 7.902 ( -12.835 0.000 -10.327) 16.473 8.234 ( 6.093 0.000 -1.227) 6.215 8.258 ( 2.905 0.000 1.334) 3.197 8.355 ( 23.746 0.000 -2.468) 23.874 8.798 ( -19.421 0.000 2.985) 19.649 9.001 ( 3.073 0.000 0.757) 3.165 9.066 ( -5.314 0.000 4.895) 7.225 9.334 ( -0.512 0.000 5.147) 5.172 9.346 ( -1.439 0.000 7.016) 7.162 9.894 ( 4.430 0.000 10.519) 11.414 10.011 ( -6.688 0.000 4.057) 7.822 10.645 ( 10.240 0.000 7.644) 12.778 10.804 ( -3.149 0.000 9.645) 10.146 11.015 ( -5.819 0.000 17.904) 18.826 11.025 ( -4.750 0.000 11.010) 11.991 11.927 ( -0.723 0.000 0.217) 0.755 11.939 ( -1.629 0.000 -0.119) 1.633 14.262 ( 20.457 0.000 -15.829) 25.866 14.633 ( -17.854 0.000 -15.339) 23.538 15.059 ( 13.566 0.000 -22.223) 26.037 15.320 ( -13.400 0.000 -22.496) 26.185 16.664 ( 4.542 0.000 -6.924) 8.281 16.777 ( -6.768 0.000 -5.387) 8.650 ======================= Grid point 144 (51/120) ======================= q-point: ( 0.00 0.20 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 0.000 8.097 22.953) 24.339 1.995 ( 0.000 -3.897 21.007) 21.365 2.589 ( 0.000 -12.429 0.908) 12.462 2.607 ( 0.000 -10.114 23.809) 25.868 3.286 ( 0.000 16.827 -7.818) 18.554 4.275 ( 0.000 16.407 53.436) 55.898 4.503 ( 0.000 12.462 24.388) 27.387 4.910 ( 0.000 -7.063 7.631) 10.399 5.541 ( 0.000 -0.376 23.630) 23.633 5.685 ( 0.000 -2.795 24.127) 24.288 5.694 ( 0.000 -14.593 1.598) 14.680 5.920 ( 0.000 -8.832 24.593) 26.131 6.022 ( 0.000 -3.082 11.577) 11.980 6.499 ( 0.000 -13.038 13.639) 18.868 6.561 ( 0.000 14.371 12.681) 19.166 6.825 ( 0.000 -7.963 2.083) 8.231 6.859 ( 0.000 -5.584 -2.929) 6.306 7.165 ( 0.000 3.177 3.953) 5.072 7.371 ( 0.000 9.470 -0.627) 9.491 7.521 ( 0.000 0.036 -11.239) 11.239 7.727 ( 0.000 3.820 0.820) 3.907 8.156 ( 0.000 -1.048 5.572) 5.670 8.428 ( 0.000 4.479 -6.355) 7.775 8.713 ( 0.000 -5.799 -2.749) 6.417 9.114 ( 0.000 2.459 9.475) 9.789 9.384 ( 0.000 4.662 0.824) 4.735 9.445 ( 0.000 -3.243 -7.818) 8.464 9.819 ( 0.000 10.547 -7.503) 12.943 9.822 ( 0.000 -5.472 -1.302) 5.625 10.258 ( 0.000 1.643 17.914) 17.989 10.336 ( 0.000 -0.228 9.639) 9.641 10.586 ( 0.000 -8.730 -6.207) 10.712 11.653 ( 0.000 -1.051 9.959) 10.014 11.700 ( 0.000 -8.843 -0.447) 8.855 11.892 ( 0.000 4.688 -8.510) 9.716 12.428 ( 0.000 14.077 -4.702) 14.841 12.970 ( 0.000 -3.463 -7.975) 8.694 14.131 ( 0.000 -15.964 -10.695) 19.215 15.489 ( 0.000 8.458 -14.598) 16.872 15.904 ( 0.000 -2.617 -18.404) 18.589 16.871 ( 0.000 5.283 -6.420) 8.314 17.138 ( 0.000 -1.820 -1.157) 2.156 ======================= Grid point 145 (52/120) ======================= q-point: ( 0.11 0.20 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 14.685 2.882 15.404) 21.476 2.057 ( 8.671 -1.137 18.610) 20.563 2.616 ( 4.052 -10.393 5.128) 12.277 2.698 ( 8.794 -7.892 20.042) 23.265 3.288 ( 0.859 16.835 -5.561) 17.750 4.309 ( 3.040 12.300 48.838) 50.455 4.464 ( -1.439 7.655 28.002) 29.065 5.038 ( 9.428 -5.327 6.232) 12.494 5.541 ( -0.027 -1.734 22.981) 23.046 5.626 ( -5.783 -11.437 8.048) 15.133 5.698 ( -0.107 -2.852 20.410) 20.609 5.936 ( 0.727 -2.807 11.195) 11.564 6.021 ( 2.043 -6.965 24.627) 25.675 6.440 ( -5.382 -2.146 17.391) 18.331 6.562 ( -0.550 7.752 8.647) 11.626 6.714 ( -11.144 -1.229 1.536) 11.316 6.868 ( 5.093 -7.920 2.322) 9.698 7.283 ( 12.243 -3.072 -0.192) 12.624 7.526 ( 0.336 2.622 -9.248) 9.618 7.555 ( 13.830 6.422 -2.042) 15.384 7.719 ( 0.195 3.655 -1.822) 4.088 8.154 ( -0.294 -0.689 4.118) 4.186 8.395 ( -3.522 3.900 -7.160) 8.882 8.732 ( 1.683 -6.414 -2.917) 7.245 9.107 ( -0.614 2.371 9.866) 10.166 9.388 ( -0.445 2.371 -1.253) 2.718 9.431 ( -0.832 -1.624 -0.419) 1.872 9.775 ( -4.562 8.565 -8.313) 12.778 9.854 ( 3.073 -4.720 -0.019) 5.632 10.136 ( -6.712 5.080 14.757) 16.989 10.478 ( 8.703 -2.577 12.192) 15.200 10.554 ( -3.059 -8.613 -5.901) 10.880 11.524 ( -11.658 -3.958 3.744) 12.868 11.582 ( -8.924 -2.536 2.958) 9.737 11.969 ( 4.598 3.374 -1.024) 5.794 12.384 ( -4.656 10.945 -3.718) 12.461 13.112 ( 13.652 -0.903 -10.120) 17.018 14.193 ( 6.138 -16.555 -12.433) 21.594 15.444 ( -4.508 9.001 -14.708) 17.824 15.867 ( -3.953 -2.582 -18.709) 19.296 16.816 ( -5.084 5.507 -6.469) 9.900 17.104 ( -3.410 -2.052 -1.516) 4.259 ======================= Grid point 146 (53/120) ======================= q-point: ( 0.22 0.20 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( 6.027 -2.500 14.462) 15.865 2.326 ( 10.199 2.381 0.197) 10.475 2.788 ( 13.943 -5.296 9.838) 17.867 2.938 ( 15.649 -4.042 17.085) 23.519 3.367 ( 8.989 14.504 0.948) 17.090 4.365 ( 2.358 0.381 37.062) 37.138 4.495 ( 3.961 5.015 34.249) 34.840 5.136 ( -2.515 -14.254 0.669) 14.490 5.484 ( -4.066 -3.136 9.888) 11.142 5.556 ( -0.538 1.479 26.451) 26.498 5.678 ( -1.510 -1.544 24.014) 24.111 5.903 ( -3.294 3.306 15.444) 16.134 6.169 ( 8.695 -6.203 19.821) 22.516 6.297 ( -8.100 4.241 19.552) 21.584 6.445 ( -6.004 6.277 7.166) 11.261 6.687 ( 6.807 0.241 1.863) 7.062 7.013 ( 9.346 -9.762 1.698) 13.621 7.443 ( -1.336 -6.696 -2.519) 7.278 7.612 ( 11.462 2.982 -6.486) 13.503 7.779 ( 7.616 4.674 -6.882) 11.279 7.815 ( 11.505 5.163 -3.269) 13.027 8.139 ( -1.008 0.974 1.453) 2.018 8.297 ( -6.250 2.021 -7.801) 10.198 8.762 ( 1.045 -8.834 -3.248) 9.470 9.091 ( -1.176 2.890 10.249) 10.713 9.336 ( -4.062 -3.527 5.599) 7.765 9.435 ( 0.322 3.530 4.680) 5.871 9.639 ( -9.434 6.271 -8.855) 14.378 9.917 ( 1.925 -3.330 5.856) 7.006 10.044 ( -1.645 5.812 9.560) 11.309 10.487 ( -3.127 -6.784 -4.360) 8.649 10.630 ( 6.764 -4.190 12.313) 14.660 11.290 ( -11.392 -3.166 2.805) 12.152 11.384 ( -11.370 -2.590 8.726) 14.564 12.026 ( 1.326 4.938 2.609) 5.740 12.264 ( -7.065 9.646 -1.423) 12.041 13.443 ( 19.583 0.353 -13.232) 23.637 14.346 ( 8.962 -17.742 -15.628) 25.285 15.325 ( -7.436 10.640 -15.481) 20.203 15.750 ( -8.146 -2.126 -19.699) 21.422 16.711 ( -4.843 5.227 -6.902) 9.921 17.013 ( -5.808 -2.383 -2.488) 6.753 ======================= Grid point 147 (54/120) ======================= q-point: ( 0.33 0.20 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 5.117 0.333 9.068) 10.418 2.414 ( 0.507 5.083 -2.249) 5.581 3.096 ( 17.284 -2.609 7.742) 19.118 3.241 ( 14.465 -0.294 13.821) 20.008 3.649 ( 18.043 6.051 8.113) 20.688 4.372 ( -2.913 -7.928 31.626) 32.734 4.566 ( 2.578 -1.163 29.764) 29.898 4.907 ( -17.580 -17.438 -0.880) 24.777 5.523 ( 0.665 3.975 21.334) 21.711 5.564 ( 7.610 7.336 14.929) 18.293 5.671 ( 1.596 -0.110 27.551) 27.597 5.831 ( -3.895 3.438 25.110) 25.642 6.030 ( -12.458 5.093 21.938) 25.737 6.227 ( -5.718 1.615 8.571) 10.429 6.600 ( 16.643 2.428 3.990) 17.286 6.874 ( 11.498 0.014 3.752) 12.095 7.194 ( 6.743 -8.969 -1.429) 11.312 7.380 ( -1.678 -4.956 -4.056) 6.621 7.703 ( -4.541 3.157 -5.914) 8.098 7.975 ( 7.349 -1.792 -4.992) 9.063 8.029 ( 14.153 5.808 -3.960) 15.802 8.158 ( -6.911 1.705 -9.725) 12.052 8.183 ( 6.319 1.208 1.763) 6.670 8.774 ( 0.527 -11.224 -0.186) 11.238 9.058 ( -2.413 2.599 8.788) 9.476 9.227 ( -9.301 -4.072 8.625) 13.322 9.415 ( -3.011 4.371 0.197) 5.311 9.462 ( -5.720 5.968 2.052) 8.517 9.905 ( -1.059 2.573 11.414) 11.748 10.060 ( 0.178 -1.917 2.559) 3.202 10.477 ( 3.342 -2.610 1.573) 4.522 10.736 ( 4.341 -4.274 11.669) 13.163 11.101 ( -8.456 -3.526 8.413) 12.438 11.153 ( -12.106 -3.591 10.255) 16.267 12.031 ( -0.321 7.034 2.738) 7.555 12.139 ( -5.426 9.939 -0.396) 11.331 13.833 ( 20.266 -1.034 -14.762) 25.094 14.496 ( 4.983 -18.467 -16.775) 25.441 15.187 ( -5.503 12.643 -18.080) 22.738 15.562 ( -10.943 -0.792 -21.317) 23.975 16.653 ( -0.873 3.573 -7.158) 8.048 16.891 ( -6.669 -2.116 -3.832) 7.977 ======================= Grid point 148 (55/120) ======================= q-point: ( 0.44 0.20 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( 4.014 3.881 4.114) 6.936 2.386 ( -2.788 6.056 0.442) 6.682 3.410 ( 12.496 0.538 8.142) 14.924 3.463 ( 6.803 2.230 11.110) 13.217 3.961 ( 13.634 -7.239 9.342) 18.043 4.221 ( -12.660 -15.855 18.014) 27.132 4.578 ( -0.873 -2.702 27.425) 27.571 4.626 ( -7.916 -2.625 17.036) 18.968 5.548 ( 3.992 0.756 21.471) 21.852 5.639 ( -2.353 -0.662 19.008) 19.164 5.767 ( -0.847 2.740 28.605) 28.748 5.824 ( -5.985 5.629 20.883) 22.441 5.853 ( 12.397 6.852 15.617) 21.084 6.084 ( -9.523 5.706 6.652) 12.942 6.914 ( 14.870 2.116 -1.522) 15.097 7.106 ( 12.489 -0.589 3.436) 12.966 7.144 ( -8.328 0.024 -3.947) 9.216 7.364 ( -10.348 -5.041 -1.657) 11.629 7.650 ( 8.465 0.431 -3.068) 9.014 7.889 ( -12.751 -1.616 -6.244) 14.290 8.184 ( 6.202 -3.211 -2.902) 7.563 8.224 ( 2.972 -2.053 -1.364) 3.861 8.419 ( 17.705 4.111 -1.728) 18.258 8.735 ( -9.655 -5.565 2.481) 11.416 8.979 ( -3.322 -1.437 0.286) 3.630 9.031 ( -6.272 -2.859 4.333) 8.142 9.382 ( 0.218 4.678 5.678) 7.360 9.406 ( -1.934 4.967 8.863) 10.342 9.924 ( 3.148 1.772 8.961) 9.661 10.008 ( -4.699 -0.990 4.954) 6.899 10.618 ( 10.015 -1.610 7.296) 12.495 10.778 ( -2.532 -2.162 8.716) 9.330 10.943 ( -5.418 -5.636 15.426) 17.294 10.975 ( -5.702 -3.989 9.731) 11.963 12.031 ( 0.570 8.718 1.100) 8.806 12.061 ( -2.703 9.574 -0.130) 9.949 14.202 ( 17.353 -4.796 -14.944) 23.398 14.466 ( -8.742 -12.469 -15.149) 21.480 15.179 ( 5.247 8.250 -22.036) 24.108 15.347 ( -10.830 2.024 -22.676) 25.210 16.678 ( 3.212 1.219 -6.542) 7.389 16.768 ( -5.827 -0.871 -5.286) 7.915 ======================= Grid point 153 (56/120) ======================= q-point: ( 0.00 0.40 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 0.000 5.717 12.561) 13.801 1.946 ( 0.000 0.542 16.925) 16.934 2.322 ( 0.000 -7.711 18.479) 20.024 2.392 ( 0.000 -10.046 22.831) 24.943 3.817 ( 0.000 32.070 -3.736) 32.287 4.430 ( 0.000 -18.900 11.193) 21.966 4.711 ( 0.000 1.955 33.961) 34.017 4.721 ( 0.000 6.362 28.970) 29.660 5.445 ( 0.000 -0.133 14.288) 14.289 5.575 ( 0.000 -8.942 24.530) 26.109 5.647 ( 0.000 2.675 18.329) 18.523 5.727 ( 0.000 -6.724 18.064) 19.275 6.033 ( 0.000 5.686 15.926) 16.911 6.236 ( 0.000 -12.547 18.202) 22.108 6.707 ( 0.000 -0.466 -0.582) 0.746 6.743 ( 0.000 -4.262 -4.100) 5.914 6.861 ( 0.000 11.504 7.931) 13.973 7.077 ( 0.000 -8.948 5.996) 10.771 7.516 ( 0.000 4.893 -2.042) 5.302 7.568 ( 0.000 0.322 -4.975) 4.985 7.870 ( 0.000 10.824 -3.918) 11.511 8.078 ( 0.000 -7.468 -1.196) 7.563 8.509 ( 0.000 3.339 -1.064) 3.504 8.588 ( 0.000 -5.230 0.276) 5.237 9.209 ( 0.000 6.447 2.808) 7.032 9.346 ( 0.000 -6.253 -3.600) 7.216 9.511 ( 0.000 7.583 -1.083) 7.660 9.677 ( 0.000 -8.187 -1.527) 8.328 10.082 ( 0.000 14.078 -3.653) 14.545 10.294 ( 0.000 1.517 14.563) 14.641 10.324 ( 0.000 -0.968 11.480) 11.521 10.361 ( 0.000 -12.483 -3.277) 12.906 11.613 ( 0.000 -0.843 0.915) 1.244 11.625 ( 0.000 -1.398 4.201) 4.427 12.053 ( 0.000 11.360 -4.431) 12.193 12.340 ( 0.000 -15.126 -3.012) 15.423 13.235 ( 0.000 23.437 -9.136) 25.155 13.723 ( 0.000 -22.980 -9.782) 24.975 15.672 ( 0.000 8.598 -16.170) 18.314 15.820 ( 0.000 -5.749 -17.571) 18.488 16.987 ( 0.000 5.500 -4.305) 6.984 17.082 ( 0.000 -3.718 -2.262) 4.352 ======================= Grid point 154 (57/120) ======================= q-point: ( 0.11 0.40 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 5.289 2.332 14.391) 15.508 2.072 ( 10.558 -1.619 7.714) 13.176 2.426 ( 11.522 -2.699 19.482) 22.795 2.522 ( 12.699 -8.559 19.276) 24.618 3.801 ( -1.222 30.221 -0.862) 30.258 4.338 ( -6.442 -15.327 14.999) 22.392 4.672 ( -1.589 9.464 37.106) 38.327 4.819 ( 3.094 -9.677 15.340) 18.400 5.471 ( 3.398 3.965 17.431) 18.197 5.594 ( 1.152 -1.182 25.058) 25.112 5.657 ( 0.159 -1.281 20.884) 20.924 5.749 ( 4.254 -11.387 19.383) 22.879 6.034 ( 0.453 7.610 15.288) 17.083 6.246 ( 0.901 -11.670 18.357) 21.771 6.679 ( -5.246 -0.596 -0.468) 5.301 6.697 ( -2.368 -1.284 3.355) 4.302 6.890 ( 3.444 11.363 3.920) 12.504 7.126 ( 5.200 -10.628 3.177) 12.251 7.592 ( 5.721 3.750 -6.576) 9.489 7.642 ( 7.438 -0.498 -3.179) 8.105 7.878 ( 1.822 11.610 -4.271) 12.504 8.085 ( 1.011 -7.020 -1.109) 7.179 8.480 ( -3.320 4.365 -3.052) 6.277 8.588 ( -0.522 -6.619 -1.021) 6.717 9.190 ( -1.593 5.621 5.335) 7.911 9.316 ( -2.952 -6.035 0.275) 6.723 9.525 ( 1.282 7.517 -0.352) 7.634 9.694 ( 1.338 -8.420 -0.826) 8.565 10.032 ( -4.836 13.559 -3.553) 14.827 10.244 ( -4.797 1.907 8.418) 9.875 10.340 ( 0.388 -8.135 2.389) 8.487 10.401 ( 4.946 -5.200 11.247) 13.342 11.491 ( -10.334 0.670 1.081) 10.412 11.529 ( -9.092 -2.565 2.654) 9.812 12.115 ( 4.524 10.370 -0.716) 11.337 12.354 ( 0.364 -10.979 -1.305) 11.063 13.330 ( 9.562 20.198 -10.945) 24.884 13.784 ( 6.105 -22.430 -11.455) 25.915 15.634 ( -3.813 8.768 -16.413) 18.994 15.783 ( -3.778 -5.720 -17.871) 19.141 16.939 ( -4.638 5.894 -4.499) 8.746 17.042 ( -3.972 -4.102 -2.560) 6.258 ======================= Grid point 155 (58/120) ======================= q-point: ( 0.22 0.40 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( 8.307 4.088 9.905) 13.559 2.272 ( 9.671 -7.609 0.582) 12.320 2.741 ( 18.809 2.544 14.979) 24.178 2.838 ( 18.900 -5.555 14.517) 24.470 3.800 ( 1.930 25.421 5.426) 26.065 4.249 ( -2.704 -14.086 19.990) 24.604 4.609 ( -5.065 4.796 28.497) 29.339 4.770 ( -7.641 -14.611 9.182) 18.873 5.581 ( 3.418 5.153 24.705) 25.467 5.615 ( 4.446 8.914 20.119) 22.450 5.637 ( -0.543 -2.278 25.219) 25.327 5.881 ( 4.935 -11.527 25.501) 28.417 6.087 ( 6.376 5.291 15.205) 17.316 6.245 ( -2.314 -7.512 21.842) 23.213 6.573 ( -2.606 5.481 2.521) 6.572 6.679 ( 2.037 -4.057 -0.343) 4.552 6.986 ( 5.811 8.861 0.170) 10.597 7.225 ( 3.265 -12.348 -0.828) 12.799 7.714 ( 6.810 5.034 -7.883) 11.570 7.794 ( 7.602 -2.305 -4.672) 9.216 7.988 ( 9.536 9.415 -4.170) 14.035 8.125 ( 2.860 -3.344 -0.428) 4.421 8.373 ( -7.556 6.044 -5.690) 11.225 8.551 ( -3.243 -10.753 -3.947) 11.905 9.158 ( -1.916 3.792 9.406) 10.321 9.246 ( -3.959 -4.740 7.962) 10.076 9.546 ( 0.393 7.065 1.642) 7.264 9.689 ( -3.422 -5.039 0.269) 6.097 9.936 ( -3.365 8.743 -1.736) 9.528 10.118 ( -7.287 -3.908 2.171) 8.549 10.381 ( 3.671 1.292 7.401) 8.362 10.507 ( 5.579 -7.463 11.684) 14.944 11.273 ( -11.439 1.230 2.516) 11.777 11.321 ( -11.812 -3.061 3.732) 12.760 12.179 ( 1.920 8.965 2.469) 9.495 12.330 ( -2.610 -3.749 0.516) 4.597 13.579 ( 15.338 13.694 -13.479) 24.586 13.944 ( 9.928 -20.308 -14.289) 26.743 15.532 ( -6.530 8.916 -17.441) 20.648 15.676 ( -7.147 -5.261 -18.927) 20.904 16.833 ( -5.695 6.060 -5.095) 9.753 16.942 ( -5.923 -4.540 -3.371) 8.189 ======================= Grid point 156 (59/120) ======================= q-point: ( 0.33 0.40 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.296 ( 8.364 6.075 3.011) 10.767 2.431 ( 6.208 -4.646 -4.329) 8.881 3.092 ( 17.642 3.744 11.300) 21.283 3.197 ( 17.354 -4.461 11.798) 21.453 3.867 ( 3.002 14.565 9.618) 17.711 4.170 ( -8.414 -13.060 18.851) 24.428 4.525 ( -1.867 -0.802 25.685) 25.766 4.605 ( -6.283 -9.834 15.285) 19.231 5.571 ( -1.136 2.196 24.898) 25.020 5.613 ( -0.321 -1.671 21.813) 21.880 5.801 ( 8.481 8.713 24.565) 27.409 5.883 ( -3.164 0.593 27.289) 27.478 6.114 ( -6.509 3.643 17.782) 19.283 6.206 ( 0.349 -4.040 13.164) 13.774 6.686 ( 13.953 6.040 -0.172) 15.205 6.830 ( 13.142 -6.392 -1.797) 14.724 7.093 ( 5.177 2.554 0.001) 5.772 7.230 ( -2.093 -8.488 -2.952) 9.227 7.807 ( 0.155 6.271 -4.907) 7.965 7.920 ( 3.388 -4.062 -2.826) 5.997 8.144 ( 1.061 2.769 -2.032) 3.595 8.170 ( -0.683 -0.534 -5.773) 5.838 8.270 ( 5.938 9.528 -3.953) 11.903 8.517 ( 1.960 -13.292 -3.174) 13.805 9.098 ( -4.874 1.856 8.777) 10.210 9.149 ( -7.234 -3.249 8.875) 11.901 9.527 ( -2.283 5.624 3.886) 7.207 9.574 ( -5.898 2.742 5.303) 8.392 9.918 ( 0.265 1.144 2.797) 3.033 10.005 ( -3.811 -4.890 1.454) 6.368 10.478 ( 6.458 4.218 8.674) 11.608 10.613 ( 5.559 -7.365 10.988) 14.349 11.063 ( -10.530 -0.059 6.966) 12.626 11.089 ( -11.861 -2.399 5.435) 13.265 12.196 ( 0.219 7.494 2.244) 7.826 12.271 ( -3.047 1.398 0.414) 3.378 13.883 ( 15.307 7.264 -14.213) 22.116 14.132 ( 8.540 -16.235 -15.128) 23.778 15.400 ( -6.414 8.170 -19.735) 22.301 15.520 ( -8.600 -3.712 -20.854) 22.861 16.741 ( -3.408 4.624 -5.680) 8.078 16.829 ( -5.473 -3.812 -4.391) 7.985 ======================= Grid point 157 (60/120) ======================= q-point: ( 0.44 0.40 0.21) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 5.424 6.125 -3.016) 8.720 2.490 ( -0.169 1.988 -5.857) 6.187 3.426 ( 16.068 2.207 10.305) 19.216 3.490 ( 11.720 -1.302 11.189) 16.256 3.826 ( -6.205 -2.969 9.103) 11.409 3.915 ( -15.114 -11.423 12.211) 22.540 4.541 ( 3.239 0.483 29.611) 29.792 4.580 ( 0.262 -2.606 29.011) 29.129 5.574 ( 1.812 1.664 23.341) 23.470 5.610 ( -0.680 -1.785 23.009) 23.088 5.808 ( -2.875 1.366 27.714) 27.896 5.828 ( -4.169 -0.611 27.214) 27.538 6.093 ( 4.628 9.550 4.059) 11.362 6.177 ( -3.106 1.393 3.378) 4.796 6.988 ( 13.829 5.355 -1.615) 14.918 7.088 ( 10.967 -2.129 0.330) 11.176 7.145 ( -3.148 0.456 -2.317) 3.936 7.212 ( 1.925 -7.667 -0.934) 7.960 7.706 ( -4.499 4.926 3.909) 7.732 7.820 ( -11.651 -5.211 2.535) 13.013 8.152 ( 2.434 0.034 -7.137) 7.540 8.176 ( 0.692 -2.132 -6.605) 6.975 8.506 ( 12.871 4.605 -0.765) 13.692 8.612 ( 4.194 -5.811 0.633) 7.194 8.961 ( -7.944 -0.162 1.212) 8.038 8.978 ( -7.828 -1.869 2.846) 8.536 9.492 ( -0.462 4.667 9.548) 10.637 9.507 ( -1.822 3.500 12.026) 12.656 9.929 ( 1.063 -0.580 4.399) 4.562 9.958 ( -1.790 -3.259 3.890) 5.381 10.629 ( 9.001 3.234 8.164) 12.575 10.721 ( 4.752 -4.244 8.115) 10.317 10.857 ( -9.380 -1.025 10.989) 14.485 10.894 ( -8.290 -3.532 8.772) 12.576 12.201 ( 0.571 6.121 0.641) 6.181 12.224 ( -1.810 4.356 -0.063) 4.717 14.134 ( 9.844 -0.187 -13.668) 16.845 14.229 ( 0.442 -9.246 -13.943) 16.736 15.319 ( -1.105 4.901 -22.512) 23.066 15.371 ( -6.037 -0.301 -22.815) 23.602 16.709 ( 0.085 1.708 -5.744) 5.993 16.743 ( -3.300 -1.517 -5.258) 6.390 ======================= Grid point 180 (61/120) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 0.000 0.000 7.534) 7.534 2.370 ( 0.000 0.000 14.573) 14.573 2.784 ( 0.000 0.000 16.341) 16.341 2.967 ( 0.000 0.000 -7.663) 7.663 3.356 ( 0.000 0.000 32.419) 32.419 4.812 ( 0.000 0.000 19.256) 19.256 5.038 ( 0.000 0.000 16.207) 16.207 5.238 ( 0.000 0.000 39.043) 39.043 5.866 ( 0.000 0.000 -11.163) 11.163 6.017 ( 0.000 0.000 2.726) 2.726 6.025 ( 0.000 0.000 22.750) 22.750 6.165 ( 0.000 0.000 20.165) 20.165 6.294 ( 0.000 0.000 0.957) 0.957 6.852 ( 0.000 0.000 20.527) 20.527 6.958 ( 0.000 0.000 -4.213) 4.213 6.992 ( 0.000 0.000 3.370) 3.370 7.026 ( 0.000 0.000 20.856) 20.856 7.081 ( 0.000 0.000 6.764) 6.764 7.190 ( 0.000 0.000 -1.277) 1.277 7.313 ( 0.000 0.000 -10.122) 10.122 7.915 ( 0.000 0.000 15.806) 15.806 8.196 ( 0.000 0.000 -7.730) 7.730 8.275 ( 0.000 0.000 2.697) 2.697 8.688 ( 0.000 0.000 -5.179) 5.179 9.324 ( 0.000 0.000 -4.786) 4.786 9.380 ( 0.000 0.000 13.947) 13.947 9.405 ( 0.000 0.000 5.044) 5.044 9.447 ( 0.000 0.000 -13.348) 13.348 9.841 ( 0.000 0.000 -2.535) 2.535 10.443 ( 0.000 0.000 1.886) 1.886 10.476 ( 0.000 0.000 -11.621) 11.621 10.637 ( 0.000 0.000 18.607) 18.607 11.605 ( 0.000 0.000 -11.688) 11.688 11.907 ( 0.000 0.000 -6.034) 6.034 12.009 ( 0.000 0.000 19.565) 19.565 12.054 ( 0.000 0.000 7.569) 7.569 12.888 ( 0.000 0.000 -9.313) 9.313 14.049 ( 0.000 0.000 -13.681) 13.681 15.063 ( 0.000 0.000 -17.912) 17.912 15.517 ( 0.000 0.000 -21.545) 21.545 16.663 ( 0.000 0.000 -6.895) 6.895 17.136 ( 0.000 0.000 -1.245) 1.245 ======================= Grid point 181 (62/120) ======================= q-point: ( 0.11 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( 7.298 0.000 2.678) 7.774 2.392 ( 1.976 0.000 13.468) 13.612 2.870 ( 8.213 0.000 17.519) 19.348 2.985 ( 3.719 0.000 -5.992) 7.052 3.387 ( 3.186 0.000 30.659) 30.824 4.849 ( 3.841 0.000 19.203) 19.583 5.129 ( 8.484 0.000 20.499) 22.185 5.250 ( 0.542 0.000 29.797) 29.802 5.775 ( -9.713 0.000 -10.825) 14.544 5.943 ( -3.642 0.000 1.757) 4.044 6.038 ( 1.214 0.000 22.763) 22.796 6.177 ( 1.083 0.000 21.366) 21.394 6.397 ( 6.988 0.000 4.199) 8.152 6.749 ( -3.805 0.000 17.367) 17.779 6.804 ( -13.028 0.000 6.735) 14.666 6.989 ( -2.008 0.000 20.998) 21.094 7.094 ( 6.420 0.000 6.920) 9.439 7.235 ( 14.848 0.000 -1.469) 14.920 7.320 ( 6.997 0.000 -3.041) 7.629 7.369 ( 6.146 0.000 -8.422) 10.426 7.843 ( -6.630 0.000 9.701) 11.750 8.131 ( -5.480 0.000 -6.655) 8.621 8.279 ( -0.432 0.000 1.975) 2.022 8.708 ( 2.000 0.000 -5.627) 5.972 9.292 ( -0.805 0.000 5.805) 5.861 9.408 ( -3.536 0.000 -13.439) 13.897 9.426 ( 2.013 0.000 4.992) 5.383 9.490 ( 7.291 0.000 8.550) 11.236 9.892 ( 5.048 0.000 -1.796) 5.358 10.352 ( -6.675 0.000 8.476) 10.789 10.439 ( -3.416 0.000 -11.621) 12.112 10.734 ( 7.159 0.000 11.727) 13.740 11.472 ( -9.910 0.000 -7.562) 12.466 11.932 ( -6.174 0.000 18.504) 19.507 11.998 ( 5.448 0.000 -6.429) 8.427 12.081 ( 0.970 0.000 8.181) 8.238 12.951 ( 6.927 0.000 -10.925) 12.936 14.087 ( 3.832 0.000 -15.258) 15.732 15.007 ( -5.739 0.000 -18.111) 18.998 15.471 ( -4.857 0.000 -22.023) 22.552 16.617 ( -4.145 0.000 -5.865) 7.181 17.102 ( -3.479 0.000 -1.150) 3.664 ======================= Grid point 182 (63/120) ======================= q-point: ( 0.22 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( 5.473 0.000 -1.318) 5.630 2.432 ( 1.810 0.000 10.997) 11.145 3.008 ( 7.981 0.000 4.305) 9.068 3.241 ( 21.006 0.000 7.990) 22.474 3.475 ( 5.843 0.000 25.866) 26.517 4.955 ( 6.882 0.000 19.330) 20.518 5.202 ( -4.169 0.000 28.425) 28.729 5.336 ( 10.415 0.000 10.465) 14.764 5.482 ( -20.496 0.000 -9.333) 22.521 5.972 ( 6.801 0.000 5.043) 8.467 6.062 ( 0.696 0.000 22.874) 22.885 6.193 ( 0.152 0.000 23.930) 23.931 6.453 ( -1.676 0.000 9.574) 9.719 6.572 ( -10.202 0.000 10.319) 14.510 6.769 ( 4.164 0.000 22.628) 23.008 6.982 ( 2.982 0.000 18.503) 18.742 7.210 ( 5.821 0.000 1.877) 6.116 7.368 ( -2.828 0.000 -1.404) 3.158 7.522 ( 14.396 0.000 -4.875) 15.199 7.607 ( 18.306 0.000 -2.782) 18.516 7.708 ( -6.496 0.000 -4.128) 7.697 8.010 ( -6.864 0.000 -8.967) 11.293 8.265 ( -0.229 0.000 5.678) 5.682 8.763 ( 3.697 0.000 -6.264) 7.274 9.282 ( -2.451 0.000 1.350) 2.799 9.315 ( -4.423 0.000 -2.982) 5.334 9.469 ( 2.059 0.000 5.121) 5.520 9.590 ( 1.375 0.000 10.911) 10.997 10.016 ( 6.882 0.000 -0.709) 6.919 10.232 ( -5.465 0.000 11.949) 13.139 10.384 ( -0.246 0.000 -8.890) 8.893 10.863 ( 5.753 0.000 7.245) 9.251 11.301 ( -7.121 0.000 -3.076) 7.757 11.783 ( -9.250 0.000 19.067) 21.192 12.047 ( -0.436 0.000 -2.015) 2.062 12.077 ( -1.393 0.000 6.382) 6.532 13.165 ( 15.072 0.000 -15.093) 21.330 14.193 ( 7.106 0.000 -18.933) 20.223 14.846 ( -10.877 0.000 -18.732) 21.661 15.327 ( -10.084 0.000 -23.203) 25.300 16.537 ( -3.264 0.000 -3.752) 4.973 17.007 ( -6.251 0.000 -0.913) 6.318 ======================= Grid point 183 (64/120) ======================= q-point: ( 0.33 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 2.747 0.000 0.553) 2.802 2.450 ( -0.094 0.000 8.470) 8.471 3.242 ( 16.117 0.000 4.734) 16.798 3.600 ( 6.575 0.000 19.411) 20.494 3.682 ( 22.684 0.000 3.779) 22.996 5.015 ( -26.915 0.000 -7.185) 27.857 5.099 ( 7.365 0.000 20.822) 22.086 5.113 ( -3.212 0.000 20.247) 20.500 5.520 ( 7.874 0.000 10.516) 13.137 5.995 ( -9.314 0.000 19.369) 21.493 6.142 ( 8.710 0.000 10.430) 13.589 6.198 ( 1.520 0.000 23.742) 23.790 6.394 ( -3.143 0.000 17.690) 17.967 6.437 ( -3.942 0.000 15.426) 15.922 6.822 ( 2.495 0.000 17.344) 17.522 7.121 ( 9.030 0.000 15.935) 18.315 7.242 ( -8.592 0.000 -2.132) 8.852 7.330 ( 7.300 0.000 -4.193) 8.419 7.581 ( -7.472 0.000 -5.129) 9.063 7.861 ( 20.438 0.000 -1.811) 20.518 7.865 ( -8.232 0.000 -11.981) 14.536 7.969 ( 18.324 0.000 -1.213) 18.364 8.286 ( 2.072 0.000 7.180) 7.473 8.847 ( 4.997 0.000 -5.998) 7.807 9.130 ( -11.605 0.000 -9.615) 15.071 9.254 ( -5.704 0.000 9.616) 11.181 9.496 ( 0.688 0.000 5.994) 6.033 9.542 ( -3.964 0.000 10.623) 11.339 10.103 ( 1.787 0.000 0.203) 1.799 10.148 ( -3.113 0.000 12.293) 12.681 10.502 ( 12.066 0.000 0.381) 12.072 10.943 ( 2.285 0.000 4.661) 5.191 11.206 ( -2.754 0.000 0.874) 2.889 11.577 ( -12.005 0.000 17.991) 21.628 12.009 ( -2.640 0.000 2.520) 3.650 12.034 ( -2.821 0.000 5.456) 6.142 13.507 ( 19.654 0.000 -18.353) 26.891 14.357 ( 9.798 0.000 -22.746) 24.766 14.594 ( -15.110 0.000 -19.517) 24.683 15.094 ( -13.616 0.000 -24.624) 28.138 16.516 ( 1.336 0.000 -2.021) 2.422 16.869 ( -7.801 0.000 -0.678) 7.831 ======================= Grid point 184 (65/120) ======================= q-point: ( 0.44 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.390 ( 2.252 0.000 3.596) 4.243 2.430 ( -1.787 0.000 6.171) 6.425 3.566 ( 14.382 0.000 8.312) 16.611 3.690 ( 1.143 0.000 13.333) 13.382 4.071 ( 18.641 0.000 -2.765) 18.845 4.493 ( -25.795 0.000 -5.842) 26.448 5.130 ( 4.792 0.000 26.000) 26.438 5.195 ( 0.990 0.000 26.558) 26.576 5.631 ( 4.432 0.000 1.526) 4.687 5.768 ( -11.173 0.000 5.362) 12.393 6.240 ( 2.082 0.000 23.611) 23.702 6.249 ( 1.998 0.000 19.881) 19.982 6.361 ( 0.016 0.000 23.610) 23.610 6.385 ( -2.044 0.000 22.205) 22.299 6.915 ( 7.233 0.000 4.497) 8.517 7.074 ( -8.630 0.000 -1.972) 8.853 7.273 ( 7.156 0.000 9.597) 11.971 7.422 ( -8.406 0.000 2.136) 8.673 7.502 ( 10.024 0.000 -5.899) 11.631 7.694 ( -9.551 0.000 -9.401) 13.402 8.197 ( 11.106 0.000 -1.345) 11.187 8.306 ( -1.216 0.000 3.441) 3.649 8.360 ( 23.748 0.000 2.159) 23.846 8.812 ( -21.327 0.000 -0.875) 21.345 8.958 ( 6.608 0.000 -4.758) 8.143 9.103 ( -8.338 0.000 -1.099) 8.411 9.500 ( -0.055 0.000 7.839) 7.839 9.502 ( -0.565 0.000 10.091) 10.107 10.111 ( -0.279 0.000 5.448) 5.455 10.112 ( -0.750 0.000 10.064) 10.092 10.767 ( 13.177 0.000 4.090) 13.797 10.936 ( -3.785 0.000 3.171) 4.938 11.201 ( 2.853 0.000 6.883) 7.451 11.341 ( -11.265 0.000 14.671) 18.497 11.972 ( -0.753 0.000 4.500) 4.562 11.984 ( -1.903 0.000 5.033) 5.381 13.897 ( 20.231 0.000 -19.676) 28.221 14.271 ( -18.310 0.000 -19.912) 27.051 14.569 ( 12.219 0.000 -25.225) 28.029 14.823 ( -13.990 0.000 -25.681) 29.245 16.585 ( 5.569 0.000 -1.032) 5.664 16.717 ( -7.716 0.000 -0.645) 7.743 ======================= Grid point 189 (66/120) ======================= q-point: ( 0.00 0.20 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( 0.000 3.214 7.689) 8.333 2.342 ( 0.000 -2.859 14.803) 15.076 2.790 ( 0.000 -1.767 18.415) 18.499 3.167 ( 0.000 22.103 -3.200) 22.333 3.202 ( 0.000 -12.722 31.945) 34.385 4.927 ( 0.000 10.176 16.770) 19.616 4.959 ( 0.000 -11.372 6.770) 13.235 5.345 ( 0.000 7.468 38.626) 39.342 5.683 ( 0.000 -8.114 2.045) 8.368 6.032 ( 0.000 0.406 16.194) 16.199 6.107 ( 0.000 4.807 5.942) 7.643 6.123 ( 0.000 -4.818 15.665) 16.389 6.211 ( 0.000 -6.747 7.601) 10.164 6.789 ( 0.000 -6.032 0.013) 6.033 6.892 ( 0.000 -8.205 4.310) 9.268 6.902 ( 0.000 -11.032 19.472) 22.381 6.929 ( 0.000 5.853 18.176) 19.095 7.218 ( 0.000 6.341 0.577) 6.368 7.325 ( 0.000 5.882 -6.759) 8.960 7.369 ( 0.000 8.971 0.651) 8.995 7.875 ( 0.000 -3.514 12.438) 12.925 8.210 ( 0.000 -6.502 -0.283) 6.509 8.276 ( 0.000 6.775 -7.148) 9.848 8.646 ( 0.000 -3.692 -4.137) 5.545 9.331 ( 0.000 0.644 -2.503) 2.585 9.341 ( 0.000 -0.091 8.192) 8.193 9.414 ( 0.000 1.442 4.322) 4.556 9.645 ( 0.000 14.241 -7.574) 16.130 9.789 ( 0.000 -5.010 -1.842) 5.338 10.404 ( 0.000 -6.356 -10.804) 12.535 10.457 ( 0.000 1.326 2.714) 3.021 10.609 ( 0.000 -2.709 15.216) 15.455 11.627 ( 0.000 2.118 -9.762) 9.990 11.743 ( 0.000 -5.372 4.960) 7.311 12.010 ( 0.000 0.423 17.332) 17.338 12.359 ( 0.000 13.844 -1.186) 13.894 12.789 ( 0.000 -4.314 -9.617) 10.540 13.886 ( 0.000 -14.713 -12.860) 19.541 15.148 ( 0.000 7.085 -18.617) 19.919 15.495 ( 0.000 -2.204 -21.390) 21.504 16.736 ( 0.000 6.532 -6.446) 9.177 17.109 ( 0.000 -2.689 -1.733) 3.199 ======================= Grid point 190 (67/120) ======================= q-point: ( 0.11 0.20 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 6.395 1.972 3.814) 7.703 2.359 ( 1.528 -3.224 13.009) 13.489 2.859 ( 6.671 -1.347 17.027) 18.337 3.166 ( 3.441 10.028 9.685) 14.360 3.294 ( 6.900 0.768 20.062) 21.229 4.846 ( -1.714 -3.799 14.639) 15.221 5.107 ( 7.029 -3.907 7.444) 10.958 5.302 ( -4.750 2.755 31.269) 31.748 5.658 ( -1.521 -2.012 4.602) 5.248 5.997 ( -0.749 2.598 6.883) 7.395 6.068 ( -0.864 3.470 17.942) 18.295 6.162 ( 2.193 -1.099 21.579) 21.718 6.359 ( 11.240 -6.764 6.222) 14.519 6.708 ( -6.067 -1.230 4.681) 7.761 6.853 ( -3.393 -0.376 16.726) 17.071 6.906 ( -4.014 -4.667 15.478) 16.657 6.962 ( 3.585 -7.125 10.084) 12.857 7.274 ( 9.902 4.806 -0.813) 11.036 7.347 ( 3.588 0.323 -6.486) 7.419 7.506 ( 9.053 10.246 -2.294) 13.863 7.802 ( -6.506 -3.573 6.968) 10.181 8.189 ( -2.697 0.526 -1.254) 3.021 8.249 ( -1.925 0.957 -4.607) 5.084 8.652 ( 0.552 -4.934 -4.828) 6.925 9.308 ( -0.073 1.456 7.184) 7.330 9.380 ( 1.763 1.218 0.125) 2.147 9.472 ( 3.971 -0.604 3.695) 5.457 9.612 ( -2.401 12.233 -3.868) 13.053 9.842 ( 5.199 -4.626 -0.984) 7.028 10.334 ( -6.699 -3.918 -3.503) 8.514 10.421 ( -1.602 0.821 0.405) 1.845 10.697 ( 6.530 -3.674 9.897) 12.413 11.470 ( -10.510 0.696 -4.173) 11.330 11.770 ( -3.040 -7.041 8.408) 11.380 12.041 ( 3.793 2.838 10.372) 11.403 12.332 ( -2.769 12.416 -0.446) 12.728 12.890 ( 10.031 -1.869 -11.328) 15.246 13.915 ( 3.047 -15.176 -14.338) 21.099 15.099 ( -5.003 7.500 -18.897) 20.938 15.450 ( -4.766 -2.150 -21.852) 22.469 16.691 ( -4.200 6.574 -5.535) 9.565 17.074 ( -3.594 -2.821 -1.567) 4.831 ======================= Grid point 191 (68/120) ======================= q-point: ( 0.22 0.20 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 5.362 0.724 -0.210) 5.415 2.390 ( 1.507 -3.762 9.029) 9.897 3.017 ( 9.797 1.476 10.620) 14.523 3.349 ( 14.260 1.183 17.305) 22.455 3.459 ( 11.011 8.409 13.557) 19.384 4.870 ( 3.146 -10.462 14.986) 18.545 5.101 ( -8.907 -11.616 6.305) 15.938 5.182 ( -6.283 -4.102 14.935) 16.714 5.683 ( 4.201 14.145 13.851) 20.238 6.053 ( 5.931 5.234 8.504) 11.614 6.070 ( 0.554 1.498 20.590) 20.652 6.197 ( 1.351 1.295 23.319) 23.394 6.532 ( 0.363 0.224 11.538) 11.546 6.592 ( -4.977 4.804 7.270) 10.035 6.751 ( -1.354 0.869 20.006) 20.071 6.868 ( 2.276 -10.332 16.621) 19.702 7.074 ( 6.828 -8.561 4.577) 11.869 7.391 ( -1.822 -0.122 -2.443) 3.051 7.508 ( 9.305 -3.539 -2.525) 10.271 7.678 ( 11.041 9.750 -3.055) 15.044 7.738 ( 3.909 0.936 -5.751) 7.017 8.090 ( -7.151 6.857 -5.946) 11.555 8.237 ( 0.748 -2.918 3.441) 4.573 8.669 ( 1.403 -8.440 -5.499) 10.171 9.312 ( -0.738 1.098 10.048) 10.135 9.378 ( -4.302 7.279 -8.738) 12.159 9.474 ( -0.955 -1.311 5.391) 5.630 9.622 ( 1.985 5.005 8.711) 10.241 9.974 ( 7.851 -4.518 1.041) 9.118 10.191 ( -7.139 -4.039 0.136) 8.203 10.418 ( 1.856 3.770 0.937) 4.305 10.818 ( 5.615 -4.590 6.544) 9.768 11.286 ( -8.042 -0.257 -1.200) 8.135 11.634 ( -9.825 -9.923 13.009) 19.085 12.110 ( 2.198 5.662 6.482) 8.883 12.258 ( -4.590 10.864 1.704) 11.916 13.151 ( 16.414 0.412 -15.053) 22.275 14.001 ( 5.696 -15.955 -17.662) 24.474 14.962 ( -8.947 8.757 -19.855) 23.472 15.310 ( -9.652 -1.731 -23.047) 25.046 16.604 ( -3.985 6.054 -3.605) 8.094 16.977 ( -6.190 -2.916 -1.170) 6.942 ======================= Grid point 192 (69/120) ======================= q-point: ( 0.33 0.20 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( 2.246 0.331 0.542) 2.334 2.412 ( 0.646 -2.968 4.524) 5.449 3.265 ( 16.110 2.465 8.350) 18.312 3.583 ( 9.695 -2.051 18.714) 21.176 3.756 ( 17.066 7.573 4.532) 19.212 4.733 ( -19.386 -19.216 1.029) 27.315 5.044 ( 4.363 -3.717 18.766) 19.622 5.095 ( 0.484 -3.616 15.523) 15.946 5.750 ( 1.247 14.856 11.445) 18.795 6.006 ( -8.509 0.864 19.591) 21.377 6.186 ( 5.810 3.399 17.459) 18.712 6.241 ( 3.902 4.794 17.219) 18.295 6.416 ( -6.153 1.556 16.055) 17.264 6.486 ( -5.957 4.336 15.900) 17.525 6.799 ( 4.453 -1.896 15.354) 16.099 7.034 ( 11.440 -7.234 11.611) 17.834 7.188 ( 1.467 -4.789 1.037) 5.114 7.297 ( -1.644 -4.045 -4.201) 6.059 7.591 ( 0.256 2.757 -4.506) 5.289 7.900 ( 7.304 2.783 -1.523) 7.963 7.941 ( -3.925 4.595 -9.731) 11.455 7.992 ( 18.921 4.377 -0.530) 19.428 8.268 ( 2.037 -1.873 5.788) 6.416 8.715 ( 3.524 -11.455 -5.017) 12.992 9.191 ( -12.649 3.973 -8.147) 15.561 9.244 ( -8.088 -0.557 7.957) 11.360 9.499 ( 2.471 2.132 8.779) 9.366 9.626 ( -1.261 6.897 8.983) 11.395 10.089 ( 0.338 -1.140 1.197) 1.687 10.115 ( 2.185 -5.287 8.305) 10.085 10.517 ( 8.845 2.741 2.623) 9.624 10.902 ( 2.882 -4.299 4.764) 7.034 11.165 ( -4.574 -2.520 0.877) 5.296 11.421 ( -11.764 -11.111 13.298) 20.945 12.118 ( -0.972 7.715 6.196) 9.943 12.169 ( -4.293 10.257 3.828) 11.759 13.498 ( 18.976 -0.074 -17.789) 26.010 14.115 ( 4.977 -16.243 -20.110) 26.325 14.777 ( -9.173 10.684 -21.866) 26.008 15.090 ( -12.729 -0.623 -24.596) 27.701 16.562 ( -0.067 4.225 -1.935) 4.647 16.845 ( -7.257 -2.369 -0.776) 7.673 ======================= Grid point 193 (70/120) ======================= q-point: ( 0.44 0.20 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( 1.454 -0.341 1.640) 2.218 2.410 ( -0.828 -1.375 2.325) 2.825 3.597 ( 15.582 2.458 9.641) 18.488 3.721 ( 2.920 2.659 13.637) 14.197 4.017 ( 10.940 -4.382 0.445) 11.794 4.319 ( -20.998 -13.746 -0.918) 25.114 5.125 ( 7.042 -0.322 25.351) 26.313 5.196 ( 2.988 -0.515 25.106) 25.288 5.726 ( -1.939 7.080 1.103) 7.423 5.796 ( -9.843 2.359 4.656) 11.141 6.260 ( 2.210 2.099 21.653) 21.866 6.288 ( -0.251 2.528 20.198) 20.357 6.360 ( 0.545 0.283 23.320) 23.328 6.397 ( -2.983 1.208 21.288) 21.530 6.931 ( 8.286 1.610 3.997) 9.340 7.083 ( -7.214 1.080 -1.464) 7.440 7.227 ( 8.149 -3.824 7.280) 11.577 7.345 ( -1.666 -5.671 -0.401) 5.924 7.601 ( 4.784 7.577 -1.167) 9.036 7.758 ( -9.220 5.767 -5.809) 12.329 8.139 ( 9.879 -5.217 -0.651) 11.191 8.251 ( -0.819 -4.684 3.694) 6.021 8.407 ( 19.726 3.358 0.506) 20.016 8.752 ( -7.694 -6.176 -0.506) 9.879 8.940 ( -4.613 -0.366 -3.864) 6.029 9.059 ( -9.955 -3.562 -1.134) 10.633 9.549 ( 2.544 5.743 9.456) 11.352 9.593 ( -1.988 7.568 9.103) 12.004 10.101 ( 1.859 -0.752 7.552) 7.813 10.136 ( -0.958 -0.547 7.689) 7.768 10.733 ( 11.953 -1.970 4.007) 12.760 10.903 ( -4.080 -2.947 3.321) 6.030 11.119 ( 0.495 -6.300 5.094) 8.117 11.209 ( -8.920 -9.703 11.227) 17.314 12.096 ( -0.709 8.938 5.587) 10.564 12.106 ( -1.978 9.805 4.971) 11.170 13.855 ( 17.245 -3.294 -18.788) 25.714 14.111 ( -7.432 -11.281 -19.349) 23.598 14.692 ( 2.466 7.921 -25.249) 26.577 14.846 ( -11.666 1.750 -25.896) 28.456 16.603 ( 4.077 1.601 -0.968) 4.486 16.709 ( -6.603 -0.815 -0.636) 6.684 ======================= Grid point 198 (71/120) ======================= q-point: ( 0.00 0.40 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( 0.000 4.217 10.079) 10.926 2.259 ( 0.000 -4.806 14.148) 14.942 2.788 ( 0.000 3.310 25.236) 25.453 2.940 ( 0.000 -11.200 29.384) 31.446 3.780 ( 0.000 35.221 0.043) 35.221 4.494 ( 0.000 -32.139 1.041) 32.156 5.167 ( 0.000 12.036 14.635) 18.948 5.363 ( 0.000 -5.876 18.722) 19.623 5.715 ( 0.000 8.520 15.583) 17.760 5.934 ( 0.000 -11.846 8.773) 14.741 6.048 ( 0.000 2.011 17.032) 17.150 6.108 ( 0.000 -3.644 19.409) 19.748 6.280 ( 0.000 13.067 13.627) 18.879 6.595 ( 0.000 -15.952 12.836) 20.475 6.743 ( 0.000 -0.889 8.278) 8.325 6.771 ( 0.000 -3.411 5.783) 6.714 7.079 ( 0.000 7.304 11.068) 13.261 7.198 ( 0.000 -4.091 4.043) 5.751 7.512 ( 0.000 5.082 2.020) 5.469 7.528 ( 0.000 6.415 0.242) 6.420 7.834 ( 0.000 2.727 1.685) 3.206 8.017 ( 0.000 -11.558 -4.222) 12.305 8.426 ( 0.000 7.187 -5.621) 9.124 8.554 ( 0.000 -5.335 -3.792) 6.545 9.345 ( 0.000 0.598 3.460) 3.512 9.351 ( 0.000 0.193 9.692) 9.694 9.491 ( 0.000 6.400 -0.762) 6.445 9.649 ( 0.000 -8.152 -1.122) 8.229 9.959 ( 0.000 15.236 -7.791) 17.113 10.229 ( 0.000 -10.950 -9.212) 14.310 10.494 ( 0.000 2.236 5.277) 5.731 10.547 ( 0.000 -2.945 9.694) 10.132 11.680 ( 0.000 2.332 -0.986) 2.532 11.701 ( 0.000 -0.262 7.543) 7.547 12.061 ( 0.000 6.014 7.837) 9.878 12.278 ( 0.000 -13.659 -1.945) 13.797 13.041 ( 0.000 22.573 -9.569) 24.517 13.505 ( 0.000 -21.653 -11.212) 24.384 15.301 ( 0.000 7.184 -19.856) 21.116 15.425 ( 0.000 -4.783 -20.846) 21.388 16.890 ( 0.000 7.646 -4.995) 9.133 17.026 ( 0.000 -5.487 -3.123) 6.313 ======================= Grid point 199 (72/120) ======================= q-point: ( 0.11 0.40 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 3.706 2.597 7.549) 8.801 2.275 ( 1.522 -4.248 11.799) 12.633 2.874 ( 8.519 3.719 23.327) 25.111 3.015 ( 7.688 -9.708 27.149) 29.840 3.802 ( 2.494 33.171 1.407) 33.294 4.475 ( -1.401 -29.991 2.513) 30.129 5.126 ( -4.433 5.810 12.013) 14.062 5.261 ( -8.942 -5.957 16.268) 19.496 5.809 ( 9.391 13.285 15.772) 22.659 6.048 ( 4.103 1.551 19.192) 19.687 6.085 ( 4.372 -6.008 14.929) 16.676 6.118 ( 6.192 -8.123 17.180) 19.987 6.283 ( 0.484 11.264 14.184) 18.119 6.571 ( -1.725 -14.260 12.139) 18.807 6.758 ( 0.840 1.021 10.328) 10.412 6.819 ( 4.189 -4.633 6.713) 9.169 7.064 ( -3.317 9.416 11.932) 15.558 7.228 ( 2.706 -6.112 5.450) 8.624 7.479 ( 1.373 7.988 -4.374) 9.210 7.612 ( 3.858 -3.541 -0.269) 5.243 7.812 ( 0.083 8.867 -1.841) 9.057 8.040 ( 2.479 -11.003 -2.541) 11.561 8.383 ( -4.300 7.795 -5.094) 10.257 8.531 ( -2.382 -6.645 -3.957) 8.092 9.346 ( 0.858 2.254 7.802) 8.167 9.391 ( 2.736 -1.601 7.605) 8.239 9.519 ( 2.433 6.408 -0.350) 6.863 9.680 ( 2.795 -7.925 -0.253) 8.408 9.921 ( -3.216 14.059 -6.495) 15.817 10.180 ( -4.892 -10.533 -8.560) 14.428 10.490 ( 0.739 4.931 6.832) 8.458 10.599 ( 4.214 -5.443 7.553) 10.219 11.525 ( -10.625 4.677 1.746) 11.739 11.642 ( -8.168 -6.193 7.205) 12.529 12.144 ( 6.675 7.556 5.215) 11.351 12.332 ( 3.526 -9.175 0.428) 9.838 13.097 ( 6.124 19.854 -11.517) 23.755 13.533 ( 3.087 -21.201 -12.684) 24.897 15.257 ( -4.508 7.274 -20.224) 21.960 15.381 ( -4.565 -4.722 -21.272) 22.263 16.847 ( -4.143 7.806 -4.356) 9.852 16.987 ( -3.877 -5.690 -2.761) 7.418 ======================= Grid point 200 (73/120) ======================= q-point: ( 0.22 0.40 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 4.030 0.018 3.255) 5.181 2.312 ( 2.224 -2.948 6.139) 7.164 3.087 ( 12.879 5.430 18.175) 22.928 3.225 ( 13.464 -7.658 21.973) 26.884 3.884 ( 5.970 26.918 3.970) 27.857 4.453 ( -1.593 -26.928 3.523) 27.204 5.012 ( -5.939 1.125 12.503) 13.888 5.084 ( -7.999 -5.063 14.527) 17.339 5.976 ( 3.370 11.791 18.042) 21.815 6.073 ( -0.438 -0.468 20.630) 20.640 6.147 ( 7.899 4.765 19.023) 21.141 6.298 ( 2.081 2.926 14.039) 14.491 6.403 ( 14.291 -4.321 19.214) 24.333 6.583 ( 5.793 -11.261 8.553) 15.282 6.734 ( -4.362 3.233 14.059) 15.071 6.818 ( -8.300 -1.681 13.775) 16.170 7.016 ( 3.202 7.425 3.011) 8.628 7.240 ( -2.518 -11.327 2.345) 11.838 7.574 ( 7.401 6.425 -5.529) 11.253 7.692 ( 6.921 -4.343 -5.742) 9.986 7.910 ( 9.297 11.378 -3.373) 15.076 8.117 ( 5.266 -7.924 -0.157) 9.516 8.267 ( -7.437 8.875 -3.661) 12.144 8.466 ( -3.956 -10.436 -3.615) 11.732 9.348 ( -1.991 2.602 7.972) 8.619 9.414 ( -2.665 -3.589 7.000) 8.306 9.559 ( 1.959 9.779 0.167) 9.975 9.729 ( 2.108 -2.400 4.698) 5.681 9.895 ( 1.865 3.811 -1.918) 4.657 10.068 ( -5.359 -8.274 -5.305) 11.195 10.534 ( 3.685 7.198 6.498) 10.374 10.689 ( 4.827 -7.480 6.200) 10.848 11.322 ( -10.015 3.890 2.249) 10.977 11.445 ( -11.335 -8.053 7.444) 15.771 12.249 ( 3.353 7.270 5.275) 9.588 12.360 ( -0.875 -1.765 3.266) 3.814 13.282 ( 12.739 13.308 -15.201) 23.884 13.631 ( 7.057 -19.053 -15.966) 25.840 15.133 ( -8.220 7.323 -21.364) 24.034 15.251 ( -8.775 -4.270 -22.471) 24.498 16.751 ( -5.186 7.526 -2.927) 9.597 16.889 ( -5.914 -5.722 -1.923) 8.451 ======================= Grid point 201 (74/120) ======================= q-point: ( 0.33 0.40 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 2.238 -0.379 1.609) 2.783 2.362 ( 2.540 -1.833 -1.860) 3.642 3.356 ( 15.011 6.476 13.966) 21.501 3.498 ( 14.041 -6.295 16.745) 22.742 3.993 ( 3.271 15.126 4.784) 16.199 4.341 ( -11.203 -18.567 3.139) 21.911 4.988 ( 4.022 -1.028 18.380) 18.843 5.013 ( 3.041 -3.294 16.962) 17.544 5.955 ( -3.969 5.117 13.734) 15.184 6.011 ( -6.511 -0.944 17.784) 18.962 6.292 ( 4.213 5.508 21.837) 22.911 6.346 ( 2.758 2.143 16.683) 17.044 6.467 ( -8.214 5.856 15.548) 18.533 6.556 ( -11.298 0.717 17.194) 20.586 6.771 ( 9.595 -0.030 9.615) 13.583 6.860 ( 17.483 -8.748 6.375) 20.562 7.116 ( 5.204 -0.426 2.304) 5.707 7.181 ( -2.209 -5.813 -1.675) 6.440 7.713 ( 5.886 7.982 -4.085) 10.726 7.859 ( 8.460 -5.302 -3.807) 10.685 8.078 ( -5.736 6.597 -0.922) 8.790 8.142 ( 6.257 6.713 -0.022) 9.177 8.220 ( 4.982 0.114 0.176) 4.986 8.440 ( 4.206 -14.279 -4.222) 15.472 9.228 ( -10.764 0.631 1.861) 10.942 9.242 ( -13.388 -0.419 2.074) 13.554 9.630 ( 4.850 10.042 7.654) 13.526 9.771 ( 1.740 3.328 11.631) 12.222 9.955 ( 3.107 -5.555 0.727) 6.406 10.028 ( 1.292 -5.614 1.694) 6.005 10.624 ( 5.580 7.048 5.522) 10.550 10.777 ( 4.177 -7.388 5.182) 9.944 11.146 ( -8.196 1.055 2.205) 8.553 11.225 ( -11.103 -7.019 6.990) 14.880 12.272 ( -0.465 6.104 5.686) 8.354 12.316 ( -2.934 2.672 4.521) 6.015 13.558 ( 14.885 7.083 -17.312) 23.905 13.789 ( 8.400 -14.733 -18.153) 24.843 14.957 ( -9.256 6.848 -23.345) 26.029 15.056 ( -10.849 -3.005 -24.251) 26.737 16.668 ( -2.995 5.623 -1.587) 6.566 16.774 ( -5.624 -4.515 -1.102) 7.296 ======================= Grid point 202 (75/120) ======================= q-point: ( 0.44 0.40 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 1.405 0.148 -2.165) 2.585 2.392 ( 0.402 -0.674 -3.790) 3.871 3.659 ( 15.585 4.072 11.845) 19.995 3.747 ( 10.745 -2.293 13.357) 17.295 3.957 ( -6.011 0.690 5.516) 8.188 4.063 ( -15.390 -9.365 5.155) 18.738 5.132 ( 9.390 1.161 24.977) 26.709 5.167 ( 7.355 -1.970 24.358) 25.521 5.832 ( -7.384 2.599 2.315) 8.163 5.840 ( -8.299 1.370 3.688) 9.185 6.298 ( -2.221 1.125 19.529) 19.687 6.311 ( -4.073 -0.192 19.962) 20.374 6.398 ( 1.491 2.771 21.454) 21.684 6.422 ( -2.002 0.573 19.586) 19.696 6.994 ( 9.693 4.951 2.438) 11.154 7.102 ( -0.206 -2.320 -0.374) 2.359 7.152 ( 6.785 -0.644 4.155) 7.982 7.220 ( 2.267 -5.567 1.744) 6.259 7.786 ( 3.064 10.005 1.991) 10.651 7.895 ( -7.604 5.704 4.647) 10.580 8.011 ( 5.216 -5.517 -5.007) 9.095 8.110 ( -4.917 -8.743 1.593) 10.156 8.489 ( 16.399 4.797 -0.607) 17.097 8.606 ( 8.599 -6.831 -0.927) 11.021 8.951 ( -13.150 1.230 -1.914) 13.346 8.990 ( -12.688 -2.720 -1.216) 13.033 9.720 ( 4.106 9.943 11.488) 15.738 9.776 ( -1.404 8.175 12.852) 15.296 10.018 ( 3.187 -6.657 4.984) 8.905 10.053 ( -0.018 -6.876 5.431) 8.762 10.749 ( 7.080 3.657 3.849) 8.849 10.836 ( 0.496 -3.726 3.367) 5.046 11.011 ( -4.623 -2.778 4.150) 6.805 11.044 ( -6.706 -5.505 6.249) 10.692 12.257 ( -0.467 5.281 5.168) 7.404 12.268 ( -1.701 4.437 4.814) 6.764 13.813 ( 10.284 0.473 -17.543) 20.341 13.902 ( 1.619 -8.102 -17.850) 19.669 14.822 ( -3.233 4.423 -25.790) 26.365 14.868 ( -7.427 -0.239 -26.059) 27.098 16.643 ( 0.454 2.152 -0.806) 2.342 16.683 ( -3.583 -1.670 -0.668) 4.010 ======================= Grid point 225 (76/120) ======================= q-point: ( 0.00 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.085 ( 0.000 0.000 -0.956) 0.956 2.653 ( 0.000 0.000 12.877) 12.877 2.840 ( 0.000 0.000 -4.400) 4.400 3.252 ( 0.000 0.000 25.164) 25.164 4.001 ( 0.000 0.000 29.992) 29.992 5.128 ( 0.000 0.000 11.822) 11.822 5.170 ( 0.000 0.000 3.817) 3.817 5.630 ( 0.000 0.000 -11.597) 11.597 6.057 ( 0.000 0.000 4.011) 4.011 6.105 ( 0.000 0.000 35.898) 35.898 6.160 ( 0.000 0.000 -12.044) 12.044 6.435 ( 0.000 0.000 16.991) 16.991 6.526 ( 0.000 0.000 15.095) 15.095 6.899 ( 0.000 0.000 -0.905) 0.905 7.045 ( 0.000 0.000 2.025) 2.025 7.104 ( 0.000 0.000 6.425) 6.425 7.127 ( 0.000 0.000 -5.082) 5.082 7.158 ( 0.000 0.000 -5.019) 5.019 7.293 ( 0.000 0.000 10.891) 10.891 7.420 ( 0.000 0.000 15.016) 15.016 8.079 ( 0.000 0.000 -3.210) 3.210 8.245 ( 0.000 0.000 14.966) 14.966 8.277 ( 0.000 0.000 -1.577) 1.577 8.575 ( 0.000 0.000 -5.510) 5.510 9.135 ( 0.000 0.000 -15.221) 15.221 9.297 ( 0.000 0.000 1.746) 1.746 9.545 ( 0.000 0.000 8.585) 8.585 9.689 ( 0.000 0.000 14.370) 14.370 9.779 ( 0.000 0.000 -3.462) 3.462 10.226 ( 0.000 0.000 -12.108) 12.108 10.434 ( 0.000 0.000 -2.414) 2.414 10.962 ( 0.000 0.000 12.509) 12.509 11.380 ( 0.000 0.000 -10.212) 10.212 11.824 ( 0.000 0.000 -2.207) 2.207 12.273 ( 0.000 0.000 13.845) 13.845 12.446 ( 0.000 0.000 22.937) 22.937 12.702 ( 0.000 0.000 -8.648) 8.648 13.779 ( 0.000 0.000 -12.202) 12.202 14.662 ( 0.000 0.000 -21.201) 21.201 15.067 ( 0.000 0.000 -22.082) 22.082 16.538 ( 0.000 0.000 -5.157) 5.157 17.105 ( 0.000 0.000 -1.713) 1.713 ======================= Grid point 226 (77/120) ======================= q-point: ( 0.11 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( 4.537 0.000 -1.310) 4.723 2.649 ( -0.535 0.000 11.516) 11.529 2.879 ( 4.217 0.000 -3.494) 5.477 3.319 ( 6.971 0.000 22.847) 23.887 4.000 ( -0.112 0.000 28.548) 28.548 5.161 ( 3.470 0.000 11.584) 12.093 5.236 ( 5.727 0.000 2.443) 6.227 5.549 ( -8.638 0.000 -11.056) 14.030 5.810 ( -12.515 0.000 3.709) 13.053 6.109 ( 1.670 0.000 17.537) 17.616 6.437 ( 0.629 0.000 16.118) 16.131 6.438 ( 14.490 0.000 7.298) 16.224 6.569 ( 3.805 0.000 16.763) 17.190 6.919 ( -8.435 0.000 4.298) 9.467 6.922 ( 3.641 0.000 2.850) 4.624 7.216 ( 7.754 0.000 1.405) 7.881 7.234 ( 6.411 0.000 -5.745) 8.608 7.237 ( 9.727 0.000 0.279) 9.731 7.333 ( 4.401 0.000 9.443) 10.418 7.406 ( -0.602 0.000 14.410) 14.422 7.968 ( -19.214 0.000 2.069) 19.326 8.019 ( -5.878 0.000 -3.357) 6.769 8.381 ( 3.295 0.000 8.003) 8.655 8.581 ( 0.717 0.000 -6.453) 6.493 9.100 ( -3.204 0.000 -14.590) 14.937 9.407 ( 8.554 0.000 5.536) 10.189 9.560 ( 1.353 0.000 7.949) 8.063 9.744 ( 5.237 0.000 13.531) 14.509 9.841 ( 5.966 0.000 -3.247) 6.793 10.196 ( -2.277 0.000 -11.445) 11.669 10.421 ( -1.300 0.000 -0.558) 1.415 10.971 ( 0.896 0.000 10.219) 10.258 11.318 ( -5.128 0.000 -7.528) 9.109 11.900 ( 6.506 0.000 -3.058) 7.189 12.260 ( -1.573 0.000 14.587) 14.672 12.397 ( -4.921 0.000 21.520) 22.076 12.736 ( 3.778 0.000 -9.828) 10.529 13.787 ( 0.970 0.000 -13.445) 13.480 14.602 ( -6.194 0.000 -21.388) 22.267 15.010 ( -5.902 0.000 -22.652) 23.409 16.517 ( -1.782 0.000 -3.885) 4.274 17.076 ( -2.960 0.000 -1.356) 3.256 ======================= Grid point 227 (78/120) ======================= q-point: ( 0.22 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 6.113 0.000 -1.249) 6.240 2.630 ( -1.446 0.000 8.390) 8.514 3.020 ( 10.945 0.000 -0.659) 10.964 3.516 ( 13.025 0.000 15.479) 20.230 3.997 ( -0.145 0.000 24.362) 24.363 5.256 ( 4.600 0.000 9.649) 10.690 5.293 ( -16.188 0.000 -7.911) 18.017 5.308 ( 0.043 0.000 0.260) 0.264 5.690 ( 0.902 0.000 5.558) 5.630 6.164 ( 4.398 0.000 11.771) 12.566 6.458 ( 0.599 0.000 15.978) 15.989 6.638 ( 6.318 0.000 12.214) 13.751 6.639 ( 1.317 0.000 18.942) 18.988 6.760 ( -6.202 0.000 7.386) 9.645 7.066 ( 10.062 0.000 5.617) 11.524 7.296 ( -1.315 0.000 9.991) 10.077 7.340 ( 3.761 0.000 -2.849) 4.719 7.361 ( 3.281 0.000 13.891) 14.273 7.508 ( 15.905 0.000 2.787) 16.148 7.580 ( -18.475 0.000 -5.985) 19.420 7.582 ( 17.614 0.000 0.525) 17.622 7.871 ( -9.096 0.000 -4.020) 9.945 8.426 ( 1.853 0.000 9.001) 9.190 8.611 ( 2.656 0.000 -8.472) 8.879 9.019 ( -4.986 0.000 -13.270) 14.176 9.522 ( 1.220 0.000 8.859) 8.943 9.590 ( 1.657 0.000 6.677) 6.880 9.806 ( -1.453 0.000 8.672) 8.793 9.980 ( 7.840 0.000 -1.858) 8.058 10.239 ( 9.617 0.000 -4.347) 10.554 10.386 ( -2.333 0.000 3.140) 3.912 10.990 ( 0.876 0.000 5.354) 5.426 11.227 ( -3.509 0.000 -4.138) 5.425 12.022 ( 5.259 0.000 -0.224) 5.264 12.180 ( -8.238 0.000 19.267) 20.954 12.289 ( -4.702 0.000 14.920) 15.643 12.865 ( 10.029 0.000 -13.884) 17.127 13.822 ( 2.793 0.000 -16.775) 17.006 14.428 ( -11.639 0.000 -21.861) 24.766 14.841 ( -11.519 0.000 -23.925) 26.553 16.490 ( -0.487 0.000 -1.123) 1.225 16.995 ( -5.411 0.000 -0.408) 5.426 ======================= Grid point 228 (79/120) ======================= q-point: ( 0.33 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( 5.337 0.000 0.157) 5.339 2.591 ( -2.663 0.000 5.357) 5.983 3.311 ( 19.075 0.000 2.132) 19.193 3.786 ( 13.850 0.000 6.099) 15.134 3.992 ( -0.580 0.000 18.143) 18.152 4.871 ( -24.711 0.000 -6.500) 25.551 5.308 ( 3.015 0.000 3.629) 4.718 5.404 ( 8.280 0.000 9.840) 12.860 5.741 ( 1.206 0.000 6.408) 6.520 6.301 ( 10.005 0.000 6.291) 11.818 6.318 ( -17.720 0.000 12.152) 21.486 6.610 ( 1.257 0.000 15.903) 15.953 6.723 ( 3.422 0.000 15.580) 15.952 6.770 ( 2.996 0.000 15.929) 16.208 7.182 ( -2.359 0.000 15.272) 15.453 7.218 ( -11.480 0.000 -0.710) 11.502 7.267 ( 3.375 0.000 -1.088) 3.546 7.461 ( 5.724 0.000 15.943) 16.939 7.473 ( 3.059 0.000 -4.963) 5.830 7.683 ( -9.937 0.000 -5.250) 11.239 7.873 ( 20.190 0.000 2.701) 20.370 7.964 ( 21.673 0.000 0.446) 21.678 8.449 ( -0.040 0.000 8.363) 8.363 8.689 ( 5.431 0.000 -9.473) 10.919 8.915 ( -5.793 0.000 -10.371) 11.879 9.384 ( -14.977 0.000 1.842) 15.089 9.621 ( 1.595 0.000 6.181) 6.384 9.760 ( -1.765 0.000 11.018) 11.159 10.118 ( 6.089 0.000 1.367) 6.240 10.335 ( -2.860 0.000 5.661) 6.342 10.519 ( 16.725 0.000 0.958) 16.752 10.994 ( -0.772 0.000 1.060) 1.311 11.209 ( 2.318 0.000 -0.035) 2.318 11.949 ( -14.795 0.000 18.583) 23.753 12.090 ( 1.988 0.000 5.556) 5.901 12.217 ( -3.390 0.000 12.567) 13.016 13.125 ( 16.604 0.000 -18.597) 24.931 13.903 ( 5.860 0.000 -20.996) 21.798 14.163 ( -15.543 0.000 -22.176) 27.080 14.581 ( -14.933 0.000 -25.207) 29.298 16.513 ( 3.013 0.000 1.176) 3.235 16.874 ( -6.974 0.000 0.798) 7.019 ======================= Grid point 229 (80/120) ======================= q-point: ( 0.44 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.447 ( 4.588 0.000 1.884) 4.960 2.528 ( -3.808 0.000 3.364) 5.081 3.716 ( 20.572 0.000 5.656) 21.335 3.955 ( -4.524 0.000 11.970) 12.796 4.024 ( 11.968 0.000 -1.038) 12.013 4.379 ( -24.727 0.000 -4.919) 25.211 5.487 ( 15.602 0.000 8.795) 17.910 5.564 ( 7.802 0.000 9.560) 12.340 5.702 ( -4.575 0.000 5.447) 7.114 5.894 ( -23.338 0.000 7.576) 24.536 6.511 ( 10.040 0.000 6.917) 12.192 6.629 ( -1.583 0.000 13.930) 14.019 6.780 ( 2.345 0.000 17.005) 17.166 6.804 ( 0.177 0.000 17.100) 17.101 7.075 ( -2.963 0.000 2.941) 4.175 7.096 ( -4.117 0.000 12.128) 12.807 7.355 ( 5.077 0.000 -2.179) 5.525 7.472 ( -6.115 0.000 0.674) 6.152 7.543 ( 2.318 0.000 9.713) 9.986 7.556 ( -0.424 0.000 -2.114) 2.156 8.206 ( 13.725 0.000 2.273) 13.912 8.396 ( -6.048 0.000 5.148) 7.943 8.417 ( 23.843 0.000 3.039) 24.036 8.775 ( -10.881 0.000 -2.912) 11.263 8.815 ( 7.710 0.000 -8.952) 11.814 9.041 ( -17.423 0.000 -4.104) 17.900 9.659 ( 2.550 0.000 7.577) 7.994 9.716 ( -2.987 0.000 10.400) 10.820 10.212 ( 3.890 0.000 3.979) 5.564 10.278 ( -3.071 0.000 5.786) 6.550 10.802 ( 11.308 0.000 -0.567) 11.322 10.948 ( -4.441 0.000 -1.313) 4.631 11.344 ( 11.991 0.000 7.794) 14.302 11.637 ( -16.895 0.000 14.606) 22.334 12.117 ( 1.421 0.000 9.777) 9.880 12.156 ( -2.698 0.000 11.824) 12.128 13.477 ( 19.146 0.000 -20.949) 28.379 13.839 ( -18.025 0.000 -21.847) 28.323 14.055 ( 10.136 0.000 -24.481) 26.496 14.293 ( -14.225 0.000 -25.833) 29.490 16.602 ( 6.024 0.000 2.100) 6.379 16.734 ( -7.312 0.000 1.807) 7.532 ======================= Grid point 234 (81/120) ======================= q-point: ( 0.00 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( 0.000 7.600 2.193) 7.910 2.624 ( 0.000 -2.973 12.704) 13.047 3.049 ( 0.000 16.247 1.193) 16.291 3.327 ( 0.000 10.477 21.785) 24.174 3.844 ( 0.000 -13.575 30.010) 32.937 5.012 ( 0.000 -16.885 -0.013) 16.885 5.189 ( 0.000 5.913 9.305) 11.025 5.574 ( 0.000 -2.096 -2.935) 3.606 5.984 ( 0.000 -6.840 2.896) 7.427 6.098 ( 0.000 -5.734 -9.528) 11.120 6.266 ( 0.000 11.300 28.186) 30.367 6.475 ( 0.000 4.705 18.348) 18.942 6.516 ( 0.000 -1.113 15.214) 15.255 6.800 ( 0.000 -4.861 2.087) 5.291 6.980 ( 0.000 -6.114 3.555) 7.073 7.153 ( 0.000 -0.832 -1.317) 1.558 7.160 ( 0.000 2.169 3.568) 4.175 7.209 ( 0.000 8.461 0.814) 8.500 7.339 ( 0.000 -3.223 10.085) 10.587 7.437 ( 0.000 9.460 6.260) 11.343 8.149 ( 0.000 -2.086 5.607) 5.982 8.165 ( 0.000 -10.101 -3.300) 10.626 8.181 ( 0.000 1.480 5.090) 5.301 8.547 ( 0.000 -2.828 -5.015) 5.757 9.253 ( 0.000 9.980 -10.633) 14.583 9.346 ( 0.000 4.411 3.272) 5.491 9.590 ( 0.000 3.371 6.306) 7.150 9.677 ( 0.000 0.172 11.156) 11.157 9.748 ( 0.000 -3.345 -2.184) 3.995 10.161 ( 0.000 -5.746 -12.144) 13.435 10.466 ( 0.000 3.058 -1.437) 3.379 10.858 ( 0.000 -8.337 8.785) 12.111 11.426 ( 0.000 4.912 -9.262) 10.484 11.881 ( 0.000 3.646 7.304) 8.164 12.417 ( 0.000 8.143 7.555) 11.108 12.421 ( 0.000 -2.415 22.131) 22.263 12.589 ( 0.000 -4.801 -9.599) 10.733 13.630 ( 0.000 -13.379 -11.693) 17.768 14.738 ( 0.000 6.341 -21.247) 22.173 15.047 ( 0.000 -1.980 -22.040) 22.129 16.618 ( 0.000 7.235 -4.941) 8.761 17.069 ( 0.000 -3.566 -2.087) 4.131 ======================= Grid point 235 (82/120) ======================= q-point: ( 0.11 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 3.040 6.193 1.306) 7.022 2.608 ( -1.582 -3.716 11.221) 11.925 3.068 ( 2.434 15.248 2.364) 15.621 3.406 ( 7.864 10.466 19.481) 23.471 3.864 ( 1.914 -11.755 28.203) 30.615 4.999 ( -0.559 -17.462 1.181) 17.511 5.227 ( 1.584 0.546 6.014) 6.243 5.510 ( -7.380 -2.039 -1.510) 7.804 5.824 ( -3.751 1.696 0.685) 4.173 6.218 ( 2.312 5.277 6.098) 8.389 6.412 ( 10.291 -0.330 15.918) 18.958 6.472 ( 4.650 2.081 15.711) 16.516 6.574 ( 4.177 1.143 18.006) 18.520 6.805 ( 0.469 -4.150 4.712) 6.296 7.002 ( 0.798 -0.785 3.501) 3.675 7.158 ( -1.365 0.651 5.302) 5.513 7.215 ( 4.351 -1.968 2.836) 5.554 7.268 ( 8.178 3.461 1.824) 9.066 7.322 ( 1.642 -4.757 7.878) 9.348 7.489 ( 4.309 9.693 1.618) 10.730 7.905 ( -17.580 -5.958 2.042) 18.675 8.120 ( -4.088 7.817 -2.763) 9.244 8.264 ( 2.991 -9.696 3.348) 10.684 8.561 ( 0.845 -2.637 -2.744) 3.898 9.230 ( -2.550 11.110 -11.222) 15.996 9.427 ( 6.505 2.262 6.016) 9.145 9.593 ( 0.471 2.217 6.629) 7.006 9.731 ( 5.193 -0.283 10.988) 12.157 9.815 ( 6.556 -2.912 -1.641) 7.359 10.124 ( -3.328 -6.156 -11.516) 13.476 10.465 ( 0.077 3.995 0.008) 3.996 10.876 ( 1.761 -7.748 7.030) 10.610 11.362 ( -5.684 4.466 -6.231) 9.543 11.913 ( 1.539 -0.592 6.309) 6.521 12.354 ( -3.904 -3.364 16.224) 17.023 12.410 ( -1.490 10.938 9.229) 14.389 12.674 ( 7.288 -2.566 -7.977) 11.105 13.632 ( 0.345 -13.739 -12.870) 18.828 14.684 ( -5.611 6.652 -21.499) 23.194 14.991 ( -5.782 -1.888 -22.585) 23.390 16.596 ( -2.062 7.049 -3.787) 8.264 17.040 ( -2.932 -3.555 -1.660) 4.898 ======================= Grid point 236 (83/120) ======================= q-point: ( 0.22 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.272 ( 3.892 2.739 -0.216) 4.764 2.567 ( -2.575 -5.211 7.861) 9.776 3.168 ( 8.637 12.732 4.386) 15.998 3.612 ( 12.914 9.774 13.415) 21.030 3.912 ( 2.888 -7.543 23.703) 25.041 4.961 ( -6.591 -21.130 -2.698) 22.298 5.216 ( -0.222 -2.676 6.500) 7.033 5.346 ( -6.646 -2.674 2.620) 7.628 5.884 ( 6.582 13.747 1.584) 15.324 6.244 ( 1.658 5.750 8.802) 10.644 6.469 ( 1.020 1.170 16.461) 16.534 6.618 ( 2.047 -0.388 15.027) 15.171 6.707 ( 8.205 4.268 15.072) 17.683 6.781 ( -4.171 1.567 8.158) 9.295 7.032 ( 6.551 -1.250 5.778) 8.824 7.170 ( -0.289 -7.767 10.519) 13.080 7.238 ( 1.205 -9.451 11.132) 14.653 7.384 ( 2.608 1.367 2.677) 3.980 7.500 ( -1.126 -4.012 0.551) 4.203 7.585 ( 5.379 1.800 -6.916) 8.945 7.643 ( 9.116 7.093 -1.062) 11.599 8.017 ( -6.326 11.079 -0.639) 12.774 8.325 ( 3.866 -9.131 2.261) 10.170 8.570 ( 0.219 -4.006 -2.164) 4.558 9.150 ( -5.774 11.162 -10.946) 16.666 9.505 ( -0.718 -0.726 7.320) 7.391 9.619 ( 2.341 1.682 7.581) 8.111 9.809 ( 0.593 1.003 7.665) 7.753 9.971 ( 8.438 -1.231 -1.282) 8.623 10.113 ( 5.176 -9.538 -3.061) 11.275 10.479 ( 1.768 6.682 2.071) 7.216 10.917 ( 2.300 -6.290 3.619) 7.612 11.245 ( -5.698 2.310 -2.885) 6.792 11.871 ( -6.460 -11.508 9.866) 16.477 12.313 ( -0.564 4.659 12.709) 13.548 12.367 ( -2.790 10.535 9.443) 14.420 12.855 ( 11.731 0.358 -12.745) 17.325 13.651 ( 1.870 -14.277 -16.004) 21.528 14.529 ( -10.199 7.597 -22.214) 25.597 14.827 ( -11.148 -1.472 -23.853) 26.370 16.558 ( -1.356 6.140 -1.218) 6.404 16.961 ( -5.165 -3.327 -0.559) 6.169 ======================= Grid point 237 (84/120) ======================= q-point: ( 0.33 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( 3.185 -0.995 -0.725) 3.415 2.513 ( -2.928 -6.262 4.384) 8.185 3.410 ( 16.330 8.825 5.449) 19.345 3.864 ( 11.832 7.443 6.217) 15.299 3.968 ( 2.838 -2.712 18.035) 18.458 4.692 ( -19.250 -14.276 -3.009) 24.154 5.279 ( 5.224 -2.514 4.316) 7.228 5.335 ( 6.993 -4.732 9.627) 12.805 5.926 ( -3.991 13.172 3.392) 14.175 6.302 ( -7.663 -0.509 7.605) 10.808 6.390 ( 0.191 6.830 10.438) 12.476 6.616 ( 0.595 1.176 14.802) 14.861 6.728 ( 0.644 -0.175 14.247) 14.262 6.817 ( 2.648 4.497 15.983) 16.813 7.125 ( -2.550 -5.867 14.066) 15.452 7.203 ( -8.625 -1.425 0.350) 8.749 7.212 ( 7.871 -3.627 -0.436) 8.678 7.303 ( 3.276 -10.266 9.507) 14.370 7.531 ( 4.438 4.873 -1.750) 6.819 7.808 ( 2.639 4.261 -1.851) 5.343 7.924 ( 7.251 7.311 3.486) 10.871 7.993 ( 20.303 3.275 0.433) 20.570 8.400 ( 2.351 -4.849 5.646) 7.804 8.588 ( 2.921 -8.452 -6.155) 10.856 9.015 ( -8.121 8.005 -8.657) 14.317 9.347 ( -14.950 -2.994 1.837) 15.357 9.670 ( 2.825 4.063 6.947) 8.530 9.801 ( -0.275 4.562 8.839) 9.951 10.117 ( 6.654 -0.267 1.782) 6.893 10.255 ( 5.452 -8.272 5.230) 11.202 10.570 ( 8.859 5.168 2.081) 10.465 10.952 ( 0.755 -4.198 0.790) 4.338 11.167 ( -1.601 -2.387 -0.110) 2.876 11.686 ( -12.004 -16.333 12.721) 23.931 12.299 ( -1.398 9.766 10.678) 14.538 12.310 ( -2.845 8.887 10.885) 14.338 13.128 ( 16.259 0.806 -17.775) 24.103 13.703 ( 3.036 -14.028 -19.458) 24.179 14.311 ( -11.442 9.087 -23.309) 27.510 14.577 ( -14.226 -0.556 -25.229) 28.969 16.558 ( 1.630 4.169 1.044) 4.597 16.848 ( -6.309 -2.487 0.778) 6.826 ======================= Grid point 238 (85/120) ======================= q-point: ( 0.44 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.399 ( 2.932 -3.996 -0.007) 4.956 2.456 ( -3.014 -5.888 1.666) 6.821 3.771 ( 19.561 4.491 6.577) 21.120 3.987 ( -0.926 3.317 10.702) 11.242 4.046 ( 6.200 1.188 4.129) 7.543 4.290 ( -20.586 -7.235 -1.456) 21.868 5.484 ( 16.587 -0.259 8.745) 18.753 5.531 ( 11.635 -2.289 8.795) 14.764 5.770 ( -10.581 4.936 3.191) 12.104 5.906 ( -23.529 0.844 6.993) 24.560 6.554 ( 8.080 3.976 7.698) 11.847 6.631 ( -0.356 0.423 13.603) 13.614 6.753 ( 2.015 -2.329 15.759) 16.057 6.813 ( -2.926 0.916 15.974) 16.265 7.087 ( -1.012 1.092 6.894) 7.053 7.101 ( -1.996 0.141 7.615) 7.873 7.326 ( 4.037 -2.598 -0.063) 4.801 7.361 ( 1.158 -6.407 3.259) 7.281 7.612 ( 4.027 6.444 1.391) 7.725 7.706 ( -6.232 10.169 2.297) 12.146 8.174 ( 12.578 -3.274 3.872) 13.562 8.358 ( -5.671 -3.934 6.320) 9.358 8.434 ( 22.243 1.648 1.950) 22.389 8.702 ( 5.270 -6.434 -5.021) 9.715 8.840 ( -8.412 2.357 -5.430) 10.286 9.005 ( -17.830 -2.933 -3.395) 18.386 9.728 ( 3.096 6.444 7.571) 10.413 9.781 ( -2.078 6.598 9.336) 11.620 10.224 ( 4.409 0.382 4.413) 6.250 10.284 ( -1.482 -1.061 5.661) 5.947 10.779 ( 10.370 -1.376 0.546) 10.475 10.921 ( -4.317 -2.397 -0.982) 5.035 11.221 ( 7.621 -9.245 5.921) 13.364 11.435 ( -13.234 -14.786 11.477) 22.924 12.267 ( -1.071 9.887 10.656) 14.576 12.270 ( -1.314 8.922 11.519) 14.629 13.453 ( 16.482 -1.799 -19.962) 25.949 13.698 ( -6.517 -9.586 -20.473) 23.527 14.170 ( -0.059 7.179 -25.319) 26.317 14.311 ( -12.262 1.386 -26.129) 28.897 16.620 ( 4.576 1.594 2.049) 5.261 16.726 ( -6.176 -0.803 1.820) 6.489 ======================= Grid point 243 (86/120) ======================= q-point: ( 0.00 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.355 ( 0.000 9.549 8.208) 12.592 2.526 ( 0.000 -6.773 11.744) 13.557 3.291 ( 0.000 9.910 22.630) 24.704 3.539 ( 0.000 -14.541 28.322) 31.836 3.816 ( 0.000 33.151 3.743) 33.362 4.501 ( 0.000 -31.474 -0.373) 31.477 5.354 ( 0.000 9.707 4.946) 10.895 5.531 ( 0.000 -5.314 2.487) 5.867 5.866 ( 0.000 -1.095 -1.272) 1.678 5.954 ( 0.000 -7.376 -4.934) 8.874 6.418 ( 0.000 4.049 18.693) 19.126 6.479 ( 0.000 -2.382 16.296) 16.469 6.638 ( 0.000 8.178 16.340) 18.272 6.732 ( 0.000 -2.516 4.954) 5.556 6.931 ( 0.000 2.165 11.067) 11.277 7.055 ( 0.000 -7.892 15.072) 17.013 7.201 ( 0.000 1.495 0.641) 1.627 7.219 ( 0.000 -0.663 -0.456) 0.805 7.521 ( 0.000 12.923 -1.404) 12.999 7.620 ( 0.000 6.762 7.406) 10.029 7.927 ( 0.000 -10.382 -4.178) 11.191 7.961 ( 0.000 -10.224 9.081) 13.675 8.324 ( 0.000 7.470 -3.760) 8.362 8.460 ( 0.000 -5.622 -4.532) 7.222 9.455 ( 0.000 5.835 6.359) 8.631 9.461 ( 0.000 9.441 -2.081) 9.668 9.565 ( 0.000 -4.436 9.588) 10.564 9.635 ( 0.000 -7.466 -0.196) 7.469 9.812 ( 0.000 10.643 -5.034) 11.773 10.015 ( 0.000 -8.572 -10.839) 13.819 10.554 ( 0.000 5.468 1.001) 5.559 10.687 ( 0.000 -7.661 4.356) 8.813 11.596 ( 0.000 11.868 -5.563) 13.107 11.851 ( 0.000 -9.298 4.707) 10.422 12.324 ( 0.000 -3.171 7.553) 8.191 12.355 ( 0.000 -3.638 18.767) 19.116 12.866 ( 0.000 20.605 -6.669) 21.657 13.285 ( 0.000 -19.543 -9.884) 21.900 14.875 ( 0.000 6.370 -21.549) 22.471 14.984 ( 0.000 -4.247 -21.869) 22.278 16.794 ( 0.000 9.072 -4.185) 9.991 16.961 ( 0.000 -6.964 -3.057) 7.605 ======================= Grid point 244 (87/120) ======================= q-point: ( 0.11 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( -0.269 7.950 6.663) 10.376 2.503 ( -2.218 -6.492 10.177) 12.274 3.332 ( 4.052 10.938 20.289) 23.403 3.571 ( 3.652 -12.094 26.253) 29.134 3.863 ( 4.598 28.821 4.911) 29.596 4.497 ( -0.348 -29.981 -0.085) 29.983 5.287 ( -5.475 5.231 4.419) 8.767 5.419 ( -9.422 -6.741 2.265) 11.804 5.936 ( 9.585 9.026 -1.097) 13.212 6.141 ( 12.091 -9.663 -4.034) 15.995 6.455 ( 3.277 2.375 18.280) 18.723 6.490 ( 1.922 -0.932 17.211) 17.343 6.675 ( 3.721 7.258 18.984) 20.662 6.758 ( 2.623 -1.484 6.846) 7.480 6.966 ( 3.327 0.195 8.809) 9.419 7.059 ( -0.048 -7.780 15.893) 17.695 7.248 ( 2.128 2.832 3.847) 5.229 7.282 ( 6.079 -0.827 -0.298) 6.143 7.423 ( -5.359 11.049 -0.851) 12.310 7.625 ( -3.779 -3.125 1.395) 5.098 7.803 ( -5.387 3.292 0.177) 6.316 8.012 ( 2.751 -12.599 -0.076) 12.896 8.308 ( -1.801 8.605 -1.840) 8.982 8.466 ( 0.046 -6.518 -1.479) 6.684 9.452 ( -0.196 8.191 -0.724) 8.225 9.518 ( 3.318 6.935 3.398) 8.405 9.575 ( 1.387 -3.361 8.032) 8.816 9.698 ( 6.021 -7.764 2.235) 10.076 9.817 ( 1.380 7.684 -2.326) 8.146 9.982 ( -2.826 -7.555 -9.886) 12.759 10.571 ( 1.814 6.147 1.580) 6.601 10.712 ( 2.430 -7.689 3.669) 8.860 11.516 ( -7.318 11.007 -2.563) 13.464 11.779 ( -7.289 -12.428 5.062) 15.271 12.342 ( 3.544 3.145 12.107) 13.001 12.439 ( 5.198 -5.060 11.745) 13.805 12.882 ( 2.160 19.096 -8.643) 21.072 13.286 ( 0.326 -19.282 -11.076) 22.239 14.823 ( -5.309 6.372 -21.928) 23.444 14.931 ( -5.501 -4.124 -22.349) 23.383 16.767 ( -2.529 8.930 -3.295) 9.849 16.933 ( -2.817 -6.911 -2.438) 7.851 ======================= Grid point 245 (88/120) ======================= q-point: ( 0.22 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( -0.675 4.309 3.043) 5.318 2.449 ( -3.187 -5.885 6.322) 9.206 3.444 ( 7.622 12.859 15.717) 21.691 3.683 ( 7.635 -10.273 21.846) 25.320 3.978 ( 6.791 21.704 5.455) 23.387 4.482 ( -1.885 -25.333 0.045) 25.403 5.195 ( -2.743 1.117 5.582) 6.319 5.259 ( -5.618 -4.645 4.318) 8.473 6.147 ( 9.320 11.054 -0.761) 14.478 6.294 ( 2.945 -2.395 1.854) 4.225 6.505 ( 2.543 2.743 16.726) 17.140 6.585 ( 5.724 -3.902 13.468) 15.145 6.788 ( 7.751 4.408 20.136) 22.022 6.824 ( 3.542 2.376 10.829) 11.638 7.014 ( -2.361 -3.972 11.396) 12.297 7.051 ( -0.775 -7.396 7.889) 10.841 7.129 ( -5.568 7.557 8.090) 12.392 7.307 ( -9.120 -8.086 3.633) 12.718 7.504 ( 8.343 3.361 -1.003) 9.050 7.570 ( 8.851 -2.428 -5.202) 10.549 7.843 ( 7.921 11.448 -3.584) 14.375 8.092 ( 6.169 -12.447 -3.330) 14.286 8.250 ( -4.258 10.763 2.051) 11.755 8.446 ( -2.249 -8.099 2.457) 8.757 9.384 ( -7.733 9.522 -4.828) 13.182 9.493 ( -6.163 -1.695 3.069) 7.090 9.661 ( 6.339 4.627 7.685) 10.984 9.843 ( 7.547 -10.614 0.644) 13.040 9.876 ( 4.777 4.527 4.467) 7.955 9.971 ( 3.597 -3.912 -2.594) 5.914 10.623 ( 3.509 7.257 2.228) 8.363 10.772 ( 3.543 -7.408 2.397) 8.554 11.350 ( -9.304 8.619 0.352) 12.688 11.594 ( -11.198 -14.332 6.674) 19.374 12.420 ( 3.310 5.633 11.376) 13.119 12.498 ( 0.363 -0.148 10.610) 10.617 12.981 ( 8.566 13.216 -13.564) 20.785 13.315 ( 3.223 -17.643 -14.410) 23.007 14.676 ( -9.731 6.266 -22.955) 25.708 14.776 ( -10.336 -3.610 -23.555) 25.975 16.710 ( -3.034 8.042 -1.214) 8.681 16.861 ( -4.392 -6.385 -0.916) 7.804 ======================= Grid point 246 (89/120) ======================= q-point: ( 0.33 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -0.523 0.724 -0.595) 1.073 2.389 ( -2.792 -5.019 1.938) 6.061 3.629 ( 11.472 11.613 11.884) 20.191 3.844 ( 8.561 -8.674 16.402) 20.434 4.090 ( 3.656 13.253 4.953) 14.613 4.384 ( -8.782 -15.141 1.414) 17.561 5.235 ( 7.358 -1.062 6.117) 9.627 5.253 ( 6.320 -2.813 8.054) 10.617 6.146 ( -9.654 7.710 3.456) 12.829 6.259 ( -10.346 -3.772 5.808) 12.450 6.578 ( 5.387 9.491 10.252) 14.973 6.656 ( 2.105 1.288 13.637) 13.858 6.733 ( -7.162 2.715 11.011) 13.413 6.885 ( -5.766 -4.029 13.343) 15.083 6.984 ( 8.074 -1.326 10.100) 12.998 7.092 ( 4.584 -7.995 11.222) 14.522 7.175 ( 0.381 -0.722 1.550) 1.751 7.183 ( 4.495 -1.238 5.121) 6.925 7.659 ( 6.949 7.124 -0.989) 10.001 7.786 ( 10.442 -4.503 -1.807) 11.514 8.098 ( 17.552 6.965 -2.480) 19.046 8.149 ( -5.484 12.007 5.734) 14.392 8.259 ( 9.733 -8.294 -1.326) 12.856 8.385 ( -2.455 -10.978 2.340) 11.490 9.175 ( -13.240 6.699 -4.424) 15.484 9.278 ( -15.297 -3.821 -0.070) 15.767 9.792 ( 6.961 8.628 6.858) 13.035 9.934 ( 3.671 5.723 2.641) 7.294 10.037 ( 8.912 -10.136 8.700) 16.058 10.083 ( 6.324 -3.885 3.722) 8.303 10.701 ( 4.447 6.863 2.059) 8.433 10.837 ( 2.905 -6.479 1.175) 7.197 11.179 ( -7.940 4.553 1.502) 9.275 11.368 ( -11.794 -13.559 7.244) 19.376 12.445 ( -0.638 5.178 11.353) 12.494 12.469 ( -2.501 3.620 10.411) 11.303 13.198 ( 13.040 7.033 -17.282) 22.763 13.415 ( 6.656 -13.389 -17.791) 23.240 14.465 ( -11.399 5.811 -24.417) 27.566 14.548 ( -12.690 -2.498 -25.056) 28.197 16.664 ( -1.419 5.730 0.834) 5.962 16.774 ( -4.368 -4.709 0.756) 6.467 ======================= Grid point 247 (90/120) ======================= q-point: ( 0.44 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( 0.366 -1.885 -2.381) 3.059 2.347 ( -1.601 -3.727 -1.400) 4.291 3.874 ( 13.499 5.719 8.404) 16.898 3.999 ( 7.028 -5.333 9.970) 13.313 4.087 ( -4.301 4.589 7.947) 10.135 4.168 ( -11.961 -3.824 5.566) 13.735 5.480 ( 17.905 0.021 8.278) 19.726 5.492 ( 16.482 -1.300 7.918) 18.331 5.858 ( -17.996 3.414 1.955) 18.421 5.906 ( -22.211 -1.192 4.285) 22.652 6.626 ( 0.521 1.726 12.826) 12.952 6.649 ( -2.234 0.038 13.259) 13.446 6.742 ( 5.607 3.617 12.517) 14.185 6.820 ( -2.550 -1.402 15.555) 15.825 7.082 ( 2.313 -0.479 3.991) 4.638 7.104 ( -0.705 -1.283 2.091) 2.552 7.260 ( 4.592 -1.429 5.307) 7.162 7.280 ( 2.897 -2.202 4.495) 5.783 7.784 ( 6.493 9.429 -0.383) 11.455 7.891 ( -2.150 3.962 -1.544) 4.765 8.098 ( 3.786 -0.625 9.417) 10.169 8.228 ( -7.146 -8.515 8.377) 13.919 8.483 ( 20.038 3.118 -0.225) 20.280 8.569 ( 14.711 -5.607 -3.075) 16.041 8.892 ( -15.405 2.552 -3.719) 16.052 8.945 ( -17.890 -2.728 -2.807) 18.314 9.913 ( 5.095 11.317 6.795) 14.150 9.970 ( -0.456 10.483 6.170) 12.173 10.168 ( 3.926 -9.485 8.948) 13.618 10.177 ( 2.755 -6.404 6.429) 9.484 10.794 ( 5.097 3.021 0.814) 5.981 10.865 ( -0.991 -3.083 -0.215) 3.245 11.079 ( -0.953 -2.491 3.738) 4.592 11.163 ( -8.630 -10.084 6.319) 14.700 12.421 ( -0.926 4.726 10.977) 11.987 12.427 ( -1.478 4.360 10.673) 11.624 13.437 ( 10.203 1.116 -18.648) 21.286 13.521 ( 2.168 -6.982 -18.825) 20.195 14.287 ( -5.076 3.920 -26.160) 26.935 14.328 ( -8.622 -0.234 -26.419) 27.791 16.660 ( 0.991 2.162 1.946) 3.074 16.700 ( -3.093 -1.674 1.863) 3.980 ======================= Grid point 270 (91/120) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( 0.000 0.000 -0.567) 0.567 2.777 ( 0.000 0.000 -1.937) 1.937 2.873 ( 0.000 0.000 8.057) 8.057 3.717 ( 0.000 0.000 18.557) 18.557 4.543 ( 0.000 0.000 22.041) 22.041 5.226 ( 0.000 0.000 1.759) 1.759 5.301 ( 0.000 0.000 5.353) 5.353 5.404 ( 0.000 0.000 -10.228) 10.228 5.886 ( 0.000 0.000 -12.695) 12.695 6.082 ( 0.000 0.000 0.623) 0.623 6.706 ( 0.000 0.000 9.382) 9.382 6.766 ( 0.000 0.000 26.552) 26.552 6.773 ( 0.000 0.000 8.802) 8.802 6.912 ( 0.000 0.000 1.631) 1.631 6.994 ( 0.000 0.000 -6.995) 6.995 7.075 ( 0.000 0.000 0.837) 0.837 7.078 ( 0.000 0.000 -3.070) 3.070 7.196 ( 0.000 0.000 2.769) 2.769 7.407 ( 0.000 0.000 -0.536) 0.536 7.633 ( 0.000 0.000 6.228) 6.228 8.063 ( 0.000 0.000 1.155) 1.155 8.248 ( 0.000 0.000 -0.868) 0.868 8.485 ( 0.000 0.000 -2.956) 2.956 8.489 ( 0.000 0.000 8.454) 8.454 8.852 ( 0.000 0.000 -11.514) 11.514 9.362 ( 0.000 0.000 3.690) 3.690 9.705 ( 0.000 0.000 -3.453) 3.453 9.729 ( 0.000 0.000 8.356) 8.356 9.942 ( 0.000 0.000 9.606) 9.606 10.015 ( 0.000 0.000 -7.870) 7.870 10.362 ( 0.000 0.000 -4.032) 4.032 11.140 ( 0.000 0.000 5.206) 5.206 11.202 ( 0.000 0.000 -6.697) 6.697 11.806 ( 0.000 0.000 0.087) 0.087 12.552 ( 0.000 0.000 -5.642) 5.642 12.580 ( 0.000 0.000 14.320) 14.320 12.921 ( 0.000 0.000 22.504) 22.504 13.576 ( 0.000 0.000 -7.155) 7.155 14.217 ( 0.000 0.000 -21.377) 21.377 14.653 ( 0.000 0.000 -17.041) 17.041 16.457 ( 0.000 0.000 -2.676) 2.676 17.072 ( 0.000 0.000 -1.323) 1.323 ======================= Grid point 271 (92/120) ======================= q-point: ( 0.11 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 4.333 0.000 -0.651) 4.382 2.830 ( 5.769 0.000 -1.419) 5.941 2.844 ( -2.959 0.000 7.093) 7.686 3.737 ( 2.077 0.000 16.558) 16.688 4.514 ( -2.984 0.000 20.767) 20.980 5.268 ( 3.334 0.000 0.780) 3.424 5.327 ( 0.315 0.000 1.032) 1.079 5.339 ( -4.486 0.000 -5.316) 6.956 5.725 ( -8.498 0.000 -6.984) 10.999 6.203 ( 5.978 0.000 -1.111) 6.080 6.690 ( 0.109 0.000 8.615) 8.615 6.841 ( 5.278 0.000 9.413) 10.792 6.849 ( 6.299 0.000 21.160) 22.078 6.972 ( 6.921 0.000 3.885) 7.937 6.974 ( -3.560 0.000 0.887) 3.669 7.100 ( 3.895 0.000 -5.944) 7.107 7.178 ( 10.282 0.000 -1.836) 10.444 7.295 ( 10.220 0.000 2.348) 10.486 7.454 ( 4.835 0.000 0.810) 4.902 7.621 ( -1.005 0.000 6.372) 6.450 7.980 ( -20.290 0.000 0.205) 20.291 7.999 ( -7.836 0.000 0.883) 7.885 8.468 ( -1.572 0.000 -4.029) 4.325 8.546 ( 3.001 0.000 6.687) 7.330 8.833 ( -1.913 0.000 -10.702) 10.872 9.524 ( 12.647 0.000 5.430) 13.763 9.727 ( -0.174 0.000 7.522) 7.524 9.760 ( 4.906 0.000 -4.520) 6.670 9.960 ( -0.595 0.000 1.651) 1.755 10.033 ( 5.499 0.000 1.163) 5.621 10.372 ( 0.894 0.000 -3.374) 3.490 11.122 ( -1.781 0.000 4.554) 4.890 11.176 ( -2.323 0.000 -5.809) 6.256 11.869 ( 6.353 0.000 -0.298) 6.360 12.567 ( 1.674 0.000 -6.258) 6.478 12.573 ( -0.852 0.000 14.507) 14.532 12.854 ( -6.845 0.000 21.890) 22.935 13.564 ( -1.154 0.000 -7.895) 7.979 14.156 ( -6.333 0.000 -21.294) 22.215 14.584 ( -7.063 0.000 -17.628) 18.990 16.459 ( 0.353 0.000 -1.850) 1.884 17.051 ( -2.241 0.000 -1.032) 2.467 ======================= Grid point 272 (93/120) ======================= q-point: ( 0.22 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 6.625 0.000 -0.664) 6.658 2.767 ( -4.734 0.000 4.812) 6.751 3.011 ( 13.207 0.000 -0.187) 13.209 3.799 ( 4.400 0.000 11.069) 11.911 4.431 ( -5.566 0.000 17.092) 17.976 5.120 ( -15.204 0.000 -7.326) 16.877 5.301 ( 0.223 0.000 -0.796) 0.827 5.414 ( 5.535 0.000 4.760) 7.301 5.685 ( 4.108 0.000 -2.596) 4.859 6.283 ( 3.445 0.000 1.360) 3.703 6.715 ( 0.469 0.000 9.239) 9.251 6.848 ( -7.333 0.000 2.272) 7.676 6.942 ( 3.897 0.000 12.637) 13.224 6.954 ( 5.300 0.000 10.642) 11.889 7.136 ( 7.456 0.000 3.912) 8.419 7.215 ( 6.866 0.000 -7.559) 10.212 7.449 ( 13.638 0.000 4.510) 14.364 7.541 ( -21.176 0.000 0.933) 21.196 7.547 ( 4.407 0.000 4.865) 6.564 7.578 ( 18.087 0.000 2.272) 18.230 7.658 ( 8.509 0.000 5.699) 10.241 7.836 ( -9.894 0.000 -0.005) 9.894 8.439 ( -0.727 0.000 -7.473) 7.508 8.594 ( 2.050 0.000 6.608) 6.919 8.784 ( -3.006 0.000 -9.092) 9.576 9.613 ( -6.758 0.000 0.065) 6.758 9.724 ( 0.008 0.000 5.761) 5.761 9.887 ( 8.010 0.000 1.636) 8.176 10.000 ( 6.060 0.000 1.655) 6.282 10.233 ( 14.285 0.000 3.289) 14.659 10.389 ( 0.688 0.000 -1.635) 1.773 11.075 ( -3.034 0.000 2.748) 4.094 11.142 ( -0.127 0.000 -3.732) 3.735 12.037 ( 10.424 0.000 1.351) 10.511 12.538 ( -3.487 0.000 15.357) 15.748 12.624 ( 4.612 0.000 -9.063) 10.169 12.666 ( -11.904 0.000 19.624) 22.952 13.539 ( -1.100 0.000 -10.167) 10.226 13.980 ( -11.613 0.000 -20.876) 23.889 14.388 ( -13.063 0.000 -19.012) 23.067 16.480 ( 2.063 0.000 -0.077) 2.065 16.988 ( -4.220 0.000 -0.259) 4.228 ======================= Grid point 273 (94/120) ======================= q-point: ( 0.33 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.350 ( 6.570 0.000 -0.213) 6.573 2.670 ( -5.166 0.000 2.499) 5.739 3.339 ( 20.633 0.000 0.830) 20.650 3.903 ( 6.243 0.000 4.675) 7.799 4.306 ( -7.244 0.000 11.803) 13.848 4.758 ( -21.969 0.000 -4.408) 22.407 5.352 ( 6.684 0.000 1.151) 6.783 5.537 ( 6.870 0.000 3.791) 7.847 5.783 ( 3.609 0.000 -0.380) 3.629 6.384 ( 7.982 0.000 1.878) 8.200 6.484 ( -21.514 0.000 4.416) 21.962 6.854 ( 3.808 0.000 8.490) 9.305 7.011 ( 3.215 0.000 11.344) 11.791 7.018 ( -0.648 0.000 6.202) 6.236 7.201 ( -4.863 0.000 0.285) 4.871 7.237 ( 3.559 0.000 -0.753) 3.638 7.421 ( 7.889 0.000 -0.068) 7.889 7.447 ( -4.758 0.000 8.839) 10.038 7.632 ( -10.730 0.000 -0.668) 10.751 7.742 ( 5.056 0.000 11.206) 12.294 7.945 ( 18.914 0.000 2.772) 19.116 7.984 ( 24.306 0.000 2.403) 24.424 8.474 ( 5.009 0.000 -10.909) 12.004 8.603 ( -2.176 0.000 5.816) 6.210 8.732 ( -1.823 0.000 -6.635) 6.881 9.363 ( -17.414 0.000 -2.469) 17.588 9.736 ( 1.553 0.000 4.661) 4.913 9.970 ( -0.035 0.000 8.707) 8.707 10.140 ( 7.260 0.000 0.283) 7.266 10.388 ( -1.035 0.000 0.319) 1.083 10.530 ( 14.853 0.000 0.027) 14.853 11.007 ( -4.043 0.000 0.386) 4.061 11.221 ( 9.578 0.000 1.301) 9.666 12.234 ( 8.909 0.000 8.311) 12.184 12.321 ( -18.118 0.000 16.846) 24.739 12.519 ( -3.909 0.000 15.535) 16.020 12.772 ( 11.597 0.000 -15.339) 19.230 13.537 ( 1.271 0.000 -13.841) 13.899 13.722 ( -14.891 0.000 -19.822) 24.792 14.099 ( -16.161 0.000 -20.527) 26.125 16.543 ( 4.490 0.000 1.390) 4.700 16.891 ( -5.723 0.000 0.733) 5.770 ======================= Grid point 274 (95/120) ======================= q-point: ( 0.44 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( 5.659 0.000 0.383) 5.672 2.571 ( -5.159 0.000 1.065) 5.268 3.784 ( 24.696 0.000 1.378) 24.734 4.035 ( 7.530 0.000 1.562) 7.690 4.154 ( -9.091 0.000 7.058) 11.509 4.301 ( -24.007 0.000 -2.618) 24.150 5.577 ( 15.725 0.000 1.985) 15.849 5.664 ( 5.578 0.000 2.072) 5.950 5.794 ( -1.297 0.000 2.674) 2.972 6.025 ( -23.563 0.000 4.299) 23.952 6.586 ( 12.049 0.000 1.529) 12.145 6.803 ( -9.231 0.000 3.733) 9.957 7.027 ( 3.155 0.000 5.956) 6.740 7.055 ( 0.796 0.000 10.129) 10.161 7.223 ( 4.023 0.000 9.272) 10.107 7.287 ( 0.539 0.000 0.616) 0.818 7.356 ( -2.352 0.000 6.521) 6.932 7.436 ( -7.920 0.000 -1.979) 8.163 7.599 ( 8.456 0.000 3.123) 9.014 7.734 ( -4.748 0.000 8.042) 9.339 8.272 ( 14.498 0.000 3.560) 14.929 8.472 ( 24.046 0.000 2.106) 24.138 8.495 ( -8.680 0.000 3.751) 9.456 8.616 ( 9.250 0.000 -9.538) 13.287 8.694 ( -3.465 0.000 -4.081) 5.353 8.973 ( -22.522 0.000 -2.142) 22.624 9.796 ( 4.694 0.000 5.315) 7.092 9.904 ( -5.714 0.000 7.388) 9.339 10.262 ( 5.358 0.000 0.937) 5.439 10.346 ( -3.316 0.000 1.272) 3.552 10.766 ( 9.585 0.000 -2.205) 9.835 10.913 ( -5.981 0.000 -1.560) 6.181 11.516 ( 19.813 0.000 8.095) 21.403 11.928 ( -21.836 0.000 13.006) 25.416 12.363 ( 4.977 0.000 13.913) 14.777 12.446 ( -3.921 0.000 15.422) 15.913 13.066 ( 17.833 0.000 -18.714) 25.850 13.412 ( -17.262 0.000 -18.778) 25.507 13.607 ( 6.588 0.000 -18.061) 19.225 13.802 ( -13.540 0.000 -20.841) 24.853 16.648 ( 6.165 0.000 1.923) 6.458 16.772 ( -6.497 0.000 1.590) 6.689 ======================= Grid point 279 (96/120) ======================= q-point: ( 0.00 0.20 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( 0.000 12.185 1.213) 12.245 2.840 ( 0.000 -3.429 7.872) 8.587 3.047 ( 0.000 24.414 -0.210) 24.415 3.761 ( 0.000 4.771 17.741) 18.372 4.389 ( 0.000 -13.739 22.322) 26.211 4.972 ( 0.000 -19.842 -3.733) 20.190 5.320 ( 0.000 2.208 3.798) 4.393 5.505 ( 0.000 5.103 -3.141) 5.992 5.866 ( 0.000 -1.957 -11.081) 11.252 5.969 ( 0.000 -9.885 -1.663) 10.024 6.693 ( 0.000 0.318 11.178) 11.182 6.767 ( 0.000 -0.608 8.987) 9.008 6.834 ( 0.000 1.703 11.020) 11.151 6.857 ( 0.000 -2.947 2.968) 4.183 7.048 ( 0.000 7.433 8.015) 10.931 7.095 ( 0.000 1.633 -2.910) 3.337 7.194 ( 0.000 -0.362 2.179) 2.209 7.208 ( 0.000 10.454 -0.294) 10.458 7.513 ( 0.000 9.527 -1.138) 9.594 7.525 ( 0.000 -7.725 6.501) 10.096 8.104 ( 0.000 -12.201 -2.227) 12.402 8.123 ( 0.000 4.219 -1.043) 4.346 8.403 ( 0.000 -7.942 8.385) 11.549 8.470 ( 0.000 -2.146 -2.168) 3.051 9.041 ( 0.000 16.008 -8.661) 18.201 9.430 ( 0.000 6.078 4.228) 7.404 9.702 ( 0.000 -0.763 -2.242) 2.368 9.729 ( 0.000 0.102 6.657) 6.658 9.889 ( 0.000 -4.698 7.947) 9.231 9.945 ( 0.000 -6.123 -8.251) 10.275 10.419 ( 0.000 5.109 -2.607) 5.736 10.977 ( 0.000 -11.970 3.343) 12.428 11.266 ( 0.000 6.671 -5.967) 8.950 12.004 ( 0.000 12.739 4.736) 13.590 12.401 ( 0.000 -11.134 -7.715) 13.545 12.655 ( 0.000 6.685 12.795) 14.436 12.880 ( 0.000 -4.077 21.724) 22.103 13.428 ( 0.000 -12.739 -7.918) 14.999 14.307 ( 0.000 7.096 -19.811) 21.043 14.632 ( 0.000 -2.073 -17.185) 17.310 16.540 ( 0.000 7.524 -2.613) 7.965 17.031 ( 0.000 -4.088 -1.493) 4.352 ======================= Grid point 280 (97/120) ======================= q-point: ( 0.11 0.20 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( 2.013 10.158 0.914) 10.396 2.800 ( -3.975 -4.068 7.028) 9.041 3.086 ( 4.205 22.887 0.294) 23.272 3.790 ( 2.904 5.482 15.676) 16.859 4.377 ( -1.204 -12.323 21.048) 24.420 4.958 ( -1.779 -20.475 -4.310) 20.999 5.316 ( -1.000 -0.975 2.203) 2.608 5.466 ( -4.805 2.693 -1.784) 5.790 5.756 ( -0.495 3.306 -5.084) 6.085 6.155 ( 9.731 -4.662 -4.521) 11.699 6.700 ( 0.793 1.046 8.975) 9.070 6.808 ( 4.543 -1.209 11.092) 12.047 6.878 ( 2.744 -2.217 3.956) 5.300 6.934 ( 7.269 0.518 10.597) 12.861 7.054 ( 0.709 6.547 6.658) 9.364 7.179 ( -0.999 7.042 -0.663) 7.143 7.202 ( 10.130 2.214 -1.546) 10.484 7.291 ( 9.580 -0.457 2.267) 9.856 7.514 ( -1.005 -6.064 6.432) 8.897 7.525 ( 1.133 5.145 -0.098) 5.270 7.914 ( -18.685 -6.569 -0.266) 19.808 8.078 ( -3.474 5.013 -2.127) 6.459 8.301 ( -2.668 -9.505 0.527) 9.886 8.583 ( 4.185 -1.219 3.712) 5.725 9.019 ( -2.282 15.793 -8.425) 18.045 9.551 ( 9.588 2.776 5.762) 11.526 9.726 ( 0.475 -0.357 5.406) 5.439 9.770 ( 5.715 0.634 -2.639) 6.327 9.896 ( -1.794 -5.599 -2.340) 6.328 9.964 ( 5.516 -5.871 3.058) 8.617 10.436 ( 1.761 5.602 -2.083) 6.231 10.977 ( -0.030 -10.805 3.066) 11.231 11.237 ( -2.782 6.112 -5.254) 8.527 12.027 ( 2.038 8.562 5.026) 10.135 12.401 ( 0.195 -9.846 -7.683) 12.490 12.649 ( -0.681 6.526 13.141) 14.688 12.854 ( -2.498 -1.526 19.539) 19.757 13.410 ( -1.651 -12.995 -8.583) 15.661 14.249 ( -5.951 7.220 -19.876) 21.968 14.565 ( -6.903 -1.930 -17.750) 19.142 16.538 ( -0.104 7.160 -1.858) 7.398 17.010 ( -2.104 -3.967 -1.163) 4.639 ======================= Grid point 281 (98/120) ======================= q-point: ( 0.22 0.20 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 2.847 4.838 0.208) 5.618 2.701 ( -5.931 -5.752 4.905) 9.608 3.222 ( 10.238 18.951 1.339) 21.581 3.870 ( 5.344 6.939 10.406) 13.601 4.343 ( -2.298 -8.318 17.596) 19.598 4.873 ( -8.226 -18.516 -5.268) 20.935 5.280 ( -1.438 -2.302 0.265) 2.728 5.396 ( -0.110 -2.878 2.478) 3.799 5.849 ( 7.093 12.331 -2.954) 14.529 6.292 ( 5.007 0.042 -1.283) 5.169 6.732 ( 1.109 1.487 9.424) 9.605 6.852 ( -3.383 -0.243 4.825) 5.898 6.921 ( 2.048 0.663 7.503) 7.806 7.023 ( 3.702 3.261 7.905) 9.318 7.102 ( 3.396 1.116 6.496) 7.414 7.257 ( 8.387 -1.546 -0.524) 8.544 7.417 ( 4.579 -3.424 5.313) 7.805 7.462 ( -0.965 -2.905 2.546) 3.981 7.496 ( -11.406 -5.404 1.327) 12.691 7.567 ( 13.409 0.131 3.484) 13.855 7.634 ( 8.860 2.335 0.551) 9.179 8.030 ( -1.228 11.942 -0.055) 12.005 8.272 ( -0.242 -11.281 -4.316) 12.081 8.626 ( 0.744 -0.370 5.083) 5.151 8.954 ( -4.429 14.313 -7.717) 16.853 9.591 ( -7.951 -2.185 0.606) 8.268 9.744 ( 1.179 1.643 4.484) 4.919 9.887 ( 6.498 -0.420 1.849) 6.769 9.963 ( 9.266 -2.627 0.290) 9.636 10.135 ( 11.215 -7.009 3.676) 13.726 10.486 ( 3.538 7.008 -0.675) 7.880 10.974 ( -0.306 -7.931 2.009) 8.187 11.177 ( -2.697 3.829 -3.287) 5.722 12.049 ( -1.222 -6.763 8.310) 10.784 12.425 ( 2.920 -0.854 -6.577) 7.247 12.629 ( -1.370 6.108 13.903) 15.247 12.801 ( -2.179 3.873 11.297) 12.139 13.375 ( -1.650 -13.263 -10.532) 17.016 14.085 ( -10.706 7.574 -19.967) 23.889 14.373 ( -12.719 -1.475 -19.123) 23.014 16.545 ( 1.087 5.956 -0.190) 6.057 16.952 ( -3.841 -3.499 -0.304) 5.205 ======================= Grid point 282 (99/120) ======================= q-point: ( 0.33 0.20 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.329 ( 2.975 -1.464 -0.386) 3.338 2.583 ( -6.002 -7.394 2.386) 9.817 3.484 ( 16.774 13.082 2.005) 21.366 3.987 ( 6.396 7.692 5.081) 11.220 4.289 ( -3.390 -2.621 12.599) 13.308 4.628 ( -16.570 -10.806 -3.234) 20.045 5.327 ( 7.211 -1.917 1.074) 7.538 5.466 ( 6.723 -5.368 3.782) 9.398 5.924 ( -1.009 10.759 -1.760) 10.948 6.375 ( -0.303 -1.872 1.004) 2.146 6.555 ( -12.707 7.255 4.633) 15.349 6.847 ( 2.571 -0.062 8.310) 8.699 6.971 ( 2.357 -1.837 8.433) 8.947 7.068 ( -3.859 1.709 5.730) 7.116 7.145 ( 3.993 -2.651 -0.217) 4.798 7.259 ( -1.167 0.652 3.947) 4.167 7.389 ( -2.113 -5.431 8.388) 10.214 7.423 ( 1.260 -9.236 2.644) 9.689 7.512 ( 4.610 5.708 0.161) 7.339 7.872 ( 8.922 1.274 6.577) 11.157 7.994 ( 23.739 1.448 1.443) 23.827 8.028 ( 4.878 10.483 4.018) 12.241 8.340 ( 7.998 -10.149 -9.378) 15.966 8.610 ( -2.871 -1.386 5.877) 6.685 8.853 ( -5.948 10.121 -6.817) 13.575 9.335 ( -17.253 -2.756 -1.987) 17.585 9.779 ( 2.820 3.978 4.013) 6.315 9.980 ( 1.966 1.120 7.754) 8.077 10.143 ( 8.396 0.129 0.400) 8.407 10.321 ( 5.804 -5.732 1.288) 8.258 10.594 ( 8.302 5.267 0.341) 9.838 10.957 ( -1.864 -4.519 0.060) 4.889 11.178 ( 4.273 -2.347 1.226) 5.027 11.938 ( -10.377 -19.914 11.668) 25.306 12.497 ( 2.807 10.126 5.680) 11.945 12.597 ( -2.062 6.431 14.798) 16.267 12.832 ( 7.394 4.053 -7.483) 11.273 13.358 ( -0.204 -12.285 -13.396) 18.177 13.856 ( -12.212 7.978 -19.991) 24.747 14.093 ( -15.618 -0.683 -20.726) 25.961 16.586 ( 3.161 3.922 1.269) 5.195 16.866 ( -4.994 -2.471 0.753) 5.622 ======================= Grid point 283 (100/120) ======================= q-point: ( 0.44 0.20 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( 3.713 -6.090 -0.436) 7.146 2.476 ( -5.003 -7.890 0.444) 9.353 3.850 ( 20.608 5.781 1.708) 21.471 4.103 ( 4.941 6.052 4.063) 8.806 4.212 ( -4.511 3.124 7.139) 9.004 4.265 ( -19.857 -2.079 -0.773) 19.980 5.556 ( 14.977 -1.659 0.928) 15.097 5.630 ( 9.570 -2.909 1.995) 10.199 5.828 ( -6.597 3.007 1.936) 7.504 6.028 ( -22.943 -0.441 3.932) 23.281 6.641 ( 10.475 5.651 1.884) 12.050 6.821 ( -6.670 2.028 4.888) 8.515 6.998 ( 0.675 -2.043 5.333) 5.751 7.009 ( -0.353 -3.644 8.641) 9.384 7.232 ( 3.603 -2.303 4.719) 6.368 7.265 ( -0.087 -1.263 4.758) 4.923 7.359 ( 0.211 -1.429 3.811) 4.076 7.397 ( -2.776 -0.892 2.560) 3.880 7.651 ( 8.525 5.414 2.197) 10.335 7.815 ( -7.853 6.519 6.307) 11.997 8.272 ( 13.938 -0.307 4.968) 14.800 8.471 ( 22.728 -0.069 1.361) 22.769 8.487 ( -5.399 -2.141 5.177) 7.781 8.556 ( 9.857 -4.253 -7.399) 13.038 8.722 ( -7.905 2.733 -6.074) 10.337 8.951 ( -22.224 -2.046 -1.691) 22.382 9.856 ( 5.025 5.750 4.823) 9.032 9.953 ( -4.161 4.750 6.899) 9.352 10.278 ( 5.513 1.122 0.996) 5.714 10.350 ( -1.749 -0.224 1.139) 2.099 10.766 ( 8.148 0.284 -1.271) 8.252 10.892 ( -4.942 -1.888 -1.345) 5.459 11.366 ( 14.397 -11.640 7.357) 19.922 11.674 ( -16.055 -18.705 10.994) 26.991 12.524 ( 0.944 10.211 13.904) 17.276 12.553 ( -2.127 8.224 15.154) 17.372 13.071 ( 15.126 0.458 -16.569) 22.439 13.315 ( -7.254 -7.068 -15.841) 18.802 13.689 ( -1.815 5.426 -20.698) 21.474 13.811 ( -12.308 0.671 -21.549) 24.826 16.664 ( 4.818 1.491 1.874) 5.380 16.764 ( -5.400 -0.768 1.606) 5.686 ======================= Grid point 288 (101/120) ======================= q-point: ( 0.00 0.40 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( 0.000 13.922 4.644) 14.676 2.722 ( 0.000 -8.547 6.990) 11.041 3.625 ( 0.000 27.302 8.602) 28.625 3.960 ( 0.000 17.277 10.117) 20.021 4.055 ( 0.000 -17.818 21.177) 27.675 4.474 ( 0.000 -28.052 -2.533) 28.166 5.407 ( 0.000 6.522 0.877) 6.580 5.543 ( 0.000 -3.525 -0.492) 3.560 5.786 ( 0.000 -4.013 -4.875) 6.314 5.809 ( 0.000 -3.280 -7.580) 8.259 6.715 ( 0.000 1.572 9.941) 10.065 6.747 ( 0.000 -1.368 9.363) 9.463 6.821 ( 0.000 -0.588 3.545) 3.593 6.828 ( 0.000 -0.924 3.647) 3.763 7.136 ( 0.000 2.150 -2.388) 3.213 7.174 ( 0.000 -1.337 -1.310) 1.872 7.232 ( 0.000 7.905 14.981) 16.939 7.358 ( 0.000 -4.036 9.575) 10.391 7.489 ( 0.000 12.198 -1.285) 12.266 7.730 ( 0.000 2.152 2.547) 3.334 7.852 ( 0.000 -2.523 -3.522) 4.332 8.094 ( 0.000 -11.687 1.929) 11.845 8.298 ( 0.000 2.769 1.769) 3.286 8.395 ( 0.000 -4.876 -1.602) 5.133 9.386 ( 0.000 15.598 -4.224) 16.160 9.574 ( 0.000 5.981 4.719) 7.618 9.638 ( 0.000 -5.542 0.339) 5.552 9.720 ( 0.000 -3.175 4.786) 5.743 9.788 ( 0.000 -2.590 1.996) 3.270 9.821 ( 0.000 -4.455 -7.526) 8.746 10.554 ( 0.000 7.977 -0.541) 7.996 10.742 ( 0.000 -10.497 1.368) 10.586 11.494 ( 0.000 15.933 -3.884) 16.399 11.883 ( 0.000 -19.936 -0.145) 19.936 12.486 ( 0.000 15.085 3.878) 15.575 12.746 ( 0.000 -9.467 17.315) 19.735 12.842 ( 0.000 11.598 5.826) 12.979 13.125 ( 0.000 -15.596 -5.071) 16.400 14.453 ( 0.000 6.662 -18.370) 19.541 14.567 ( 0.000 -4.392 -17.607) 18.147 16.726 ( 0.000 9.742 -2.354) 10.022 16.909 ( 0.000 -7.759 -1.913) 7.991 ======================= Grid point 289 (102/120) ======================= q-point: ( 0.11 0.40 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.464 ( -2.450 11.958 3.985) 12.840 2.674 ( -4.687 -8.292 6.158) 11.343 3.634 ( 1.210 26.634 8.328) 27.932 3.987 ( 2.776 12.766 10.873) 16.997 4.075 ( 1.961 -13.627 17.941) 22.615 4.472 ( -0.258 -26.362 -2.613) 26.493 5.330 ( -5.326 2.809 0.375) 6.033 5.422 ( -8.546 -5.160 -1.011) 10.035 5.870 ( 10.748 7.332 -3.970) 13.603 6.026 ( 13.325 -7.477 -5.687) 16.304 6.733 ( 1.719 2.066 9.333) 9.712 6.777 ( 3.079 -1.999 9.919) 10.577 6.859 ( 3.971 0.871 3.264) 5.214 6.901 ( 6.793 -2.694 3.703) 8.192 7.202 ( 1.601 5.418 6.685) 8.752 7.253 ( 7.803 2.952 1.815) 8.538 7.268 ( 7.319 -0.611 4.896) 8.827 7.354 ( -0.187 -1.447 9.197) 9.312 7.420 ( -6.423 8.337 0.818) 10.556 7.642 ( -9.347 -4.142 -0.292) 10.227 7.786 ( -6.143 3.026 -2.332) 7.234 7.990 ( -5.138 -11.276 -2.890) 12.724 8.312 ( 1.738 8.181 1.791) 8.553 8.485 ( 5.070 -7.627 2.653) 9.535 9.364 ( -2.632 16.057 -4.912) 16.996 9.607 ( -0.029 -2.953 2.502) 3.870 9.679 ( 4.961 -1.109 2.947) 5.875 9.751 ( 2.934 -2.922 2.480) 4.826 9.816 ( 1.633 -0.496 -5.433) 5.695 9.846 ( 6.114 -4.234 3.367) 8.163 10.577 ( 2.305 7.973 -0.460) 8.313 10.759 ( 1.712 -9.957 1.214) 10.176 11.453 ( -4.165 15.403 -2.868) 16.212 11.837 ( -4.706 -20.255 1.281) 20.834 12.519 ( 3.386 14.521 2.212) 15.074 12.758 ( 1.001 -7.498 15.746) 17.469 12.832 ( -0.859 10.574 6.050) 12.213 13.107 ( -1.769 -15.475 -5.686) 16.581 14.394 ( -6.043 6.495 -18.710) 20.707 14.504 ( -6.492 -4.168 -18.100) 19.676 16.715 ( -0.975 9.366 -1.755) 9.579 16.892 ( -1.685 -7.510 -1.471) 7.836 ======================= Grid point 290 (103/120) ======================= q-point: ( 0.22 0.40 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -3.953 7.242 2.210) 8.541 2.557 ( -7.010 -7.835 3.953) 11.232 3.687 ( 4.592 23.823 7.531) 25.403 4.060 ( 4.347 1.690 11.795) 12.684 4.125 ( 3.140 -3.023 10.786) 11.634 4.459 ( -1.426 -20.879 -2.494) 21.076 5.255 ( -1.654 0.616 0.886) 1.975 5.311 ( -2.017 -4.404 1.380) 5.037 6.088 ( 9.642 10.174 -3.537) 14.456 6.245 ( 8.301 -5.051 -3.826) 10.443 6.776 ( 2.265 3.001 9.731) 10.431 6.841 ( 2.925 -2.293 9.463) 10.166 6.941 ( 2.521 3.723 2.013) 4.926 7.059 ( 8.180 -4.325 1.787) 9.424 7.174 ( -3.824 3.875 11.264) 12.510 7.189 ( -11.210 1.309 2.885) 11.649 7.328 ( 0.269 -2.398 9.970) 10.258 7.381 ( -11.487 -5.857 2.565) 13.147 7.500 ( 11.885 2.921 0.991) 12.278 7.549 ( 14.747 -1.809 3.681) 15.307 7.750 ( 5.225 8.877 -5.784) 11.814 7.975 ( 3.372 -12.388 -7.570) 14.904 8.328 ( -0.667 12.058 4.482) 12.881 8.541 ( 0.637 -7.917 5.298) 9.547 9.268 ( -7.535 14.712 -5.334) 17.368 9.502 ( -10.061 -7.631 -1.943) 12.776 9.782 ( 4.588 2.200 3.610) 6.239 9.842 ( 7.779 -3.447 1.876) 8.713 9.949 ( 9.970 1.374 0.911) 10.105 10.008 ( 9.988 -4.614 4.376) 11.841 10.638 ( 3.856 7.739 -0.260) 8.650 10.802 ( 2.499 -8.411 0.744) 8.805 11.345 ( -6.636 13.386 -0.513) 14.949 11.707 ( -8.580 -20.613 4.307) 22.739 12.611 ( 5.741 12.393 0.449) 13.666 12.761 ( -1.272 1.646 13.222) 13.385 12.831 ( 1.531 4.373 4.908) 6.749 13.074 ( -0.926 -15.173 -8.292) 17.316 14.228 ( -10.945 5.981 -19.601) 23.233 14.324 ( -11.862 -3.479 -19.367) 22.976 16.695 ( -0.920 8.030 -0.355) 8.090 16.848 ( -2.716 -6.571 -0.379) 7.120 ======================= Grid point 291 (104/120) ======================= q-point: ( 0.33 0.40 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( -3.226 1.998 0.065) 3.796 2.423 ( -6.440 -7.147 1.238) 9.700 3.813 ( 8.353 17.678 5.903) 20.424 4.131 ( 2.546 -9.464 10.794) 14.579 4.193 ( 3.595 7.508 4.847) 9.632 4.399 ( -4.901 -10.603 -0.016) 11.681 5.304 ( 7.449 0.408 1.544) 7.618 5.357 ( 6.880 -4.557 2.802) 8.715 6.137 ( -6.355 9.273 -2.279) 11.471 6.292 ( -6.624 -5.994 -0.811) 8.970 6.762 ( -2.763 11.712 6.130) 13.505 6.873 ( 0.363 2.976 6.939) 7.559 6.915 ( -0.282 -3.513 7.988) 8.731 7.051 ( -1.990 -9.570 3.533) 10.393 7.095 ( -2.595 2.229 0.829) 3.519 7.180 ( 1.906 -7.240 0.306) 7.493 7.302 ( 2.524 3.644 9.079) 10.103 7.366 ( 3.079 -2.192 9.279) 10.019 7.658 ( 6.381 8.117 0.177) 10.327 7.814 ( 10.462 -6.056 4.158) 12.784 8.036 ( 21.249 3.059 -2.959) 21.671 8.139 ( 13.758 -7.507 -7.796) 17.505 8.291 ( -2.267 12.516 6.394) 14.236 8.511 ( -3.693 -8.299 6.759) 11.323 9.076 ( -12.157 10.446 -4.725) 16.710 9.247 ( -16.077 -6.165 -2.403) 17.385 9.888 ( 6.326 6.380 2.904) 9.442 9.994 ( 6.762 -1.814 3.057) 7.639 10.141 ( 9.290 0.392 2.829) 9.719 10.197 ( 8.678 -4.985 4.744) 11.075 10.716 ( 4.097 6.301 -0.135) 7.517 10.843 ( 1.496 -6.159 -0.168) 6.340 11.221 ( -5.263 8.253 2.546) 10.114 11.517 ( -10.777 -19.453 6.820) 23.261 12.696 ( 1.484 7.397 8.873) 11.647 12.724 ( -2.019 4.432 14.003) 14.826 12.908 ( 7.390 4.843 -7.472) 11.572 13.099 ( 3.688 -12.429 -12.106) 17.738 13.991 ( -12.916 5.086 -20.833) 25.034 14.065 ( -14.303 -2.319 -21.011) 25.523 16.687 ( 0.142 5.494 1.025) 5.591 16.793 ( -2.909 -4.609 0.836) 5.514 ======================= Grid point 292 (105/120) ======================= q-point: ( 0.44 0.40 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -0.215 -2.422 -1.263) 2.740 2.323 ( -3.601 -5.505 -0.835) 6.631 3.991 ( 9.370 7.408 3.359) 12.408 4.132 ( -3.713 -5.862 3.723) 7.875 4.248 ( 2.074 5.117 6.082) 8.215 4.297 ( -4.224 0.769 6.295) 7.620 5.534 ( 14.741 -0.015 -0.134) 14.742 5.565 ( 13.574 -2.900 0.644) 13.895 5.904 ( -14.224 4.202 1.751) 14.934 5.986 ( -19.844 -3.478 2.672) 20.323 6.809 ( 4.957 9.214 4.712) 11.475 6.866 ( -1.055 1.543 8.442) 8.647 6.934 ( 1.973 -1.604 7.330) 7.759 7.006 ( -4.741 1.552 3.022) 5.832 7.100 ( 3.722 -7.335 0.282) 8.231 7.166 ( -2.496 -7.118 0.398) 7.554 7.378 ( 3.368 2.452 6.503) 7.723 7.406 ( 0.472 -0.076 6.471) 6.489 7.796 ( 7.651 7.923 1.174) 11.077 7.906 ( -1.681 -0.448 2.279) 2.867 8.280 ( 4.103 3.053 7.513) 9.089 8.399 ( -5.570 -6.344 7.190) 11.089 8.470 ( 21.514 -0.122 -1.142) 21.545 8.481 ( 17.844 -2.006 -4.689) 18.558 8.806 ( -15.783 4.801 -4.402) 17.074 8.893 ( -20.353 -3.588 -2.026) 20.766 10.008 ( 5.458 7.909 3.015) 10.071 10.066 ( 0.189 3.992 3.475) 5.296 10.284 ( 4.903 -0.699 3.521) 6.077 10.310 ( 2.456 -3.310 4.209) 5.890 10.792 ( 3.620 2.318 -0.690) 4.354 10.845 ( -1.531 -2.543 -1.186) 3.197 11.186 ( 2.508 -2.818 6.084) 7.159 11.313 ( -9.660 -14.243 7.614) 18.818 12.687 ( -0.614 4.903 14.172) 15.009 12.694 ( -1.181 4.182 14.765) 15.391 13.091 ( 9.435 1.984 -14.009) 17.006 13.174 ( 1.766 -6.085 -13.824) 15.206 13.781 ( -6.609 3.228 -22.467) 23.640 13.817 ( -9.631 -0.466 -22.562) 24.536 16.702 ( 1.452 2.037 1.764) 3.061 16.740 ( -2.436 -1.591 1.663) 3.351 ======================= Grid point 315 (106/120) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( 0.000 0.000 0.000) 0.000 2.758 ( 0.000 0.000 0.000) 0.000 2.959 ( 0.000 0.000 0.000) 0.000 3.925 ( 0.000 0.000 0.000) 0.000 4.809 ( 0.000 0.000 0.000) 0.000 5.244 ( 0.000 0.000 0.000) 0.000 5.267 ( 0.000 0.000 0.000) 0.000 5.354 ( 0.000 0.000 0.000) 0.000 5.737 ( 0.000 0.000 0.000) 0.000 6.088 ( 0.000 0.000 0.000) 0.000 6.811 ( 0.000 0.000 0.000) 0.000 6.867 ( 0.000 0.000 0.000) 0.000 6.902 ( 0.000 0.000 0.000) 0.000 6.937 ( 0.000 0.000 -0.000) 0.000 7.040 ( 0.000 0.000 0.000) 0.000 7.082 ( 0.000 0.000 0.000) 0.000 7.155 ( 0.000 0.000 -0.000) 0.000 7.170 ( 0.000 0.000 0.000) 0.000 7.337 ( 0.000 0.000 0.000) 0.000 7.693 ( 0.000 0.000 0.000) 0.000 8.086 ( 0.000 0.000 0.000) 0.000 8.241 ( 0.000 0.000 0.000) 0.000 8.456 ( 0.000 0.000 0.000) 0.000 8.578 ( 0.000 0.000 0.000) 0.000 8.720 ( 0.000 0.000 0.000) 0.000 9.408 ( 0.000 0.000 0.000) 0.000 9.662 ( 0.000 0.000 0.000) 0.000 9.829 ( 0.000 0.000 0.000) 0.000 9.931 ( 0.000 0.000 0.000) 0.000 10.046 ( 0.000 0.000 0.000) 0.000 10.309 ( 0.000 0.000 0.000) 0.000 11.129 ( 0.000 0.000 0.000) 0.000 11.190 ( 0.000 0.000 0.000) 0.000 11.810 ( 0.000 0.000 0.000) 0.000 12.491 ( 0.000 0.000 0.000) 0.000 12.751 ( 0.000 0.000 0.000) 0.000 13.225 ( 0.000 0.000 0.000) 0.000 13.501 ( 0.000 0.000 0.000) 0.000 13.925 ( 0.000 0.000 0.000) 0.000 14.458 ( 0.000 0.000 0.000) 0.000 16.430 ( 0.000 0.000 0.000) 0.000 17.058 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 317 (107/120) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( 4.244 0.000 0.000) 4.244 2.816 ( 6.304 0.000 0.000) 6.304 2.919 ( -3.980 0.000 0.000) 3.980 3.921 ( -0.294 0.000 0.000) 0.294 4.762 ( -4.813 0.000 0.000) 4.813 5.209 ( -6.014 0.000 0.000) 6.014 5.273 ( 2.039 0.000 0.000) 2.039 5.383 ( 2.910 0.000 0.000) 2.910 5.636 ( -5.120 0.000 0.000) 5.120 6.189 ( 6.567 0.000 0.000) 6.567 6.781 ( -0.035 0.000 0.000) 0.035 6.935 ( 2.252 0.000 0.000) 2.252 6.968 ( 7.139 0.000 -0.000) 7.139 6.971 ( 3.289 0.000 0.000) 3.289 7.045 ( -2.766 0.000 0.000) 2.766 7.147 ( 8.589 0.000 0.000) 8.589 7.211 ( 5.707 0.000 -0.000) 5.707 7.282 ( 12.730 0.000 0.000) 12.730 7.415 ( 8.377 0.000 0.000) 8.377 7.682 ( -0.998 0.000 0.000) 0.998 7.983 ( -20.208 0.000 0.000) 20.208 8.018 ( -8.157 0.000 0.000) 8.157 8.427 ( -2.925 0.000 0.000) 2.925 8.619 ( 2.606 0.000 0.000) 2.606 8.711 ( -0.933 0.000 0.000) 0.933 9.600 ( 16.308 0.000 0.000) 16.308 9.690 ( 0.744 0.000 0.000) 0.744 9.816 ( -1.212 0.000 0.000) 1.212 9.921 ( 0.604 0.000 0.000) 0.604 10.108 ( 6.366 0.000 0.000) 6.366 10.327 ( 1.685 0.000 0.000) 1.685 11.110 ( -1.613 0.000 0.000) 1.613 11.166 ( -2.391 0.000 0.000) 2.391 11.870 ( 6.265 0.000 0.000) 6.265 12.500 ( 0.925 0.000 0.000) 0.925 12.746 ( -0.521 0.000 0.000) 0.521 13.149 ( -7.852 0.000 0.000) 7.852 13.481 ( -1.983 0.000 0.000) 1.983 13.868 ( -5.883 0.000 0.000) 5.883 14.382 ( -7.817 0.000 0.000) 7.817 16.440 ( 1.184 0.000 0.000) 1.184 17.039 ( -1.921 0.000 0.000) 1.921 ======================= Grid point 319 (108/120) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( 6.697 0.000 0.000) 6.697 2.818 ( -6.159 0.000 0.000) 6.159 3.009 ( 13.870 0.000 0.000) 13.870 3.920 ( 0.516 0.000 0.000) 0.516 4.629 ( -8.772 0.000 0.000) 8.772 5.027 ( -13.097 0.000 0.000) 13.097 5.289 ( 0.603 0.000 0.000) 0.603 5.462 ( 5.137 0.000 0.000) 5.137 5.651 ( 5.878 0.000 0.000) 5.878 6.290 ( 4.421 0.000 0.000) 4.421 6.830 ( 4.903 0.000 -0.000) 4.903 6.849 ( -11.166 0.000 0.000) 11.166 7.050 ( 4.591 0.000 -0.000) 4.591 7.085 ( 4.740 0.000 0.000) 4.740 7.107 ( 6.967 0.000 -0.000) 6.967 7.213 ( 1.123 0.000 0.000) 1.123 7.500 ( 19.291 0.000 0.000) 19.291 7.558 ( -19.551 0.000 0.000) 19.551 7.597 ( 4.334 0.000 0.000) 4.334 7.598 ( 18.160 0.000 -0.000) 18.160 7.717 ( 11.192 0.000 0.000) 11.192 7.842 ( -10.512 0.000 0.000) 10.512 8.353 ( -4.219 0.000 0.000) 4.219 8.666 ( 2.273 0.000 0.000) 2.273 8.684 ( -1.935 0.000 0.000) 1.935 9.597 ( -10.166 0.000 0.000) 10.166 9.791 ( -1.108 0.000 0.000) 1.108 9.911 ( 14.135 0.000 0.000) 14.135 10.009 ( 6.796 0.000 0.000) 6.796 10.285 ( 11.705 0.000 0.000) 11.705 10.364 ( 1.861 0.000 0.000) 1.861 11.099 ( 1.787 0.000 0.000) 1.787 11.102 ( -4.134 0.000 0.000) 4.134 12.056 ( 13.141 0.000 0.000) 13.141 12.525 ( 1.645 0.000 0.000) 1.645 12.723 ( -2.368 0.000 0.000) 2.368 12.929 ( -14.499 0.000 0.000) 14.499 13.432 ( -2.870 0.000 0.000) 2.870 13.706 ( -10.541 0.000 0.000) 10.541 14.166 ( -14.226 0.000 0.000) 14.226 16.480 ( 3.047 0.000 0.000) 3.047 16.985 ( -3.689 0.000 0.000) 3.689 ======================= Grid point 321 (109/120) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( 6.858 0.000 0.000) 6.858 2.695 ( -6.279 0.000 0.000) 6.279 3.348 ( 20.933 0.000 -0.000) 20.933 3.954 ( 3.303 0.000 0.000) 3.303 4.436 ( -10.822 0.000 0.000) 10.822 4.706 ( -19.993 0.000 0.000) 19.993 5.363 ( 8.017 0.000 0.000) 8.017 5.573 ( 6.174 0.000 0.000) 6.174 5.774 ( 4.895 0.000 0.000) 4.895 6.399 ( 7.879 0.000 0.000) 7.879 6.523 ( -22.213 0.000 0.000) 22.213 6.953 ( 7.344 0.000 0.000) 7.344 7.039 ( -9.706 0.000 0.000) 9.706 7.143 ( 5.123 0.000 -0.000) 5.123 7.218 ( -0.639 0.000 0.000) 0.639 7.231 ( 5.929 0.000 0.000) 5.929 7.428 ( 5.931 0.000 0.000) 5.931 7.540 ( -4.171 0.000 0.000) 4.171 7.629 ( -10.934 0.000 0.000) 10.934 7.874 ( 6.714 0.000 -0.000) 6.714 7.956 ( 23.238 0.000 0.000) 23.238 8.049 ( 20.150 0.000 0.000) 20.150 8.322 ( 3.699 0.000 0.000) 3.699 8.632 ( -3.693 0.000 0.000) 3.693 8.696 ( 0.281 0.000 0.000) 0.281 9.331 ( -17.036 0.000 0.000) 17.036 9.788 ( 1.317 0.000 0.000) 1.317 10.080 ( -0.952 0.000 -0.000) 0.952 10.127 ( 8.764 0.000 0.000) 8.764 10.384 ( -0.096 0.000 0.000) 0.096 10.527 ( 12.379 0.000 0.000) 12.379 11.011 ( -5.271 0.000 0.000) 5.271 11.241 ( 13.903 0.000 0.000) 13.903 12.373 ( 19.397 0.000 -0.000) 19.397 12.530 ( -20.056 0.000 0.000) 20.056 12.562 ( 2.194 0.000 0.000) 2.194 12.724 ( -3.996 0.000 0.000) 3.996 13.386 ( -1.379 0.000 0.000) 1.379 13.473 ( -13.566 0.000 0.000) 13.566 13.855 ( -17.230 0.000 0.000) 17.230 16.559 ( 5.053 0.000 0.000) 5.053 16.899 ( -5.163 0.000 0.000) 5.163 ======================= Grid point 323 (110/120) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( 5.928 0.000 0.000) 5.928 2.580 ( -5.689 0.000 0.000) 5.689 3.794 ( 24.765 0.000 -0.000) 24.765 4.056 ( 7.298 0.000 0.000) 7.298 4.229 ( -10.297 0.000 0.000) 10.297 4.274 ( -24.307 0.000 0.000) 24.307 5.596 ( 14.549 0.000 0.000) 14.549 5.682 ( 4.222 0.000 0.000) 4.222 5.818 ( 1.322 0.000 0.000) 1.322 6.067 ( -22.802 0.000 0.000) 22.802 6.599 ( 12.138 0.000 0.000) 12.138 6.832 ( -11.504 0.000 0.000) 11.504 7.090 ( 6.303 0.000 0.000) 6.303 7.182 ( -3.235 0.000 -0.000) 3.235 7.253 ( 6.571 0.000 0.000) 6.571 7.340 ( 5.498 0.000 0.000) 5.498 7.405 ( -9.113 0.000 -0.000) 9.113 7.446 ( -5.410 0.000 0.000) 5.410 7.635 ( 10.671 0.000 0.000) 10.671 7.829 ( -8.284 0.000 0.000) 8.284 8.319 ( 14.332 0.000 0.000) 14.332 8.494 ( 10.717 0.000 0.000) 10.717 8.495 ( 24.760 0.000 -0.000) 24.760 8.527 ( -7.629 0.000 0.000) 7.629 8.654 ( -5.167 0.000 0.000) 5.167 8.952 ( -22.064 0.000 0.000) 22.064 9.854 ( 5.567 0.000 0.000) 5.567 9.987 ( -7.252 0.000 0.000) 7.252 10.266 ( 5.857 0.000 0.000) 5.857 10.354 ( -3.137 0.000 0.000) 3.137 10.740 ( 9.519 0.000 0.000) 9.519 10.896 ( -6.864 0.000 0.000) 6.864 11.612 ( 23.228 0.000 0.000) 23.228 12.085 ( -24.814 0.000 0.000) 24.814 12.609 ( 2.655 0.000 -0.000) 2.655 12.663 ( -2.914 0.000 0.000) 2.914 12.778 ( 21.825 0.000 0.000) 21.825 13.173 ( -18.183 0.000 0.000) 18.183 13.402 ( 3.704 0.000 0.000) 3.704 13.554 ( -12.439 0.000 0.000) 12.439 16.669 ( 6.187 0.000 0.000) 6.187 16.789 ( -6.121 0.000 0.000) 6.121 ======================= Grid point 333 (111/120) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.217 ( 0.000 13.766 0.000) 13.766 2.924 ( 0.000 -3.666 0.000) 3.666 3.046 ( 0.000 26.102 0.000) 26.102 3.960 ( 0.000 3.747 0.000) 3.747 4.668 ( 0.000 -12.651 0.000) 12.651 4.895 ( 0.000 -21.582 0.000) 21.582 5.356 ( 0.000 0.732 0.000) 0.732 5.468 ( 0.000 7.248 0.000) 7.248 5.736 ( 0.000 -0.302 0.000) 0.302 5.947 ( 0.000 -11.897 0.000) 11.897 6.810 ( 0.000 0.072 0.000) 0.072 6.863 ( 0.000 -0.458 0.000) 0.458 6.866 ( 0.000 -1.510 -0.000) 1.510 6.895 ( 0.000 -2.381 -0.000) 2.381 7.058 ( 0.000 1.694 0.000) 1.694 7.184 ( 0.000 0.268 -0.000) 0.268 7.204 ( 0.000 10.091 0.000) 10.091 7.359 ( 0.000 2.451 -0.000) 2.451 7.374 ( 0.000 17.499 0.000) 17.499 7.593 ( 0.000 -7.014 0.000) 7.014 8.082 ( 0.000 -13.113 0.000) 13.113 8.112 ( 0.000 2.096 0.000) 2.096 8.452 ( 0.000 -1.731 0.000) 1.731 8.490 ( 0.000 -8.087 0.000) 8.087 8.945 ( 0.000 18.483 0.000) 18.483 9.483 ( 0.000 6.641 0.000) 6.641 9.672 ( 0.000 0.752 0.000) 0.752 9.810 ( 0.000 -1.760 0.000) 1.760 9.856 ( 0.000 -6.827 0.000) 6.827 9.971 ( 0.000 -6.200 0.000) 6.200 10.387 ( 0.000 6.468 0.000) 6.468 11.009 ( 0.000 -13.010 0.000) 13.010 11.202 ( 0.000 7.497 0.000) 7.497 12.064 ( 0.000 19.796 0.000) 19.796 12.306 ( 0.000 -16.845 0.000) 16.845 12.814 ( 0.000 5.656 0.000) 5.656 13.192 ( 0.000 -3.266 0.000) 3.266 13.306 ( 0.000 -15.660 0.000) 15.660 14.055 ( 0.000 9.246 0.000) 9.246 14.435 ( 0.000 -2.328 0.000) 2.328 16.514 ( 0.000 7.587 0.000) 7.587 17.014 ( 0.000 -4.244 0.000) 4.244 ======================= Grid point 335 (112/120) ======================= q-point: ( 0.11 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 1.715 11.579 0.000) 11.705 2.875 ( -4.825 -4.346 0.000) 6.494 3.088 ( 4.616 24.686 0.000) 25.114 3.965 ( 0.526 4.453 0.000) 4.484 4.640 ( -2.864 -11.031 0.000) 11.397 4.874 ( -2.354 -21.658 0.000) 21.785 5.329 ( -2.639 -1.360 0.000) 2.969 5.450 ( -3.128 2.456 0.000) 3.977 5.691 ( 2.488 5.173 0.000) 5.740 6.105 ( 10.285 -6.902 0.000) 12.386 6.795 ( 0.501 1.318 0.000) 1.409 6.895 ( 1.935 -2.392 0.000) 3.077 6.942 ( 5.845 -2.195 0.000) 6.244 6.957 ( 5.302 -0.211 -0.000) 5.306 7.169 ( 10.001 1.774 0.000) 10.158 7.170 ( -2.103 8.637 -0.000) 8.889 7.244 ( 5.905 2.267 -0.000) 6.325 7.401 ( 2.579 11.131 -0.000) 11.426 7.411 ( 6.280 0.001 0.000) 6.280 7.595 ( 0.455 -6.078 0.000) 6.095 7.910 ( -17.778 -7.448 0.000) 19.275 8.045 ( -5.222 1.129 0.000) 5.343 8.311 ( -3.987 -6.361 0.000) 7.507 8.632 ( 4.922 -1.670 0.000) 5.198 8.926 ( -2.042 17.765 0.000) 17.882 9.636 ( 13.732 3.594 -0.000) 14.195 9.703 ( 0.330 1.206 0.000) 1.250 9.790 ( -1.171 -3.327 0.000) 3.527 9.851 ( 1.401 -5.495 0.000) 5.671 10.030 ( 5.830 -6.216 0.000) 8.522 10.410 ( 2.376 6.672 0.000) 7.082 11.008 ( -0.175 -11.841 0.000) 11.842 11.178 ( -2.279 7.059 0.000) 7.417 12.098 ( 3.754 18.375 0.000) 18.755 12.295 ( -1.337 -18.178 0.000) 18.228 12.812 ( -0.257 5.715 0.000) 5.721 13.141 ( -5.103 -1.415 0.000) 5.296 13.288 ( -1.740 -15.292 0.000) 15.391 13.997 ( -5.934 9.054 0.000) 10.826 14.360 ( -7.644 -2.165 0.000) 7.945 16.519 ( 0.663 7.156 0.000) 7.187 16.997 ( -1.744 -4.084 0.000) 4.441 ======================= Grid point 337 (113/120) ======================= q-point: ( 0.22 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 2.438 5.726 0.000) 6.223 2.753 ( -7.359 -5.958 0.000) 9.469 3.234 ( 10.768 20.600 0.000) 23.245 3.985 ( 1.813 6.224 0.000) 6.483 4.561 ( -5.292 -6.443 0.000) 8.338 4.786 ( -7.350 -19.119 0.000) 20.483 5.275 ( -1.192 -1.680 0.000) 2.060 5.424 ( 1.534 -3.799 0.000) 4.097 5.813 ( 7.499 12.075 0.000) 14.214 6.271 ( 6.953 -1.986 0.000) 7.231 6.844 ( 4.374 1.391 -0.000) 4.590 6.871 ( -8.117 1.067 0.000) 8.187 7.006 ( 2.111 2.619 0.000) 3.364 7.053 ( 5.111 -4.095 -0.000) 6.549 7.205 ( 3.022 3.826 -0.000) 4.876 7.273 ( 2.265 4.369 0.000) 4.922 7.451 ( 0.396 -8.018 -0.000) 8.028 7.494 ( 12.057 -1.671 0.000) 12.172 7.540 ( -14.329 -0.788 0.000) 14.350 7.564 ( 10.349 -1.009 -0.000) 10.398 7.693 ( 13.876 -1.881 0.000) 14.003 7.995 ( 1.837 5.988 0.000) 6.264 8.238 ( -4.762 -5.003 0.000) 6.907 8.689 ( 1.594 -0.235 0.000) 1.612 8.866 ( -4.131 15.436 0.000) 15.979 9.580 ( -11.137 -2.206 0.000) 11.353 9.795 ( 0.592 0.549 0.000) 0.808 9.916 ( 13.590 0.803 -0.000) 13.613 9.962 ( 8.262 -4.208 0.000) 9.272 10.181 ( 9.106 -6.384 0.000) 11.121 10.477 ( 4.595 7.172 0.000) 8.518 10.997 ( -1.139 -8.627 0.000) 8.701 11.137 ( -0.873 4.766 0.000) 4.845 12.221 ( 9.419 14.263 -0.000) 17.092 12.243 ( -4.565 -21.892 0.000) 22.363 12.802 ( -0.808 6.051 0.000) 6.105 13.008 ( -8.145 3.905 0.000) 9.032 13.246 ( -2.381 -14.042 0.000) 14.242 13.835 ( -10.556 8.421 0.000) 13.503 14.149 ( -13.917 -1.711 0.000) 14.022 16.544 ( 2.037 5.850 0.000) 6.194 16.949 ( -3.265 -3.531 0.000) 4.809 ======================= Grid point 339 (114/120) ======================= q-point: ( 0.33 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( 2.720 -1.421 0.000) 3.069 2.608 ( -7.356 -7.697 0.000) 10.646 3.503 ( 16.870 14.320 0.000) 22.128 4.043 ( 4.310 8.005 0.000) 9.092 4.440 ( -7.105 -0.314 0.000) 7.112 4.576 ( -14.376 -11.655 0.000) 18.507 5.337 ( 7.975 -1.968 0.000) 8.214 5.503 ( 6.336 -5.539 0.000) 8.415 5.901 ( 0.383 9.904 0.000) 9.911 6.379 ( 0.955 -2.753 0.000) 2.914 6.596 ( -14.338 7.429 0.000) 16.148 6.947 ( 5.893 -0.334 0.000) 5.902 7.021 ( -4.740 0.377 0.000) 4.755 7.122 ( 1.688 -5.504 -0.000) 5.757 7.158 ( -0.268 -0.169 0.000) 0.317 7.318 ( 2.969 4.703 0.000) 5.562 7.427 ( -2.812 -11.837 0.000) 12.166 7.495 ( 5.919 4.096 0.000) 7.198 7.517 ( -1.841 -1.762 0.000) 2.548 7.966 ( 23.033 0.871 0.000) 23.049 8.041 ( 20.604 -0.788 0.000) 20.619 8.071 ( -4.409 12.256 0.000) 13.025 8.188 ( 8.546 -10.189 -0.000) 13.299 8.693 ( -1.529 -1.683 -0.000) 2.274 8.764 ( -6.689 11.387 0.000) 13.206 9.308 ( -16.969 -2.492 0.000) 17.151 9.824 ( 2.760 3.372 0.000) 4.358 10.077 ( 2.030 -0.656 -0.000) 2.133 10.135 ( 9.309 0.917 0.000) 9.354 10.328 ( 4.827 -4.123 0.000) 6.348 10.595 ( 7.688 5.175 0.000) 9.268 10.958 ( -3.015 -4.764 0.000) 5.638 11.197 ( 8.283 -2.308 0.000) 8.599 12.095 ( -11.357 -24.594 0.000) 27.089 12.467 ( 15.994 8.685 0.000) 18.199 12.782 ( -1.183 7.005 0.000) 7.104 12.860 ( -6.382 9.372 0.000) 11.339 13.205 ( -1.787 -11.478 0.000) 11.616 13.609 ( -12.211 7.158 0.000) 14.155 13.844 ( -16.894 -1.076 0.000) 16.928 16.600 ( 3.750 3.804 0.000) 5.342 16.874 ( -4.417 -2.443 0.000) 5.048 ======================= Grid point 341 (115/120) ======================= q-point: ( 0.44 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.387 ( 3.868 -6.648 0.000) 7.691 2.480 ( -5.803 -8.455 0.000) 10.255 3.865 ( 20.057 6.428 0.000) 21.062 4.151 ( 6.787 8.018 0.000) 10.505 4.248 ( -19.099 -2.510 0.000) 19.264 4.294 ( -7.797 5.095 0.000) 9.314 5.563 ( 13.474 -2.548 0.000) 13.713 5.647 ( 7.150 -3.344 0.000) 7.893 5.846 ( -2.945 2.691 0.000) 3.989 6.066 ( -21.668 -0.909 0.000) 21.687 6.657 ( 10.579 6.122 0.000) 12.223 6.861 ( -9.973 3.500 0.000) 10.569 7.052 ( 4.649 -2.981 0.000) 5.523 7.117 ( -1.947 -4.999 0.000) 5.365 7.229 ( 5.119 -2.961 0.000) 5.913 7.333 ( -5.539 -7.214 -0.000) 9.096 7.389 ( 4.055 3.670 0.000) 5.469 7.464 ( -3.504 1.413 0.000) 3.778 7.676 ( 11.146 4.602 0.000) 12.058 7.895 ( -11.008 4.983 0.000) 12.083 8.344 ( 16.142 2.240 0.000) 16.297 8.427 ( 12.246 -5.224 -0.000) 13.313 8.486 ( 24.226 -0.978 0.000) 24.246 8.600 ( -10.529 6.408 -0.000) 12.326 8.615 ( -6.910 -4.031 0.000) 7.999 8.934 ( -21.653 -1.872 0.000) 21.733 9.909 ( 5.955 5.168 0.000) 7.885 10.031 ( -5.696 3.984 0.000) 6.951 10.282 ( 5.918 1.454 0.000) 6.094 10.356 ( -1.528 0.081 0.000) 1.530 10.750 ( 7.691 1.018 0.000) 7.759 10.877 ( -5.421 -1.754 0.000) 5.698 11.456 ( 17.353 -12.320 0.000) 21.282 11.807 ( -17.744 -20.626 0.000) 27.208 12.764 ( -0.397 8.551 -0.000) 8.560 12.778 ( -2.162 9.749 -0.000) 9.986 12.814 ( 18.918 3.371 0.000) 19.216 13.123 ( -10.202 -4.273 0.000) 11.061 13.434 ( -2.277 2.594 0.000) 3.452 13.548 ( -12.216 -0.593 0.000) 12.230 16.685 ( 4.887 1.442 0.000) 5.095 16.782 ( -5.048 -0.749 0.000) 5.103 ======================= Grid point 351 (116/120) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( 0.000 15.559 0.000) 15.559 2.795 ( 0.000 -9.366 0.000) 9.366 3.697 ( 0.000 34.851 -0.000) 34.851 4.095 ( 0.000 9.965 0.000) 9.965 4.363 ( 0.000 -15.513 -0.000) 15.513 4.371 ( 0.000 -29.932 0.000) 29.932 5.412 ( 0.000 5.269 0.000) 5.269 5.534 ( 0.000 -2.782 0.000) 2.782 5.717 ( 0.000 -1.419 0.000) 1.419 5.725 ( 0.000 -5.660 0.000) 5.660 6.820 ( 0.000 0.978 0.000) 0.978 6.845 ( 0.000 -1.259 0.000) 1.259 6.852 ( 0.000 -0.031 -0.000) 0.031 6.861 ( 0.000 -0.961 -0.000) 0.961 7.104 ( 0.000 2.697 0.000) 2.697 7.159 ( 0.000 -2.377 0.000) 2.377 7.422 ( 0.000 3.011 0.000) 3.011 7.458 ( 0.000 14.404 -0.000) 14.404 7.483 ( 0.000 -3.623 0.000) 3.623 7.746 ( 0.000 3.936 -0.000) 3.936 7.796 ( 0.000 -0.468 0.000) 0.468 8.091 ( 0.000 -8.772 0.000) 8.772 8.334 ( 0.000 -2.484 0.000) 2.484 8.384 ( 0.000 -4.264 0.000) 4.264 9.336 ( 0.000 17.775 0.000) 17.775 9.627 ( 0.000 -9.669 0.000) 9.669 9.646 ( 0.000 8.727 -0.000) 8.727 9.734 ( 0.000 -0.534 0.000) 0.534 9.766 ( 0.000 -2.289 0.000) 2.289 9.821 ( 0.000 -8.220 0.000) 8.220 10.546 ( 0.000 9.021 0.000) 9.021 10.754 ( 0.000 -11.449 0.000) 11.449 11.453 ( 0.000 17.290 0.000) 17.290 11.879 ( 0.000 -22.995 0.000) 22.995 12.501 ( 0.000 22.041 0.000) 22.041 12.935 ( 0.000 -20.138 -0.000) 20.138 12.954 ( 0.000 7.413 0.000) 7.413 13.095 ( 0.000 -6.075 0.000) 6.075 14.233 ( 0.000 7.684 0.000) 7.684 14.361 ( 0.000 -4.931 0.000) 4.931 16.701 ( 0.000 9.913 0.000) 9.913 16.888 ( 0.000 -7.983 0.000) 7.983 ======================= Grid point 353 (117/120) ======================= q-point: ( 0.11 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.506 ( -3.116 13.432 0.000) 13.789 2.739 ( -5.556 -9.087 0.000) 10.650 3.708 ( 1.326 33.338 -0.000) 33.365 4.112 ( 1.723 10.179 0.000) 10.324 4.357 ( -1.300 -29.124 -0.000) 29.153 4.368 ( 0.563 -14.192 0.000) 14.203 5.328 ( -5.350 1.978 0.000) 5.704 5.407 ( -7.747 -4.812 0.000) 9.120 5.821 ( 11.685 6.866 0.000) 13.553 5.960 ( 14.011 -6.892 0.000) 15.615 6.833 ( 1.803 2.385 0.000) 2.990 6.883 ( 2.833 1.024 -0.000) 3.012 6.888 ( 3.638 -2.907 0.000) 4.657 6.923 ( 6.016 -2.423 -0.000) 6.485 7.212 ( 10.113 2.325 0.000) 10.377 7.255 ( 9.128 -1.406 0.000) 9.236 7.396 ( -6.700 12.994 -0.000) 14.619 7.437 ( 2.217 2.511 0.000) 3.349 7.497 ( 2.039 -3.501 0.000) 4.052 7.623 ( -11.522 0.510 0.000) 11.533 7.738 ( -6.454 0.018 0.000) 6.454 7.940 ( -9.694 -10.357 0.000) 14.186 8.340 ( 3.072 7.837 0.000) 8.417 8.522 ( 6.873 -8.409 0.000) 10.861 9.307 ( -3.172 17.726 0.000) 18.008 9.614 ( -3.602 -12.256 0.000) 12.774 9.740 ( 2.773 1.805 -0.000) 3.309 9.743 ( 9.282 6.585 0.000) 11.381 9.781 ( 1.801 -2.227 0.000) 2.864 9.888 ( 6.591 -7.352 0.000) 9.874 10.570 ( 2.355 8.831 0.000) 9.139 10.770 ( 1.572 -10.899 0.000) 11.012 11.421 ( -3.196 17.090 0.000) 17.386 11.849 ( -3.154 -23.438 0.000) 23.650 12.512 ( 1.254 21.076 0.000) 21.114 12.928 ( -0.537 -19.436 -0.000) 19.443 12.949 ( -0.479 7.057 0.000) 7.073 13.076 ( -1.909 -4.959 0.000) 5.313 14.169 ( -6.529 7.365 0.000) 9.842 14.291 ( -7.173 -4.652 0.000) 8.549 16.697 ( -0.353 9.451 0.000) 9.458 16.876 ( -1.216 -7.663 0.000) 7.759 ======================= Grid point 355 (118/120) ======================= q-point: ( 0.22 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -5.094 8.277 0.000) 9.719 2.599 ( -8.458 -8.575 0.000) 12.044 3.759 ( 4.237 28.626 0.000) 28.938 4.161 ( 3.279 10.477 0.000) 10.978 4.325 ( -2.063 -25.800 -0.000) 25.882 4.383 ( 0.767 -10.518 0.000) 10.546 5.259 ( -0.978 0.956 0.000) 1.368 5.324 ( -0.549 -4.983 0.000) 5.013 6.045 ( 9.651 9.817 0.000) 13.766 6.199 ( 9.802 -5.339 0.000) 11.162 6.887 ( 3.530 2.946 -0.000) 4.598 6.927 ( -0.287 5.258 -0.000) 5.266 6.963 ( 3.641 -4.356 0.000) 5.677 7.055 ( 6.083 -4.107 -0.000) 7.339 7.210 ( -10.922 3.940 0.000) 11.611 7.337 ( -15.567 -5.786 -0.000) 16.608 7.361 ( 3.513 3.993 0.000) 5.319 7.434 ( 4.855 -3.333 0.000) 5.889 7.590 ( 16.599 2.597 0.000) 16.800 7.616 ( -3.043 8.949 -0.000) 9.453 7.646 ( 15.521 -2.659 0.000) 15.748 7.852 ( -0.144 -12.871 -0.000) 12.872 8.383 ( 0.630 12.446 0.000) 12.462 8.605 ( 1.748 -8.144 0.000) 8.330 9.206 ( -7.482 15.995 0.000) 17.659 9.470 ( -10.650 -9.307 0.000) 14.143 9.818 ( 4.219 1.815 0.000) 4.593 9.873 ( 7.871 -3.703 0.000) 8.699 9.959 ( 11.947 3.518 0.000) 12.454 10.055 ( 10.090 -5.699 0.000) 11.588 10.632 ( 3.960 8.110 0.000) 9.025 10.809 ( 2.167 -9.189 0.000) 9.441 11.339 ( -4.945 15.618 0.000) 16.382 11.756 ( -6.548 -23.973 0.000) 24.851 12.561 ( 4.312 17.971 0.000) 18.481 12.924 ( 0.359 -17.150 0.000) 17.154 12.936 ( -0.924 6.213 0.000) 6.282 13.026 ( -3.086 -2.127 0.000) 3.748 13.989 ( -11.814 6.409 0.000) 13.440 14.093 ( -13.056 -3.853 0.000) 13.613 16.692 ( -0.078 7.959 0.000) 7.960 16.844 ( -2.020 -6.579 0.000) 6.882 ======================= Grid point 357 (119/120) ======================= q-point: ( 0.33 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( -4.308 2.450 0.000) 4.956 2.436 ( -7.879 -7.822 0.000) 11.102 3.872 ( 7.252 20.242 0.000) 21.502 4.234 ( 4.163 9.553 0.000) 10.420 4.270 ( -3.941 -17.895 -0.000) 18.324 4.390 ( -0.193 -5.127 0.000) 5.131 5.318 ( 7.399 0.872 0.000) 7.450 5.384 ( 6.685 -5.301 0.000) 8.531 6.108 ( -4.626 9.586 0.000) 10.644 6.277 ( -4.805 -6.942 0.000) 8.442 6.816 ( -5.861 13.400 0.000) 14.626 6.955 ( 3.151 1.439 0.000) 3.464 7.015 ( 1.584 -4.435 0.000) 4.710 7.068 ( -3.100 0.523 0.000) 3.144 7.096 ( -2.589 -6.331 0.000) 6.840 7.174 ( -1.246 -8.066 0.000) 8.161 7.411 ( 2.490 4.122 0.000) 4.816 7.477 ( 1.078 -2.349 0.000) 2.585 7.653 ( 6.253 10.345 0.000) 12.088 7.904 ( 4.425 -13.757 0.000) 14.451 7.989 ( 22.449 1.395 0.000) 22.492 8.019 ( 21.561 -1.363 -0.000) 21.604 8.365 ( -1.694 13.173 0.000) 13.282 8.591 ( -3.041 -8.419 0.000) 8.952 9.018 ( -11.954 12.024 0.000) 16.955 9.215 ( -15.733 -6.984 0.000) 17.213 9.919 ( 6.152 5.640 0.000) 8.347 10.029 ( 7.089 -4.360 0.000) 8.323 10.172 ( 9.731 2.747 0.000) 10.112 10.243 ( 8.392 -4.029 0.000) 9.309 10.712 ( 4.047 6.140 0.000) 7.353 10.840 ( 0.794 -6.325 0.000) 6.374 11.255 ( -2.876 9.890 0.000) 10.300 11.599 ( -9.505 -22.417 0.000) 24.349 12.692 ( 9.367 12.566 0.000) 15.673 12.917 ( -0.916 5.305 0.000) 5.384 12.955 ( 3.095 -12.891 -0.000) 13.257 12.966 ( -2.938 1.047 0.000) 3.119 13.732 ( -14.259 4.844 0.000) 15.059 13.807 ( -15.894 -2.670 0.000) 16.116 16.698 ( 0.763 5.362 0.000) 5.416 16.802 ( -2.299 -4.531 0.000) 5.080 ======================= Grid point 359 (120/120) ======================= q-point: ( 0.44 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.25e-05 2.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -0.535 -2.538 0.000) 2.594 2.315 ( -4.350 -6.012 0.000) 7.421 4.024 ( 8.079 8.211 0.000) 11.520 4.168 ( -6.595 -5.558 0.000) 8.625 4.312 ( 3.704 6.296 0.000) 7.304 4.369 ( -2.055 0.969 0.000) 2.272 5.528 ( 12.558 -0.197 0.000) 12.560 5.566 ( 10.564 -3.699 0.000) 11.192 5.921 ( -10.641 4.391 0.000) 11.512 6.012 ( -17.384 -4.079 0.000) 17.857 6.849 ( 6.489 12.033 0.000) 13.671 6.982 ( -6.371 7.827 -0.000) 10.092 7.003 ( 1.847 -1.100 0.000) 2.150 7.025 ( -0.403 -3.253 0.000) 3.277 7.099 ( 2.704 -10.768 0.000) 11.103 7.151 ( -2.075 -8.667 0.000) 8.912 7.458 ( 2.085 2.618 0.000) 3.347 7.484 ( -0.502 0.093 0.000) 0.510 7.811 ( 8.852 7.784 0.000) 11.788 7.939 ( -2.814 -2.762 0.000) 3.943 8.376 ( 4.122 2.389 0.000) 4.764 8.400 ( 19.755 2.918 0.000) 19.970 8.453 ( 22.656 -2.192 0.000) 22.761 8.495 ( -6.567 -7.151 0.000) 9.709 8.748 ( -16.012 7.188 0.000) 17.552 8.870 ( -19.942 -4.553 0.000) 20.455 10.040 ( 5.740 6.486 0.000) 8.662 10.104 ( 0.024 1.241 0.000) 1.241 10.318 ( 5.028 1.877 0.000) 5.367 10.349 ( 2.111 -0.945 0.000) 2.313 10.782 ( 3.178 2.106 0.000) 3.813 10.831 ( -1.722 -2.557 0.000) 3.083 11.263 ( 4.270 -2.955 0.000) 5.193 11.407 ( -9.694 -15.907 0.000) 18.628 12.905 ( 11.394 5.326 -0.002) 12.577 12.906 ( -0.008 4.471 0.002) 4.471 12.921 ( -1.590 3.280 0.000) 3.645 13.019 ( 1.298 -5.605 0.000) 5.753 13.488 ( -8.346 2.409 0.000) 8.687 13.528 ( -11.189 -1.459 0.000) 11.284 16.721 ( 1.627 1.974 0.000) 2.558 16.758 ( -2.154 -1.546 0.000) 2.651 =================== 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 3/26460 10.0 4018.516 2742.925 2839.967 0.000 0.000 0.000 3/26460 20.0 1107.881 810.456 965.662 0.000 0.000 0.000 3/26460 30.0 426.190 299.061 392.843 0.000 0.000 0.000 3/26460 40.0 192.322 142.242 197.902 0.000 0.000 0.000 3/26460 50.0 102.168 78.961 115.925 0.000 0.000 0.000 3/26460 60.0 62.480 49.784 76.790 0.000 0.000 0.000 3/26460 70.0 42.549 34.644 55.725 0.000 0.000 0.000 3/26460 80.0 31.380 25.940 43.154 0.000 0.000 0.000 3/26460 90.0 24.541 20.499 35.008 0.000 0.000 0.000 3/26460 100.0 20.044 16.862 29.380 0.000 0.000 0.000 3/26460 110.0 16.913 14.295 25.292 0.000 0.000 0.000 3/26460 120.0 14.628 12.404 22.204 0.000 0.000 0.000 3/26460 130.0 12.897 10.960 19.795 0.000 0.000 0.000 3/26460 140.0 11.544 9.825 17.868 0.000 0.000 0.000 3/26460 150.0 10.458 8.911 16.293 0.000 0.000 0.000 3/26460 160.0 9.569 8.159 14.982 0.000 0.000 0.000 3/26460 170.0 8.826 7.530 13.875 0.000 0.000 0.000 3/26460 180.0 8.196 6.996 12.926 0.000 0.000 0.000 3/26460 190.0 7.655 6.536 12.104 0.000 0.000 0.000 3/26460 200.0 7.185 6.137 11.385 0.000 0.000 0.000 3/26460 210.0 6.773 5.786 10.751 0.000 0.000 0.000 3/26460 220.0 6.408 5.475 10.186 0.000 0.000 0.000 3/26460 230.0 6.082 5.198 9.681 0.000 0.000 0.000 3/26460 240.0 5.789 4.949 9.225 0.000 0.000 0.000 3/26460 250.0 5.525 4.724 8.813 0.000 0.000 0.000 3/26460 260.0 5.285 4.519 8.437 0.000 0.000 0.000 3/26460 270.0 5.066 4.332 8.093 0.000 0.000 0.000 3/26460 280.0 4.865 4.161 7.777 0.000 0.000 0.000 3/26460 290.0 4.680 4.003 7.486 0.000 0.000 0.000 3/26460 300.0 4.509 3.858 7.216 0.000 0.000 0.000 3/26460 310.0 4.351 3.722 6.966 0.000 0.000 0.000 3/26460 320.0 4.204 3.597 6.734 0.000 0.000 0.000 3/26460 330.0 4.067 3.480 6.516 0.000 0.000 0.000 3/26460 340.0 3.939 3.370 6.313 0.000 0.000 0.000 3/26460 350.0 3.818 3.268 6.123 0.000 0.000 0.000 3/26460 360.0 3.706 3.171 5.943 0.000 0.000 0.000 3/26460 370.0 3.600 3.081 5.775 0.000 0.000 0.000 3/26460 380.0 3.499 2.995 5.616 0.000 0.000 0.000 3/26460 390.0 3.405 2.914 5.465 0.000 0.000 0.000 3/26460 400.0 3.316 2.838 5.323 0.000 0.000 0.000 3/26460 410.0 3.231 2.766 5.188 0.000 0.000 0.000 3/26460 420.0 3.150 2.697 5.060 0.000 0.000 0.000 3/26460 430.0 3.074 2.632 4.938 0.000 0.000 0.000 3/26460 440.0 3.001 2.570 4.822 0.000 0.000 0.000 3/26460 450.0 2.932 2.510 4.711 0.000 0.000 0.000 3/26460 460.0 2.866 2.454 4.606 0.000 0.000 0.000 3/26460 470.0 2.803 2.400 4.505 0.000 0.000 0.000 3/26460 480.0 2.742 2.348 4.408 0.000 0.000 0.000 3/26460 490.0 2.685 2.299 4.316 0.000 0.000 0.000 3/26460 500.0 2.629 2.251 4.228 0.000 0.000 0.000 3/26460 510.0 2.576 2.206 4.143 0.000 0.000 0.000 3/26460 520.0 2.525 2.162 4.061 0.000 0.000 0.000 3/26460 530.0 2.476 2.121 3.983 0.000 0.000 0.000 3/26460 540.0 2.429 2.080 3.908 0.000 0.000 0.000 3/26460 550.0 2.384 2.042 3.835 0.000 0.000 0.000 3/26460 560.0 2.340 2.004 3.765 0.000 0.000 0.000 3/26460 570.0 2.298 1.968 3.698 0.000 0.000 0.000 3/26460 580.0 2.258 1.934 3.633 0.000 0.000 0.000 3/26460 590.0 2.219 1.900 3.570 0.000 0.000 0.000 3/26460 600.0 2.181 1.868 3.510 0.000 0.000 0.000 3/26460 610.0 2.145 1.837 3.451 0.000 0.000 0.000 3/26460 620.0 2.109 1.807 3.395 0.000 0.000 0.000 3/26460 630.0 2.075 1.777 3.340 0.000 0.000 0.000 3/26460 640.0 2.042 1.749 3.287 0.000 0.000 0.000 3/26460 650.0 2.010 1.722 3.236 0.000 0.000 0.000 3/26460 660.0 1.979 1.695 3.186 0.000 0.000 0.000 3/26460 670.0 1.949 1.670 3.138 0.000 0.000 0.000 3/26460 680.0 1.920 1.645 3.091 0.000 0.000 0.000 3/26460 690.0 1.892 1.621 3.046 0.000 0.000 0.000 3/26460 700.0 1.864 1.597 3.002 0.000 0.000 0.000 3/26460 710.0 1.838 1.574 2.959 0.000 0.000 0.000 3/26460 720.0 1.812 1.552 2.918 0.000 0.000 0.000 3/26460 730.0 1.787 1.531 2.877 0.000 0.000 0.000 3/26460 740.0 1.762 1.510 2.838 0.000 0.000 0.000 3/26460 750.0 1.739 1.489 2.800 0.000 0.000 0.000 3/26460 760.0 1.715 1.469 2.763 0.000 0.000 0.000 3/26460 770.0 1.693 1.450 2.727 0.000 0.000 0.000 3/26460 780.0 1.671 1.431 2.691 0.000 0.000 0.000 3/26460 790.0 1.649 1.413 2.657 0.000 0.000 0.000 3/26460 800.0 1.629 1.395 2.623 0.000 0.000 0.000 3/26460 810.0 1.608 1.378 2.591 0.000 0.000 0.000 3/26460 820.0 1.588 1.361 2.559 0.000 0.000 0.000 3/26460 830.0 1.569 1.344 2.528 0.000 0.000 0.000 3/26460 840.0 1.550 1.328 2.498 0.000 0.000 0.000 3/26460 850.0 1.532 1.312 2.468 0.000 0.000 0.000 3/26460 860.0 1.514 1.297 2.439 0.000 0.000 0.000 3/26460 870.0 1.496 1.282 2.411 0.000 0.000 0.000 3/26460 880.0 1.479 1.267 2.383 0.000 0.000 0.000 3/26460 890.0 1.462 1.253 2.356 0.000 0.000 0.000 3/26460 900.0 1.446 1.239 2.330 0.000 0.000 0.000 3/26460 910.0 1.430 1.225 2.304 0.000 0.000 0.000 3/26460 920.0 1.414 1.212 2.279 0.000 0.000 0.000 3/26460 930.0 1.399 1.199 2.254 0.000 0.000 0.000 3/26460 940.0 1.384 1.186 2.230 0.000 0.000 0.000 3/26460 950.0 1.369 1.173 2.207 0.000 0.000 0.000 3/26460 960.0 1.355 1.161 2.184 0.000 0.000 0.000 3/26460 970.0 1.341 1.149 2.161 0.000 0.000 0.000 3/26460 980.0 1.327 1.137 2.139 0.000 0.000 0.000 3/26460 990.0 1.314 1.125 2.117 0.000 0.000 0.000 3/26460 1000.0 1.300 1.114 2.096 0.000 0.000 0.000 3/26460 Thermal conductivity related properties were written into "kappa-m9514.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:47:17]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|