----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 21:03:33]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) Number of symmetry operations in supercell: 72 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.568836440245227 1.483118410279699 4.863400859999993 b -2.568836440245222 1.483118410279699 4.863400859999993 c 0.000000000000003 -2.966236820559402 4.863400859999993 Atomic positions (fractional): *1 F 0.10893244044204 0.43351691442011 0.72255590998473 18.998 2 F 0.43351691442010 0.72255590998473 0.10893244044204 18.998 3 F 0.27744409001527 0.89106755955796 0.56648308557990 18.998 4 F 0.56648308557990 0.27744409001527 0.89106755955796 18.998 5 F 0.89106755955796 0.56648308557990 0.27744409001527 18.998 6 F 0.72255590998473 0.10893244044204 0.43351691442010 18.998 *7 Cd 0.00000000000000 0.00000000000000 0.00000000000000 112.411 *8 Pt 0.50000000000000 0.50000000000000 0.50000000000000 195.084 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.137672880490450 0.000000000000000 0.000000000000000 b -2.568836440245225 4.449355230839101 0.000000000000000 c 0.000000000000000 0.000000000000000 14.590202579999996 Atomic positions (fractional): *1 F 0.02059735215975 0.36577917829756 0.08833508828229 18.998 > 1 2 F 0.34518182613781 0.97940264784025 0.08833508828229 18.998 > 2 3 F 0.03244584496423 0.67851515947115 0.24499824505104 18.998 > 3 4 F 0.32148484052885 0.35393068549308 0.24499824505104 18.998 > 4 5 F 0.64606931450692 0.96755415503577 0.24499824505104 18.998 > 5 6 F 0.63422082170244 0.65481817386219 0.08833508828229 18.998 > 6 7 F 0.68726401882642 0.69911251163090 0.42166842161562 18.998 > 1 8 F 0.01184849280448 0.31273598117358 0.42166842161562 18.998 > 2 9 F 0.69911251163090 0.01184849280448 0.57833157838438 18.998 > 3 10 F 0.98815150719552 0.68726401882642 0.57833157838438 18.998 > 4 11 F 0.31273598117358 0.30088748836910 0.57833157838438 18.998 > 5 12 F 0.30088748836910 0.98815150719552 0.42166842161562 18.998 > 6 13 F 0.35393068549308 0.03244584496423 0.75500175494896 18.998 > 1 14 F 0.67851515947115 0.64606931450692 0.75500175494896 18.998 > 2 15 F 0.36577917829756 0.34518182613781 0.91166491171771 18.998 > 3 16 F 0.65481817386219 0.02059735215975 0.91166491171771 18.998 > 4 17 F 0.97940264784025 0.63422082170244 0.91166491171771 18.998 > 5 18 F 0.96755415503577 0.32148484052885 0.75500175494896 18.998 > 6 *19 Cd 0.00000000000000 0.00000000000000 0.00000000000000 112.411 > 7 20 Cd 0.66666666666667 0.33333333333333 0.33333333333333 112.411 > 7 21 Cd 0.33333333333333 0.66666666666667 0.66666666666667 112.411 > 7 *22 Pt 0.33333333333333 0.66666666666667 0.16666666666667 195.084 > 8 23 Pt 0.00000000000000 0.00000000000000 0.50000000000000 195.084 > 8 24 Pt 0.66666666666667 0.33333333333333 0.83333333333333 195.084 > 8 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.275345760980899 0.000000000000000 0.000000000000000 b -5.137672880490450 8.898710461678203 0.000000000000000 c 0.000000000000000 0.000000000000000 14.590202579999996 Atomic positions (fractional): *1 F 0.01029867607988 0.18288958914878 0.08833508828229 18.998 > 1 2 F 0.51029867607988 0.18288958914878 0.08833508828229 18.998 > 1 3 F 0.01029867607988 0.68288958914878 0.08833508828229 18.998 > 1 4 F 0.51029867607988 0.68288958914878 0.08833508828229 18.998 > 1 5 F 0.17259091306891 0.48970132392012 0.08833508828229 18.998 > 2 6 F 0.67259091306891 0.48970132392012 0.08833508828229 18.998 > 2 7 F 0.17259091306891 0.98970132392012 0.08833508828229 18.998 > 2 8 F 0.67259091306891 0.98970132392012 0.08833508828229 18.998 > 2 9 F 0.01622292248212 0.33925757973557 0.24499824505104 18.998 > 3 10 F 0.51622292248211 0.33925757973557 0.24499824505104 18.998 > 3 11 F 0.01622292248212 0.83925757973557 0.24499824505104 18.998 > 3 12 F 0.51622292248211 0.83925757973557 0.24499824505104 18.998 > 3 13 F 0.16074242026443 0.17696534274654 0.24499824505104 18.998 > 4 14 F 0.66074242026443 0.17696534274654 0.24499824505104 18.998 > 4 15 F 0.16074242026443 0.67696534274654 0.24499824505104 18.998 > 4 16 F 0.66074242026443 0.67696534274654 0.24499824505104 18.998 > 4 17 F 0.32303465725346 0.48377707751789 0.24499824505104 18.998 > 5 18 F 0.82303465725346 0.48377707751789 0.24499824505104 18.998 > 5 19 F 0.32303465725346 0.98377707751789 0.24499824505104 18.998 > 5 20 F 0.82303465725346 0.98377707751789 0.24499824505104 18.998 > 5 21 F 0.31711041085122 0.32740908693109 0.08833508828229 18.998 > 6 22 F 0.81711041085122 0.32740908693109 0.08833508828229 18.998 > 6 23 F 0.31711041085122 0.82740908693109 0.08833508828229 18.998 > 6 24 F 0.81711041085122 0.82740908693109 0.08833508828229 18.998 > 6 25 F 0.34363200941321 0.34955625581545 0.42166842161562 18.998 > 1 26 F 0.84363200941321 0.34955625581545 0.42166842161562 18.998 > 1 27 F 0.34363200941321 0.84955625581545 0.42166842161562 18.998 > 1 28 F 0.84363200941321 0.84955625581545 0.42166842161562 18.998 > 1 29 F 0.00592424640224 0.15636799058679 0.42166842161562 18.998 > 2 30 F 0.50592424640224 0.15636799058679 0.42166842161562 18.998 > 2 31 F 0.00592424640224 0.65636799058679 0.42166842161562 18.998 > 2 32 F 0.50592424640224 0.65636799058679 0.42166842161562 18.998 > 2 33 F 0.34955625581545 0.00592424640224 0.57833157838438 18.998 > 3 34 F 0.84955625581545 0.00592424640224 0.57833157838438 18.998 > 3 35 F 0.34955625581545 0.50592424640224 0.57833157838438 18.998 > 3 36 F 0.84955625581545 0.50592424640224 0.57833157838438 18.998 > 3 37 F 0.49407575359776 0.34363200941321 0.57833157838438 18.998 > 4 38 F 0.99407575359776 0.34363200941321 0.57833157838438 18.998 > 4 39 F 0.49407575359776 0.84363200941321 0.57833157838438 18.998 > 4 40 F 0.99407575359776 0.84363200941321 0.57833157838438 18.998 > 4 41 F 0.15636799058679 0.15044374418455 0.57833157838438 18.998 > 5 42 F 0.65636799058679 0.15044374418455 0.57833157838438 18.998 > 5 43 F 0.15636799058679 0.65044374418455 0.57833157838438 18.998 > 5 44 F 0.65636799058679 0.65044374418455 0.57833157838438 18.998 > 5 45 F 0.15044374418455 0.49407575359776 0.42166842161562 18.998 > 6 46 F 0.65044374418455 0.49407575359776 0.42166842161562 18.998 > 6 47 F 0.15044374418455 0.99407575359776 0.42166842161562 18.998 > 6 48 F 0.65044374418455 0.99407575359776 0.42166842161562 18.998 > 6 49 F 0.17696534274654 0.01622292248212 0.75500175494896 18.998 > 1 50 F 0.67696534274654 0.01622292248212 0.75500175494896 18.998 > 1 51 F 0.17696534274654 0.51622292248211 0.75500175494896 18.998 > 1 52 F 0.67696534274654 0.51622292248211 0.75500175494896 18.998 > 1 53 F 0.33925757973557 0.32303465725346 0.75500175494896 18.998 > 2 54 F 0.83925757973557 0.32303465725346 0.75500175494896 18.998 > 2 55 F 0.33925757973557 0.82303465725346 0.75500175494896 18.998 > 2 56 F 0.83925757973557 0.82303465725346 0.75500175494896 18.998 > 2 57 F 0.18288958914878 0.17259091306891 0.91166491171771 18.998 > 3 58 F 0.68288958914878 0.17259091306891 0.91166491171771 18.998 > 3 59 F 0.18288958914878 0.67259091306891 0.91166491171771 18.998 > 3 60 F 0.68288958914878 0.67259091306891 0.91166491171771 18.998 > 3 61 F 0.32740908693109 0.01029867607988 0.91166491171771 18.998 > 4 62 F 0.82740908693109 0.01029867607988 0.91166491171771 18.998 > 4 63 F 0.32740908693109 0.51029867607988 0.91166491171771 18.998 > 4 64 F 0.82740908693109 0.51029867607988 0.91166491171771 18.998 > 4 65 F 0.48970132392012 0.31711041085122 0.91166491171771 18.998 > 5 66 F 0.98970132392012 0.31711041085122 0.91166491171771 18.998 > 5 67 F 0.48970132392012 0.81711041085122 0.91166491171771 18.998 > 5 68 F 0.98970132392012 0.81711041085122 0.91166491171771 18.998 > 5 69 F 0.48377707751789 0.16074242026443 0.75500175494896 18.998 > 6 70 F 0.98377707751789 0.16074242026443 0.75500175494896 18.998 > 6 71 F 0.48377707751789 0.66074242026443 0.75500175494896 18.998 > 6 72 F 0.98377707751789 0.66074242026443 0.75500175494896 18.998 > 6 *73 Cd 0.00000000000000 0.00000000000000 0.00000000000000 112.411 > 7 74 Cd 0.50000000000000 0.00000000000000 0.00000000000000 112.411 > 7 75 Cd 0.00000000000000 0.50000000000000 0.00000000000000 112.411 > 7 76 Cd 0.50000000000000 0.50000000000000 0.00000000000000 112.411 > 7 77 Cd 0.33333333333333 0.16666666666667 0.33333333333333 112.411 > 7 78 Cd 0.83333333333333 0.16666666666667 0.33333333333333 112.411 > 7 79 Cd 0.33333333333333 0.66666666666667 0.33333333333333 112.411 > 7 80 Cd 0.83333333333333 0.66666666666667 0.33333333333333 112.411 > 7 81 Cd 0.16666666666667 0.33333333333333 0.66666666666667 112.411 > 7 82 Cd 0.66666666666667 0.33333333333333 0.66666666666667 112.411 > 7 83 Cd 0.16666666666667 0.83333333333333 0.66666666666667 112.411 > 7 84 Cd 0.66666666666667 0.83333333333333 0.66666666666667 112.411 > 7 *85 Pt 0.16666666666667 0.33333333333333 0.16666666666667 195.084 > 8 86 Pt 0.66666666666667 0.33333333333333 0.16666666666667 195.084 > 8 87 Pt 0.16666666666667 0.83333333333333 0.16666666666667 195.084 > 8 88 Pt 0.66666666666667 0.83333333333333 0.16666666666667 195.084 > 8 89 Pt 0.00000000000000 0.00000000000000 0.50000000000000 195.084 > 8 90 Pt 0.50000000000000 0.00000000000000 0.50000000000000 195.084 > 8 91 Pt 0.00000000000000 0.50000000000000 0.50000000000000 195.084 > 8 92 Pt 0.50000000000000 0.50000000000000 0.50000000000000 195.084 > 8 93 Pt 0.33333333333333 0.16666666666667 0.83333333333333 195.084 > 8 94 Pt 0.83333333333333 0.16666666666667 0.83333333333333 195.084 > 8 95 Pt 0.33333333333333 0.66666666666667 0.83333333333333 195.084 > 8 96 Pt 0.83333333333333 0.66666666666667 0.83333333333333 195.084 > 8 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.0344338 -0.0000000 0.0000000 0.0000000 3.0344338 0.0000000 0.0000000 0.0000000 3.2295200 -------------------------- Born effective charges -------------------------- 1 F -0.5486430 -0.2192093 -0.1943410 -0.2570128 -1.2669959 -0.7378162 -0.2316269 -0.7015520 -0.9671685 2 F -0.8811975 0.4490132 -0.5417971 0.4112097 -0.9344414 0.5372124 -0.4917484 0.5513707 -0.9671685 3 F -1.2936179 -0.1730987 0.7361381 -0.2109022 -0.5220210 0.2006038 0.7233753 0.1501812 -0.9671685 4 F -0.8811975 0.4490132 -0.5417971 0.4112097 -0.9344414 0.5372124 -0.4917484 0.5513707 -0.9671685 5 F -0.5486430 -0.2192093 -0.1943410 -0.2570128 -1.2669959 -0.7378162 -0.2316269 -0.7015520 -0.9671685 6 F -1.2936179 -0.1730987 0.7361381 -0.2109022 -0.5220210 0.2006038 0.7233753 0.1501812 -0.9671685 7 Cd 2.5770493 0.3545882 0.0000000 -0.3545882 2.5770493 0.0000000 -0.0000000 -0.0000000 2.8909173 8 Pt 2.8698673 -0.4679988 0.0000000 0.4679988 2.8698673 0.0000000 -0.0000000 -0.0000000 2.9120935 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 288/288 Permutation basis: 4920/4920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 620 Number of blocks in projector: 292 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 284 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 256 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 80 Use standard eigh solver. Tree of FC basis block matrices: - (620, 606), data: False |-- (80, 77), data: True |-- (256, 252), data: True |-- (284, 277), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.010 Solver_block: 100 / 160 - Time: 0.504 Solver_block: 160 / 160 - Time: 0.320 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.842 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yz) -0.00000000 (yz) Permutation basis: 288/288 Permutation basis: 4920/4920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 620 Number of blocks in projector: 292 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 284 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 256 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 80 Use standard eigh solver. Tree of FC basis block matrices: - (620, 606), data: False |-- (80, 77), data: True |-- (256, 252), data: True |-- (284, 277), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 21:03:43]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:03:43]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.568836440245227 1.483118410279699 4.863400859999993 b -2.568836440245222 1.483118410279699 4.863400859999993 c 0.000000000000003 -2.966236820559402 4.863400859999993 Atomic positions (fractional): 1 F 0.10893244044204 0.43351691442011 0.72255590998473 18.998 2 F 0.43351691442010 0.72255590998473 0.10893244044204 18.998 3 F 0.27744409001527 0.89106755955796 0.56648308557990 18.998 4 F 0.56648308557990 0.27744409001527 0.89106755955796 18.998 5 F 0.89106755955796 0.56648308557990 0.27744409001527 18.998 6 F 0.72255590998473 0.10893244044204 0.43351691442010 18.998 7 Cd 0.00000000000000 0.00000000000000 0.00000000000000 112.411 8 Pt 0.50000000000000 0.50000000000000 0.50000000000000 195.084 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.275345760980899 0.000000000000000 0.000000000000000 b -5.137672880490450 8.898710461678203 0.000000000000000 c 0.000000000000000 0.000000000000000 14.590202579999996 Atomic positions (fractional): 1 F 0.01029867607988 0.18288958914878 0.08833508828229 18.998 > 1 2 F 0.51029867607988 0.18288958914878 0.08833508828229 18.998 > 1 3 F 0.01029867607988 0.68288958914878 0.08833508828229 18.998 > 1 4 F 0.51029867607988 0.68288958914878 0.08833508828229 18.998 > 1 5 F 0.17259091306891 0.48970132392012 0.08833508828229 18.998 > 5 6 F 0.67259091306891 0.48970132392012 0.08833508828229 18.998 > 5 7 F 0.17259091306891 0.98970132392012 0.08833508828229 18.998 > 5 8 F 0.67259091306891 0.98970132392012 0.08833508828229 18.998 > 5 9 F 0.01622292248212 0.33925757973557 0.24499824505104 18.998 > 9 10 F 0.51622292248211 0.33925757973557 0.24499824505104 18.998 > 9 11 F 0.01622292248212 0.83925757973557 0.24499824505104 18.998 > 9 12 F 0.51622292248211 0.83925757973557 0.24499824505104 18.998 > 9 13 F 0.16074242026443 0.17696534274654 0.24499824505104 18.998 > 13 14 F 0.66074242026443 0.17696534274654 0.24499824505104 18.998 > 13 15 F 0.16074242026443 0.67696534274654 0.24499824505104 18.998 > 13 16 F 0.66074242026443 0.67696534274654 0.24499824505104 18.998 > 13 17 F 0.32303465725346 0.48377707751789 0.24499824505104 18.998 > 17 18 F 0.82303465725346 0.48377707751789 0.24499824505104 18.998 > 17 19 F 0.32303465725346 0.98377707751789 0.24499824505104 18.998 > 17 20 F 0.82303465725346 0.98377707751789 0.24499824505104 18.998 > 17 21 F 0.31711041085122 0.32740908693109 0.08833508828229 18.998 > 21 22 F 0.81711041085122 0.32740908693109 0.08833508828229 18.998 > 21 23 F 0.31711041085122 0.82740908693109 0.08833508828229 18.998 > 21 24 F 0.81711041085122 0.82740908693109 0.08833508828229 18.998 > 21 25 F 0.34363200941321 0.34955625581545 0.42166842161562 18.998 > 1 26 F 0.84363200941321 0.34955625581545 0.42166842161562 18.998 > 1 27 F 0.34363200941321 0.84955625581545 0.42166842161562 18.998 > 1 28 F 0.84363200941321 0.84955625581545 0.42166842161562 18.998 > 1 29 F 0.00592424640224 0.15636799058679 0.42166842161562 18.998 > 5 30 F 0.50592424640224 0.15636799058679 0.42166842161562 18.998 > 5 31 F 0.00592424640224 0.65636799058679 0.42166842161562 18.998 > 5 32 F 0.50592424640224 0.65636799058679 0.42166842161562 18.998 > 5 33 F 0.34955625581545 0.00592424640224 0.57833157838438 18.998 > 9 34 F 0.84955625581545 0.00592424640224 0.57833157838438 18.998 > 9 35 F 0.34955625581545 0.50592424640224 0.57833157838438 18.998 > 9 36 F 0.84955625581545 0.50592424640224 0.57833157838438 18.998 > 9 37 F 0.49407575359776 0.34363200941321 0.57833157838438 18.998 > 13 38 F 0.99407575359776 0.34363200941321 0.57833157838438 18.998 > 13 39 F 0.49407575359776 0.84363200941321 0.57833157838438 18.998 > 13 40 F 0.99407575359776 0.84363200941321 0.57833157838438 18.998 > 13 41 F 0.15636799058679 0.15044374418455 0.57833157838438 18.998 > 17 42 F 0.65636799058679 0.15044374418455 0.57833157838438 18.998 > 17 43 F 0.15636799058679 0.65044374418455 0.57833157838438 18.998 > 17 44 F 0.65636799058679 0.65044374418455 0.57833157838438 18.998 > 17 45 F 0.15044374418455 0.49407575359776 0.42166842161562 18.998 > 21 46 F 0.65044374418455 0.49407575359776 0.42166842161562 18.998 > 21 47 F 0.15044374418455 0.99407575359776 0.42166842161562 18.998 > 21 48 F 0.65044374418455 0.99407575359776 0.42166842161562 18.998 > 21 49 F 0.17696534274654 0.01622292248212 0.75500175494896 18.998 > 1 50 F 0.67696534274654 0.01622292248212 0.75500175494896 18.998 > 1 51 F 0.17696534274654 0.51622292248211 0.75500175494896 18.998 > 1 52 F 0.67696534274654 0.51622292248211 0.75500175494896 18.998 > 1 53 F 0.33925757973557 0.32303465725346 0.75500175494896 18.998 > 5 54 F 0.83925757973557 0.32303465725346 0.75500175494896 18.998 > 5 55 F 0.33925757973557 0.82303465725346 0.75500175494896 18.998 > 5 56 F 0.83925757973557 0.82303465725346 0.75500175494896 18.998 > 5 57 F 0.18288958914878 0.17259091306891 0.91166491171771 18.998 > 9 58 F 0.68288958914878 0.17259091306891 0.91166491171771 18.998 > 9 59 F 0.18288958914878 0.67259091306891 0.91166491171771 18.998 > 9 60 F 0.68288958914878 0.67259091306891 0.91166491171771 18.998 > 9 61 F 0.32740908693109 0.01029867607988 0.91166491171771 18.998 > 13 62 F 0.82740908693109 0.01029867607988 0.91166491171771 18.998 > 13 63 F 0.32740908693109 0.51029867607988 0.91166491171771 18.998 > 13 64 F 0.82740908693109 0.51029867607988 0.91166491171771 18.998 > 13 65 F 0.48970132392012 0.31711041085122 0.91166491171771 18.998 > 17 66 F 0.98970132392012 0.31711041085122 0.91166491171771 18.998 > 17 67 F 0.48970132392012 0.81711041085122 0.91166491171771 18.998 > 17 68 F 0.98970132392012 0.81711041085122 0.91166491171771 18.998 > 17 69 F 0.48377707751789 0.16074242026443 0.75500175494896 18.998 > 21 70 F 0.98377707751789 0.16074242026443 0.75500175494896 18.998 > 21 71 F 0.48377707751789 0.66074242026443 0.75500175494896 18.998 > 21 72 F 0.98377707751789 0.66074242026443 0.75500175494896 18.998 > 21 73 Cd 0.00000000000000 0.00000000000000 0.00000000000000 112.411 > 73 74 Cd 0.50000000000000 0.00000000000000 0.00000000000000 112.411 > 73 75 Cd 0.00000000000000 0.50000000000000 0.00000000000000 112.411 > 73 76 Cd 0.50000000000000 0.50000000000000 0.00000000000000 112.411 > 73 77 Cd 0.33333333333333 0.16666666666667 0.33333333333333 112.411 > 73 78 Cd 0.83333333333333 0.16666666666667 0.33333333333333 112.411 > 73 79 Cd 0.33333333333333 0.66666666666667 0.33333333333333 112.411 > 73 80 Cd 0.83333333333333 0.66666666666667 0.33333333333333 112.411 > 73 81 Cd 0.16666666666667 0.33333333333333 0.66666666666667 112.411 > 73 82 Cd 0.66666666666667 0.33333333333333 0.66666666666667 112.411 > 73 83 Cd 0.16666666666667 0.83333333333333 0.66666666666667 112.411 > 73 84 Cd 0.66666666666667 0.83333333333333 0.66666666666667 112.411 > 73 85 Pt 0.16666666666667 0.33333333333333 0.16666666666667 195.084 > 85 86 Pt 0.66666666666667 0.33333333333333 0.16666666666667 195.084 > 85 87 Pt 0.16666666666667 0.83333333333333 0.16666666666667 195.084 > 85 88 Pt 0.66666666666667 0.83333333333333 0.16666666666667 195.084 > 85 89 Pt 0.00000000000000 0.00000000000000 0.50000000000000 195.084 > 85 90 Pt 0.50000000000000 0.00000000000000 0.50000000000000 195.084 > 85 91 Pt 0.00000000000000 0.50000000000000 0.50000000000000 195.084 > 85 92 Pt 0.50000000000000 0.50000000000000 0.50000000000000 195.084 > 85 93 Pt 0.33333333333333 0.16666666666667 0.83333333333333 195.084 > 85 94 Pt 0.83333333333333 0.16666666666667 0.83333333333333 195.084 > 85 95 Pt 0.33333333333333 0.66666666666667 0.83333333333333 195.084 > 85 96 Pt 0.83333333333333 0.66666666666667 0.83333333333333 195.084 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.0344338 -0.0000000 0.0000000 0.0000000 3.0344338 0.0000000 0.0000000 0.0000000 3.2295200 -------------------------- Born effective charges -------------------------- 1 F -0.5486430 -0.2192093 -0.1943410 -0.2570128 -1.2669959 -0.7378162 -0.2316269 -0.7015520 -0.9671685 2 F -0.8811975 0.4490132 -0.5417971 0.4112097 -0.9344414 0.5372124 -0.4917484 0.5513707 -0.9671685 3 F -1.2936179 -0.1730987 0.7361381 -0.2109022 -0.5220210 0.2006038 0.7233753 0.1501812 -0.9671685 4 F -0.8811975 0.4490132 -0.5417971 0.4112097 -0.9344414 0.5372124 -0.4917484 0.5513707 -0.9671685 5 F -0.5486430 -0.2192093 -0.1943410 -0.2570128 -1.2669959 -0.7378162 -0.2316269 -0.7015520 -0.9671685 6 F -1.2936179 -0.1730987 0.7361381 -0.2109022 -0.5220210 0.2006038 0.7233753 0.1501812 -0.9671685 7 Cd 2.5770493 0.3545882 0.0000000 -0.3545882 2.5770493 0.0000000 -0.0000000 -0.0000000 2.8909173 8 Pt 2.8698673 -0.4679988 0.0000000 0.4679988 2.8698673 0.0000000 -0.0000000 -0.0000000 2.9120935 ---------------------------------------------------------------------------- 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] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 85, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000003 (xxz) -0.00000003 (xxz) -0.00000003 (xzx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000007 (yx) -0.00000007 (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 2026-01-07 21:03:50]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:03:51]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.568836440245227 1.483118410279699 4.863400859999993 b -2.568836440245222 1.483118410279699 4.863400859999993 c 0.000000000000003 -2.966236820559402 4.863400859999993 Atomic positions (fractional): 1 F 0.10893244044204 0.43351691442011 0.72255590998473 18.998 2 F 0.43351691442010 0.72255590998473 0.10893244044204 18.998 3 F 0.27744409001527 0.89106755955796 0.56648308557990 18.998 4 F 0.56648308557990 0.27744409001527 0.89106755955796 18.998 5 F 0.89106755955796 0.56648308557990 0.27744409001527 18.998 6 F 0.72255590998473 0.10893244044204 0.43351691442010 18.998 7 Cd 0.00000000000000 0.00000000000000 0.00000000000000 112.411 8 Pt 0.50000000000000 0.50000000000000 0.50000000000000 195.084 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.275345760980899 0.000000000000000 0.000000000000000 b -5.137672880490450 8.898710461678203 0.000000000000000 c 0.000000000000000 0.000000000000000 14.590202579999996 Atomic positions (fractional): 1 F 0.01029867607988 0.18288958914878 0.08833508828229 18.998 > 1 2 F 0.51029867607988 0.18288958914878 0.08833508828229 18.998 > 1 3 F 0.01029867607988 0.68288958914878 0.08833508828229 18.998 > 1 4 F 0.51029867607988 0.68288958914878 0.08833508828229 18.998 > 1 5 F 0.17259091306891 0.48970132392012 0.08833508828229 18.998 > 5 6 F 0.67259091306891 0.48970132392012 0.08833508828229 18.998 > 5 7 F 0.17259091306891 0.98970132392012 0.08833508828229 18.998 > 5 8 F 0.67259091306891 0.98970132392012 0.08833508828229 18.998 > 5 9 F 0.01622292248212 0.33925757973557 0.24499824505104 18.998 > 9 10 F 0.51622292248211 0.33925757973557 0.24499824505104 18.998 > 9 11 F 0.01622292248212 0.83925757973557 0.24499824505104 18.998 > 9 12 F 0.51622292248211 0.83925757973557 0.24499824505104 18.998 > 9 13 F 0.16074242026443 0.17696534274654 0.24499824505104 18.998 > 13 14 F 0.66074242026443 0.17696534274654 0.24499824505104 18.998 > 13 15 F 0.16074242026443 0.67696534274654 0.24499824505104 18.998 > 13 16 F 0.66074242026443 0.67696534274654 0.24499824505104 18.998 > 13 17 F 0.32303465725346 0.48377707751789 0.24499824505104 18.998 > 17 18 F 0.82303465725346 0.48377707751789 0.24499824505104 18.998 > 17 19 F 0.32303465725346 0.98377707751789 0.24499824505104 18.998 > 17 20 F 0.82303465725346 0.98377707751789 0.24499824505104 18.998 > 17 21 F 0.31711041085122 0.32740908693109 0.08833508828229 18.998 > 21 22 F 0.81711041085122 0.32740908693109 0.08833508828229 18.998 > 21 23 F 0.31711041085122 0.82740908693109 0.08833508828229 18.998 > 21 24 F 0.81711041085122 0.82740908693109 0.08833508828229 18.998 > 21 25 F 0.34363200941321 0.34955625581545 0.42166842161562 18.998 > 1 26 F 0.84363200941321 0.34955625581545 0.42166842161562 18.998 > 1 27 F 0.34363200941321 0.84955625581545 0.42166842161562 18.998 > 1 28 F 0.84363200941321 0.84955625581545 0.42166842161562 18.998 > 1 29 F 0.00592424640224 0.15636799058679 0.42166842161562 18.998 > 5 30 F 0.50592424640224 0.15636799058679 0.42166842161562 18.998 > 5 31 F 0.00592424640224 0.65636799058679 0.42166842161562 18.998 > 5 32 F 0.50592424640224 0.65636799058679 0.42166842161562 18.998 > 5 33 F 0.34955625581545 0.00592424640224 0.57833157838438 18.998 > 9 34 F 0.84955625581545 0.00592424640224 0.57833157838438 18.998 > 9 35 F 0.34955625581545 0.50592424640224 0.57833157838438 18.998 > 9 36 F 0.84955625581545 0.50592424640224 0.57833157838438 18.998 > 9 37 F 0.49407575359776 0.34363200941321 0.57833157838438 18.998 > 13 38 F 0.99407575359776 0.34363200941321 0.57833157838438 18.998 > 13 39 F 0.49407575359776 0.84363200941321 0.57833157838438 18.998 > 13 40 F 0.99407575359776 0.84363200941321 0.57833157838438 18.998 > 13 41 F 0.15636799058679 0.15044374418455 0.57833157838438 18.998 > 17 42 F 0.65636799058679 0.15044374418455 0.57833157838438 18.998 > 17 43 F 0.15636799058679 0.65044374418455 0.57833157838438 18.998 > 17 44 F 0.65636799058679 0.65044374418455 0.57833157838438 18.998 > 17 45 F 0.15044374418455 0.49407575359776 0.42166842161562 18.998 > 21 46 F 0.65044374418455 0.49407575359776 0.42166842161562 18.998 > 21 47 F 0.15044374418455 0.99407575359776 0.42166842161562 18.998 > 21 48 F 0.65044374418455 0.99407575359776 0.42166842161562 18.998 > 21 49 F 0.17696534274654 0.01622292248212 0.75500175494896 18.998 > 1 50 F 0.67696534274654 0.01622292248212 0.75500175494896 18.998 > 1 51 F 0.17696534274654 0.51622292248211 0.75500175494896 18.998 > 1 52 F 0.67696534274654 0.51622292248211 0.75500175494896 18.998 > 1 53 F 0.33925757973557 0.32303465725346 0.75500175494896 18.998 > 5 54 F 0.83925757973557 0.32303465725346 0.75500175494896 18.998 > 5 55 F 0.33925757973557 0.82303465725346 0.75500175494896 18.998 > 5 56 F 0.83925757973557 0.82303465725346 0.75500175494896 18.998 > 5 57 F 0.18288958914878 0.17259091306891 0.91166491171771 18.998 > 9 58 F 0.68288958914878 0.17259091306891 0.91166491171771 18.998 > 9 59 F 0.18288958914878 0.67259091306891 0.91166491171771 18.998 > 9 60 F 0.68288958914878 0.67259091306891 0.91166491171771 18.998 > 9 61 F 0.32740908693109 0.01029867607988 0.91166491171771 18.998 > 13 62 F 0.82740908693109 0.01029867607988 0.91166491171771 18.998 > 13 63 F 0.32740908693109 0.51029867607988 0.91166491171771 18.998 > 13 64 F 0.82740908693109 0.51029867607988 0.91166491171771 18.998 > 13 65 F 0.48970132392012 0.31711041085122 0.91166491171771 18.998 > 17 66 F 0.98970132392012 0.31711041085122 0.91166491171771 18.998 > 17 67 F 0.48970132392012 0.81711041085122 0.91166491171771 18.998 > 17 68 F 0.98970132392012 0.81711041085122 0.91166491171771 18.998 > 17 69 F 0.48377707751789 0.16074242026443 0.75500175494896 18.998 > 21 70 F 0.98377707751789 0.16074242026443 0.75500175494896 18.998 > 21 71 F 0.48377707751789 0.66074242026443 0.75500175494896 18.998 > 21 72 F 0.98377707751789 0.66074242026443 0.75500175494896 18.998 > 21 73 Cd 0.00000000000000 0.00000000000000 0.00000000000000 112.411 > 73 74 Cd 0.50000000000000 0.00000000000000 0.00000000000000 112.411 > 73 75 Cd 0.00000000000000 0.50000000000000 0.00000000000000 112.411 > 73 76 Cd 0.50000000000000 0.50000000000000 0.00000000000000 112.411 > 73 77 Cd 0.33333333333333 0.16666666666667 0.33333333333333 112.411 > 73 78 Cd 0.83333333333333 0.16666666666667 0.33333333333333 112.411 > 73 79 Cd 0.33333333333333 0.66666666666667 0.33333333333333 112.411 > 73 80 Cd 0.83333333333333 0.66666666666667 0.33333333333333 112.411 > 73 81 Cd 0.16666666666667 0.33333333333333 0.66666666666667 112.411 > 73 82 Cd 0.66666666666667 0.33333333333333 0.66666666666667 112.411 > 73 83 Cd 0.16666666666667 0.83333333333333 0.66666666666667 112.411 > 73 84 Cd 0.66666666666667 0.83333333333333 0.66666666666667 112.411 > 73 85 Pt 0.16666666666667 0.33333333333333 0.16666666666667 195.084 > 85 86 Pt 0.66666666666667 0.33333333333333 0.16666666666667 195.084 > 85 87 Pt 0.16666666666667 0.83333333333333 0.16666666666667 195.084 > 85 88 Pt 0.66666666666667 0.83333333333333 0.16666666666667 195.084 > 85 89 Pt 0.00000000000000 0.00000000000000 0.50000000000000 195.084 > 85 90 Pt 0.50000000000000 0.00000000000000 0.50000000000000 195.084 > 85 91 Pt 0.00000000000000 0.50000000000000 0.50000000000000 195.084 > 85 92 Pt 0.50000000000000 0.50000000000000 0.50000000000000 195.084 > 85 93 Pt 0.33333333333333 0.16666666666667 0.83333333333333 195.084 > 85 94 Pt 0.83333333333333 0.16666666666667 0.83333333333333 195.084 > 85 95 Pt 0.33333333333333 0.66666666666667 0.83333333333333 195.084 > 85 96 Pt 0.83333333333333 0.66666666666667 0.83333333333333 195.084 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.0344338 -0.0000000 0.0000000 0.0000000 3.0344338 0.0000000 0.0000000 0.0000000 3.2295200 -------------------------- Born effective charges -------------------------- 1 F -0.5486430 -0.2192093 -0.1943410 -0.2570128 -1.2669959 -0.7378162 -0.2316269 -0.7015520 -0.9671685 2 F -0.8811975 0.4490132 -0.5417971 0.4112097 -0.9344414 0.5372124 -0.4917484 0.5513707 -0.9671685 3 F -1.2936179 -0.1730987 0.7361381 -0.2109022 -0.5220210 0.2006038 0.7233753 0.1501812 -0.9671685 4 F -0.8811975 0.4490132 -0.5417971 0.4112097 -0.9344414 0.5372124 -0.4917484 0.5513707 -0.9671685 5 F -0.5486430 -0.2192093 -0.1943410 -0.2570128 -1.2669959 -0.7378162 -0.2316269 -0.7015520 -0.9671685 6 F -1.2936179 -0.1730987 0.7361381 -0.2109022 -0.5220210 0.2006038 0.7233753 0.1501812 -0.9671685 7 Cd 2.5770493 0.3545882 0.0000000 -0.3545882 2.5770493 0.0000000 -0.0000000 -0.0000000 2.8909173 8 Pt 2.8698673 -0.4679988 0.0000000 0.4679988 2.8698673 0.0000000 -0.0000000 -0.0000000 2.9120935 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000003 (xxz) -0.00000003 (xxz) -0.00000003 (xzx) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- 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 ... [ 12 12 12 ] 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: 0.86, Number of G-points: 297, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/294) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 294 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 3.415 ( 0.000 0.000 0.000) 0.000 3.415 ( 0.000 0.000 0.000) 0.000 3.910 ( 0.000 0.000 0.000) 0.000 3.910 ( 0.000 0.000 0.000) 0.000 3.924 ( 0.000 0.000 0.000) 0.000 5.528 ( 0.000 0.000 0.000) 0.000 6.277 ( 0.000 0.000 0.000) 0.000 6.277 ( 0.000 0.000 0.000) 0.000 6.876 ( 0.000 0.000 0.000) 0.000 7.043 ( 0.000 0.000 0.000) 0.000 7.043 ( 0.000 0.000 0.000) 0.000 7.368 ( 0.000 0.000 0.000) 0.000 9.217 ( 0.000 0.000 0.000) 0.000 9.587 ( 0.000 0.000 0.000) 0.000 9.587 ( 0.000 0.000 0.000) 0.000 16.984 ( 0.000 0.000 0.000) 0.000 16.984 ( 0.000 0.000 0.000) 0.000 17.111 ( 0.000 0.000 0.000) 0.000 17.162 ( 0.000 0.000 0.000) 0.000 17.162 ( 0.000 0.000 0.000) 0.000 18.062 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/294) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.295 ( -3.184 27.218 18.214) 32.905 0.429 ( 21.767 3.650 7.466) 23.299 0.508 ( 25.724 5.929 4.601) 26.797 3.250 ( -12.772 -4.354 -5.253) 14.480 3.350 ( -1.291 -9.187 -2.384) 9.579 3.937 ( -0.415 4.098 0.545) 4.155 3.997 ( 5.062 2.113 0.903) 5.560 4.416 ( -11.973 -5.858 0.772) 13.352 5.482 ( -3.729 -1.887 -0.196) 4.184 6.272 ( 0.081 -0.397 -1.256) 1.320 6.357 ( 5.807 3.644 2.468) 7.286 6.899 ( 0.753 0.970 3.336) 3.555 7.036 ( 1.147 -1.854 -1.050) 2.420 7.107 ( 4.587 3.419 3.751) 6.841 7.420 ( 3.794 2.511 0.720) 4.606 9.191 ( -3.810 -2.646 2.761) 5.398 9.579 ( 0.477 -2.005 -0.719) 2.183 9.805 ( -2.351 1.407 -7.462) 7.949 16.937 ( -2.858 0.251 -6.183) 6.816 16.998 ( -5.170 -4.728 1.247) 7.116 17.207 ( 1.842 1.846 4.535) 5.231 17.254 ( 6.026 4.188 -5.648) 9.260 18.059 ( -0.155 -0.092 -0.549) 0.578 18.605 ( -2.123 -2.516 9.114) 9.690 ======================= Grid point 2 (3/294) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.622 ( -0.833 27.034 18.801) 32.939 0.859 ( 21.378 6.103 3.982) 22.586 0.990 ( 23.986 3.553 6.897) 25.209 2.929 ( -15.764 -5.729 -6.559) 18.010 3.195 ( -2.000 -13.588 -3.784) 14.246 3.951 ( -4.252 2.029 0.234) 4.717 4.043 ( -4.647 -0.538 -3.216) 5.677 4.118 ( -9.969 -5.710 -2.402) 11.737 5.394 ( -4.291 -1.314 -0.977) 4.593 6.273 ( 1.478 -0.267 -1.101) 1.862 6.522 ( 6.800 4.867 3.303) 8.992 6.946 ( -0.090 0.753 8.176) 8.211 7.051 ( 3.555 0.136 -3.115) 4.729 7.288 ( 9.461 4.114 5.859) 11.864 7.528 ( 5.343 3.610 -0.290) 6.455 9.087 ( -6.252 -4.254 1.051) 7.634 9.552 ( 0.571 -3.947 -2.925) 4.946 9.713 ( -6.101 1.714 -4.666) 7.870 16.847 ( -4.854 2.114 -6.241) 8.185 16.886 ( -3.029 -5.702 0.496) 6.476 17.288 ( 2.341 2.127 4.777) 5.729 17.346 ( 4.188 3.483 -4.004) 6.760 18.046 ( -0.709 -0.474 -1.165) 1.444 18.597 ( -1.194 -2.885 6.494) 7.206 ======================= Grid point 3 (4/294) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( 1.087 26.416 19.151) 32.645 1.275 ( 19.850 10.026 -2.659) 22.397 1.424 ( 21.535 -0.916 11.046) 24.220 2.580 ( -15.356 -5.973 -6.008) 17.538 2.997 ( -2.607 -15.444 -4.415) 16.273 3.639 ( -18.192 -10.468 -5.073) 21.593 3.940 ( -5.756 1.087 -5.467) 8.013 4.038 ( -3.742 0.286 0.109) 3.754 5.318 ( -3.267 -0.185 -1.100) 3.452 6.301 ( 2.456 -0.018 -0.558) 2.519 6.687 ( 5.678 4.537 2.085) 7.561 7.006 ( -0.372 1.133 11.144) 11.207 7.123 ( 6.430 2.156 -3.756) 7.752 7.539 ( 12.026 2.426 8.013) 14.653 7.646 ( 5.101 4.943 -1.855) 7.341 8.925 ( -8.421 -5.491 0.446) 10.063 9.465 ( -3.455 -3.757 -8.661) 10.053 9.618 ( -4.467 0.740 0.249) 4.534 16.759 ( -4.820 1.810 -2.984) 5.951 16.799 ( -1.217 -3.887 -3.066) 5.098 17.369 ( 2.615 1.741 2.154) 3.809 17.411 ( 1.908 2.722 -0.110) 3.326 18.013 ( -1.404 -1.131 -1.667) 2.456 18.588 ( -0.751 -2.866 5.146) 5.938 ======================= Grid point 4 (5/294) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( 1.165 24.383 18.637) 30.712 1.643 ( 16.145 12.794 -10.012) 22.904 1.783 ( 16.816 -5.424 11.925) 21.317 2.286 ( -9.883 -4.539 -1.553) 10.986 2.772 ( -3.619 -16.475 -4.303) 17.408 3.235 ( -15.009 -10.112 -4.793) 18.722 3.753 ( -11.065 -1.531 -8.493) 14.032 3.993 ( -3.163 1.074 0.509) 3.379 5.273 ( -1.888 0.362 -0.603) 2.014 6.336 ( 1.948 0.048 -0.229) 1.962 6.806 ( 3.997 2.677 0.375) 4.825 7.078 ( -0.822 3.174 9.405) 9.960 7.256 ( 8.904 2.426 -1.669) 9.379 7.717 ( 5.303 -1.883 2.782) 6.277 7.843 ( 11.021 8.100 3.455) 14.107 8.725 ( -9.419 -6.352 0.524) 11.373 9.287 ( -7.694 -1.859 -10.330) 13.014 9.578 ( -1.406 -1.015 1.416) 2.239 16.693 ( -3.340 0.481 -0.515) 3.413 16.740 ( -0.340 -1.284 -4.672) 4.857 17.417 ( 1.720 0.703 -1.690) 2.512 17.468 ( 0.699 2.376 4.318) 4.978 17.965 ( -1.524 -1.558 -1.737) 2.787 18.578 ( -0.450 -2.251 3.502) 4.187 ======================= Grid point 5 (6/294) ======================= q-point: ( 0.42 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( -1.074 14.242 11.766) 18.505 1.881 ( 0.983 3.654 0.220) 3.790 1.950 ( 10.618 7.704 -7.871) 15.299 2.275 ( 8.473 -3.294 7.624) 11.865 2.525 ( -5.496 -16.096 -1.473) 17.072 2.944 ( -7.584 -6.788 -2.258) 10.425 3.499 ( -11.075 -1.138 -8.386) 13.938 3.960 ( -1.949 0.500 0.269) 2.030 5.253 ( -0.804 0.314 -0.185) 0.883 6.359 ( 0.916 0.031 -0.082) 0.920 6.874 ( 2.165 0.994 -0.113) 2.385 7.135 ( -0.575 2.529 4.818) 5.472 7.413 ( 6.932 2.671 0.020) 7.429 7.777 ( 3.178 -2.009 1.198) 3.946 8.109 ( 9.482 7.615 3.055) 12.539 8.522 ( -7.946 -7.163 1.643) 10.824 9.091 ( -7.331 -0.803 -8.283) 11.090 9.562 ( -0.389 -0.924 0.853) 1.316 16.653 ( -1.605 -0.201 0.216) 1.631 16.710 ( 0.010 0.065 -3.251) 3.252 17.429 ( 0.496 0.125 -0.892) 1.029 17.516 ( 0.284 1.452 2.766) 3.137 17.923 ( -0.864 -1.164 -1.119) 1.831 18.571 ( -0.230 -1.232 1.723) 2.130 ======================= Grid point 6 (7/294) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 436 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( 0.000 0.000 -0.000) 0.000 1.905 ( 0.000 -0.000 0.000) 0.000 2.165 ( 0.000 0.000 0.000) 0.000 2.262 ( 0.000 0.000 0.000) 0.000 2.420 ( 0.000 0.000 -0.000) 0.000 2.850 ( 0.000 0.000 0.000) 0.000 3.357 ( -0.000 0.000 -0.000) 0.000 3.946 ( 0.000 0.000 0.000) 0.000 5.248 ( 0.000 0.000 0.000) 0.000 6.366 ( 0.000 0.000 0.000) 0.000 6.895 ( 0.000 0.000 0.000) 0.000 7.157 ( 0.000 0.000 0.000) 0.000 7.490 ( 0.000 0.000 0.000) 0.000 7.797 ( 0.000 0.000 0.000) 0.000 8.275 ( 0.000 0.000 -0.000) 0.000 8.390 ( -0.000 -0.000 0.000) 0.000 8.991 ( 0.000 0.000 0.000) 0.000 9.557 ( 0.000 0.000 0.000) 0.000 16.640 ( 0.000 0.000 0.000) 0.000 16.701 ( 0.000 0.000 0.000) 0.000 17.431 ( 0.000 0.000 0.000) 0.000 17.533 ( 0.000 0.000 0.000) 0.000 17.907 ( 0.000 0.000 0.000) 0.000 18.568 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 14 (8/294) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.235 ( 17.166 11.620 1.402) 20.777 0.303 ( 0.535 4.333 18.759) 19.260 0.749 ( -5.087 27.274 20.434) 34.457 3.305 ( -0.576 -7.143 -7.362) 10.274 3.351 ( -5.702 -6.175 -0.367) 8.413 3.912 ( -0.232 0.493 -1.103) 1.230 3.951 ( 3.821 3.808 -1.112) 5.508 4.398 ( 1.469 -15.423 -2.437) 15.683 5.474 ( 0.375 -5.157 -1.059) 5.278 6.310 ( -2.713 1.605 2.519) 4.035 6.325 ( 2.518 4.662 -0.506) 5.323 6.887 ( 0.867 -2.253 2.336) 3.359 7.038 ( -3.635 -0.403 0.450) 3.685 7.174 ( 1.665 8.513 8.921) 12.443 7.422 ( -0.089 4.415 0.880) 4.503 9.215 ( -0.780 -6.340 4.002) 7.538 9.557 ( -3.040 -1.016 -3.524) 4.763 9.758 ( 3.915 2.138 -9.496) 10.491 16.995 ( 1.948 1.537 -0.779) 2.600 17.062 ( -1.327 -2.257 2.311) 3.492 17.140 ( 0.705 2.156 -7.100) 7.454 17.181 ( 0.716 1.973 -0.304) 2.121 18.056 ( -0.013 -0.038 -0.988) 0.989 18.648 ( -1.562 -7.241 9.840) 12.316 ======================= Grid point 15 (9/294) ======================= q-point: ( 0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.624 ( 17.681 -1.251 22.264) 28.458 0.679 ( 21.314 13.424 -4.378) 25.567 1.055 ( -2.880 27.146 20.428) 34.096 3.051 ( -11.301 -5.818 -14.917) 19.598 3.126 ( -9.094 -13.103 2.158) 16.095 3.962 ( 3.390 0.106 -3.043) 4.557 4.046 ( 2.484 2.624 -0.817) 3.704 4.175 ( -8.047 -13.966 -4.380) 16.702 5.403 ( -1.327 -5.065 -2.528) 5.815 6.284 ( -2.206 2.318 0.128) 3.202 6.469 ( 7.154 4.358 2.833) 8.843 6.924 ( 4.752 -3.342 3.051) 6.562 6.993 ( -0.636 -1.513 0.978) 1.910 7.346 ( 1.163 11.784 9.527) 15.198 7.497 ( 2.971 5.325 0.218) 6.101 9.119 ( -3.887 -7.112 0.597) 8.127 9.500 ( -0.550 -1.372 -4.622) 4.853 9.754 ( -0.836 -0.096 -5.072) 5.141 16.918 ( -7.229 2.947 -3.186) 8.432 16.970 ( -6.752 -2.163 3.002) 7.700 17.245 ( 5.979 -2.212 5.068) 8.144 17.261 ( 7.300 4.834 -8.720) 12.357 18.044 ( -0.514 -0.329 -1.511) 1.630 18.602 ( -0.978 -6.393 6.016) 8.833 ======================= Grid point 16 (10/294) ======================= q-point: ( 0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.040 ( 19.587 2.225 14.013) 24.187 1.109 ( 19.697 9.771 -0.320) 21.990 1.392 ( -0.464 24.972 20.210) 32.129 2.711 ( -13.031 -5.503 -14.128) 19.992 2.867 ( -5.788 -16.847 -0.986) 17.841 3.789 ( -15.017 -12.641 -3.814) 19.996 3.977 ( -1.712 0.544 -6.646) 6.885 4.085 ( -1.425 0.056 0.514) 1.516 5.322 ( -0.996 -3.862 -3.564) 5.349 6.291 ( 0.059 2.573 0.351) 2.597 6.640 ( 6.637 3.797 2.325) 7.992 6.995 ( 5.053 -6.727 9.043) 12.352 7.018 ( 4.879 1.761 -3.970) 6.532 7.535 ( 2.913 9.596 8.309) 13.024 7.613 ( 4.359 6.809 0.328) 8.091 8.973 ( -5.391 -7.891 -0.543) 9.572 9.441 ( -2.118 -1.107 -5.445) 5.946 9.687 ( -3.728 -0.599 -2.651) 4.614 16.822 ( -5.369 3.541 -4.879) 8.073 16.861 ( -6.548 -1.890 3.760) 7.784 17.325 ( 3.788 1.400 -1.686) 4.376 17.377 ( 5.920 0.809 0.332) 5.985 18.012 ( -1.299 -1.207 -2.252) 2.866 18.568 ( 0.605 -6.278 3.735) 7.330 ======================= Grid point 17 (11/294) ======================= q-point: ( 0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 17.571 8.395 0.502) 19.480 1.495 ( 17.894 2.955 6.601) 19.300 1.712 ( -0.504 19.146 18.713) 26.777 2.395 ( -11.033 -3.287 -9.362) 14.838 2.617 ( -3.316 -17.287 -3.402) 17.928 3.397 ( -16.769 -10.987 -0.634) 20.058 3.858 ( -8.073 0.183 -8.986) 12.082 4.044 ( -2.820 -0.804 -0.166) 2.937 5.262 ( 0.167 -3.275 -3.414) 4.734 6.330 ( 0.846 3.062 0.461) 3.210 6.766 ( 4.355 2.342 0.401) 4.961 7.062 ( 5.445 -6.171 3.754) 9.045 7.137 ( 8.161 2.619 1.942) 8.788 7.670 ( 2.958 3.495 0.934) 4.673 7.802 ( 7.021 9.119 5.742) 12.862 8.794 ( -7.248 -7.873 0.097) 10.701 9.338 ( -5.837 0.783 -7.681) 9.679 9.613 ( -2.968 -1.335 0.388) 3.277 16.757 ( -3.517 4.343 -5.607) 7.916 16.770 ( -5.422 -1.654 4.660) 7.338 17.378 ( 2.695 1.245 -2.736) 4.037 17.468 ( 3.667 0.018 2.900) 4.675 17.956 ( -1.440 -2.235 -2.930) 3.957 18.546 ( 1.549 -5.633 1.763) 6.103 ======================= Grid point 18 (12/294) ======================= q-point: ( 0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 6.568 2.784 -2.828) 7.674 1.778 ( 12.036 1.325 -2.384) 12.341 1.895 ( 2.618 2.293 4.648) 5.806 2.281 ( -2.187 9.952 4.529) 11.151 2.433 ( -1.226 -10.815 3.792) 11.526 3.064 ( -13.253 -8.257 3.684) 16.044 3.637 ( -11.875 0.968 -10.249) 15.716 3.987 ( -2.232 -1.543 -0.913) 2.863 5.226 ( 1.270 -3.400 -2.776) 4.569 6.371 ( -0.001 3.487 0.236) 3.495 6.840 ( 3.089 0.780 -0.135) 3.189 7.091 ( 4.236 -6.131 -1.098) 7.532 7.330 ( 8.869 3.488 4.071) 10.363 7.730 ( 2.006 1.086 -0.289) 2.299 8.040 ( 9.208 5.875 4.145) 11.683 8.600 ( -8.518 -6.790 1.946) 11.066 9.190 ( -8.592 3.085 -7.543) 11.842 9.574 ( -1.229 -1.321 1.837) 2.575 16.703 ( -3.727 0.194 1.287) 3.948 16.730 ( -2.309 3.234 -0.662) 4.028 17.407 ( 1.623 0.495 -1.989) 2.614 17.523 ( 1.430 -0.644 2.169) 2.677 17.902 ( -0.161 -2.340 -2.822) 3.670 18.532 ( 2.091 -4.564 -0.147) 5.022 ======================= Grid point 19 (13/294) ======================= q-point: ( 0.50 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( -2.860 -8.352 -7.798) 11.778 1.797 ( 2.925 -9.577 -2.510) 10.324 2.030 ( 9.909 2.571 -11.159) 15.143 2.426 ( -3.555 3.685 13.316) 14.266 2.462 ( 1.478 10.519 8.105) 13.362 2.894 ( -4.105 -2.632 8.242) 9.577 3.425 ( -8.228 3.197 -7.163) 11.368 3.939 ( -0.755 -1.790 -1.265) 2.318 5.206 ( 2.094 -3.760 -2.172) 4.820 6.395 ( -1.189 3.661 0.032) 3.849 6.882 ( 1.803 -0.246 0.127) 1.824 7.070 ( 3.139 -7.467 -5.060) 9.550 7.490 ( 3.394 2.693 2.238) 4.877 7.772 ( 2.929 0.639 0.432) 3.029 8.212 ( 5.840 -1.941 -0.439) 6.170 8.444 ( -5.803 -1.239 3.345) 6.812 9.065 ( -6.464 4.985 -2.436) 8.518 9.564 ( -0.378 -0.373 1.659) 1.742 16.664 ( -2.184 -0.080 1.580) 2.697 16.735 ( -1.596 3.769 1.704) 4.433 17.420 ( 0.945 -0.119 -0.911) 1.318 17.525 ( -0.175 -1.755 -0.672) 1.887 17.884 ( 1.495 -1.120 -1.535) 2.418 18.526 ( 2.471 -3.375 -1.891) 4.591 ======================= Grid point 20 (14/294) ======================= q-point: (-0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -3.122 -18.808 -13.632) 23.437 1.821 ( 5.932 0.141 0.554) 5.959 2.044 ( -3.218 -6.683 3.503) 8.203 2.416 ( -7.108 2.243 -4.458) 8.685 2.577 ( 0.366 11.836 -0.189) 11.843 2.977 ( 3.570 6.187 11.471) 13.513 3.429 ( 4.885 5.820 3.911) 8.546 3.919 ( 1.002 -1.518 -0.988) 2.070 5.198 ( 2.787 -3.970 -1.542) 5.090 6.402 ( -2.126 3.549 0.050) 4.138 6.891 ( -0.542 -0.989 0.879) 1.430 6.999 ( 2.979 -8.928 -9.011) 13.031 7.493 ( -4.176 -0.708 0.217) 4.241 7.829 ( 0.123 3.204 -0.199) 3.213 8.145 ( -4.670 -9.145 0.419) 10.277 8.468 ( 3.848 4.989 -2.013) 6.615 9.082 ( 1.565 5.264 5.576) 7.826 9.569 ( -0.180 0.641 0.861) 1.088 16.648 ( -0.545 -0.591 1.638) 1.825 16.766 ( -1.570 4.349 4.619) 6.535 17.427 ( 0.782 -0.548 -0.382) 1.028 17.485 ( -0.663 -2.669 -3.122) 4.160 17.907 ( 2.193 0.304 -0.232) 2.226 18.527 ( 2.727 -2.249 -3.459) 4.945 ======================= Grid point 21 (15/294) ======================= q-point: (-0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( -4.740 -21.241 -14.966) 26.413 1.825 ( -11.653 -11.365 11.590) 19.982 1.975 ( -2.190 3.814 -1.262) 4.575 2.240 ( -5.125 5.950 -11.083) 13.583 2.755 ( 10.748 7.253 -3.075) 13.326 3.207 ( 7.812 8.690 10.264) 15.552 3.659 ( 9.584 6.488 7.933) 14.032 3.930 ( 2.134 -1.044 -0.175) 2.382 5.207 ( 3.618 -3.724 -0.597) 5.227 6.393 ( -2.960 3.133 0.321) 4.322 6.837 ( -3.410 -4.430 -1.184) 5.715 6.923 ( 3.659 -6.578 -8.857) 11.624 7.379 ( -7.629 -1.166 -0.852) 7.765 7.810 ( -4.828 1.530 0.161) 5.067 7.947 ( -10.011 -5.614 -2.377) 11.722 8.611 ( 9.356 3.810 -1.175) 10.170 9.244 ( 6.857 3.927 8.428) 11.553 9.577 ( -0.203 1.139 -0.084) 1.160 16.656 ( 1.250 -1.144 1.926) 2.566 16.817 ( -1.654 5.352 6.708) 8.739 17.412 ( 0.243 -3.975 -5.218) 6.564 17.439 ( -0.732 -0.226 0.735) 1.062 17.952 ( 2.339 1.050 0.534) 2.618 18.532 ( 2.794 -1.317 -4.846) 5.747 ======================= Grid point 22 (16/294) ======================= q-point: (-0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.710 ( -6.301 -20.862 -13.251) 25.505 1.518 ( -18.422 -13.909 12.421) 26.213 1.738 ( -20.884 6.411 -14.582) 26.266 2.412 ( 14.794 6.534 1.235) 16.220 2.989 ( 12.080 5.256 -3.041) 13.520 3.504 ( 13.916 6.389 7.061) 16.862 3.885 ( 4.698 4.769 5.486) 8.655 3.969 ( 4.104 -0.172 1.168) 4.271 5.244 ( 4.721 -2.675 0.740) 5.476 6.368 ( -3.681 2.311 0.688) 4.401 6.708 ( -4.004 -5.793 -4.041) 8.119 6.882 ( 2.453 -4.491 -5.515) 7.523 7.241 ( -7.610 1.229 -2.348) 8.058 7.679 ( -10.394 -9.657 3.846) 14.700 7.743 ( -9.005 5.185 -5.455) 11.736 8.804 ( 10.578 2.946 -0.737) 11.006 9.446 ( 8.211 2.130 7.826) 11.541 9.581 ( -0.285 1.248 -0.802) 1.511 16.692 ( 3.250 -1.195 2.187) 4.095 16.888 ( -1.517 6.437 7.627) 10.095 17.332 ( -0.637 -4.543 -6.311) 7.803 17.432 ( -1.239 -0.561 1.867) 2.310 18.002 ( 2.016 0.970 0.763) 2.364 18.537 ( 2.714 -0.674 -5.783) 6.423 ======================= Grid point 23 (17/294) ======================= q-point: (-0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.362 ( -8.020 -14.538 -5.522) 17.498 1.132 ( -21.119 -12.803 9.836) 26.583 1.341 ( -24.369 5.195 -13.247) 28.219 2.746 ( 16.699 6.694 2.056) 18.108 3.183 ( 10.315 0.723 -4.465) 11.263 3.843 ( 16.775 3.409 4.013) 17.582 3.949 ( 0.297 1.408 2.790) 3.140 4.065 ( 3.281 0.802 1.401) 3.657 5.319 ( 5.584 -0.904 1.690) 5.903 6.329 ( -3.306 1.105 0.512) 3.523 6.565 ( -5.623 -3.543 -2.712) 7.178 6.858 ( 2.303 -3.528 -2.773) 5.044 7.142 ( -5.496 4.779 -4.862) 8.758 7.424 ( -12.224 -7.686 3.113) 14.771 7.622 ( -8.026 1.982 -2.130) 8.537 8.984 ( 9.084 1.903 -1.046) 9.340 9.571 ( 1.973 -1.483 -2.618) 3.598 9.639 ( 5.431 2.923 7.266) 9.531 16.765 ( 5.192 -0.619 2.085) 5.629 16.971 ( -1.126 6.370 7.062) 9.577 17.241 ( -0.879 -4.260 -6.020) 7.427 17.404 ( -2.945 -0.977 2.389) 3.916 18.040 ( 1.248 0.444 0.517) 1.422 18.541 ( 2.506 -0.399 -5.526) 6.081 ======================= Grid point 24 (18/294) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.238 ( -8.961 16.039 18.738) 26.242 0.716 ( -22.134 -13.402 10.981) 28.109 0.904 ( -26.749 6.348 -12.490) 30.196 3.081 ( 15.730 5.404 0.862) 16.655 3.269 ( 8.513 -7.302 -8.673) 14.178 3.960 ( -2.075 5.556 2.514) 6.442 4.035 ( -1.744 -3.284 2.389) 4.420 4.206 ( 16.496 -0.212 0.766) 16.515 5.415 ( 5.272 -0.084 1.107) 5.387 6.293 ( -1.393 -0.316 -0.936) 1.708 6.437 ( -7.150 0.326 0.683) 7.190 6.867 ( 2.045 -1.001 1.271) 2.607 7.085 ( -3.715 5.517 -8.547) 10.830 7.201 ( -9.598 -5.538 6.285) 12.739 7.501 ( -7.158 0.991 -0.714) 7.262 9.114 ( 6.322 0.148 -0.782) 6.372 9.567 ( 1.189 -0.594 -2.929) 3.217 9.775 ( 4.667 0.428 3.914) 6.106 16.869 ( 6.430 0.246 1.423) 6.590 17.019 ( -0.162 -1.536 -0.189) 1.556 17.183 ( -1.132 1.878 -0.009) 2.192 17.344 ( -4.908 -0.446 1.470) 5.143 18.057 ( 0.500 0.014 -0.007) 0.501 18.551 ( 2.014 -0.143 -2.147) 2.948 ======================= Grid point 26 (19/294) ======================= q-point: ( 0.08 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.297 ( -12.593 -6.231 19.899) 24.360 0.602 ( -17.491 8.513 0.859) 19.472 1.203 ( -5.619 25.877 20.095) 33.242 3.045 ( 14.022 -8.637 -6.329) 17.643 3.326 ( 2.356 -3.856 -1.413) 4.734 3.918 ( 0.640 1.186 -2.536) 2.872 3.972 ( -2.907 -4.490 -4.332) 6.883 4.155 ( 6.810 -11.264 -4.525) 13.919 5.379 ( 2.184 -6.792 -2.591) 7.590 6.309 ( 2.124 3.579 0.952) 4.269 6.448 ( -7.125 3.302 1.827) 8.063 6.884 ( -2.611 -4.352 2.960) 5.875 7.111 ( -2.236 3.986 -1.104) 4.702 7.280 ( -1.789 4.766 10.140) 11.346 7.529 ( -2.656 9.579 2.983) 10.379 9.143 ( 3.822 -6.500 1.691) 7.727 9.583 ( -3.840 -3.774 -3.587) 6.470 9.640 ( 5.579 1.127 -7.768) 9.630 16.861 ( 8.246 0.261 -3.599) 9.001 16.990 ( 5.806 -1.797 1.784) 6.334 17.234 ( -7.618 3.975 -7.965) 11.716 17.249 ( -4.507 -0.895 4.867) 6.693 18.045 ( 0.418 -0.291 -1.373) 1.465 18.649 ( 0.047 -4.873 6.686) 8.274 ======================= Grid point 27 (20/294) ======================= q-point: ( 0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.469 ( 15.517 12.054 0.981) 19.673 0.585 ( 2.542 3.572 17.493) 18.034 1.480 ( -4.109 25.662 20.049) 32.824 2.996 ( -1.957 -13.659 -10.819) 17.534 3.190 ( -8.585 -8.538 -3.217) 12.528 3.872 ( 2.846 -3.974 -4.272) 6.491 4.014 ( 4.628 4.016 -1.454) 6.297 4.081 ( -0.526 -10.275 -3.915) 11.008 5.318 ( 1.408 -7.990 -4.139) 9.108 6.380 ( -5.567 3.166 0.704) 6.443 6.416 ( 5.361 3.566 2.595) 6.942 6.853 ( 1.298 -3.773 2.983) 4.982 7.046 ( -5.231 0.423 0.884) 5.322 7.407 ( 4.666 4.521 4.253) 7.765 7.619 ( -3.120 12.474 6.702) 14.500 9.086 ( -1.325 -9.386 -0.516) 9.493 9.485 ( -1.244 -0.161 -5.472) 5.614 9.698 ( 3.235 -0.059 -3.839) 5.021 17.019 ( 2.905 2.160 -1.476) 3.909 17.042 ( 5.858 -5.726 7.203) 10.908 17.101 ( -5.440 5.230 -10.550) 12.971 17.221 ( -0.326 1.760 0.969) 2.036 18.036 ( -0.055 -0.637 -1.761) 1.874 18.593 ( -2.326 -7.885 4.787) 9.514 ======================= Grid point 28 (21/294) ======================= q-point: ( 0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 16.833 1.122 17.209) 24.099 0.886 ( 16.811 12.279 -0.626) 20.827 1.770 ( -2.803 23.224 19.006) 30.141 2.706 ( -7.870 -12.348 -11.048) 18.343 2.901 ( -12.405 -9.590 -4.849) 16.413 3.805 ( -3.483 -12.248 -5.102) 13.717 3.960 ( -1.785 -0.478 -4.250) 4.634 4.091 ( 1.445 0.811 0.472) 1.723 5.239 ( 1.391 -6.811 -6.212) 9.323 6.345 ( -2.618 3.342 0.399) 4.264 6.564 ( 7.293 1.259 3.374) 8.134 6.881 ( 3.962 -3.172 2.254) 5.554 7.002 ( -1.001 -0.064 2.663) 2.846 7.539 ( 5.160 4.080 -0.220) 6.582 7.730 ( -1.817 11.278 7.051) 13.424 8.958 ( -3.033 -8.452 -0.838) 9.019 9.449 ( -1.471 1.211 -3.636) 4.105 9.692 ( -0.479 -1.274 -3.124) 3.408 16.953 ( -8.022 5.453 -5.120) 10.968 16.976 ( -6.120 -2.537 6.183) 9.062 17.229 ( 10.919 0.456 -3.723) 11.545 17.269 ( 3.496 0.864 0.135) 3.604 18.005 ( -1.069 -1.724 -2.614) 3.309 18.512 ( -0.419 -8.549 2.791) 9.002 ======================= Grid point 29 (22/294) ======================= q-point: ( 0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( 17.598 -2.415 19.402) 26.305 1.263 ( 17.142 13.263 -8.345) 23.225 1.975 ( -3.672 7.600 8.360) 11.880 2.478 ( -6.008 2.816 -1.597) 6.825 2.589 ( -10.627 -10.132 -3.512) 15.097 3.527 ( -12.253 -12.147 -0.461) 17.260 3.903 ( -3.159 1.202 -8.552) 9.196 4.076 ( -2.692 -1.828 0.641) 3.317 5.171 ( 2.117 -5.632 -6.907) 9.160 6.363 ( -0.036 3.785 0.801) 3.869 6.692 ( 6.565 -0.979 0.680) 6.672 6.926 ( 4.070 -5.631 3.557) 7.805 7.063 ( 5.383 2.720 2.552) 6.549 7.646 ( 4.185 3.696 -2.106) 5.968 7.847 ( 1.555 7.010 4.589) 8.522 8.827 ( -4.860 -6.204 1.209) 7.974 9.405 ( -4.011 2.860 -3.707) 6.165 9.638 ( -2.179 -1.843 -1.318) 3.143 16.853 ( -6.279 5.446 -6.225) 10.385 16.896 ( -6.776 -0.677 8.127) 10.603 17.321 ( 3.717 2.233 -5.161) 6.740 17.379 ( 7.684 -2.090 2.911) 8.479 17.938 ( -1.783 -3.321 -3.763) 5.327 18.457 ( 1.900 -8.036 0.712) 8.288 ======================= Grid point 30 (23/294) ======================= q-point: ( 0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( 13.127 -5.295 10.408) 17.570 1.581 ( 13.946 11.020 -10.109) 20.448 1.846 ( -5.011 -12.306 -7.799) 15.407 2.376 ( -3.584 -5.236 2.208) 6.718 2.585 ( -3.575 19.346 14.465) 24.419 3.217 ( -13.114 -10.359 3.652) 17.106 3.765 ( -8.805 2.319 -10.595) 13.970 4.001 ( -3.082 -3.110 -0.096) 4.379 5.124 ( 2.917 -5.409 -5.993) 8.584 6.412 ( 0.445 4.548 0.538) 4.601 6.766 ( 5.336 -2.152 -2.602) 6.315 6.946 ( 3.607 -7.361 2.632) 8.609 7.236 ( 9.059 3.843 3.484) 10.439 7.713 ( 1.968 2.614 -2.756) 4.278 7.966 ( 6.012 1.321 1.417) 6.317 8.697 ( -7.273 -3.421 3.694) 8.846 9.327 ( -7.286 5.431 -4.458) 10.122 9.589 ( -1.296 -2.048 1.391) 2.795 16.778 ( -4.684 2.613 -2.522) 5.926 16.846 ( -5.620 3.380 5.884) 8.811 17.363 ( 2.712 0.888 -3.513) 4.526 17.474 ( 4.438 -2.156 2.135) 5.376 17.857 ( -0.504 -3.758 -4.318) 5.747 18.427 ( 3.226 -7.016 -1.324) 7.834 ======================= Grid point 31 (24/294) ======================= q-point: ( 0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( -4.935 -16.009 -8.248) 18.672 1.666 ( 4.118 -3.517 -1.823) 5.715 1.818 ( 11.863 4.598 -11.215) 16.961 2.431 ( 5.966 -0.376 12.108) 13.503 2.754 ( -8.464 14.086 12.347) 20.555 3.000 ( -6.021 -4.001 7.010) 10.070 3.571 ( -10.372 4.542 -9.196) 14.586 3.933 ( -1.745 -2.249 -0.316) 2.864 5.094 ( 3.545 -5.651 -4.471) 8.031 6.458 ( -0.741 5.166 -0.112) 5.220 6.800 ( 5.184 -4.314 -5.256) 8.551 6.933 ( 1.694 -6.484 1.077) 6.787 7.436 ( 8.040 3.114 2.849) 9.081 7.740 ( 1.681 1.219 -1.540) 2.586 8.067 ( 7.252 -4.120 -1.499) 8.474 8.574 ( -8.020 -0.577 4.278) 9.108 9.236 ( -8.239 7.348 -2.322) 11.281 9.575 ( -0.188 -1.197 2.458) 2.740 16.720 ( -3.643 0.461 0.545) 3.712 16.846 ( -3.809 6.089 5.070) 8.792 17.385 ( 1.904 -0.574 -2.181) 2.951 17.496 ( 0.669 -2.851 -0.769) 3.028 17.825 ( 2.432 -1.890 -2.666) 4.073 18.412 ( 4.005 -6.007 -3.095) 7.855 ======================= Grid point 32 (25/294) ======================= q-point: (-0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( -6.543 -14.755 -8.785) 18.376 1.714 ( 6.605 0.271 -2.039) 6.918 1.944 ( 7.891 -1.905 -6.092) 10.150 2.531 ( -4.660 -1.245 9.214) 10.400 2.724 ( -6.008 4.369 2.667) 7.893 3.025 ( 1.039 3.587 4.668) 5.978 3.491 ( -1.605 8.299 -0.120) 8.454 3.909 ( -0.636 0.874 1.712) 2.025 5.082 ( 4.078 -5.719 -2.767) 7.549 6.482 ( -2.105 5.328 -0.411) 5.743 6.783 ( 4.619 -8.041 -8.842) 12.813 6.904 ( -0.423 -3.188 1.769) 3.671 7.527 ( -0.238 0.186 -0.717) 0.778 7.815 ( 5.178 2.983 1.029) 6.064 8.081 ( 2.148 -8.510 -0.553) 8.794 8.492 ( -3.838 1.710 0.401) 4.220 9.197 ( -4.601 7.666 2.290) 9.229 9.581 ( 0.090 -0.264 1.923) 1.943 16.676 ( -2.375 -0.725 1.804) 3.069 16.889 ( -2.829 7.349 6.351) 10.117 17.383 ( 1.294 -3.408 -2.412) 4.371 17.459 ( -0.414 -1.286 -2.730) 3.046 17.859 ( 3.441 0.078 -0.672) 3.507 18.409 ( 4.545 -4.977 -4.353) 8.023 ======================= Grid point 33 (26/294) ======================= q-point: (-0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( -9.156 -11.385 -6.179) 15.863 1.861 ( 7.243 2.449 0.010) 7.646 1.957 ( 0.984 -7.644 5.741) 9.610 2.401 ( -11.874 2.739 -6.358) 13.745 2.679 ( -0.998 3.740 -3.466) 5.196 3.143 ( 8.838 -1.057 2.528) 9.253 3.645 ( 7.069 7.778 5.302) 11.772 3.945 ( -0.871 4.707 4.650) 6.673 5.091 ( 4.701 -5.101 -0.715) 6.974 6.486 ( -3.275 4.936 -0.002) 5.924 6.710 ( 2.928 -8.304 -9.320) 12.822 6.878 ( -1.237 -1.862 1.274) 2.573 7.463 ( -4.930 -0.744 -2.493) 5.574 7.898 ( -1.882 3.443 0.521) 3.959 7.986 ( -2.947 -8.453 1.109) 9.020 8.506 ( 4.612 1.775 -1.886) 5.289 9.259 ( 1.401 5.902 5.068) 7.905 9.589 ( 0.004 0.016 0.777) 0.777 16.652 ( -0.731 -1.341 2.260) 2.728 16.958 ( -2.639 7.824 7.871) 11.407 17.332 ( 0.595 -5.086 -5.628) 7.609 17.445 ( 0.089 0.231 -0.497) 0.555 17.917 ( 3.171 0.956 0.028) 3.312 18.416 ( 4.668 -3.827 -4.880) 7.762 ======================= Grid point 34 (27/294) ======================= q-point: (-0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.712 ( -12.059 -3.377 1.245) 12.585 1.740 ( -14.022 -12.780 14.111) 23.644 2.010 ( -10.324 5.622 -8.663) 14.603 2.266 ( 6.297 6.881 -5.624) 10.892 2.766 ( 11.163 -0.320 -5.984) 12.670 3.307 ( 13.932 -3.756 -0.256) 14.432 3.865 ( 8.292 4.231 4.492) 10.336 4.004 ( -1.979 6.124 4.824) 8.043 5.137 ( 5.548 -3.326 1.725) 6.695 6.461 ( -4.454 2.626 -0.101) 5.171 6.640 ( 1.408 -3.917 -5.644) 7.013 6.840 ( -1.565 -1.877 0.219) 2.454 7.350 ( -6.375 1.330 -4.314) 7.812 7.781 ( -9.211 -8.760 6.569) 14.309 7.890 ( -6.452 4.082 -5.205) 9.240 8.643 ( 10.522 0.938 -0.780) 10.592 9.388 ( 5.120 2.980 4.447) 7.407 9.592 ( 0.285 0.022 -0.023) 0.287 16.657 ( 1.312 -1.264 2.302) 2.936 17.032 ( -2.535 6.528 7.689) 10.401 17.258 ( 0.058 -3.772 -6.298) 7.342 17.448 ( -0.137 -0.004 0.750) 0.763 17.975 ( 2.680 0.882 -0.003) 2.822 18.433 ( 4.269 -2.488 -4.401) 6.617 ======================= Grid point 35 (28/294) ======================= q-point: (-0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.587 ( -12.145 11.815 13.775) 21.837 1.417 ( -20.135 -13.776 15.679) 29.000 1.701 ( -21.798 7.348 -14.285) 27.077 2.541 ( 16.443 5.794 0.256) 17.435 2.899 ( 13.151 -5.467 -10.812) 17.881 3.539 ( 19.360 -4.216 -0.027) 19.813 4.012 ( 3.696 0.476 3.441) 5.072 4.045 ( -0.903 4.391 1.100) 4.615 5.228 ( 6.101 -0.875 3.286) 6.985 6.389 ( -4.312 -0.663 -1.931) 4.771 6.618 ( -2.484 2.190 1.367) 3.582 6.809 ( 0.078 -1.273 0.458) 1.355 7.245 ( -5.726 4.645 -7.241) 10.334 7.568 ( -11.410 -8.878 8.315) 16.678 7.774 ( -8.698 3.893 -4.468) 10.524 8.823 ( 11.010 0.066 -0.646) 11.029 9.493 ( 3.781 -0.392 -0.378) 3.820 9.622 ( 3.274 0.482 2.028) 3.882 16.699 ( 3.536 -0.651 1.997) 4.113 17.051 ( -1.663 -1.783 -0.335) 2.461 17.222 ( -1.070 3.382 0.489) 3.581 17.443 ( -1.242 -0.209 1.063) 1.648 18.017 ( 2.018 0.211 -0.404) 2.069 18.460 ( 3.571 -0.863 -2.370) 4.372 ======================= Grid point 36 (29/294) ======================= q-point: (-0.08 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.690 ( -8.682 22.570 20.379) 31.624 1.029 ( -22.559 -13.732 16.060) 30.909 1.318 ( -24.305 7.895 -12.581) 28.484 2.841 ( 15.690 -3.331 -0.870) 16.063 2.975 ( 12.102 -1.833 -12.084) 17.200 3.825 ( 19.880 -5.930 -0.177) 20.747 4.053 ( 0.281 1.990 -0.548) 2.083 4.060 ( 0.414 -2.122 1.049) 2.403 5.336 ( 5.185 -0.253 2.019) 5.570 6.308 ( -2.750 -0.787 -2.324) 3.686 6.587 ( -6.759 3.741 3.873) 8.641 6.848 ( 2.596 1.654 5.307) 6.135 7.156 ( -5.521 4.055 -9.317) 11.564 7.372 ( -10.605 -3.061 9.353) 14.468 7.639 ( -8.623 2.226 -2.641) 9.289 8.979 ( 9.089 -1.410 -0.363) 9.205 9.518 ( 2.136 0.119 -3.391) 4.009 9.703 ( 4.884 -2.208 1.200) 5.493 16.780 ( 5.487 -0.083 1.451) 5.676 16.958 ( -1.272 -6.593 -6.660) 9.457 17.267 ( -1.682 5.195 4.680) 7.192 17.412 ( -2.994 0.224 -0.072) 3.003 18.039 ( 1.299 -0.370 -0.871) 1.607 18.511 ( 3.117 0.901 1.842) 3.731 ======================= Grid point 38 (30/294) ======================= q-point: ( 0.08 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.624 ( -20.761 -9.348 20.457) 30.609 0.973 ( -20.102 7.822 -6.011) 22.392 1.635 ( -5.112 23.455 18.518) 30.318 2.695 ( 14.533 -7.991 -4.843) 17.278 3.199 ( 8.538 -1.567 -2.076) 8.925 3.721 ( 11.496 -14.035 -10.072) 20.751 3.896 ( 0.821 -0.811 -3.868) 4.037 4.042 ( 2.613 -3.276 -0.572) 4.230 5.273 ( 0.409 -6.844 -3.428) 7.666 6.332 ( 0.583 4.658 0.944) 4.788 6.606 ( -7.385 2.251 2.035) 7.984 6.922 ( -5.282 -5.400 3.586) 8.362 7.169 ( 0.121 6.075 0.968) 6.153 7.450 ( -9.646 1.668 3.866) 10.525 7.693 ( -1.249 12.217 6.308) 13.806 8.999 ( 6.317 -7.440 0.290) 9.765 9.470 ( 4.523 -3.847 -11.276) 12.744 9.606 ( 0.371 0.226 1.120) 1.201 16.736 ( 4.205 -0.900 -3.471) 5.526 16.888 ( 5.980 0.018 -0.377) 5.992 17.329 ( -4.336 2.728 -3.985) 6.490 17.345 ( -5.084 -1.039 4.446) 6.833 18.019 ( 1.089 -0.746 -1.901) 2.315 18.632 ( 0.641 -4.050 4.152) 5.836 ======================= Grid point 39 (31/294) ======================= q-point: ( 0.17 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.478 ( -2.822 4.506 12.853) 13.909 0.773 ( -10.394 5.737 5.474) 13.073 1.882 ( -3.757 22.069 17.492) 28.410 2.768 ( 7.067 -10.705 -7.223) 14.721 3.185 ( -2.485 -8.369 -2.427) 9.061 3.674 ( 6.959 -12.665 -8.830) 16.935 3.945 ( 5.377 3.662 -3.851) 7.560 4.037 ( 0.084 -1.904 -0.872) 2.096 5.185 ( 1.168 -9.264 -4.291) 10.276 6.403 ( 1.667 4.346 0.845) 4.731 6.517 ( -6.876 1.730 2.136) 7.405 6.841 ( -1.601 -3.854 3.652) 5.545 7.162 ( -6.364 3.046 -1.009) 7.127 7.409 ( 0.545 2.009 3.612) 4.169 7.816 ( -2.272 10.673 6.415) 12.658 8.983 ( 2.157 -9.452 -0.996) 9.746 9.441 ( 2.315 -0.747 -7.109) 7.513 9.643 ( 2.069 1.089 -0.609) 2.416 16.842 ( 9.980 1.160 -2.172) 10.279 16.977 ( 5.081 -0.605 0.552) 5.146 17.229 ( -7.480 3.607 -5.399) 9.905 17.294 ( -4.140 0.024 4.398) 6.040 18.011 ( 0.561 -1.362 -2.379) 2.799 18.576 ( -2.227 -8.640 2.710) 9.324 ======================= Grid point 40 (32/294) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.712 ( 12.717 12.433 1.329) 17.835 0.836 ( 4.952 2.910 15.789) 16.801 2.094 ( -3.168 13.146 11.405) 17.690 2.657 ( -3.367 -6.035 -2.600) 7.383 2.968 ( -9.936 -8.770 -6.721) 14.860 3.635 ( 5.762 -10.926 -6.234) 13.836 3.981 ( -2.380 -1.056 -0.741) 2.707 4.061 ( 3.882 2.897 -2.013) 5.245 5.095 ( 2.162 -9.055 -6.350) 11.269 6.410 ( -2.495 0.359 -2.341) 3.440 6.514 ( 1.646 1.660 5.692) 6.154 6.837 ( 1.417 -1.192 2.979) 3.508 7.074 ( -5.559 1.314 1.141) 5.825 7.493 ( 4.279 2.951 0.307) 5.207 7.882 ( -2.413 6.154 2.789) 7.175 8.913 ( -0.533 -6.517 0.666) 6.573 9.449 ( 1.230 1.812 -3.364) 4.014 9.665 ( 0.635 -0.181 -1.694) 1.818 17.018 ( 9.462 -1.850 1.978) 9.842 17.041 ( 3.263 2.156 -1.525) 4.198 17.106 ( -7.983 4.358 -4.924) 10.342 17.266 ( -1.933 1.085 2.327) 3.214 17.979 ( -0.362 -2.716 -3.243) 4.245 18.457 ( -2.044 -10.494 1.633) 10.815 ======================= Grid point 41 (33/294) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.054 ( 15.120 6.951 4.123) 17.144 1.113 ( 13.237 5.637 9.611) 17.303 2.045 ( -6.342 -9.493 -4.626) 12.319 2.637 ( -8.143 -3.753 1.244) 9.052 2.710 ( -6.268 11.793 4.324) 14.038 3.536 ( -2.847 -10.919 -1.967) 11.454 3.919 ( -3.115 1.251 -5.005) 6.026 4.099 ( -0.669 -0.745 0.870) 1.326 5.018 ( 3.327 -7.292 -8.742) 11.860 6.381 ( 0.773 -0.662 -0.991) 1.420 6.586 ( 3.513 -2.121 3.904) 5.664 6.880 ( 1.619 -0.143 2.515) 2.994 7.052 ( 0.433 2.708 1.768) 3.263 7.590 ( 4.720 2.625 -1.538) 5.615 7.895 ( -0.624 1.340 -1.005) 1.787 8.859 ( -2.626 -2.637 3.497) 5.107 9.464 ( -0.947 3.316 -1.102) 3.621 9.641 ( -1.408 -0.916 -1.910) 2.543 16.979 ( -7.391 3.481 -4.322) 9.243 17.043 ( -4.162 1.544 6.324) 7.726 17.200 ( 9.427 1.942 -4.953) 10.824 17.287 ( 2.659 -0.389 2.469) 3.649 17.905 ( -1.661 -4.808 -4.466) 6.769 18.353 ( 0.683 -9.887 0.264) 9.914 ======================= Grid point 42 (34/294) ======================= q-point: ( 0.42 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( 13.524 -0.011 5.434) 14.575 1.418 ( 12.553 6.733 -1.014) 14.280 1.778 ( -7.077 -13.027 -7.398) 16.569 2.407 ( -6.011 -5.287 -1.687) 8.181 2.909 ( -2.153 19.030 13.093) 23.199 3.332 ( -10.462 -9.338 3.984) 14.578 3.840 ( -4.570 3.059 -8.668) 10.266 4.040 ( -4.490 -2.917 1.688) 5.614 4.968 ( 4.284 -6.050 -8.853) 11.547 6.409 ( 3.856 -1.034 -0.625) 4.041 6.630 ( 3.702 -3.564 0.495) 5.163 6.897 ( 0.126 -1.881 2.902) 3.460 7.162 ( 6.605 4.688 1.768) 8.290 7.671 ( 3.832 2.089 -2.978) 5.284 7.888 ( 2.299 -2.939 -2.133) 4.298 8.807 ( -5.234 -0.385 4.456) 6.884 9.463 ( -4.167 5.815 -0.727) 7.191 9.594 ( -1.461 -1.938 -0.142) 2.431 16.878 ( -6.172 2.758 -2.546) 7.224 17.020 ( -6.111 4.432 6.703) 10.096 17.291 ( 4.330 1.310 -5.736) 7.305 17.377 ( 6.221 -2.076 3.743) 7.551 17.800 ( -1.076 -5.377 -5.239) 7.584 18.294 ( 2.857 -8.532 -1.588) 9.137 ======================= Grid point 43 (35/294) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( -1.511 -11.238 -2.469) 11.605 1.570 ( 0.950 -4.624 -1.567) 4.974 1.617 ( 10.418 4.937 -10.685) 15.718 2.400 ( 5.079 0.548 8.866) 10.233 3.061 ( -2.203 -1.792 0.975) 3.003 3.111 ( -13.645 6.710 13.097) 20.069 3.723 ( -8.490 5.054 -8.137) 12.800 3.962 ( -3.005 -0.861 2.927) 4.282 4.941 ( 4.711 -5.726 -6.810) 10.068 6.464 ( 4.573 -1.126 -2.174) 5.187 6.648 ( 2.653 -2.643 -1.952) 4.223 6.893 ( 0.226 -2.695 2.653) 3.789 7.343 ( 8.628 3.943 1.883) 9.671 7.712 ( 1.807 1.201 -3.165) 3.837 7.902 ( 5.730 -5.634 -1.779) 8.230 8.725 ( -7.602 0.375 3.519) 8.385 9.423 ( -7.247 7.350 -1.357) 10.411 9.573 ( 0.276 -2.050 2.491) 3.238 16.799 ( -5.032 1.154 -0.252) 5.169 17.017 ( -5.204 6.968 6.549) 10.887 17.321 ( 2.731 -1.459 -3.785) 4.890 17.442 ( 2.470 -2.686 0.349) 3.666 17.746 ( 2.631 -2.144 -3.260) 4.706 18.262 ( 4.092 -7.518 -3.325) 9.183 ======================= Grid point 44 (36/294) ======================= q-point: ( 0.58 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( -7.566 -6.771 -2.405) 10.435 1.595 ( 5.744 -0.764 -2.808) 6.439 1.741 ( 9.486 -0.751 -8.592) 12.821 2.587 ( 5.458 2.242 10.224) 11.804 2.872 ( -9.158 -8.287 9.119) 15.352 3.101 ( -6.329 5.980 -5.341) 10.215 3.603 ( -5.915 4.637 -3.220) 8.176 3.980 ( -1.141 5.374 5.805) 7.993 4.936 ( 4.958 -5.386 -3.841) 8.267 6.503 ( 4.065 -1.227 -4.500) 6.187 6.644 ( -0.129 -0.334 -2.138) 2.168 6.887 ( 0.450 -2.817 2.104) 3.545 7.495 ( 4.547 1.340 -0.315) 4.751 7.753 ( 4.648 0.958 0.606) 4.784 7.933 ( 5.720 -6.446 -2.074) 8.864 8.613 ( -8.234 0.639 1.468) 8.389 9.371 ( -6.599 7.020 0.348) 9.641 9.579 ( 0.551 -1.532 2.193) 2.731 16.732 ( -4.012 -0.372 1.350) 4.249 17.058 ( -3.693 8.641 7.021) 11.730 17.300 ( 1.370 -5.631 -3.825) 6.944 17.436 ( 0.575 -0.283 -2.597) 2.675 17.796 ( 4.328 0.705 -0.031) 4.385 18.249 ( 5.154 -6.347 -4.191) 9.187 ======================= Grid point 45 (37/294) ======================= q-point: (-0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( -10.101 0.375 2.819) 10.494 1.727 ( 10.481 3.505 -2.177) 11.264 1.823 ( 8.042 -4.825 -3.156) 9.895 2.585 ( -10.804 -3.226 7.706) 13.657 2.781 ( -4.824 1.372 -0.549) 5.046 2.996 ( 0.810 -3.268 -8.710) 9.339 3.627 ( 3.881 4.321 2.493) 6.321 4.056 ( -1.160 6.171 5.227) 8.170 4.961 ( 5.311 -4.151 -0.398) 6.752 6.531 ( 3.769 -0.048 -4.507) 5.876 6.611 ( -3.402 1.588 -1.269) 3.963 6.876 ( -0.002 -2.362 1.225) 2.661 7.499 ( -2.068 -0.411 -2.604) 3.351 7.882 ( 6.672 -2.404 4.201) 8.242 7.932 ( 1.968 -2.730 -1.862) 3.846 8.507 ( -4.745 0.618 -0.902) 4.869 9.357 ( -3.325 6.004 2.202) 7.208 9.579 ( 0.501 -2.048 0.485) 2.163 16.679 ( -2.604 -1.215 2.023) 3.514 17.128 ( -3.266 8.092 7.396) 11.440 17.233 ( 1.251 -5.575 -5.555) 7.969 17.437 ( 0.610 0.762 -1.760) 2.012 17.873 ( 3.550 1.227 0.457) 3.784 18.266 ( 5.796 -4.382 -3.429) 8.035 ======================= Grid point 46 (38/294) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.983 ( -11.533 9.184 10.153) 17.901 1.835 ( -0.682 -6.644 4.202) 7.891 1.966 ( 12.522 2.934 1.844) 12.993 2.376 ( -13.372 2.345 -6.303) 14.968 2.664 ( -4.756 -0.264 -5.405) 7.204 3.016 ( 12.091 -7.971 -5.533) 15.503 3.794 ( 7.740 3.534 4.773) 9.756 4.093 ( -1.221 1.805 0.611) 2.264 5.031 ( 5.907 -1.812 2.850) 6.805 6.540 ( -3.547 -0.543 -2.347) 4.288 6.595 ( 1.436 5.405 0.667) 5.632 6.854 ( -1.171 -1.356 0.342) 1.824 7.424 ( -4.586 0.652 -3.581) 5.855 7.839 ( -3.089 -8.816 3.525) 9.984 7.984 ( -2.090 4.348 -0.073) 4.825 8.500 ( 5.204 -0.262 -1.406) 5.397 9.397 ( 0.429 4.011 2.369) 4.679 9.564 ( 0.975 -2.894 -1.174) 3.271 16.652 ( -0.658 -1.220 2.070) 2.492 17.111 ( -1.469 -4.533 -3.865) 6.136 17.247 ( -0.711 6.738 4.128) 7.934 17.446 ( 0.576 0.394 -0.632) 0.942 17.934 ( 2.927 0.497 -0.586) 3.026 18.316 ( 5.363 -1.653 -1.045) 5.709 ======================= Grid point 47 (39/294) ======================= q-point: (-0.17 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( -10.349 17.693 16.690) 26.433 1.680 ( -14.342 -11.723 15.728) 24.300 1.998 ( -14.958 5.524 -11.149) 19.456 2.341 ( 12.076 5.096 -2.568) 13.356 2.609 ( 6.815 -4.993 -11.044) 13.905 3.170 ( 18.036 -6.809 -2.704) 19.467 3.954 ( 5.749 0.876 3.647) 6.864 4.061 ( -0.314 -3.039 -4.180) 5.177 5.147 ( 6.252 0.475 4.272) 7.587 6.444 ( -5.177 -0.989 -2.378) 5.782 6.703 ( 0.764 8.211 6.116) 10.267 6.822 ( -1.643 -0.076 0.339) 1.679 7.332 ( -5.392 2.793 -5.472) 8.174 7.702 ( -7.595 -7.096 6.984) 12.522 7.923 ( -8.152 3.979 -2.625) 9.443 8.631 ( 11.086 -1.260 -0.555) 11.171 9.448 ( 1.745 0.682 -1.119) 2.182 9.561 ( 3.097 -2.681 -0.315) 4.108 16.662 ( 1.612 -0.709 1.733) 2.471 17.006 ( -1.312 -6.092 -6.875) 9.279 17.321 ( -1.630 6.532 5.229) 8.524 17.453 ( 0.120 0.033 -0.047) 0.133 17.972 ( 2.643 -0.420 -1.517) 3.076 18.394 ( 4.261 0.970 1.827) 4.736 ======================= Grid point 48 (40/294) ======================= q-point: (-0.08 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( -8.239 22.358 19.079) 30.525 1.365 ( -21.342 -12.487 18.462) 30.859 1.682 ( -20.679 7.197 -13.049) 25.489 2.524 ( 11.784 -10.318 -4.138) 16.200 2.721 ( 15.120 6.310 -9.429) 18.904 3.416 ( 20.743 -7.242 -1.932) 22.056 3.996 ( 1.644 -5.645 -6.409) 8.697 4.031 ( 2.498 -1.905 1.817) 3.630 5.268 ( 4.830 0.491 2.611) 5.513 6.345 ( -3.914 -0.559 -2.164) 4.507 6.748 ( -5.541 3.595 2.441) 7.041 6.883 ( 2.179 5.576 9.890) 11.561 7.235 ( -6.065 2.987 -6.842) 9.619 7.571 ( -8.388 -0.723 8.876) 12.234 7.790 ( -9.650 2.731 -3.148) 10.512 8.795 ( 10.931 -2.574 -0.156) 11.231 9.455 ( 2.595 -1.081 -5.629) 6.292 9.603 ( 4.125 -3.284 0.878) 5.345 16.710 ( 3.780 -0.397 1.278) 4.010 16.882 ( -1.661 -5.828 -7.729) 9.822 17.367 ( -2.099 3.881 4.000) 5.956 17.445 ( -1.186 0.023 -0.016) 1.187 17.997 ( 2.248 -0.757 -1.699) 2.918 18.490 ( 3.478 2.334 4.201) 5.933 ======================= Grid point 50 (41/294) ======================= q-point: ( 0.08 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.001 ( -22.064 -9.417 19.260) 30.765 1.321 ( -19.744 6.462 -9.273) 22.750 1.974 ( -0.701 14.744 10.551) 18.144 2.421 ( 10.054 -0.592 3.322) 10.605 3.009 ( 11.661 -1.282 -1.260) 11.799 3.336 ( 13.219 -10.100 -11.799) 20.395 3.786 ( 7.875 -3.190 -5.378) 10.055 3.965 ( 1.050 -4.371 0.468) 4.520 5.206 ( -2.077 -6.025 -3.635) 7.337 6.377 ( 0.837 5.108 1.563) 5.407 6.744 ( -6.028 1.604 1.069) 6.328 6.987 ( -6.378 -6.214 4.266) 9.874 7.250 ( -2.451 6.387 0.929) 6.904 7.639 ( -10.383 0.976 -0.777) 10.458 7.862 ( -1.621 10.063 7.052) 12.395 8.818 ( 7.466 -6.868 0.837) 10.178 9.283 ( 6.549 -3.108 -10.286) 12.584 9.603 ( 1.082 -0.007 1.348) 1.729 16.669 ( 1.328 -0.514 -1.983) 2.441 16.797 ( 5.000 0.858 -1.444) 5.274 17.387 ( -2.507 1.962 -2.570) 4.091 17.434 ( -3.826 -1.428 4.978) 6.439 17.976 ( 1.536 -1.086 -2.287) 2.962 18.602 ( 0.461 -3.891 1.451) 4.178 ======================= Grid point 51 (42/294) ======================= q-point: ( 0.17 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.737 ( -14.785 -2.063 17.633) 23.103 1.051 ( -15.392 5.957 -2.727) 16.729 2.137 ( 1.712 6.922 5.311) 8.891 2.599 ( 5.009 4.728 6.466) 9.447 3.083 ( 4.168 -8.467 -1.188) 9.512 3.367 ( 9.741 -9.453 -10.536) 17.183 3.857 ( 6.122 3.405 -7.929) 10.580 3.975 ( 3.834 -4.485 2.099) 6.263 5.079 ( -1.741 -8.713 -3.995) 9.742 6.447 ( -0.270 5.600 0.946) 5.686 6.652 ( -7.138 0.287 1.696) 7.342 6.865 ( -3.709 -4.702 3.210) 6.795 7.271 ( -2.927 4.990 -1.007) 5.872 7.491 ( -7.291 0.346 2.062) 7.585 7.943 ( -0.931 4.488 2.116) 5.048 8.854 ( 4.104 -5.954 1.748) 7.440 9.326 ( 6.144 0.577 -7.178) 9.466 9.631 ( 1.122 0.611 0.936) 1.584 16.724 ( 5.409 2.202 -0.941) 5.916 16.886 ( 5.783 0.720 -0.866) 5.891 17.335 ( -4.888 2.404 -3.114) 6.274 17.385 ( -4.016 -0.594 4.845) 6.321 17.966 ( 0.933 -2.014 -3.069) 3.788 18.534 ( -1.807 -8.789 0.009) 8.973 ======================= Grid point 52 (43/294) ======================= q-point: ( 0.25 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.733 ( 0.581 8.736 9.190) 12.693 0.941 ( -4.922 4.255 7.623) 10.022 2.168 ( -0.037 -6.715 -2.991) 7.351 2.749 ( -0.857 11.481 9.694) 15.051 2.979 ( -5.225 -7.878 -4.594) 10.510 3.383 ( 8.879 -8.115 -4.451) 12.825 3.965 ( 5.522 2.767 -3.280) 6.994 4.001 ( 2.726 -0.526 -1.887) 3.357 4.952 ( -0.087 -9.915 -4.238) 10.783 6.433 ( -4.160 -0.878 -2.909) 5.152 6.586 ( -3.032 1.792 4.500) 5.715 6.831 ( 0.425 -1.037 2.691) 2.915 7.205 ( -7.592 2.023 0.067) 7.858 7.472 ( 1.231 2.066 1.178) 2.678 7.936 ( -1.110 -1.065 -3.117) 3.476 8.876 ( 1.413 -2.353 4.210) 5.026 9.401 ( 4.622 2.838 -3.762) 6.601 9.655 ( 0.528 0.475 0.198) 0.738 16.862 ( 8.610 2.902 -0.713) 9.114 16.984 ( 5.514 1.010 -0.206) 5.610 17.239 ( -7.112 2.345 -2.844) 8.011 17.350 ( -3.794 1.152 3.580) 5.342 17.931 ( 0.111 -3.432 -3.956) 5.238 18.395 ( -2.627 -11.699 -0.327) 11.994 ======================= Grid point 53 (44/294) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.954 ( 9.004 10.818 1.774) 14.186 1.055 ( 6.515 2.729 13.192) 14.964 1.996 ( -4.924 -12.765 -6.297) 15.061 2.699 ( -9.449 -8.077 -7.359) 14.445 2.950 ( -0.483 12.636 8.252) 15.100 3.442 ( 4.023 -2.217 3.218) 5.608 3.962 ( -2.825 -0.310 -0.807) 2.955 4.079 ( 3.705 1.970 -2.611) 4.942 4.846 ( 2.083 -9.174 -6.800) 11.608 6.328 ( -1.269 -5.849 -2.938) 6.667 6.599 ( -1.080 1.295 4.026) 4.365 6.873 ( 1.983 1.543 1.896) 3.148 7.119 ( -4.625 1.895 1.313) 5.167 7.536 ( 3.478 1.945 -0.549) 4.023 7.874 ( -0.372 -3.439 -5.269) 6.303 8.899 ( -0.698 -0.090 5.107) 5.155 9.476 ( 2.501 3.222 -0.748) 4.147 9.655 ( -1.103 0.748 -0.628) 1.474 17.027 ( 8.077 3.153 -2.658) 9.068 17.069 ( 2.251 -0.200 3.314) 4.011 17.137 ( -4.683 4.154 -3.997) 7.427 17.323 ( -3.521 1.667 3.575) 5.288 17.853 ( -1.443 -5.724 -4.949) 7.703 18.253 ( -0.612 -11.369 -0.450) 11.395 ======================= Grid point 54 (45/294) ======================= q-point: ( 0.42 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( 10.298 3.508 1.819) 11.030 1.293 ( 10.148 3.717 5.326) 12.049 1.750 ( -6.914 -10.218 -4.531) 13.143 2.445 ( -7.074 -5.564 -4.772) 10.187 3.066 ( 1.242 2.698 0.062) 2.971 3.499 ( -6.337 6.892 14.192) 17.002 3.893 ( -3.907 2.071 -4.700) 6.453 4.091 ( -2.220 -0.910 1.243) 2.703 4.778 ( 4.713 -6.902 -9.637) 12.756 6.272 ( 4.240 -8.163 -1.737) 9.361 6.616 ( -0.338 1.290 2.180) 2.555 6.910 ( -0.378 0.421 1.629) 1.724 7.135 ( 2.572 3.971 1.018) 4.839 7.605 ( 3.943 1.048 -1.819) 4.467 7.811 ( 0.732 -4.429 -4.221) 6.162 8.900 ( -2.945 0.689 3.927) 4.956 9.531 ( 0.956 1.917 1.763) 2.775 9.627 ( -3.264 2.115 -1.269) 4.091 16.994 ( -6.561 2.025 -2.006) 7.153 17.160 ( 0.243 3.574 4.616) 5.843 17.187 ( 5.963 2.466 -5.042) 8.189 17.323 ( 0.220 0.438 4.570) 4.596 17.734 ( -1.481 -6.550 -5.388) 8.610 18.163 ( 1.847 -9.313 -1.500) 9.613 ======================= Grid point 55 (46/294) ======================= q-point: ( 0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.339 ( 6.009 -5.012 0.700) 7.856 1.455 ( 7.144 2.254 -7.693) 10.738 1.566 ( -5.221 -3.266 -0.245) 6.164 2.381 ( 2.816 0.608 4.997) 5.768 3.036 ( -0.913 -5.835 -3.689) 6.964 3.476 ( -14.402 6.199 11.990) 19.738 3.841 ( -4.723 4.969 -4.665) 8.292 4.042 ( -3.470 1.356 4.431) 5.789 4.758 ( 6.106 -5.003 -8.782) 11.808 6.287 ( 7.542 -7.654 -1.414) 10.838 6.642 ( 0.352 2.620 0.695) 2.733 6.897 ( -1.378 -1.129 1.432) 2.285 7.262 ( 6.840 4.275 0.490) 8.081 7.659 ( 3.502 0.573 -3.207) 4.783 7.772 ( 2.390 -5.582 -1.327) 6.215 8.857 ( -5.559 0.946 2.170) 6.042 9.559 ( 0.515 -2.194 2.167) 3.126 9.582 ( -5.229 5.668 -0.701) 7.743 16.899 ( -6.102 1.280 -0.514) 6.256 17.199 ( -3.707 6.366 4.641) 8.707 17.235 ( 2.484 -1.191 -3.765) 4.665 17.377 ( 3.123 -2.063 2.314) 4.401 17.667 ( 2.465 -1.666 -3.167) 4.346 18.112 ( 3.128 -7.769 -2.844) 8.845 ======================= Grid point 56 (47/294) ======================= q-point: ( 0.58 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.323 ( -2.647 -0.999 1.635) 3.267 1.502 ( 2.828 0.399 -5.198) 5.931 1.542 ( 6.352 -1.887 -5.269) 8.466 2.550 ( 7.820 3.246 8.413) 11.936 2.917 ( -3.574 -8.064 -0.308) 8.826 3.309 ( -14.746 2.074 1.974) 15.022 3.732 ( -8.194 2.116 -3.659) 9.221 4.084 ( -0.802 5.322 5.169) 7.462 4.780 ( 6.161 -3.287 -4.686) 8.410 6.348 ( 7.399 -3.456 -1.693) 8.340 6.681 ( -0.069 3.954 0.276) 3.965 6.869 ( -0.693 -2.602 1.024) 2.881 7.414 ( 6.885 2.455 -0.159) 7.311 7.696 ( 2.988 0.109 -1.379) 3.293 7.775 ( 5.039 -5.665 -0.694) 7.613 8.764 ( -7.989 1.133 0.811) 8.109 9.518 ( -4.198 1.968 -0.247) 4.643 9.573 ( -1.213 0.150 1.493) 1.930 16.813 ( -5.376 -0.035 0.859) 5.445 17.194 ( 0.881 -5.639 -4.058) 7.003 17.242 ( -3.585 7.374 5.567) 9.911 17.402 ( 1.865 -0.121 -1.843) 2.625 17.737 ( 4.837 2.174 1.119) 5.420 18.089 ( 4.450 -5.912 -3.160) 8.046 ======================= Grid point 57 (48/294) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.295 ( -6.770 6.857 6.263) 11.493 1.582 ( 8.450 2.979 -2.717) 9.363 1.614 ( 9.348 -3.487 -5.196) 11.249 2.698 ( 4.353 -0.671 0.423) 4.425 2.780 ( -6.738 -7.613 6.842) 12.255 3.078 ( -13.938 0.910 -6.040) 15.218 3.651 ( -1.694 2.987 0.673) 3.500 4.121 ( -0.572 0.571 0.112) 0.816 4.844 ( 5.831 -1.164 0.104) 5.947 6.446 ( 5.658 2.989 -0.134) 6.401 6.697 ( -3.009 3.716 -0.125) 4.783 6.847 ( 1.014 -2.906 0.367) 3.099 7.492 ( 1.494 0.299 -1.704) 2.286 7.761 ( 5.127 -6.387 6.080) 10.201 7.827 ( 7.405 1.382 -4.506) 8.778 8.636 ( -9.114 1.233 -0.111) 9.198 9.474 ( -3.681 2.518 0.399) 4.477 9.550 ( -0.649 -2.481 -0.338) 2.587 16.736 ( -4.295 -0.986 1.597) 4.688 17.113 ( 0.882 -7.562 -5.791) 9.566 17.302 ( -2.619 8.477 6.080) 10.756 17.421 ( 1.137 1.221 -2.278) 2.824 17.832 ( 3.462 1.195 1.059) 3.813 18.123 ( 5.990 -2.058 -0.662) 6.368 ======================= Grid point 58 (49/294) ======================= q-point: (-0.25 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( -7.630 12.346 10.540) 17.936 1.712 ( 8.291 -2.680 -2.559) 9.081 1.791 ( 13.195 4.404 -0.097) 13.911 2.595 ( -14.231 -4.345 6.852) 16.381 2.731 ( 8.219 -7.095 -5.625) 12.229 2.808 ( -14.289 0.413 -9.210) 17.005 3.744 ( 5.623 3.634 4.500) 8.067 4.073 ( -0.392 -5.416 -5.493) 7.724 4.947 ( 5.924 0.741 3.350) 6.845 6.570 ( 1.073 5.007 1.953) 5.481 6.664 ( -2.121 4.164 0.471) 4.696 6.850 ( 0.752 -0.346 -0.241) 0.862 7.473 ( -2.464 0.674 -1.780) 3.114 7.776 ( 2.287 -7.946 3.599) 9.018 7.980 ( 7.737 3.314 0.203) 8.420 8.507 ( -6.686 0.690 -0.934) 6.786 9.446 ( -1.275 -0.709 -0.781) 1.655 9.512 ( -0.385 -1.799 -1.050) 2.118 16.678 ( -2.577 -1.090 1.655) 3.251 17.020 ( 0.513 -7.079 -6.756) 9.799 17.375 ( -1.791 7.179 5.322) 9.114 17.435 ( 0.702 1.116 -1.667) 2.125 17.883 ( 2.727 -0.489 -0.912) 2.917 18.230 ( 5.741 1.920 3.152) 6.825 ======================= Grid point 59 (50/294) ======================= q-point: (-0.17 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -6.496 16.860 14.103) 22.921 1.767 ( 1.276 -5.731 4.646) 7.487 2.051 ( 10.296 3.966 1.299) 11.110 2.347 ( -11.971 1.621 -5.095) 13.111 2.525 ( -9.609 -5.239 -9.085) 14.224 2.830 ( 13.535 -5.256 -1.990) 14.656 3.892 ( 5.659 1.321 3.620) 6.846 3.958 ( 0.458 -9.276 -9.201) 13.073 5.084 ( 6.132 2.213 4.635) 7.999 6.506 ( -5.461 -2.095 -2.186) 6.244 6.805 ( 2.944 10.262 7.454) 13.020 6.854 ( -1.040 2.565 -0.227) 2.777 7.416 ( -4.707 2.240 -2.225) 5.668 7.739 ( -1.158 -5.865 3.971) 7.177 8.070 ( -3.209 4.080 1.485) 5.399 8.468 ( 4.506 -1.370 -1.243) 4.871 9.394 ( 1.132 -5.867 -5.258) 7.959 9.512 ( 0.696 0.802 1.062) 1.502 16.654 ( -0.416 -0.668 1.256) 1.482 16.920 ( -0.312 -6.246 -7.099) 9.461 17.425 ( -1.228 3.157 2.504) 4.212 17.451 ( 0.046 2.203 0.673) 2.304 17.913 ( 2.671 -0.671 -1.563) 3.167 18.364 ( 4.396 3.611 5.009) 7.580 ======================= Grid point 60 (51/294) ======================= q-point: (-0.08 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( -5.322 19.412 14.970) 25.085 1.658 ( -13.249 -10.015 15.928) 23.012 1.967 ( -15.763 4.208 -10.182) 19.232 2.291 ( 0.622 -7.163 -4.216) 8.335 2.482 ( 15.358 5.784 -7.614) 18.091 3.031 ( 17.272 -5.361 -0.956) 18.110 3.826 ( 2.932 -10.840 -10.706) 15.515 3.980 ( 3.008 -1.284 1.867) 3.766 5.220 ( 4.542 1.763 3.280) 5.873 6.389 ( -4.221 -1.740 -2.277) 5.102 6.840 ( -2.374 2.015 -0.151) 3.118 6.992 ( 1.055 8.024 10.859) 13.543 7.338 ( -6.425 3.836 -3.275) 8.168 7.695 ( -2.741 -0.664 5.061) 5.794 7.987 ( -11.029 4.382 0.902) 11.902 8.585 ( 11.012 -3.120 -0.256) 11.448 9.329 ( 3.210 -6.712 -8.229) 11.093 9.546 ( 1.811 -0.071 1.478) 2.339 16.666 ( 1.773 -0.466 0.755) 1.982 16.814 ( -1.223 -4.735 -6.772) 8.353 17.431 ( -0.775 1.028 -0.491) 1.377 17.473 ( -1.281 1.318 3.270) 3.751 17.941 ( 2.497 -0.452 -1.578) 2.988 18.489 ( 3.221 3.299 4.962) 6.773 ======================= Grid point 62 (52/294) ======================= q-point: ( 0.08 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( -19.935 -9.573 16.685) 27.702 1.625 ( -17.864 4.886 -10.246) 21.165 1.961 ( 6.572 -1.953 -1.154) 6.953 2.483 ( 2.943 14.142 13.284) 19.624 2.790 ( 13.286 -1.469 0.728) 13.386 2.996 ( 9.964 -6.070 -13.147) 17.578 3.568 ( 10.695 -2.543 -1.669) 11.119 3.929 ( -0.752 -3.424 -0.574) 3.552 5.180 ( -3.526 -5.096 -3.757) 7.247 6.411 ( 2.091 4.891 2.227) 5.766 6.838 ( -3.706 0.848 0.051) 3.802 7.053 ( -5.879 -6.423 4.008) 9.586 7.372 ( -4.835 5.511 -0.379) 7.341 7.778 ( -4.985 2.729 -2.108) 6.061 7.997 ( -5.687 0.442 1.551) 5.912 8.660 ( 7.883 -2.749 4.318) 9.399 9.102 ( 6.332 -0.450 -7.360) 9.720 9.588 ( 1.505 -0.197 1.082) 1.865 16.656 ( 0.132 0.241 1.099) 1.133 16.729 ( 3.171 1.590 -2.595) 4.395 17.419 ( -1.049 0.991 -1.162) 1.853 17.497 ( -2.313 -1.373 4.096) 4.900 17.929 ( 1.180 -1.160 -2.162) 2.722 18.564 ( -0.333 -3.905 -1.174) 4.092 ======================= Grid point 63 (53/294) ======================= q-point: ( 0.17 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.074 ( -17.647 -4.937 17.039) 25.022 1.339 ( -16.541 5.280 -6.635) 18.587 2.040 ( 6.772 -5.064 -1.632) 8.612 2.721 ( 2.561 10.201 6.767) 12.507 2.898 ( 7.575 -7.463 5.858) 12.141 3.093 ( 11.285 0.728 -11.571) 16.179 3.714 ( 8.551 1.713 -4.450) 9.790 3.893 ( 1.840 -4.340 1.638) 4.990 5.031 ( -4.167 -7.229 -4.157) 9.323 6.509 ( 0.877 6.317 1.806) 6.628 6.765 ( -5.962 -0.713 0.543) 6.029 6.904 ( -5.507 -6.704 2.349) 8.988 7.357 ( -2.959 5.192 -1.011) 6.061 7.651 ( -10.190 0.723 0.197) 10.217 7.939 ( 0.514 -4.305 -4.164) 6.011 8.775 ( 4.941 -1.278 6.079) 7.937 9.196 ( 7.010 4.080 -5.141) 9.603 9.618 ( 1.619 -0.196 1.215) 2.034 16.694 ( 1.858 3.291 1.499) 4.066 16.799 ( 5.100 1.337 -1.615) 5.514 17.397 ( -2.322 1.271 -1.263) 2.933 17.464 ( -3.187 -0.962 4.351) 5.479 17.913 ( 0.736 -2.250 -3.270) 4.037 18.475 ( -2.002 -8.372 -2.936) 9.095 ======================= Grid point 64 (54/294) ======================= q-point: ( 0.25 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.933 ( -8.882 2.971 14.289) 17.085 1.140 ( -10.775 5.258 -0.031) 11.990 2.032 ( 2.623 -10.144 -4.048) 11.232 2.799 ( 4.729 -3.432 -5.034) 7.713 2.991 ( -0.977 -0.723 3.045) 3.278 3.226 ( 7.363 6.561 5.089) 11.098 3.834 ( 8.618 5.164 -10.091) 14.239 3.935 ( 4.132 -3.696 5.257) 7.640 4.876 ( -3.417 -8.423 -2.790) 9.508 6.503 ( -7.003 -0.535 -3.752) 7.963 6.673 ( -3.485 0.183 3.488) 4.935 6.828 ( -0.112 -2.024 1.674) 2.628 7.333 ( -5.212 2.725 -0.921) 5.954 7.524 ( -5.288 0.787 2.051) 5.726 7.872 ( 0.890 -5.400 -7.104) 8.968 8.865 ( 2.828 -0.454 6.251) 6.876 9.329 ( 5.995 5.871 -2.938) 8.891 9.648 ( 1.295 -0.067 1.227) 1.786 16.794 ( 4.513 4.942 1.325) 6.823 16.896 ( 6.017 1.271 -0.802) 6.202 17.342 ( -4.909 0.686 -0.933) 5.044 17.435 ( -2.934 0.983 3.216) 4.463 17.872 ( 0.039 -3.352 -4.174) 5.353 18.320 ( -2.899 -11.572 -2.959) 12.291 ======================= Grid point 65 (55/294) ======================= q-point: ( 0.33 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.992 ( 0.571 8.244 7.061) 10.870 1.105 ( -1.348 3.702 7.379) 8.365 1.904 ( -1.732 -11.511 -4.696) 12.552 2.708 ( -5.811 -7.631 -7.907) 12.431 2.969 ( 3.611 -1.955 -3.456) 5.367 3.491 ( 4.780 12.767 15.017) 20.282 3.972 ( 6.377 2.499 -6.190) 9.231 3.982 ( 2.886 0.965 1.137) 3.249 4.729 ( -2.343 -9.592 -2.575) 10.205 6.310 ( -6.629 -6.321 -5.559) 10.715 6.659 ( -2.233 0.881 3.037) 3.871 6.861 ( 2.443 1.487 1.497) 3.228 7.236 ( -6.994 0.442 1.074) 7.090 7.518 ( 0.589 1.865 0.646) 2.060 7.796 ( 0.598 -4.374 -6.745) 8.061 8.927 ( 1.137 -0.183 4.983) 5.115 9.451 ( 3.912 4.802 -1.190) 6.307 9.672 ( 0.415 0.729 1.081) 1.369 16.937 ( 6.213 5.391 0.100) 8.227 17.004 ( 6.031 0.698 0.605) 6.102 17.249 ( -6.446 1.258 -1.453) 6.727 17.420 ( -2.975 2.351 2.752) 4.685 17.796 ( -1.665 -5.133 -4.782) 7.210 18.155 ( -1.512 -11.736 -1.870) 11.980 ======================= Grid point 66 (56/294) ======================= q-point: ( 0.42 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.119 ( 4.005 4.336 0.661) 5.940 1.230 ( 5.742 2.771 7.660) 9.966 1.744 ( -3.931 -7.036 -2.066) 8.320 2.475 ( -7.079 -5.896 -6.415) 11.226 2.992 ( 3.564 -3.255 -3.950) 6.237 3.753 ( 0.583 12.926 16.260) 20.780 3.954 ( -4.313 0.303 0.170) 4.327 4.087 ( 3.888 3.557 -3.788) 6.490 4.600 ( 1.092 -9.360 -5.978) 11.160 6.151 ( -0.970 -7.360 -3.752) 8.318 6.653 ( -1.118 0.884 1.761) 2.265 6.921 ( 1.349 1.426 1.029) 2.217 7.166 ( -2.474 1.460 1.006) 3.044 7.556 ( 2.027 0.827 -0.414) 2.228 7.737 ( 0.592 -3.368 -4.432) 5.598 8.954 ( -0.635 0.189 2.961) 3.034 9.525 ( 1.766 1.535 0.271) 2.356 9.687 ( -1.016 2.411 0.588) 2.682 17.057 ( 1.889 3.071 -3.154) 4.790 17.118 ( 5.944 0.010 5.580) 8.153 17.162 ( -3.168 3.006 -3.610) 5.666 17.416 ( -3.173 3.594 3.465) 5.915 17.673 ( -2.531 -6.559 -4.550) 8.374 18.045 ( 0.948 -8.833 -1.527) 9.014 ======================= Grid point 67 (57/294) ======================= q-point: ( 0.50 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( 5.551 -1.491 -0.822) 5.806 1.345 ( 3.691 -0.194 -2.589) 4.513 1.639 ( -4.395 -0.573 1.194) 4.590 2.375 ( 1.047 0.373 2.034) 2.318 2.965 ( 0.255 -4.443 -3.887) 5.909 3.810 ( -13.709 2.476 6.897) 15.545 3.918 ( -1.455 3.360 1.997) 4.170 4.131 ( -1.458 3.874 2.661) 4.921 4.552 ( 7.054 -4.587 -9.261) 12.512 6.113 ( 5.002 -5.406 0.029) 7.365 6.663 ( 0.186 1.703 0.516) 1.789 6.924 ( -1.755 -0.402 0.583) 1.893 7.208 ( 4.122 3.093 -0.241) 5.159 7.590 ( 2.683 -0.472 -1.478) 3.099 7.702 ( 0.690 -3.075 -1.085) 3.333 8.942 ( -2.798 0.787 0.936) 3.054 9.544 ( 0.264 -1.490 1.242) 1.958 9.685 ( -2.671 3.100 -0.220) 4.098 17.007 ( -5.944 0.599 -0.109) 5.975 17.158 ( 1.268 -0.126 -4.761) 4.928 17.248 ( 5.497 0.428 2.959) 6.257 17.411 ( -4.214 2.527 4.058) 6.373 17.603 ( 2.325 -0.424 -2.189) 3.221 17.991 ( 1.848 -5.954 -1.922) 6.524 ======================= Grid point 68 (58/294) ======================= q-point: (-0.42 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.280 ( 5.624 -2.219 1.354) 6.196 1.342 ( 4.431 -2.038 -10.835) 11.882 1.593 ( -4.656 3.771 2.937) 6.673 2.510 ( 6.641 4.314 6.962) 10.545 2.885 ( -1.905 -4.475 -2.160) 5.321 3.593 ( -16.477 -0.609 3.019) 16.762 3.854 ( -7.145 -0.294 -0.811) 7.197 4.142 ( -1.007 -0.134 -0.411) 1.096 4.628 ( 7.862 1.423 -4.177) 9.015 6.206 ( 8.152 -0.124 3.227) 8.768 6.698 ( 1.597 2.489 -0.063) 2.958 6.879 ( -2.554 -1.765 -0.129) 3.107 7.326 ( 6.597 2.791 -0.911) 7.221 7.622 ( 3.846 -0.903 -2.804) 4.845 7.689 ( 0.910 -3.319 2.474) 4.238 8.888 ( -5.361 1.473 -0.457) 5.578 9.524 ( -0.615 -3.529 1.363) 3.833 9.654 ( -3.774 2.401 -1.125) 4.612 16.912 ( -6.167 -0.115 0.680) 6.206 17.103 ( -0.554 -6.182 -4.343) 7.575 17.337 ( 3.893 1.246 -0.633) 4.136 17.400 ( -2.813 3.880 3.947) 6.208 17.694 ( 4.962 3.609 1.723) 6.373 17.975 ( 2.682 -2.271 -1.277) 3.739 ======================= Grid point 70 (59/294) ======================= q-point: (-0.33 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( 6.411 0.603 -7.537) 9.913 1.403 ( 9.647 -3.337 -0.986) 10.255 1.605 ( -3.561 9.152 5.253) 11.137 2.620 ( 0.592 -1.377 -1.354) 2.020 2.849 ( -0.530 -0.087 5.636) 5.662 3.316 ( -16.941 -2.272 0.602) 17.104 3.735 ( -5.600 0.829 -0.092) 5.662 4.085 ( -0.359 -5.559 -5.973) 8.167 4.756 ( 6.186 3.016 0.519) 6.901 6.395 ( 8.096 6.349 4.891) 11.392 6.755 ( 1.379 3.368 0.085) 3.640 6.810 ( -2.001 -3.445 -1.254) 4.177 7.437 ( 4.815 0.550 -0.382) 4.862 7.687 ( 7.419 0.648 -3.744) 8.335 7.695 ( 1.068 -3.635 5.244) 6.470 8.792 ( -7.913 2.046 -1.010) 8.235 9.472 ( -0.913 -6.116 0.051) 6.184 9.603 ( -3.890 2.204 -1.397) 4.684 16.816 ( -5.579 -0.938 1.257) 5.795 17.002 ( -0.153 -7.548 -5.069) 9.093 17.394 ( 2.411 1.397 -1.871) 3.356 17.432 ( -1.522 5.203 3.376) 6.386 17.793 ( 3.127 0.441 1.264) 3.402 18.046 ( 4.822 3.999 2.617) 6.789 ======================= Grid point 71 (60/294) ======================= q-point: (-0.25 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( 8.162 3.884 -8.909) 12.692 1.561 ( 10.537 -1.927 6.552) 12.556 1.707 ( 0.688 11.084 3.577) 11.667 2.566 ( 0.465 -3.941 -3.391) 5.220 2.809 ( -10.040 -2.000 6.581) 12.170 3.018 ( -15.999 -1.920 -3.911) 16.582 3.733 ( 2.139 2.501 3.350) 4.696 3.963 ( -0.675 -8.811 -9.482) 12.961 4.891 ( 5.682 3.368 3.197) 7.338 6.606 ( 3.654 5.540 4.178) 7.842 6.727 ( -1.661 2.240 -0.806) 2.903 6.825 ( 2.587 1.929 -0.362) 3.247 7.483 ( 1.430 -0.653 0.342) 1.609 7.708 ( 0.890 -3.484 5.461) 6.539 7.838 ( 10.891 1.878 -1.660) 11.175 8.662 ( -9.680 2.276 -0.991) 9.994 9.381 ( -0.557 -8.787 -2.774) 9.232 9.562 ( -3.067 2.407 -0.585) 3.942 16.733 ( -4.254 -1.016 1.206) 4.537 16.906 ( 0.577 -7.173 -5.558) 9.093 17.423 ( 0.964 1.009 -1.243) 1.869 17.476 ( -0.674 4.507 1.538) 4.810 17.835 ( 2.077 -0.233 0.383) 2.125 18.208 ( 5.020 6.437 5.747) 9.983 ======================= Grid point 72 (61/294) ======================= q-point: (-0.17 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 8.148 6.491 -2.420) 10.695 1.715 ( 1.737 3.420 4.667) 6.042 1.893 ( 11.958 4.980 1.527) 13.043 2.537 ( -4.323 -5.627 1.243) 7.204 2.597 ( -12.108 -1.192 2.925) 12.513 2.743 ( -9.845 -0.496 -5.032) 11.068 3.778 ( 0.884 -11.026 -9.702) 14.713 3.858 ( 3.145 1.615 1.324) 3.775 5.043 ( 5.835 3.993 4.714) 8.498 6.547 ( -4.775 -4.421 -2.499) 6.971 6.848 ( 2.076 3.109 1.708) 4.110 6.913 ( 3.621 10.541 2.634) 11.452 7.486 ( -1.366 0.617 0.797) 1.698 7.719 ( 0.059 -2.199 5.190) 5.637 8.034 ( 10.462 1.984 1.019) 10.697 8.518 ( -9.232 1.749 -1.035) 9.453 9.266 ( 0.507 -10.037 -5.520) 11.466 9.543 ( -1.643 1.914 0.150) 2.527 16.676 ( -2.365 -0.545 0.531) 2.484 16.823 ( 0.600 -6.038 -5.063) 7.903 17.433 ( 0.296 0.425 -0.790) 0.945 17.507 ( -0.521 2.888 0.655) 3.007 17.869 ( 1.760 0.434 0.213) 1.825 18.374 ( 3.861 5.821 6.133) 9.295 ======================= Grid point 73 (62/294) ======================= q-point: (-0.08 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 2.085 -3.195 2.645) 4.642 1.802 ( 1.776 11.061 3.706) 11.800 2.136 ( 3.490 1.952 2.756) 4.856 2.301 ( -4.322 -5.350 1.634) 7.069 2.385 ( -14.028 3.826 -6.293) 15.844 2.784 ( 9.451 0.130 2.534) 9.786 3.606 ( 1.501 -12.398 -12.301) 17.529 3.937 ( 2.695 0.132 1.668) 3.172 5.191 ( 4.366 3.082 3.763) 6.536 6.418 ( -3.886 -3.281 -2.533) 5.682 6.878 ( -0.370 1.624 0.025) 1.665 7.081 ( 2.331 6.607 4.566) 8.362 7.460 ( -4.177 2.729 0.564) 5.021 7.736 ( -0.309 0.968 4.151) 4.274 8.177 ( -1.105 4.256 3.824) 5.827 8.425 ( 1.244 -1.503 -1.458) 2.436 9.157 ( 2.204 -9.324 -7.487) 12.160 9.545 ( -0.099 0.962 0.569) 1.122 16.652 ( -0.268 -0.359 -0.189) 0.486 16.755 ( -0.142 -3.831 -3.914) 5.479 17.434 ( 0.043 0.137 -0.667) 0.683 17.520 ( -0.827 1.078 1.222) 1.827 17.900 ( 1.570 0.459 -0.288) 1.661 18.503 ( 2.511 3.743 4.534) 6.393 ======================= Grid point 76 (63/294) ======================= q-point: ( 0.08 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( -11.425 -5.813 7.267) 14.736 1.816 ( -4.578 -4.339 0.586) 6.335 1.944 ( -11.973 2.170 -3.916) 12.783 2.502 ( 14.258 9.350 -8.231) 18.933 2.591 ( 12.463 -1.683 11.704) 17.180 2.777 ( 0.968 -5.575 -9.651) 11.187 3.465 ( 4.479 6.660 7.499) 10.984 3.918 ( -1.783 -1.914 -1.255) 2.901 5.178 ( -4.132 -4.177 -3.876) 7.038 6.425 ( 3.178 4.318 2.568) 5.944 6.881 ( -1.468 -0.496 -0.182) 1.561 7.094 ( -4.308 -6.079 1.039) 7.523 7.477 ( -2.673 2.732 -1.016) 3.955 7.795 ( 1.527 -0.903 -4.098) 4.466 8.105 ( -10.752 -3.301 -2.957) 11.629 8.530 ( 9.807 -1.268 3.443) 10.471 9.040 ( 1.614 6.419 1.314) 6.748 9.565 ( 1.214 -0.650 0.396) 1.433 16.661 ( 1.543 0.068 2.652) 3.069 16.710 ( -0.126 3.067 -1.367) 3.360 17.430 ( -0.228 0.167 0.040) 0.286 17.528 ( -0.716 -0.926 1.788) 2.137 17.898 ( -0.027 -1.051 -1.275) 1.652 18.529 ( -1.448 -3.896 -3.248) 5.275 ======================= Grid point 77 (64/294) ======================= q-point: ( 0.17 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( -15.551 -6.030 13.306) 21.336 1.598 ( -15.078 3.064 -7.664) 17.189 1.898 ( 3.443 -5.259 0.498) 6.305 2.611 ( 4.093 -6.003 -6.742) 9.912 2.832 ( 11.741 -0.862 3.231) 12.208 2.881 ( 13.091 9.782 -1.386) 16.401 3.649 ( 3.628 7.566 6.181) 10.422 3.854 ( -1.120 -3.380 -0.793) 3.648 5.024 ( -5.304 -5.656 -4.522) 8.976 6.548 ( 3.139 5.982 2.508) 7.206 6.832 ( -3.612 -1.720 -0.527) 4.035 6.934 ( -5.869 -9.166 0.426) 10.893 7.450 ( -3.438 4.125 -1.571) 5.595 7.776 ( -0.263 0.137 -5.804) 5.812 7.881 ( -9.120 -5.892 -1.441) 10.953 8.685 ( 8.669 -2.135 3.566) 9.614 9.163 ( 2.920 9.510 1.439) 10.051 9.587 ( 2.086 -1.103 0.796) 2.490 16.720 ( 3.105 0.062 4.456) 5.431 16.744 ( 0.614 5.792 -2.192) 6.224 17.424 ( -0.815 0.058 0.168) 0.834 17.513 ( -1.435 -1.275 2.602) 3.234 17.871 ( -0.254 -1.823 -2.400) 3.024 18.415 ( -2.854 -7.393 -5.285) 9.525 ======================= Grid point 78 (65/294) ======================= q-point: ( 0.25 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( -12.029 -0.849 14.564) 18.908 1.367 ( -12.613 4.478 -4.666) 14.174 1.870 ( 2.887 -10.485 -3.397) 11.394 2.620 ( 6.336 -3.387 -3.646) 8.057 2.946 ( 3.217 -2.728 -3.207) 5.299 3.203 ( 13.571 9.214 4.225) 16.939 3.743 ( 2.106 4.053 -3.992) 6.066 3.886 ( 3.485 1.180 7.829) 8.650 4.864 ( -5.082 -5.937 -2.806) 8.304 6.584 ( -6.461 -2.059 -4.229) 7.991 6.733 ( -1.644 -0.736 2.573) 3.141 6.816 ( -1.305 -3.535 0.374) 3.786 7.422 ( -3.657 3.048 -1.386) 4.958 7.667 ( -9.849 -0.634 2.227) 10.118 7.759 ( 1.623 -3.612 -7.140) 8.164 8.810 ( 6.620 -2.164 3.636) 7.857 9.313 ( 3.497 9.265 0.502) 9.916 9.620 ( 2.450 -1.181 1.283) 3.007 16.808 ( 5.444 0.482 0.483) 5.487 16.818 ( 1.182 7.092 2.123) 7.496 17.400 ( -2.407 -0.527 0.480) 2.511 17.491 ( -1.515 -0.723 1.868) 2.512 17.829 ( -0.770 -2.013 -3.041) 3.727 18.247 ( -3.729 -9.853 -5.336) 11.809 ======================= Grid point 79 (66/294) ======================= q-point: ( 0.33 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.152 ( -5.726 3.806 12.196) 14.001 1.235 ( -6.961 4.305 -0.195) 8.187 1.778 ( 1.642 -10.577 -4.332) 11.547 2.651 ( 0.698 -4.065 -4.225) 5.905 2.885 ( -0.296 -2.841 -4.863) 5.640 3.528 ( 13.173 6.882 6.321) 16.150 3.834 ( 7.268 4.312 -5.398) 10.028 3.999 ( 1.243 3.884 7.791) 8.793 4.710 ( -5.525 -6.993 -0.770) 8.945 6.348 ( -9.350 -6.678 -6.954) 13.430 6.718 ( -2.927 -0.234 1.775) 3.431 6.836 ( 3.153 1.256 1.191) 3.597 7.350 ( -6.336 -0.641 0.509) 6.389 7.569 ( -3.998 1.347 2.280) 4.796 7.717 ( 0.680 -1.392 -6.048) 6.244 8.900 ( 4.308 -1.688 3.111) 5.575 9.441 ( 2.886 6.620 -0.674) 7.253 9.659 ( 2.356 -0.572 1.757) 2.994 16.909 ( 6.071 2.183 -2.469) 6.907 16.933 ( 2.933 5.538 4.919) 7.967 17.340 ( -4.555 -0.368 0.330) 4.582 17.474 ( -0.757 -0.342 0.398) 0.921 17.769 ( -2.428 -2.382 -3.153) 4.637 18.070 ( -2.799 -9.701 -3.340) 10.635 ======================= Grid point 80 (67/294) ======================= q-point: ( 0.42 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.161 ( -3.637 3.164 1.878) 5.173 1.245 ( 1.070 3.141 7.074) 7.813 1.702 ( 0.885 -5.453 -1.970) 5.865 2.492 ( -6.493 -5.585 -6.946) 11.027 2.899 ( 3.239 -0.053 -0.947) 3.375 3.808 ( 10.132 2.275 6.763) 12.392 3.959 ( 6.700 3.720 -6.658) 10.152 4.092 ( -0.249 7.433 5.400) 9.191 4.538 ( -6.304 -8.692 0.315) 10.743 6.130 ( -6.043 -3.941 -5.206) 8.897 6.683 ( -1.505 -0.644 1.010) 1.923 6.906 ( 2.626 1.539 0.627) 3.108 7.241 ( -5.496 -1.417 1.263) 5.815 7.558 ( -0.956 1.381 0.971) 1.940 7.688 ( 0.208 -0.432 -3.409) 3.443 8.954 ( 2.087 -0.916 1.815) 2.914 9.516 ( 1.437 2.932 -0.886) 3.383 9.701 ( 1.608 0.260 1.369) 2.128 17.010 ( 5.425 1.919 -2.437) 6.249 17.062 ( 3.894 3.318 5.072) 7.204 17.255 ( -5.780 0.943 -0.914) 5.927 17.469 ( 0.657 0.066 -0.558) 0.864 17.660 ( -4.718 -4.330 -2.273) 6.795 17.963 ( -0.381 -4.976 -0.962) 5.082 ======================= Grid point 81 (68/294) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 436 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( 0.000 0.000 0.000) 0.000 1.307 ( -0.000 0.000 0.000) 0.000 1.680 ( -0.000 0.000 0.000) 0.000 2.375 ( 0.000 0.000 0.000) 0.000 2.926 ( 0.000 -0.000 -0.000) 0.000 3.925 ( 0.000 0.000 0.000) 0.000 4.015 ( 0.000 0.000 0.000) 0.000 4.180 ( -0.000 0.000 0.000) 0.000 4.404 ( -0.000 -0.000 0.000) 0.000 6.044 ( 0.000 0.000 0.000) 0.000 6.671 ( 0.000 0.000 0.000) 0.000 6.941 ( 0.000 0.000 0.000) 0.000 7.187 ( 0.000 0.000 0.000) 0.000 7.561 ( 0.000 0.000 0.000) 0.000 7.678 ( -0.000 0.000 0.000) 0.000 8.971 ( 0.000 0.000 0.000) 0.000 9.538 ( 0.000 0.000 0.000) 0.000 9.721 ( 0.000 0.000 0.000) 0.000 17.067 ( -0.000 0.000 0.000) 0.000 17.162 ( 0.000 -0.000 0.000) 0.000 17.170 ( -0.000 0.000 -0.000) 0.000 17.488 ( 0.000 0.000 0.000) 0.000 17.567 ( -0.000 0.000 0.000) 0.000 17.937 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 162 (69/294) ======================= q-point: ( 0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.368 ( 0.000 0.000 21.390) 21.390 0.368 ( 0.000 0.000 21.390) 21.390 0.531 ( 0.000 0.000 30.833) 30.833 3.319 ( -0.000 -0.000 -10.249) 10.249 3.319 ( -0.000 -0.000 -10.249) 10.249 3.922 ( 0.000 0.000 0.673) 0.673 3.922 ( -0.000 0.000 0.673) 0.673 4.603 ( -0.000 -0.000 -12.472) 12.472 5.526 ( -0.000 -0.000 -0.636) 0.636 6.291 ( 0.000 0.000 1.800) 1.800 6.291 ( 0.000 0.000 1.800) 1.800 6.953 ( 0.000 0.000 8.554) 8.554 7.086 ( 0.000 0.000 4.889) 4.889 7.086 ( 0.000 0.000 4.889) 4.889 7.403 ( 0.000 0.000 0.171) 0.171 9.377 ( -0.000 -0.000 -1.961) 1.961 9.557 ( -0.000 -0.000 -3.466) 3.466 9.557 ( -0.000 -0.000 -3.466) 3.466 16.924 ( -0.000 -0.000 -5.599) 5.599 16.924 ( -0.000 -0.000 -5.599) 5.599 17.218 ( 0.000 0.000 5.040) 5.040 17.218 ( 0.000 0.000 5.040) 5.040 18.046 ( -0.000 -0.000 -1.786) 1.786 18.834 ( 0.000 0.000 1.303) 1.303 ======================= Grid point 163 (70/294) ======================= q-point: ( 0.17 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.474 ( 10.338 6.500 9.670) 15.577 0.659 ( -0.591 18.972 21.888) 28.972 0.888 ( 18.838 -2.809 26.231) 32.417 3.079 ( -8.447 -8.141 -13.653) 18.001 3.313 ( -2.367 -4.467 -5.394) 7.393 3.902 ( 1.255 1.563 -3.344) 3.899 3.993 ( 2.471 3.640 -0.996) 4.511 4.340 ( -13.744 -6.320 -9.964) 18.114 5.464 ( -4.490 -2.235 -1.986) 5.395 6.272 ( -0.447 -1.107 1.274) 1.746 6.404 ( 6.168 4.322 3.062) 8.130 6.961 ( -1.385 -0.547 3.474) 3.780 7.105 ( 0.230 -0.907 9.481) 9.527 7.226 ( 6.241 2.943 8.828) 11.205 7.432 ( 3.177 1.817 0.512) 3.696 9.242 ( -6.095 -4.721 1.299) 7.818 9.531 ( 2.117 -5.357 -5.520) 7.978 9.632 ( 0.111 8.097 -8.926) 12.052 16.819 ( -3.767 -0.462 -7.045) 8.002 17.053 ( 4.723 1.328 -1.842) 5.241 17.137 ( -3.025 0.020 0.142) 3.028 17.293 ( 2.317 1.452 5.085) 5.774 18.036 ( -0.021 -0.100 -2.089) 2.092 18.757 ( -4.415 -4.137 5.982) 8.509 ======================= Grid point 164 (71/294) ======================= q-point: ( 0.25 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.810 ( 15.426 11.473 -0.534) 19.232 0.975 ( -0.418 24.000 21.257) 32.063 1.325 ( 21.093 -4.334 22.978) 31.491 2.765 ( -10.629 -8.771 -12.237) 18.429 3.139 ( -4.420 -12.561 -4.107) 13.934 3.907 ( -3.107 2.119 -8.463) 9.261 3.917 ( -12.714 -3.807 -7.521) 15.255 4.087 ( -2.566 -0.648 -1.026) 2.839 5.350 ( -4.516 -1.489 -3.911) 6.157 6.278 ( 1.308 -0.655 1.611) 2.176 6.570 ( 6.247 4.943 2.434) 8.330 6.966 ( 1.791 0.770 -1.923) 2.738 7.164 ( 0.188 -1.037 12.729) 12.773 7.434 ( 7.394 6.104 9.270) 13.337 7.532 ( 6.687 0.566 1.218) 6.821 9.099 ( -6.492 -5.425 -0.202) 8.463 9.444 ( -2.580 -3.244 -9.478) 10.345 9.632 ( -1.392 3.594 -3.778) 5.397 16.722 ( -3.135 0.721 -7.015) 7.717 16.966 ( -7.751 -4.247 6.939) 11.237 17.231 ( 7.040 4.402 -7.172) 10.972 17.378 ( 2.740 2.055 4.485) 5.644 18.015 ( -0.688 -0.657 -2.400) 2.582 18.697 ( -2.459 -4.010 4.286) 6.363 ======================= Grid point 165 (72/294) ======================= q-point: ( 0.33 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 15.150 12.653 -5.307) 20.440 1.328 ( 0.801 24.681 19.661) 31.564 1.726 ( 18.009 -5.145 18.207) 26.121 2.459 ( -8.940 -8.247 -7.504) 14.292 2.912 ( -3.117 -16.160 -5.711) 17.420 3.521 ( -18.499 -5.064 -9.142) 21.247 3.834 ( -5.515 -1.258 -6.305) 8.471 4.045 ( -3.707 0.227 1.005) 3.848 5.261 ( -2.404 0.352 -5.478) 5.993 6.315 ( 2.339 -0.523 2.100) 3.187 6.712 ( 4.870 3.823 1.048) 6.280 7.016 ( 4.386 2.749 -4.524) 6.875 7.236 ( 0.811 -0.189 11.929) 11.958 7.623 ( 4.415 5.393 -0.419) 6.982 7.709 ( 11.089 1.069 10.109) 15.043 8.926 ( -7.928 -5.839 -0.490) 9.858 9.290 ( -5.996 -1.460 -11.103) 12.703 9.620 ( -1.119 0.438 -0.090) 1.205 16.658 ( -1.534 1.727 -5.696) 6.146 16.851 ( -6.514 -3.231 5.875) 9.348 17.323 ( 4.604 2.313 -4.324) 6.726 17.466 ( 2.489 2.264 3.653) 4.966 17.974 ( -1.243 -1.367 -2.825) 3.376 18.644 ( -1.748 -3.456 1.221) 4.061 ======================= Grid point 166 (73/294) ======================= q-point: ( 0.42 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( 13.354 12.492 -8.360) 20.106 1.659 ( 0.607 19.952 15.442) 25.237 1.937 ( 3.087 -4.153 5.028) 7.215 2.313 ( 3.834 -8.910 3.214) 10.218 2.693 ( -1.184 -15.143 -2.637) 15.416 3.156 ( -16.091 -2.213 -5.785) 17.242 3.644 ( -9.778 -4.958 -3.470) 11.499 3.990 ( -3.474 0.417 -0.194) 3.504 5.214 ( -0.574 1.604 -6.242) 6.470 6.358 ( 1.893 -0.987 2.613) 3.375 6.812 ( 3.682 2.197 0.039) 4.288 7.088 ( 3.892 2.702 -5.343) 7.141 7.330 ( 3.008 1.807 7.976) 8.714 7.718 ( 4.270 0.982 -0.791) 4.452 7.956 ( 8.798 4.973 6.705) 12.129 8.738 ( -7.830 -6.415 1.121) 10.184 9.113 ( -6.815 -0.439 -9.143) 11.413 9.603 ( -1.160 -0.804 1.493) 2.055 16.642 ( 0.338 2.157 -3.215) 3.886 16.764 ( -5.001 -2.096 5.111) 7.452 17.379 ( 2.913 1.017 -2.456) 3.943 17.532 ( 0.976 1.314 2.801) 3.244 17.924 ( -0.882 -1.615 -3.011) 3.529 18.590 ( -1.175 -2.207 -2.052) 3.234 ======================= Grid point 167 (74/294) ======================= q-point: ( 0.50 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( 2.864 4.477 -6.704) 8.555 1.860 ( 7.842 3.892 -2.124) 9.008 1.958 ( -1.885 5.050 4.186) 6.825 2.293 ( 1.258 -6.094 -2.292) 6.631 2.631 ( 0.594 -7.485 11.657) 13.865 2.913 ( -10.458 2.281 -2.026) 10.894 3.445 ( -5.221 -6.089 2.652) 8.448 3.944 ( -1.812 0.282 -1.662) 2.475 5.195 ( 0.482 2.067 -6.440) 6.780 6.385 ( 0.903 -1.497 2.951) 3.430 6.875 ( 2.188 1.057 -0.156) 2.435 7.114 ( 1.890 -0.526 -6.005) 6.318 7.446 ( 3.358 3.459 3.010) 5.684 7.767 ( 2.076 -0.297 -1.861) 2.804 8.134 ( 3.797 7.013 -1.334) 8.086 8.575 ( -6.133 -7.638 4.101) 10.619 8.997 ( -2.207 0.696 -1.611) 2.819 9.585 ( -1.315 -0.755 1.784) 2.342 16.669 ( 1.673 1.574 0.340) 2.322 16.708 ( -3.545 -0.618 4.263) 5.578 17.412 ( 1.712 0.282 -1.150) 2.081 17.549 ( -0.595 -0.514 1.047) 1.309 17.890 ( 0.314 -0.747 -2.592) 2.716 18.543 ( -0.509 -0.581 -4.846) 4.908 ======================= Grid point 168 (75/294) ======================= q-point: (-0.42 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( -0.424 -7.660 -9.296) 12.053 1.886 ( 0.626 -5.543 -1.389) 5.749 2.026 ( 5.538 1.322 -11.178) 12.545 2.324 ( -0.876 11.678 2.188) 11.913 2.544 ( -10.838 -7.863 12.778) 18.508 2.864 ( -2.338 9.440 3.352) 10.287 3.463 ( 8.149 -4.055 10.264) 13.719 3.922 ( 0.418 0.216 -2.383) 2.429 5.193 ( 1.230 2.120 -6.200) 6.667 6.394 ( -0.026 -1.721 3.047) 3.499 6.900 ( 0.047 0.362 0.080) 0.374 7.072 ( 0.722 -3.744 -8.763) 9.556 7.499 ( -1.419 0.546 0.547) 1.616 7.756 ( -1.910 2.607 -4.658) 5.669 8.193 ( -0.075 2.421 -7.746) 8.115 8.455 ( -3.584 -3.013 6.495) 8.007 9.060 ( 6.063 0.952 7.172) 9.439 9.568 ( -1.395 0.073 1.280) 1.895 16.681 ( -1.984 -0.335 4.500) 4.929 16.727 ( 1.880 1.535 3.080) 3.921 17.430 ( 0.876 -0.014 -0.182) 0.895 17.520 ( -1.100 -2.247 -1.516) 2.925 17.892 ( 1.422 0.658 -1.675) 2.294 18.509 ( 0.138 0.921 -6.755) 6.819 ======================= Grid point 169 (76/294) ======================= q-point: (-0.33 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -1.922 -19.508 -15.807) 25.181 1.833 ( -13.159 5.737 -9.010) 16.949 1.989 ( 3.191 -1.419 -3.227) 4.755 2.287 ( -8.111 -10.334 11.782) 17.646 2.568 ( 6.961 11.493 3.519) 13.890 3.033 ( 4.555 14.256 7.418) 16.704 3.675 ( 11.948 -1.790 10.684) 16.128 3.934 ( 2.346 0.181 -2.250) 3.256 5.205 ( 2.063 2.094 -5.467) 6.208 6.387 ( -1.003 -1.612 3.018) 3.566 6.882 ( -2.633 -0.670 0.743) 2.817 6.974 ( 0.175 -4.661 -12.561) 13.399 7.415 ( -6.207 -2.976 -1.012) 6.958 7.714 ( -3.938 4.172 -5.570) 7.996 8.063 ( -7.910 -5.654 -2.278) 9.986 8.532 ( 6.368 4.701 3.042) 8.480 9.246 ( 8.770 1.238 9.109) 12.705 9.557 ( -1.144 1.031 0.324) 1.574 16.686 ( -0.613 0.824 3.918) 4.050 16.792 ( 1.611 0.430 6.110) 6.333 17.440 ( 0.479 -0.145 0.101) 0.510 17.459 ( -1.407 -3.047 -3.687) 4.985 17.927 ( 2.323 1.515 -0.609) 2.840 18.487 ( 0.662 1.942 -7.728) 7.996 ======================= Grid point 170 (77/294) ======================= q-point: (-0.25 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.052 ( -2.751 -23.261 -15.782) 28.243 1.489 ( -23.501 6.425 -16.599) 29.481 1.883 ( -13.509 -12.501 12.745) 22.388 2.345 ( 13.185 1.997 4.838) 14.186 2.826 ( 8.284 11.141 2.541) 14.114 3.337 ( 10.983 14.339 6.377) 19.154 3.892 ( 9.094 -1.232 6.315) 11.140 3.974 ( 3.544 0.261 -0.715) 3.625 5.239 ( 3.053 2.297 -4.381) 5.813 6.366 ( -2.079 -1.244 3.092) 3.928 6.785 ( -4.857 -4.729 -4.500) 8.136 6.886 ( -0.262 -0.051 -8.953) 8.957 7.270 ( -5.074 -5.377 -1.756) 7.599 7.624 ( -7.995 3.303 -5.307) 10.149 7.868 ( -8.353 -7.476 4.064) 11.924 8.722 ( 9.040 5.514 0.392) 10.596 9.448 ( 7.565 2.240 8.012) 11.244 9.555 ( 0.029 1.160 -1.153) 1.636 16.723 ( 1.059 1.673 3.693) 4.190 16.856 ( 1.106 0.170 7.721) 7.802 17.377 ( -1.589 -3.457 -5.185) 6.431 17.442 ( -0.391 -0.107 -0.133) 0.427 17.982 ( 2.533 1.448 0.192) 2.924 18.479 ( 1.262 2.347 -7.492) 7.952 ======================= Grid point 171 (78/294) ======================= q-point: (-0.17 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.704 ( -2.415 -23.993 -12.012) 26.940 1.050 ( -25.953 7.076 -16.750) 31.689 1.559 ( -18.942 -15.546 14.801) 28.627 2.667 ( 17.744 4.642 4.261) 18.830 3.058 ( 6.267 10.183 1.993) 12.121 3.702 ( 14.144 12.220 2.257) 18.827 3.982 ( 4.275 -2.499 -0.348) 4.964 4.055 ( 3.009 0.869 1.861) 3.643 5.298 ( 3.911 2.919 -3.450) 5.977 6.336 ( -2.475 -0.862 3.445) 4.329 6.620 ( -5.594 -4.650 -6.323) 9.638 6.848 ( -0.328 1.770 -5.512) 5.798 7.144 ( -1.575 -7.195 -2.236) 7.698 7.467 ( -11.711 2.070 -0.403) 11.899 7.700 ( -7.029 -7.636 4.674) 11.383 8.916 ( 8.640 4.793 -0.440) 9.890 9.552 ( -0.549 1.979 0.172) 2.061 9.629 ( 6.960 1.858 2.500) 7.625 16.796 ( 2.875 2.438 4.106) 5.574 16.920 ( 0.728 0.831 7.838) 7.915 17.287 ( -1.634 -3.406 -5.440) 6.623 17.415 ( -2.060 -0.557 -2.175) 3.047 18.030 ( 1.708 0.845 0.260) 1.923 18.490 ( 2.199 1.984 -5.107) 5.903 ======================= Grid point 172 (79/294) ======================= q-point: (-0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.413 ( -1.753 -20.497 -1.777) 20.649 0.605 ( -26.631 8.743 -14.349) 31.489 1.163 ( -21.418 -17.242 16.360) 31.995 3.027 ( 17.616 4.176 5.025) 18.789 3.239 ( 5.417 6.844 -0.768) 8.762 3.919 ( 3.146 -0.438 -2.479) 4.029 4.044 ( -2.816 1.270 -1.788) 3.570 4.132 ( 11.808 6.781 -1.411) 13.689 5.379 ( 4.493 3.522 -2.619) 6.281 6.316 ( -1.410 -0.887 3.825) 4.172 6.455 ( -5.991 -3.598 -4.127) 8.116 6.848 ( 0.820 2.393 -2.597) 3.626 7.062 ( 1.092 -6.636 -2.010) 7.020 7.301 ( -11.564 0.126 6.418) 13.227 7.545 ( -6.408 -6.075 2.094) 9.075 9.081 ( 6.870 3.329 0.442) 7.647 9.557 ( 0.964 -0.073 -2.199) 2.402 9.746 ( 3.388 3.407 -1.105) 4.930 16.911 ( 4.847 2.989 5.796) 8.126 16.980 ( -0.202 2.110 6.018) 6.380 17.204 ( -0.916 -3.443 -4.492) 5.733 17.328 ( -4.811 -1.014 -7.041) 8.588 18.053 ( 0.609 0.316 -0.291) 0.745 18.534 ( 3.313 0.951 0.518) 3.485 ======================= Grid point 175 (80/294) ======================= q-point: ( 0.17 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.457 ( 0.963 -4.679 18.588) 19.192 0.682 ( 8.175 0.067 22.964) 24.376 1.139 ( -4.498 22.689 24.418) 33.634 3.064 ( -3.420 -5.072 -16.738) 17.821 3.267 ( -1.489 -0.141 -9.867) 9.979 3.881 ( -0.623 -1.146 -2.862) 3.146 3.955 ( 3.084 1.306 -0.597) 3.402 4.275 ( 1.014 -13.047 -11.496) 17.419 5.443 ( 0.179 -6.525 -2.748) 7.082 6.320 ( -1.766 2.340 1.234) 3.181 6.380 ( 1.807 3.327 4.458) 5.848 6.980 ( -0.337 -6.191 8.173) 10.259 7.086 ( -0.180 -2.734 5.120) 5.807 7.344 ( 0.383 8.567 9.773) 13.002 7.442 ( -1.062 6.614 1.990) 6.988 9.249 ( -1.393 -7.889 -0.841) 8.055 9.462 ( -1.733 -1.361 -6.872) 7.216 9.616 ( 3.419 5.345 -6.922) 9.390 16.890 ( 5.028 5.993 -10.294) 12.929 16.940 ( -4.261 4.697 -5.235) 8.223 17.219 ( 3.755 -6.568 6.691) 10.100 17.248 ( -2.896 -1.292 5.327) 6.200 18.026 ( -0.084 0.329 -2.427) 2.451 18.772 ( -1.162 -7.202 4.736) 8.697 ======================= Grid point 176 (81/294) ======================= q-point: ( 0.25 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.676 ( 13.046 6.608 5.885) 15.763 1.023 ( 16.596 -1.472 22.220) 27.773 1.439 ( -2.080 23.162 23.540) 33.090 2.778 ( -10.363 -6.394 -16.119) 20.201 3.099 ( -6.924 -10.914 -6.212) 14.340 3.873 ( 2.140 0.368 -6.674) 7.018 3.987 ( -5.131 -3.337 -7.891) 9.986 4.082 ( -0.312 -3.322 -4.464) 5.574 5.338 ( -1.896 -6.770 -4.728) 8.472 6.303 ( -2.143 1.807 2.214) 3.572 6.527 ( 6.348 4.265 3.698) 8.495 6.943 ( -0.886 -3.016 2.366) 3.934 7.134 ( 4.950 -7.697 11.597) 14.773 7.470 ( 3.899 3.832 1.979) 5.814 7.546 ( -0.984 12.511 7.851) 14.803 9.108 ( -3.820 -8.215 -2.217) 9.327 9.414 ( -1.094 -0.409 -5.368) 5.493 9.644 ( 0.404 3.366 -6.983) 7.763 16.799 ( -7.229 5.547 -7.410) 11.745 17.059 ( 4.066 0.940 -0.769) 4.243 17.138 ( -2.195 -0.101 0.139) 2.201 17.331 ( 5.654 -2.235 4.555) 7.597 18.006 ( -0.665 -0.288 -2.808) 2.900 18.695 ( -1.887 -8.079 4.316) 9.352 ======================= Grid point 177 (82/294) ======================= q-point: ( 0.33 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.002 ( 14.743 10.558 -1.623) 18.206 1.407 ( 17.043 -1.572 18.585) 25.265 1.759 ( -0.142 20.028 21.246) 29.198 2.471 ( -9.038 -6.046 -12.807) 16.800 2.821 ( -7.219 -14.644 -4.668) 16.981 3.684 ( -13.957 -6.804 -9.004) 17.949 3.844 ( -1.754 -0.072 -8.362) 8.544 4.093 ( -0.976 0.350 0.698) 1.250 5.226 ( -0.542 -4.763 -7.196) 8.646 6.318 ( -0.030 1.921 2.795) 3.391 6.671 ( 4.923 2.990 1.248) 5.894 6.948 ( 2.716 0.318 -0.969) 2.901 7.214 ( 5.601 -8.756 12.736) 16.439 7.572 ( 4.407 2.977 -0.754) 5.372 7.717 ( 3.025 10.178 8.148) 13.384 8.956 ( -4.716 -7.378 -1.345) 8.859 9.331 ( -5.236 1.540 -7.262) 9.084 9.633 ( -0.430 1.093 -3.206) 3.414 16.711 ( -4.956 5.177 -5.779) 9.207 16.984 ( -7.862 -3.083 8.136) 11.726 17.228 ( 6.801 3.705 -6.790) 10.300 17.427 ( 5.287 -0.972 3.123) 6.217 17.963 ( -1.388 -1.601 -3.378) 3.987 18.616 ( -0.809 -7.762 1.727) 7.993 ======================= Grid point 178 (83/294) ======================= q-point: ( 0.42 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( 13.970 11.309 -5.803) 18.887 1.705 ( 10.304 -3.373 8.633) 13.859 1.977 ( -0.304 1.344 8.576) 8.686 2.294 ( -4.780 6.638 0.692) 8.209 2.595 ( -2.396 -10.614 2.099) 11.082 3.349 ( -14.835 -3.886 -6.344) 16.596 3.719 ( -6.716 -2.444 -6.607) 9.733 4.048 ( -4.002 -1.637 1.554) 4.594 5.155 ( 1.691 -2.667 -8.691) 9.247 6.361 ( 0.574 1.943 3.070) 3.678 6.758 ( 4.128 0.967 -1.790) 4.602 7.006 ( 3.854 0.820 -2.759) 4.810 7.302 ( 5.863 -5.276 9.814) 12.591 7.656 ( 3.748 1.818 -1.261) 4.352 7.915 ( 6.768 5.684 5.704) 10.519 8.800 ( -6.541 -5.929 0.698) 8.855 9.204 ( -7.762 3.877 -7.341) 11.365 9.619 ( -0.586 -0.496 0.305) 0.826 16.672 ( -2.398 4.899 -3.412) 6.434 16.885 ( -7.092 -1.497 7.684) 10.564 17.314 ( 4.570 1.868 -4.271) 6.528 17.511 ( 3.728 -0.522 1.783) 4.165 17.898 ( -1.138 -2.840 -3.787) 4.869 18.545 ( 0.165 -6.349 -1.771) 6.594 ======================= Grid point 179 (84/294) ======================= q-point: ( 0.50 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 9.609 8.450 -7.975) 15.078 1.746 ( 2.302 -4.804 -4.607) 7.043 1.872 ( -0.208 -16.932 -4.245) 17.457 2.424 ( -0.688 14.920 8.902) 17.388 2.618 ( 2.432 -0.322 15.635) 15.826 3.086 ( -10.787 -0.518 -2.533) 11.092 3.527 ( -9.110 -3.711 -1.754) 9.992 3.971 ( -3.442 -2.008 0.085) 3.986 5.125 ( 2.949 -1.582 -8.665) 9.289 6.400 ( -0.177 1.734 3.090) 3.548 6.812 ( 4.478 -0.621 -4.166) 6.148 7.027 ( 1.811 -2.779 -3.412) 4.758 7.420 ( 5.791 0.545 4.485) 7.345 7.713 ( 3.027 0.454 -1.206) 3.290 8.083 ( 6.717 1.842 0.002) 6.965 8.648 ( -7.290 -4.629 3.442) 9.296 9.095 ( -6.829 5.742 -2.796) 9.350 9.608 ( -0.830 -0.848 2.070) 2.386 16.683 ( -0.277 3.713 -0.188) 3.728 16.817 ( -5.719 0.514 7.095) 9.128 17.367 ( 3.087 0.739 -2.590) 4.096 17.543 ( 0.549 -1.919 0.154) 2.002 17.848 ( 0.911 -2.281 -3.410) 4.203 18.485 ( 1.101 -4.316 -5.143) 6.804 ======================= Grid point 180 (85/294) ======================= q-point: ( 0.58 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( -5.208 -13.740 -9.550) 17.524 1.732 ( 5.608 -4.789 -6.976) 10.151 1.881 ( 10.366 2.608 -3.063) 11.119 2.513 ( -6.982 10.370 -2.930) 12.840 2.709 ( -4.960 -2.636 18.192) 19.040 3.004 ( -1.972 5.462 3.922) 7.008 3.416 ( -0.434 -0.805 6.017) 6.086 3.914 ( -1.371 -0.852 -0.701) 1.760 5.118 ( 3.477 -1.126 -7.709) 8.531 6.421 ( -1.117 1.557 2.904) 3.480 6.837 ( 4.530 -3.113 -7.556) 9.344 6.982 ( -0.681 -4.354 -2.352) 4.995 7.512 ( 1.454 1.156 0.017) 1.858 7.759 ( 2.322 2.252 -1.923) 3.763 8.143 ( 2.281 -0.274 -7.403) 7.751 8.533 ( -5.057 -3.726 6.807) 9.262 9.085 ( -1.235 5.870 4.380) 7.428 9.600 ( -1.086 -0.344 2.381) 2.639 16.712 ( -0.118 -0.547 4.106) 4.144 16.802 ( -3.276 4.944 5.645) 8.187 17.401 ( 2.114 -0.032 -1.372) 2.521 17.499 ( -1.273 -3.924 -2.252) 4.700 17.850 ( 2.507 -0.118 -2.377) 3.456 18.442 ( 1.985 -2.322 -7.573) 8.166 ======================= Grid point 181 (86/294) ======================= q-point: (-0.33 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.204 ( -6.357 -16.751 -10.425) 20.729 1.812 ( 9.287 0.793 -2.852) 9.748 1.998 ( 0.582 3.031 -6.297) 7.013 2.397 ( -9.159 -0.693 -2.131) 9.429 2.640 ( -6.451 -0.844 11.557) 13.263 3.125 ( 4.587 7.084 4.849) 9.733 3.563 ( 8.656 3.309 10.087) 13.697 3.907 ( 0.279 1.265 0.534) 1.401 5.129 ( 3.885 -0.692 -6.160) 7.316 6.428 ( -1.833 1.561 2.757) 3.661 6.800 ( 3.647 -7.160 -12.335) 14.722 6.920 ( -2.331 -2.036 0.924) 3.230 7.472 ( -4.588 -1.742 -2.824) 5.662 7.792 ( -1.830 5.875 -3.829) 7.248 8.084 ( -2.349 -2.831 -6.690) 7.635 8.514 ( 1.336 -1.127 6.805) 7.026 9.201 ( 4.749 3.955 7.571) 9.773 9.593 ( -1.267 0.351 1.804) 2.232 16.716 ( -0.544 -2.622 5.991) 6.562 16.860 ( -1.269 6.772 6.178) 9.254 17.401 ( -0.071 -4.604 -3.172) 5.591 17.439 ( 0.339 -0.507 -1.699) 1.805 17.890 ( 2.947 1.351 -1.766) 3.692 18.419 ( 2.560 -0.693 -8.684) 9.080 ======================= Grid point 182 (87/294) ======================= q-point: (-0.25 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.885 ( -8.030 -15.120 -6.950) 18.477 1.819 ( -18.676 7.150 -13.892) 24.350 1.956 ( 3.600 -2.253 1.511) 4.508 2.260 ( -1.601 -6.985 11.942) 13.927 2.721 ( 9.378 3.126 -0.159) 9.887 3.317 ( 9.892 4.660 2.204) 11.154 3.800 ( 8.411 4.398 7.612) 12.167 3.945 ( 0.718 2.576 2.443) 3.622 5.164 ( 4.435 0.159 -4.203) 6.112 6.423 ( -2.612 1.526 3.016) 4.272 6.699 ( 1.402 -6.984 -11.689) 13.688 6.874 ( -2.090 -1.313 0.342) 2.492 7.325 ( -7.628 -1.801 -5.172) 9.391 7.757 ( -6.034 5.876 -4.746) 9.667 7.951 ( -6.642 -5.809 1.216) 8.907 8.624 ( 7.721 1.482 2.817) 8.351 9.373 ( 7.368 1.964 6.221) 9.841 9.586 ( -1.180 0.864 1.126) 1.845 16.726 ( 0.881 -2.872 6.039) 6.746 16.943 ( -1.431 6.894 7.661) 10.405 17.315 ( -0.511 -5.651 -5.828) 8.133 17.446 ( 0.261 0.386 -0.513) 0.693 17.946 ( 3.139 1.667 -1.338) 3.798 18.413 ( 2.802 0.567 -8.284) 8.763 ======================= Grid point 183 (88/294) ======================= q-point: (-0.17 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.610 ( -9.559 -8.223 2.867) 12.931 1.444 ( -24.375 7.835 -14.617) 29.482 1.795 ( -15.662 -13.314 14.816) 25.340 2.446 ( 15.994 3.865 2.512) 16.645 2.914 ( 13.146 -0.475 -5.607) 14.300 3.567 ( 15.661 2.783 0.680) 15.921 3.955 ( 0.404 4.623 2.722) 5.380 4.014 ( 4.156 1.194 3.438) 5.525 5.229 ( 4.900 1.564 -2.593) 5.760 6.399 ( -3.419 -0.155 2.697) 4.357 6.600 ( -1.213 -2.315 -7.191) 7.651 6.836 ( -0.691 -1.067 -0.550) 1.385 7.159 ( -6.962 -0.454 -6.179) 9.320 7.659 ( -8.859 4.109 -3.035) 10.226 7.786 ( -8.321 -7.542 6.215) 12.835 8.797 ( 9.694 2.341 0.047) 9.973 9.508 ( 4.504 -0.962 -0.382) 4.621 9.607 ( 2.093 2.469 3.522) 4.783 16.764 ( 3.043 -2.954 6.113) 7.440 17.026 ( -1.825 6.399 7.879) 10.313 17.220 ( -0.363 -5.019 -6.563) 8.271 17.436 ( -1.421 0.606 -1.956) 2.493 18.001 ( 2.685 1.030 -0.967) 3.034 18.429 ( 3.158 1.473 -5.788) 6.756 ======================= Grid point 184 (89/294) ======================= q-point: (-0.08 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.506 ( -8.961 6.927 18.144) 21.389 1.038 ( -25.295 8.920 -12.056) 29.406 1.451 ( -20.781 -15.292 17.295) 31.062 2.784 ( 18.470 4.208 1.399) 18.995 3.042 ( 12.008 -6.430 -10.777) 17.369 3.862 ( 15.964 2.606 -1.458) 16.241 3.990 ( 0.513 3.126 1.062) 3.341 4.078 ( 0.426 0.288 0.525) 0.735 5.316 ( 4.897 2.620 -2.373) 6.040 6.341 ( -2.499 -3.099 0.536) 4.017 6.532 ( -5.341 2.911 -0.264) 6.089 6.844 ( 1.696 1.536 1.159) 2.565 7.035 ( -3.967 0.605 -5.499) 6.807 7.515 ( -10.966 -1.062 4.427) 11.873 7.623 ( -7.698 -4.616 3.334) 9.575 8.970 ( 9.242 1.791 -0.627) 9.435 9.514 ( 1.043 -1.472 -3.782) 4.190 9.712 ( 4.330 1.813 1.234) 4.854 16.840 ( 5.368 -3.132 6.587) 9.056 17.050 ( -1.055 -4.179 -1.190) 4.472 17.176 ( -1.005 4.799 1.212) 5.050 17.380 ( -4.322 1.475 -5.409) 7.079 18.036 ( 1.543 0.166 -1.004) 1.848 18.484 ( 4.075 2.035 -0.472) 4.579 ======================= Grid point 187 (90/294) ======================= q-point: ( 0.17 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.616 ( -13.059 -4.573 16.026) 21.172 0.784 ( -5.367 -1.562 19.090) 19.891 1.565 ( -4.895 22.622 21.687) 31.718 2.854 ( 9.589 -4.677 -14.188) 17.752 3.235 ( 0.945 -0.239 -9.155) 9.207 3.819 ( 1.917 -7.081 -9.461) 11.972 3.900 ( 3.992 -3.219 -4.765) 7.001 4.080 ( 1.536 -4.020 -3.816) 5.752 5.329 ( 2.474 -7.769 -3.376) 8.824 6.333 ( 2.330 3.469 2.099) 4.676 6.492 ( -6.617 2.484 3.152) 7.739 6.957 ( 0.591 -4.332 5.297) 6.868 7.156 ( -5.293 -1.997 6.322) 8.484 7.406 ( -1.553 0.951 4.042) 4.433 7.624 ( -2.127 13.721 8.044) 16.047 9.145 ( 3.396 -7.932 -1.859) 8.827 9.410 ( 1.424 -1.639 -11.046) 11.257 9.592 ( 0.372 3.104 -2.282) 3.870 16.748 ( 7.208 2.957 -7.371) 10.725 17.080 ( 5.172 -5.058 3.659) 8.107 17.102 ( -6.599 4.907 -3.802) 9.060 17.341 ( -4.507 -1.249 5.112) 6.929 18.010 ( 0.486 -0.152 -2.665) 2.713 18.736 ( 0.767 -6.074 3.389) 6.998 ======================= Grid point 188 (91/294) ======================= q-point: ( 0.25 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.614 ( 4.521 1.393 14.062) 14.837 0.930 ( 8.365 -0.646 21.259) 22.855 1.829 ( -3.339 21.985 19.926) 29.859 2.752 ( -3.978 -7.305 -14.939) 17.099 3.084 ( -7.368 -6.936 -9.567) 13.926 3.751 ( 4.685 -6.426 -9.425) 12.332 3.974 ( 4.873 3.293 -3.654) 6.924 4.002 ( -2.003 -3.531 -5.892) 7.156 5.245 ( 0.162 -9.652 -4.295) 10.566 6.380 ( -2.481 2.141 1.140) 3.469 6.503 ( 2.986 3.221 5.622) 7.134 6.946 ( -0.447 -6.783 7.691) 10.265 7.100 ( -2.043 -2.125 5.323) 6.085 7.447 ( 2.674 2.151 1.089) 3.601 7.746 ( -2.893 11.074 6.909) 13.369 9.053 ( -1.183 -8.728 -3.067) 9.327 9.394 ( 1.321 1.401 -4.877) 5.243 9.619 ( 1.077 2.995 -5.479) 6.336 16.885 ( 7.088 6.032 -10.045) 13.694 16.974 ( -5.392 5.153 -4.948) 8.950 17.172 ( 3.398 -6.258 7.007) 9.990 17.289 ( -2.594 -0.687 4.901) 5.587 17.993 ( -0.188 -0.791 -3.227) 3.327 18.665 ( -1.842 -9.648 3.333) 10.372 ======================= Grid point 189 (92/294) ======================= q-point: ( 0.33 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.869 ( 12.540 8.015 4.095) 15.436 1.232 ( 14.399 -2.382 20.457) 25.130 2.050 ( -3.167 11.499 10.686) 16.015 2.531 ( -8.026 2.070 -5.286) 9.831 2.803 ( -9.244 -11.236 -7.122) 16.200 3.687 ( -0.510 -8.075 -8.536) 11.761 3.854 ( -6.059 1.230 -8.030) 10.135 4.081 ( 3.745 2.256 -1.968) 4.795 5.123 ( -0.032 -8.657 -6.685) 10.938 6.370 ( -1.546 1.836 2.559) 3.509 6.627 ( 4.449 1.230 3.602) 5.855 6.924 ( 0.367 -2.576 3.584) 4.429 7.114 ( 3.252 -6.439 9.075) 11.593 7.529 ( 3.964 2.958 -0.831) 5.015 7.824 ( -0.918 6.775 3.393) 7.633 8.946 ( -2.493 -5.502 -0.205) 6.044 9.388 ( -2.238 3.072 -3.651) 5.270 9.618 ( 0.358 1.535 -5.177) 5.411 16.836 ( -7.177 6.613 -6.249) 11.589 17.071 ( 6.461 2.694 -3.251) 7.719 17.140 ( -3.062 -1.538 3.392) 4.822 17.337 ( 5.169 -2.053 4.044) 6.877 17.947 ( -1.251 -2.292 -4.103) 4.863 18.557 ( -1.277 -10.575 2.204) 10.877 ======================= Grid point 190 (93/294) ======================= q-point: ( 0.42 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.172 ( 13.125 9.752 -1.970) 16.470 1.532 ( 12.645 -4.714 13.648) 19.194 1.965 ( -5.688 -10.404 -6.810) 13.674 2.499 ( -7.048 0.418 -0.525) 7.080 2.639 ( -2.366 11.045 11.920) 16.422 3.476 ( -10.308 -5.872 -6.318) 13.440 3.745 ( -3.915 0.908 -8.897) 9.763 4.099 ( -2.136 -1.375 1.876) 3.158 5.025 ( 2.406 -6.055 -9.463) 11.489 6.396 ( 0.237 2.116 3.147) 3.800 6.687 ( 2.767 -1.688 -1.097) 3.422 6.954 ( 2.343 -0.798 1.468) 2.878 7.187 ( 6.712 -5.852 9.026) 12.680 7.611 ( 3.612 2.637 -1.997) 4.898 7.894 ( 3.102 2.015 0.967) 3.823 8.857 ( -4.699 -2.965 2.121) 5.947 9.336 ( -6.263 5.900 -4.060) 9.515 9.612 ( 0.579 -0.171 -1.682) 1.787 16.767 ( -5.082 6.138 -3.599) 8.743 17.039 ( -7.107 -0.881 8.218) 10.901 17.214 ( 6.688 2.953 -6.432) 9.738 17.431 ( 5.735 -1.723 2.561) 6.513 17.865 ( -1.674 -4.136 -4.659) 6.451 18.458 ( 0.186 -9.502 -0.585) 9.522 ======================= Grid point 191 (94/294) ======================= q-point: ( 0.50 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( 11.501 8.240 -6.158) 15.431 1.653 ( 3.449 -5.990 0.950) 6.977 1.708 ( -4.440 -15.817 -6.702) 17.743 2.474 ( 4.223 -1.426 8.692) 9.768 2.833 ( -3.409 17.294 12.391) 21.546 3.219 ( -10.965 -3.398 -4.622) 12.375 3.627 ( -6.766 0.753 -3.837) 7.815 4.025 ( -4.972 -3.364 3.431) 6.914 4.981 ( 4.653 -3.879 -10.208) 11.870 6.441 ( 0.319 2.178 2.788) 3.552 6.693 ( 3.426 -3.149 -5.728) 7.379 6.973 ( 1.138 -3.099 1.225) 3.521 7.323 ( 8.403 -0.913 5.062) 9.852 7.669 ( 2.672 1.580 -2.203) 3.807 7.972 ( 6.065 -2.094 -0.524) 6.438 8.754 ( -6.985 -1.738 2.481) 7.614 9.267 ( -7.505 8.021 -1.988) 11.163 9.614 ( 0.368 -0.970 1.349) 1.702 16.744 ( -2.669 4.568 -0.580) 5.322 16.975 ( -6.688 1.792 7.959) 10.549 17.294 ( 4.657 1.255 -4.282) 6.450 17.497 ( 2.697 -2.327 0.366) 3.581 17.785 ( 0.542 -3.850 -3.939) 5.534 18.380 ( 1.516 -7.400 -4.049) 8.571 ======================= Grid point 192 (95/294) ======================= q-point: ( 0.58 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -6.688 -13.305 -6.646) 16.307 1.581 ( 5.342 0.591 -7.646) 9.346 1.712 ( 9.561 -1.286 -0.283) 9.651 2.616 ( 2.959 1.989 6.173) 7.129 2.914 ( -8.822 7.526 6.581) 13.333 3.055 ( -2.327 -2.572 -1.263) 3.691 3.529 ( -6.695 3.261 5.776) 9.424 3.954 ( -3.150 -0.155 3.334) 4.589 4.979 ( 5.421 -2.801 -8.720) 10.643 6.471 ( -0.299 1.847 1.240) 2.245 6.674 ( 3.363 -4.285 -8.299) 9.926 6.957 ( -0.018 -3.255 1.342) 3.521 7.466 ( 5.620 1.242 0.215) 5.760 7.716 ( 3.447 1.658 -1.293) 4.038 8.029 ( 5.211 -3.889 -3.096) 7.202 8.634 ( -7.152 -1.855 3.000) 7.974 9.234 ( -5.650 8.049 2.029) 10.041 9.618 ( -0.135 -1.022 2.482) 2.688 16.746 ( -1.512 0.911 2.807) 3.316 16.958 ( -4.832 5.680 7.249) 10.400 17.343 ( 3.309 -0.540 -2.793) 4.364 17.464 ( -1.086 -4.425 -2.781) 5.339 17.786 ( 3.473 -0.339 -1.756) 3.906 18.324 ( 2.825 -5.097 -6.825) 8.975 ======================= Grid point 193 (96/294) ======================= q-point: (-0.33 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.169 ( -8.627 -9.159 -2.820) 12.894 1.649 ( 8.312 1.333 -6.193) 10.451 1.873 ( 10.594 -1.181 -0.408) 10.667 2.568 ( -11.116 4.918 -7.787) 14.436 2.838 ( -9.978 -3.799 13.848) 17.486 3.046 ( 5.865 -3.703 -2.619) 7.414 3.574 ( 2.317 4.603 8.770) 10.172 3.968 ( -1.513 5.323 4.889) 7.384 5.003 ( 5.589 -1.912 -6.156) 8.531 6.484 ( -0.222 1.867 -0.722) 2.014 6.626 ( 1.496 -4.373 -7.638) 8.927 6.930 ( -0.799 -2.512 1.011) 2.823 7.493 ( -1.390 -0.679 -2.878) 3.267 7.811 ( 4.187 4.989 -1.580) 6.702 8.022 ( 1.378 -3.297 -6.060) 7.036 8.544 ( -3.362 -3.243 5.587) 7.283 9.262 ( -1.530 6.163 4.879) 8.009 9.616 ( -0.531 -1.086 1.984) 2.324 16.737 ( -1.362 -2.430 5.098) 5.809 17.007 ( -2.745 8.543 7.035) 11.402 17.328 ( 0.185 -6.535 -3.813) 7.568 17.413 ( 0.970 0.186 -2.658) 2.836 17.843 ( 3.303 1.593 -1.278) 3.883 18.300 ( 3.940 -2.727 -7.796) 9.151 ======================= Grid point 194 (97/294) ======================= q-point: (-0.25 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.957 ( -10.782 -2.079 3.917) 11.659 1.804 ( 11.487 3.353 -6.298) 13.523 1.980 ( 0.792 1.338 -3.511) 3.840 2.348 ( -11.162 -2.179 -0.854) 11.405 2.714 ( -6.893 -3.921 8.897) 11.918 3.120 ( 11.107 -5.531 -4.345) 13.147 3.752 ( 7.715 4.116 6.799) 11.077 4.028 ( -1.682 5.874 4.096) 7.356 5.056 ( 5.764 -0.505 -3.249) 6.635 6.501 ( -0.737 3.744 0.554) 3.856 6.559 ( 0.362 -3.659 -6.701) 7.644 6.892 ( -1.607 -2.208 0.270) 2.744 7.400 ( -6.001 -0.667 -4.494) 7.526 7.869 ( -3.158 6.392 -3.548) 7.964 7.961 ( -0.740 -3.788 -3.480) 5.196 8.546 ( 3.567 -3.142 5.860) 7.546 9.348 ( 2.544 3.507 5.149) 6.729 9.603 ( -0.429 -1.432 0.668) 1.637 16.723 ( -0.386 -3.674 5.747) 6.832 17.092 ( -2.243 8.337 7.523) 11.451 17.230 ( -0.300 -6.389 -5.941) 8.730 17.431 ( 1.365 0.613 -1.428) 2.069 17.902 ( 3.024 1.921 -2.043) 4.124 18.313 ( 4.269 -0.230 -6.519) 7.796 ======================= Grid point 195 (98/294) ======================= q-point: (-0.17 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.849 ( -11.332 7.885 13.330) 19.191 1.797 ( -18.815 7.490 -13.811) 24.512 1.925 ( -1.296 -4.813 4.807) 6.925 2.290 ( 6.358 -2.155 7.671) 10.193 2.676 ( 5.473 -5.447 -3.939) 8.668 3.275 ( 16.794 -5.174 -2.085) 17.697 3.938 ( 6.663 2.843 3.393) 8.000 4.052 ( -1.700 2.300 0.527) 2.908 5.143 ( 5.858 1.330 -1.240) 6.134 6.461 ( -4.394 -1.883 -0.605) 4.819 6.577 ( 2.216 6.103 -0.914) 6.557 6.845 ( -1.726 -1.805 0.261) 2.511 7.256 ( -7.968 1.382 -5.879) 9.998 7.798 ( -6.695 2.893 -4.707) 8.680 7.880 ( -5.872 -3.558 3.898) 7.895 8.657 ( 8.838 -1.072 2.453) 9.235 9.444 ( 3.229 0.297 2.142) 3.886 9.596 ( 1.592 -1.133 0.310) 1.978 16.729 ( 1.486 -3.820 5.873) 7.162 17.093 ( -1.501 -6.113 -3.563) 7.233 17.210 ( -1.080 7.484 3.736) 8.434 17.441 ( 0.159 0.609 -1.846) 1.950 17.953 ( 3.123 1.150 -2.632) 4.243 18.359 ( 3.978 2.139 -3.534) 5.734 ======================= Grid point 196 (99/294) ======================= q-point: (-0.08 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.895 ( -9.429 16.640 20.264) 27.864 1.443 ( -23.009 8.051 -11.951) 27.149 1.732 ( -16.966 -12.603 16.772) 26.981 2.539 ( 16.706 5.334 -1.646) 17.614 2.703 ( 10.926 -9.906 -10.556) 18.137 3.529 ( 20.124 -4.743 -0.456) 20.680 4.016 ( -0.079 0.206 -4.255) 4.261 4.060 ( 2.714 -0.374 1.684) 3.216 5.246 ( 5.158 2.433 -1.612) 5.926 6.364 ( -4.055 -2.460 -0.858) 4.820 6.661 ( -2.911 7.611 2.840) 8.629 6.843 ( 2.058 1.994 3.912) 4.849 7.116 ( -7.225 3.395 -6.690) 10.416 7.674 ( -7.882 -1.224 0.569) 7.997 7.751 ( -9.176 -2.026 4.486) 10.412 8.817 ( 10.180 -0.104 -0.011) 10.180 9.460 ( 1.058 -2.095 -2.800) 3.653 9.648 ( 4.508 -0.947 0.467) 4.630 16.770 ( 3.753 -3.630 6.075) 8.011 16.970 ( -1.325 -7.931 -6.831) 10.551 17.289 ( -1.527 7.205 5.024) 8.915 17.421 ( -2.111 1.512 -3.573) 4.417 17.992 ( 2.717 0.012 -2.437) 3.650 18.443 ( 4.150 3.805 0.343) 5.641 ======================= Grid point 199 (100/294) ======================= q-point: ( 0.17 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.918 ( -16.825 0.817 5.675) 17.775 1.019 ( -14.875 -6.627 18.853) 24.912 1.939 ( -2.647 18.025 15.699) 24.049 2.587 ( 10.218 -1.113 -6.397) 12.107 3.115 ( 8.166 1.791 -7.673) 11.348 3.514 ( 10.785 -13.984 -13.390) 22.163 3.807 ( 1.952 -1.659 -6.511) 6.997 4.053 ( 1.017 -2.428 1.455) 3.008 5.204 ( 1.200 -6.785 -4.654) 8.314 6.359 ( 0.419 4.261 2.129) 4.781 6.637 ( -6.645 1.888 1.664) 7.105 6.956 ( -1.909 -1.965 1.231) 3.004 7.252 ( -3.241 -1.847 8.236) 9.042 7.499 ( -7.262 0.027 1.959) 7.522 7.817 ( -1.519 11.222 6.951) 13.288 8.987 ( 5.370 -7.447 -1.572) 9.315 9.276 ( 5.320 -0.837 -10.702) 11.981 9.613 ( -0.571 1.371 -0.398) 1.537 16.647 ( 3.501 2.189 -5.364) 6.769 16.951 ( 6.815 -4.542 5.932) 10.112 17.243 ( -6.516 4.507 -4.794) 9.261 17.429 ( -4.110 -0.682 4.167) 5.892 17.975 ( 1.155 -0.842 -3.155) 3.464 18.672 ( 1.761 -5.506 0.628) 5.814 ======================= Grid point 200 (101/294) ======================= q-point: ( 0.25 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.743 ( -8.722 -1.208 16.422) 18.634 0.974 ( -0.722 -0.376 16.586) 16.606 2.133 ( -1.120 11.818 9.331) 15.099 2.654 ( 1.806 0.973 -3.251) 3.844 3.075 ( -4.519 -5.196 -9.638) 11.845 3.496 ( 9.622 -9.164 -11.255) 17.413 3.850 ( 7.680 2.851 -7.052) 10.809 4.027 ( -2.707 -0.765 -1.141) 3.036 5.120 ( 0.748 -9.792 -3.592) 10.456 6.414 ( 0.327 2.148 1.230) 2.497 6.574 ( -3.978 2.123 3.927) 5.979 6.926 ( -0.154 -5.711 5.959) 8.255 7.199 ( -6.320 -0.484 5.234) 8.220 7.449 ( -0.612 1.142 1.344) 1.867 7.894 ( -2.133 5.302 1.795) 5.990 8.964 ( 1.610 -5.933 -0.614) 6.178 9.325 ( 5.254 2.219 -6.215) 8.435 9.619 ( -0.387 2.605 -2.380) 3.549 16.745 ( 7.901 5.090 -6.302) 11.315 17.044 ( 4.714 -3.209 3.896) 6.907 17.149 ( -6.459 3.964 -2.800) 8.079 17.376 ( -4.325 -0.823 4.438) 6.252 17.958 ( 0.531 -1.802 -3.772) 4.214 18.607 ( -0.847 -10.250 0.975) 10.331 ======================= Grid point 201 (102/294) ======================= q-point: ( 0.33 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.825 ( 5.062 5.421 11.145) 13.387 1.140 ( 8.471 -1.283 18.449) 20.341 2.146 ( -3.714 -5.268 -5.010) 8.164 2.717 ( -2.282 13.326 9.223) 16.367 2.823 ( -10.301 -7.577 -9.494) 15.926 3.515 ( 6.730 -5.718 -6.944) 11.234 3.934 ( -5.948 1.212 -5.167) 7.972 3.989 ( 7.920 4.088 -6.414) 10.980 5.003 ( -0.409 -10.482 -4.234) 11.312 6.407 ( -1.044 -1.831 1.835) 2.795 6.609 ( 1.378 1.032 5.090) 5.373 6.910 ( 0.456 -4.677 5.421) 7.174 7.130 ( -4.122 -1.089 5.323) 6.820 7.493 ( 2.888 2.228 -0.268) 3.658 7.882 ( -1.348 0.399 -2.714) 3.057 8.941 ( -0.611 -2.105 2.556) 3.367 9.398 ( 3.045 3.702 -2.610) 5.458 9.612 ( -1.086 2.503 -4.406) 5.183 16.896 ( 7.381 5.931 -7.154) 11.867 17.019 ( -5.448 5.361 -4.515) 8.878 17.153 ( 3.258 -3.956 6.357) 8.166 17.333 ( -2.882 -0.106 4.285) 5.165 17.910 ( -0.607 -3.378 -4.716) 5.833 18.484 ( -1.480 -12.352 1.362) 12.514 ======================= Grid point 202 (103/294) ======================= q-point: ( 0.42 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( 10.178 7.781 3.945) 13.405 1.383 ( 10.626 -3.619 14.505) 18.342 1.923 ( -7.018 -11.218 -8.237) 15.587 2.544 ( -7.764 -7.568 -5.170) 12.011 2.902 ( -1.228 15.947 9.724) 18.718 3.501 ( -1.798 -1.960 -1.068) 2.866 3.800 ( -6.788 3.064 -8.444) 11.259 4.091 ( 3.501 1.465 -2.412) 4.497 4.877 ( 0.692 -8.956 -6.875) 11.312 6.400 ( 1.593 -3.386 2.958) 4.770 6.640 ( 0.319 -2.581 2.200) 3.406 6.926 ( 1.562 -1.207 2.800) 3.426 7.125 ( 1.426 -1.545 6.169) 6.518 7.563 ( 3.582 2.141 -1.645) 4.485 7.853 ( 1.287 -1.992 -3.303) 4.066 8.919 ( -2.981 -0.605 3.028) 4.292 9.451 ( -1.584 6.056 -0.285) 6.266 9.589 ( -0.246 1.121 -4.046) 4.206 16.900 ( -6.332 5.969 -3.463) 9.365 17.081 ( 7.609 4.028 -6.005) 10.496 17.173 ( -2.689 -0.649 6.076) 6.676 17.354 ( 3.089 -0.871 3.929) 5.073 17.820 ( -1.723 -5.360 -5.272) 7.713 18.359 ( -0.311 -11.713 0.215) 11.719 ======================= Grid point 203 (104/294) ======================= q-point: ( 0.50 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( 10.031 6.219 -1.236) 11.867 1.514 ( 4.822 -8.340 3.226) 10.159 1.666 ( -7.058 -8.772 -5.190) 12.398 2.440 ( 2.095 -3.000 5.679) 6.755 3.029 ( -0.340 6.073 -0.171) 6.085 3.392 ( -12.958 4.795 0.506) 13.826 3.722 ( -3.514 5.359 -1.460) 6.573 4.090 ( -3.040 -2.284 3.380) 5.087 4.800 ( 4.463 -5.700 -9.899) 12.263 6.418 ( 3.356 -5.048 1.454) 6.234 6.620 ( -0.115 -0.893 -1.215) 1.512 6.943 ( 0.547 -2.267 2.147) 3.170 7.221 ( 6.626 0.591 4.330) 7.937 7.623 ( 3.114 1.469 -2.537) 4.276 7.856 ( 3.982 -3.806 -1.256) 5.650 8.859 ( -5.518 -0.253 1.382) 5.695 9.448 ( -6.123 7.920 -0.820) 10.045 9.593 ( 1.611 -0.632 0.064) 1.732 16.844 ( -4.862 4.431 -0.826) 6.630 17.141 ( -5.088 2.605 6.465) 8.630 17.195 ( 5.601 2.264 -5.116) 7.917 17.428 ( 3.807 -1.659 2.145) 4.674 17.716 ( -0.245 -5.146 -4.229) 6.665 18.259 ( 1.081 -9.580 -2.437) 9.944 ======================= Grid point 204 (105/294) ======================= q-point: ( 0.58 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -4.759 -6.837 -3.201) 8.924 1.466 ( 5.051 -0.616 -5.561) 7.538 1.569 ( 4.549 -2.679 1.097) 5.392 2.575 ( 7.601 0.157 9.674) 12.304 3.007 ( -0.506 -3.098 -6.703) 7.402 3.205 ( -14.773 6.661 -3.197) 16.518 3.721 ( -7.016 3.489 9.103) 12.011 4.040 ( -3.302 0.987 5.705) 6.665 4.799 ( 6.823 -3.002 -9.328) 11.940 6.417 ( 3.430 -5.281 -3.613) 7.260 6.622 ( -0.160 2.328 -0.136) 2.337 6.932 ( 0.176 -3.139 1.605) 3.530 7.370 ( 7.599 1.756 0.821) 7.842 7.668 ( 3.078 1.097 -2.151) 3.912 7.888 ( 5.240 -5.235 0.248) 7.411 8.755 ( -7.394 -0.130 0.088) 7.396 9.413 ( -6.212 7.255 0.177) 9.553 9.613 ( 0.835 -1.391 2.079) 2.637 16.811 ( -3.378 1.565 1.688) 4.088 17.134 ( -4.806 5.926 6.434) 9.981 17.256 ( 3.850 -1.139 -3.564) 5.368 17.423 ( -0.587 -3.831 -2.270) 4.491 17.715 ( 4.308 0.144 -0.420) 4.331 18.188 ( 2.523 -7.028 -5.008) 8.991 ======================= Grid point 205 (106/294) ======================= q-point: (-0.33 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( -7.441 -0.730 2.442) 7.866 1.500 ( 6.301 0.257 -7.359) 9.692 1.687 ( 9.853 -2.691 2.252) 10.459 2.692 ( -0.794 2.254 -0.720) 2.496 2.908 ( -0.688 -6.028 -8.080) 10.104 3.039 ( -9.931 1.586 4.772) 11.132 3.666 ( -5.029 -0.863 9.728) 10.985 4.075 ( -1.263 5.026 4.397) 6.797 4.850 ( 7.072 -1.048 -5.814) 9.215 6.410 ( 3.631 -1.352 -5.900) 7.059 6.637 ( -2.078 2.986 1.444) 3.914 6.911 ( 0.210 -3.328 0.492) 3.371 7.469 ( 2.644 0.711 -2.257) 3.548 7.747 ( 6.254 2.977 -1.840) 7.167 7.918 ( 4.006 -5.371 0.082) 6.700 8.631 ( -7.138 -0.923 1.094) 7.280 9.393 ( -4.414 5.855 2.067) 7.618 9.612 ( 0.005 -2.691 1.505) 3.083 16.777 ( -2.743 -1.487 3.532) 4.713 17.173 ( -2.846 8.066 5.890) 10.385 17.234 ( 0.446 -7.109 -3.328) 7.862 17.385 ( 0.786 0.618 -3.152) 3.307 17.801 ( 3.704 2.240 0.322) 4.341 18.161 ( 4.446 -3.643 -5.616) 8.036 ======================= Grid point 206 (107/294) ======================= q-point: (-0.25 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.185 ( -8.703 6.494 8.324) 13.682 1.609 ( 10.614 3.311 -8.864) 14.220 1.850 ( 10.639 -2.776 3.893) 11.664 2.550 ( -14.165 4.191 -9.888) 17.776 2.851 ( 7.634 -8.038 -5.343) 12.306 2.904 ( -11.541 -6.523 11.307) 17.423 3.719 ( 4.409 2.135 7.311) 8.800 4.099 ( -1.078 0.848 -0.594) 1.495 4.939 ( 6.724 0.785 -2.096) 7.087 6.458 ( 3.833 4.607 -3.597) 6.990 6.618 ( -4.205 2.076 1.717) 4.994 6.882 ( -0.116 -2.803 -0.580) 2.865 7.450 ( -2.929 0.210 -2.797) 4.056 7.871 ( 5.581 0.838 -4.451) 7.187 7.920 ( 1.143 0.397 -0.242) 1.234 8.537 ( -3.188 -3.267 4.179) 6.189 9.406 ( -1.718 4.026 3.333) 5.502 9.581 ( -0.097 -4.183 -0.386) 4.202 16.738 ( -1.871 -3.211 4.399) 5.759 17.130 ( -0.527 -8.213 -4.979) 9.619 17.253 ( -1.767 8.862 5.885) 10.784 17.403 ( 1.561 1.265 -2.179) 2.964 17.863 ( 2.354 1.583 -1.929) 3.430 18.206 ( 5.512 0.793 -3.081) 6.364 ======================= Grid point 207 (108/294) ======================= q-point: (-0.17 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -8.504 13.077 13.852) 20.862 1.782 ( 11.425 2.762 -7.682) 14.042 1.978 ( 1.750 3.067 -3.885) 5.250 2.300 ( -9.879 -1.154 -2.030) 10.152 2.682 ( -11.777 -9.878 7.324) 17.026 2.943 ( 14.471 -6.843 -1.419) 16.070 3.875 ( 6.516 2.481 3.907) 7.992 4.047 ( -0.603 -4.524 -5.742) 7.335 5.056 ( 6.419 2.397 -0.101) 6.853 6.514 ( -3.746 1.037 -0.877) 3.984 6.626 ( 2.174 9.256 2.546) 9.843 6.851 ( -0.817 -1.415 -0.422) 1.688 7.362 ( -6.468 1.620 -3.229) 7.409 7.840 ( -1.604 -3.523 -2.815) 4.786 7.972 ( -2.216 5.909 -1.216) 6.427 8.536 ( 4.557 -4.436 4.954) 8.061 9.436 ( -0.117 0.242 1.991) 2.009 9.541 ( 1.564 -3.738 -1.344) 4.269 16.713 ( -0.201 -3.668 4.742) 5.998 17.012 ( -1.034 -7.629 -5.861) 9.676 17.339 ( -1.469 7.705 5.175) 9.397 17.425 ( 1.222 0.850 -1.921) 2.430 17.896 ( 2.613 0.849 -3.694) 4.604 18.306 ( 4.772 4.029 -0.188) 6.248 ======================= Grid point 208 (109/294) ======================= q-point: (-0.08 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( -7.231 17.698 17.174) 25.699 1.779 ( -16.180 6.261 -12.177) 21.196 1.893 ( -3.853 -4.420 5.004) 7.708 2.341 ( 11.793 1.091 2.598) 12.125 2.467 ( -2.808 -10.079 -3.355) 10.987 3.158 ( 18.583 -6.643 1.842) 19.820 3.941 ( 1.091 -6.747 -8.974) 11.280 3.999 ( 4.458 -0.368 0.941) 4.571 5.180 ( 5.346 3.261 -0.604) 6.291 6.417 ( -5.248 -1.915 -0.933) 5.664 6.783 ( -1.286 7.590 1.056) 7.771 6.863 ( 3.341 6.034 5.706) 8.951 7.244 ( -8.213 3.479 -3.964) 9.760 7.753 ( -4.076 -2.240 -1.067) 4.772 7.924 ( -8.585 2.932 2.686) 9.461 8.645 ( 9.718 -2.896 2.062) 10.348 9.402 ( 0.286 -4.904 -3.878) 6.258 9.569 ( 3.664 -1.263 0.956) 3.992 16.721 ( 2.003 -3.575 5.039) 6.495 16.886 ( -1.709 -6.960 -6.431) 9.630 17.393 ( -1.713 3.799 1.767) 4.526 17.442 ( -0.018 2.772 0.020) 2.772 17.927 ( 3.037 0.341 -3.581) 4.707 18.425 ( 4.018 5.245 1.364) 6.746 ======================= Grid point 211 (110/294) ======================= q-point: ( 0.17 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( -15.591 4.107 -2.745) 16.355 1.341 ( -19.712 -10.030 19.129) 29.242 2.059 ( 5.781 2.535 0.214) 6.316 2.534 ( 4.057 12.706 7.538) 15.321 2.937 ( 11.890 4.850 -6.656) 14.464 3.135 ( 10.058 -13.558 -9.967) 19.604 3.701 ( 4.388 -2.658 -5.067) 7.211 3.996 ( 3.189 -4.400 3.479) 6.452 5.120 ( -1.553 -5.092 -6.425) 8.344 6.413 ( 0.194 4.871 2.503) 5.480 6.756 ( -5.307 1.495 0.195) 5.517 6.992 ( -4.385 -1.292 -1.913) 4.956 7.326 ( -2.584 -1.012 6.617) 7.175 7.643 ( -8.036 0.652 1.170) 8.147 7.945 ( -2.168 3.289 1.649) 4.271 8.840 ( 5.986 -3.430 2.084) 7.207 9.117 ( 6.315 0.087 -8.436) 10.538 9.623 ( 0.549 0.307 0.889) 1.089 16.616 ( 0.264 2.732 -2.954) 4.032 16.846 ( 5.656 -3.400 5.742) 8.747 17.340 ( -3.747 3.188 -2.839) 5.680 17.506 ( -3.290 -0.633 3.158) 4.605 17.925 ( 1.282 -1.138 -3.560) 3.951 18.586 ( 1.628 -5.208 -2.949) 6.203 ======================= Grid point 212 (111/294) ======================= q-point: ( 0.25 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( -13.644 -0.041 10.185) 17.026 1.131 ( -9.366 -2.600 14.764) 17.677 2.137 ( 4.184 -3.006 -4.002) 6.524 2.730 ( 1.575 10.215 5.472) 11.694 3.026 ( 0.187 -1.903 -5.235) 5.574 3.178 ( 12.961 -4.036 -8.664) 16.104 3.718 ( 5.268 1.332 -7.659) 9.391 4.028 ( 1.489 -2.917 3.213) 4.588 5.011 ( -0.565 -7.868 -4.235) 8.953 6.455 ( -1.772 3.340 0.175) 3.785 6.682 ( -5.015 0.918 1.729) 5.383 6.917 ( -1.548 -4.665 2.876) 5.695 7.310 ( -3.319 -0.097 4.988) 5.992 7.525 ( -6.877 0.413 2.133) 7.212 7.919 ( -0.492 -2.533 -4.929) 5.563 8.905 ( 2.758 -0.990 4.119) 5.055 9.211 ( 7.281 3.925 -5.936) 10.182 9.637 ( -0.065 1.449 -0.291) 1.479 16.671 ( 3.869 5.492 -3.331) 7.499 16.945 ( 6.139 -3.095 5.864) 9.036 17.279 ( -5.954 3.989 -3.373) 7.921 17.458 ( -3.841 -0.652 3.384) 5.161 17.903 ( 0.750 -2.402 -4.235) 4.926 18.512 ( 0.122 -10.171 -2.296) 10.427 ======================= Grid point 213 (112/294) ======================= q-point: ( 0.33 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.938 ( -4.646 3.158 13.552) 14.671 1.144 ( 1.546 -0.779 14.881) 14.982 2.070 ( -1.021 -9.111 -7.492) 11.840 2.794 ( -2.776 -4.309 -6.184) 8.032 2.934 ( -2.542 3.955 -0.555) 4.734 3.352 ( 8.668 5.980 2.471) 10.817 3.829 ( 9.667 4.597 -8.838) 13.881 4.007 ( -3.359 -0.162 -0.703) 3.435 4.899 ( -0.932 -9.690 -2.470) 10.043 6.405 ( -2.752 -4.454 -0.179) 5.239 6.656 ( -1.918 1.557 3.523) 4.303 6.889 ( 0.559 -3.654 3.922) 5.389 7.251 ( -6.740 -0.506 5.194) 8.524 7.486 ( -0.288 1.746 0.570) 1.859 7.843 ( 0.082 -4.360 -7.079) 8.314 8.955 ( 0.613 0.042 4.443) 4.485 9.341 ( 6.230 5.309 -3.039) 8.731 9.641 ( -1.143 2.434 -1.724) 3.194 16.796 ( 6.650 6.584 -4.039) 10.192 17.049 ( 5.439 -1.732 4.989) 7.581 17.186 ( -7.151 3.442 -2.851) 8.433 17.415 ( -3.555 0.273 3.349) 4.891 17.853 ( -0.201 -3.871 -4.907) 6.253 18.385 ( -0.803 -13.043 -0.792) 13.092 ======================= Grid point 214 (113/294) ======================= q-point: ( 0.42 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.047 ( 3.890 5.090 8.722) 10.822 1.292 ( 6.709 -2.225 13.147) 14.927 1.883 ( -4.989 -9.718 -6.556) 12.740 2.567 ( -7.895 -7.522 -6.687) 12.792 2.991 ( 3.074 1.884 -2.918) 4.639 3.575 ( 2.312 12.956 11.103) 17.218 3.907 ( -7.590 2.644 -5.900) 9.970 3.980 ( 8.991 3.952 -8.111) 12.738 4.768 ( -1.717 -10.380 -2.469) 10.807 6.322 ( 0.881 -9.761 2.055) 10.014 6.655 ( -1.564 -0.196 2.438) 2.903 6.910 ( 1.577 -0.159 2.380) 2.860 7.177 ( -4.453 -0.646 5.346) 6.988 7.524 ( 2.287 1.871 -0.941) 3.101 7.779 ( 1.313 -3.672 -5.148) 6.459 8.970 ( -1.396 -0.104 2.761) 3.096 9.466 ( 4.472 4.428 -0.595) 6.321 9.625 ( -2.755 3.649 -2.489) 5.206 16.946 ( 6.573 5.913 -3.777) 9.614 17.069 ( -6.308 4.879 -3.908) 8.881 17.166 ( 4.422 -1.926 5.543) 7.348 17.389 ( -2.769 1.388 3.551) 4.712 17.764 ( -1.678 -5.697 -5.038) 7.788 18.249 ( -0.273 -12.877 -0.140) 12.881 ======================= Grid point 215 (114/294) ======================= q-point: ( 0.50 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.212 ( 7.144 1.908 3.221) 8.065 1.403 ( 3.519 -5.271 4.377) 7.702 1.689 ( -6.068 -5.333 -2.776) 8.542 2.419 ( -0.462 -3.380 2.104) 4.008 3.001 ( 1.469 -2.210 -6.199) 6.744 3.691 ( -13.274 9.755 -1.323) 16.526 3.828 ( -0.419 8.461 5.649) 10.182 4.088 ( 4.231 1.897 -2.784) 5.409 4.639 ( 0.769 -8.877 -5.408) 10.423 6.283 ( 4.229 -10.754 2.722) 11.872 6.639 ( -1.320 0.913 0.634) 1.725 6.937 ( 0.047 -0.406 1.339) 1.400 7.181 ( 1.856 0.638 4.072) 4.520 7.572 ( 2.754 1.083 -2.024) 3.585 7.760 ( 2.650 -3.450 -1.411) 4.573 8.938 ( -3.572 0.026 0.425) 3.598 9.553 ( 2.925 0.913 -0.264) 3.076 9.597 ( -4.422 5.786 -1.153) 7.373 16.969 ( -6.167 3.516 -0.706) 7.134 17.091 ( 5.757 3.663 -4.792) 8.338 17.242 ( 1.176 1.446 3.667) 4.113 17.401 ( -0.095 1.062 4.180) 4.314 17.653 ( -1.130 -5.632 -3.623) 6.792 18.139 ( 0.744 -10.565 -1.280) 10.668 ======================= Grid point 216 (115/294) ======================= q-point: ( 0.58 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( 6.678 -2.252 -0.988) 7.116 1.373 ( 0.096 -5.501 -0.741) 5.551 1.569 ( -4.316 -0.208 0.337) 4.334 2.508 ( 6.953 0.640 8.265) 10.820 2.937 ( -0.516 -3.788 -6.946) 7.929 3.483 ( -15.277 7.215 -9.283) 19.277 3.908 ( -5.556 2.101 10.401) 11.978 4.125 ( -1.451 1.879 4.316) 4.926 4.603 ( 7.092 -3.109 -8.323) 11.369 6.283 ( 4.565 -6.526 0.925) 8.018 6.651 ( 0.402 2.627 0.756) 2.763 6.920 ( -1.086 -2.232 0.957) 2.660 7.279 ( 6.118 1.853 1.305) 6.525 7.611 ( 2.969 0.319 -2.435) 3.853 7.778 ( 3.543 -4.185 2.017) 5.842 8.861 ( -5.751 0.608 -1.488) 5.971 9.548 ( -3.095 2.850 -1.910) 4.620 9.605 ( -0.592 1.113 1.806) 2.202 16.900 ( -5.011 1.611 0.234) 5.269 17.161 ( 3.343 -0.953 -2.879) 4.514 17.279 ( -1.569 4.367 2.340) 5.197 17.400 ( -1.797 -2.112 1.142) 2.999 17.649 ( 4.644 1.206 0.893) 4.880 18.061 ( 1.722 -7.537 -2.865) 8.245 ======================= Grid point 217 (116/294) ======================= q-point: ( 0.67 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.325 ( 2.580 -2.635 -5.339) 6.488 1.412 ( 1.777 2.503 3.293) 4.502 1.560 ( 3.114 -1.266 3.250) 4.676 2.644 ( 3.822 -1.345 0.780) 4.126 2.867 ( -0.845 -1.380 -3.727) 4.063 3.260 ( -13.177 5.394 -5.681) 15.330 3.819 ( -8.965 -4.648 11.371) 15.208 4.127 ( -0.940 -0.770 -0.563) 1.340 4.696 ( 8.411 1.933 -4.451) 9.710 6.329 ( 4.197 1.487 -0.369) 4.468 6.697 ( 0.254 3.289 1.770) 3.743 6.878 ( -0.744 -3.819 -0.216) 3.897 7.402 ( 5.687 2.039 -0.844) 6.100 7.659 ( 4.815 0.587 -2.640) 5.522 7.813 ( 3.789 -5.039 4.259) 7.609 8.751 ( -7.344 1.033 -2.038) 7.691 9.515 ( -3.675 3.429 -0.144) 5.028 9.592 ( -0.811 -3.016 0.624) 3.184 16.836 ( -4.010 -0.636 1.022) 4.186 17.134 ( 0.145 -7.466 -1.771) 7.674 17.311 ( -0.832 5.406 0.194) 5.473 17.379 ( -0.912 2.300 1.192) 2.746 17.767 ( 4.359 2.991 1.819) 5.591 18.037 ( 3.940 -2.691 -2.625) 5.446 ======================= Grid point 218 (117/294) ======================= q-point: (-0.25 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( 3.908 1.534 -4.774) 6.357 1.495 ( 0.379 8.790 2.612) 9.178 1.683 ( 10.051 -2.812 6.695) 12.400 2.631 ( 2.822 -4.824 -5.587) 7.902 2.759 ( -10.579 2.525 -8.821) 14.004 3.107 ( -10.322 -2.442 7.869) 13.207 3.748 ( -1.825 -1.214 9.169) 9.428 4.064 ( -0.382 -6.069 -6.534) 8.926 4.835 ( 7.245 3.327 -0.910) 8.024 6.450 ( 4.472 9.114 0.575) 10.168 6.711 ( -3.623 1.811 1.551) 4.337 6.838 ( 1.312 -3.321 -1.353) 3.819 7.467 ( 0.680 1.596 -0.749) 1.889 7.750 ( 6.552 0.731 -4.094) 7.760 7.863 ( 4.921 -3.233 4.964) 7.701 8.628 ( -7.441 0.329 -0.638) 7.476 9.492 ( -2.741 1.281 1.548) 3.399 9.534 ( -1.036 -4.557 -1.404) 4.880 16.771 ( -3.065 -2.289 1.617) 4.153 17.036 ( -0.747 -8.749 -2.202) 9.053 17.356 ( 0.917 4.810 -1.805) 5.219 17.409 ( -1.036 3.980 2.737) 4.940 17.831 ( 1.734 0.599 -1.162) 2.172 18.125 ( 6.059 4.052 0.821) 7.335 ======================= Grid point 219 (118/294) ======================= q-point: (-0.17 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 4.024 7.310 -0.074) 8.345 1.615 ( 4.122 7.739 -2.180) 9.036 1.874 ( 9.836 0.085 5.379) 11.211 2.508 ( -15.525 3.809 -9.797) 18.748 2.641 ( 7.328 -6.926 -1.715) 10.228 2.913 ( -13.274 -8.332 12.833) 20.256 3.827 ( 4.446 1.733 4.474) 6.541 3.934 ( -0.122 -9.891 -10.244) 14.240 4.982 ( 6.593 4.144 0.808) 7.829 6.587 ( -3.072 2.187 -0.173) 3.775 6.687 ( 2.624 8.978 1.418) 9.461 6.841 ( 0.850 -0.012 -0.397) 0.938 7.456 ( -3.728 2.340 0.118) 4.403 7.788 ( 1.761 -2.722 -1.520) 3.580 7.987 ( 6.464 3.807 0.209) 7.505 8.522 ( -4.491 -2.296 2.407) 5.588 9.421 ( -1.138 -8.356 -2.153) 8.704 9.510 ( -0.573 1.786 1.036) 2.143 16.718 ( -1.576 -2.992 2.179) 4.023 16.930 ( -1.044 -7.697 -2.828) 8.267 17.401 ( 1.616 2.219 -2.182) 3.506 17.445 ( -1.160 4.539 2.617) 5.366 17.850 ( 1.534 0.863 -2.543) 3.092 18.280 ( 5.122 6.496 2.254) 8.574 ======================= Grid point 220 (119/294) ======================= q-point: (-0.08 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( 1.131 12.883 6.570) 14.506 1.734 ( 8.431 1.094 -6.703) 10.826 2.007 ( -1.705 7.102 -8.153) 10.946 2.287 ( -6.204 1.731 2.172) 6.798 2.550 ( -12.240 -12.404 9.432) 19.816 2.869 ( 10.697 -4.825 6.377) 13.356 3.767 ( 1.143 -11.859 -12.149) 17.016 3.934 ( 4.289 0.816 0.866) 4.451 5.129 ( 5.448 4.614 0.408) 7.151 6.474 ( -5.436 -3.438 -1.555) 6.617 6.845 ( -0.782 2.740 -0.792) 2.957 6.906 ( 5.761 11.757 3.309) 13.504 7.398 ( -7.129 4.052 0.708) 8.231 7.763 ( -0.910 -1.921 -0.650) 2.222 8.082 ( -2.320 6.701 -0.138) 7.092 8.497 ( 4.340 -5.033 3.948) 7.730 9.303 ( -0.064 -9.692 -5.065) 10.936 9.537 ( 1.078 0.760 1.875) 2.293 16.694 ( 0.453 -3.129 2.811) 4.231 16.825 ( -1.785 -6.001 -3.099) 6.986 17.418 ( 0.043 0.895 -1.560) 1.799 17.487 ( 0.077 3.425 1.696) 3.823 17.873 ( 1.885 1.404 -2.808) 3.662 18.425 ( 3.730 6.235 1.622) 7.444 ======================= Grid point 223 (120/294) ======================= q-point: ( 0.17 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( -13.604 2.586 -5.411) 14.867 1.655 ( -17.613 -8.654 13.538) 23.841 1.952 ( 5.000 -1.120 -0.143) 5.126 2.542 ( 13.325 11.407 -6.652) 18.759 2.745 ( 6.175 -4.851 -9.583) 12.390 2.931 ( 5.720 -1.199 11.069) 12.517 3.590 ( 5.596 1.293 2.442) 6.241 3.927 ( 1.777 -4.022 1.554) 4.664 5.081 ( -3.561 -3.793 -7.663) 9.262 6.461 ( 1.710 4.717 3.332) 6.023 6.838 ( -3.592 0.760 -0.694) 3.737 7.036 ( -4.480 -2.008 -4.498) 6.658 7.401 ( -3.697 0.338 3.170) 4.881 7.746 ( -2.364 0.741 -2.172) 3.295 7.980 ( -5.841 -5.022 -3.062) 8.289 8.733 ( 8.359 -0.974 3.075) 8.959 9.028 ( 2.387 4.648 -0.160) 5.227 9.611 ( 1.511 -0.695 1.519) 2.253 16.649 ( -1.699 3.353 -0.649) 3.814 16.772 ( 4.165 -2.343 6.175) 7.808 17.397 ( -1.864 2.120 -1.418) 3.159 17.551 ( -1.085 -0.913 2.067) 2.506 17.880 ( 0.421 -0.836 -3.463) 3.587 18.496 ( 0.277 -4.706 -6.471) 8.006 ======================= Grid point 224 (121/294) ======================= q-point: ( 0.25 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( -12.055 2.886 0.464) 12.404 1.389 ( -15.292 -6.551 15.911) 23.020 2.000 ( 4.237 -4.986 -3.619) 7.477 2.676 ( 6.049 -4.517 -5.762) 9.497 2.865 ( 13.234 5.539 -14.219) 20.199 3.098 ( 3.814 5.425 11.527) 13.298 3.650 ( 0.957 3.145 -1.963) 3.829 3.969 ( 4.480 -4.031 6.324) 8.736 4.946 ( -2.608 -5.350 -5.825) 8.328 6.525 ( -1.971 4.312 -0.314) 4.752 6.765 ( -4.406 -0.422 -0.640) 4.472 6.917 ( -2.982 -5.321 0.049) 6.100 7.374 ( -2.290 0.879 2.491) 3.496 7.672 ( -7.194 0.458 1.640) 7.393 7.834 ( -1.094 -7.019 -6.973) 9.954 8.859 ( 6.262 -1.088 2.472) 6.820 9.146 ( 4.007 8.344 0.286) 9.261 9.637 ( 1.250 -0.029 0.885) 1.532 16.678 ( 0.712 5.767 -1.195) 5.932 16.864 ( 5.038 -2.016 6.804) 8.703 17.370 ( -3.338 2.724 -1.962) 4.734 17.522 ( -2.686 -0.888 2.276) 3.631 17.849 ( 0.109 -2.082 -4.110) 4.609 18.395 ( -0.119 -9.143 -5.924) 10.895 ======================= Grid point 225 (122/294) ======================= q-point: ( 0.33 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( -8.196 2.986 7.523) 11.519 1.253 ( -6.653 -2.148 14.615) 16.201 1.942 ( 1.155 -9.423 -6.675) 11.605 2.706 ( 4.123 -4.205 -4.314) 7.300 2.897 ( 0.466 -2.602 -10.480) 10.808 3.345 ( 10.693 12.297 2.622) 16.506 3.726 ( 3.712 6.139 0.662) 7.204 4.027 ( 1.154 -1.441 4.614) 4.970 4.829 ( -1.993 -6.849 -3.068) 7.765 6.428 ( -6.768 -4.568 -4.423) 9.286 6.722 ( -2.373 0.991 2.030) 3.276 6.865 ( 0.746 -3.355 2.591) 4.305 7.357 ( -3.225 0.192 2.912) 4.349 7.566 ( -6.848 0.648 3.164) 7.571 7.740 ( 1.296 -4.808 -7.626) 9.108 8.942 ( 3.723 -1.156 2.111) 4.433 9.297 ( 4.666 8.133 -0.443) 9.387 9.660 ( 0.563 1.110 0.177) 1.257 16.765 ( 3.397 7.092 -1.750) 8.056 16.972 ( 5.539 -1.560 6.589) 8.748 17.310 ( -5.801 2.854 -2.558) 6.953 17.483 ( -2.715 -0.127 1.858) 3.292 17.798 ( -0.562 -2.963 -4.286) 5.241 18.261 ( -0.375 -12.163 -3.635) 12.700 ======================= Grid point 226 (123/294) ======================= q-point: ( 0.42 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.131 ( -2.987 2.694 8.077) 9.023 1.283 ( 1.143 -0.921 12.738) 12.822 1.816 ( -1.090 -8.489 -5.683) 10.273 2.579 ( -6.669 -7.257 -6.444) 11.776 2.887 ( 4.995 -0.619 -5.166) 7.213 3.658 ( 12.512 12.344 -1.388) 17.631 3.860 ( 3.752 6.150 1.535) 7.366 4.021 ( -4.659 2.982 0.781) 5.586 4.707 ( -2.898 -8.889 -0.824) 9.386 6.247 ( -3.427 -9.790 -1.498) 10.480 6.698 ( -2.261 -0.120 1.413) 2.669 6.894 ( 2.145 0.092 2.132) 3.025 7.290 ( -6.213 -1.848 4.940) 8.150 7.527 ( -1.152 1.992 0.232) 2.313 7.695 ( 1.619 -2.450 -4.393) 5.284 8.981 ( 1.179 -1.042 1.200) 1.979 9.429 ( 4.147 5.448 -1.509) 7.011 9.678 ( -0.516 2.614 -0.136) 2.668 16.892 ( 5.082 6.923 -2.080) 8.836 17.087 ( 5.633 -0.786 5.654) 8.020 17.213 ( -7.212 2.684 -2.473) 8.083 17.458 ( -1.855 0.962 1.165) 2.393 17.721 ( -2.169 -4.064 -3.559) 5.821 18.127 ( 0.055 -12.206 -1.273) 12.272 ======================= Grid point 227 (124/294) ======================= q-point: ( 0.50 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.168 ( 1.484 -0.613 4.648) 4.918 1.357 ( 1.156 -2.921 7.136) 7.797 1.704 ( -2.292 -3.672 -3.019) 5.277 2.413 ( -2.210 -3.824 -0.400) 4.435 2.920 ( 2.207 -0.604 -4.018) 4.624 3.884 ( -5.258 2.799 -4.558) 7.501 3.949 ( 11.490 5.797 -11.057) 16.967 4.014 ( -3.517 12.269 9.570) 15.953 4.559 ( -3.631 -10.453 0.639) 11.084 6.147 ( 1.973 -9.421 3.239) 10.156 6.670 ( -1.482 0.099 0.299) 1.515 6.937 ( 1.097 0.497 0.833) 1.464 7.216 ( -3.251 -1.580 4.615) 5.862 7.542 ( 0.911 1.401 -1.317) 2.127 7.693 ( 1.911 -1.460 -0.446) 2.445 8.976 ( -1.183 -0.564 -0.444) 1.384 9.511 ( 2.827 2.197 -2.100) 4.150 9.688 ( -1.767 3.421 -0.222) 3.857 17.020 ( 4.761 4.798 -1.470) 6.917 17.104 ( -7.105 2.628 -2.669) 8.032 17.201 ( 5.145 -0.384 3.781) 6.396 17.460 ( -0.574 2.353 1.505) 2.852 17.619 ( -2.911 -4.569 -1.298) 5.571 18.027 ( 0.633 -9.223 -0.489) 9.258 ======================= Grid point 228 (125/294) ======================= q-point: ( 0.58 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 4.220 -2.875 3.520) 6.202 1.319 ( -1.426 -6.623 -0.240) 6.779 1.641 ( -2.806 1.413 -1.146) 3.344 2.461 ( 5.655 1.839 6.863) 9.081 2.897 ( -1.375 -0.671 -3.622) 3.932 3.711 ( -12.392 5.116 -11.413) 17.606 4.020 ( -0.122 0.053 0.909) 0.918 4.165 ( 0.961 3.066 0.772) 3.305 4.455 ( 2.211 -3.233 0.528) 3.952 6.170 ( 5.148 -4.532 6.415) 9.391 6.663 ( 0.253 1.019 -0.342) 1.104 6.932 ( -1.570 -1.222 0.259) 2.006 7.227 ( 2.814 0.265 2.410) 3.715 7.561 ( 1.612 0.147 -1.803) 2.423 7.720 ( 2.069 -1.556 2.940) 3.917 8.929 ( -3.304 0.320 -2.411) 4.103 9.543 ( 1.238 0.055 -1.431) 1.893 9.675 ( -2.917 2.238 -0.878) 3.780 16.999 ( -6.107 1.166 -2.654) 6.760 17.102 ( 2.221 0.331 -0.077) 2.247 17.274 ( 2.862 -0.687 0.063) 2.944 17.467 ( -3.055 0.892 2.511) 4.054 17.601 ( 3.969 2.101 1.914) 4.881 17.969 ( 0.780 -5.018 -0.454) 5.099 ======================= Grid point 229 (126/294) ======================= q-point: (-0.33 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.202 ( 1.186 -6.848 -4.903) 8.505 1.340 ( 7.783 -3.935 6.085) 10.634 1.628 ( -2.878 6.266 0.894) 6.953 2.612 ( 2.469 2.411 4.062) 5.330 2.856 ( -0.315 1.328 -1.065) 1.731 3.478 ( -12.969 4.554 -11.626) 18.003 3.973 ( -6.646 -4.077 8.204) 11.318 4.082 ( -1.817 -8.272 -5.178) 9.927 4.583 ( 7.659 6.138 -0.243) 9.818 6.289 ( 5.649 2.939 6.112) 8.827 6.697 ( 2.618 1.270 -0.031) 2.910 6.876 ( -2.841 -2.806 -0.203) 3.998 7.324 ( 6.127 1.887 0.975) 6.484 7.580 ( 2.802 -0.841 -2.151) 3.631 7.760 ( 1.934 -2.096 5.436) 6.139 8.849 ( -5.164 1.341 -3.946) 6.636 9.538 ( -0.248 -2.551 0.182) 2.570 9.626 ( -3.578 1.046 -2.113) 4.285 16.897 ( -4.696 -0.414 -3.573) 5.915 17.082 ( -1.841 -6.390 2.960) 7.279 17.306 ( 2.254 1.624 -2.757) 3.914 17.455 ( -1.582 2.245 2.282) 3.571 17.734 ( 4.886 3.469 2.643) 6.550 17.970 ( 2.435 1.421 0.882) 2.954 ======================= Grid point 230 (127/294) ======================= q-point: (-0.25 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.170 ( 6.623 -4.397 -8.521) 11.653 1.498 ( 11.298 -4.628 8.665) 14.971 1.678 ( -2.463 10.802 2.598) 11.380 2.593 ( -4.099 0.334 -1.122) 4.263 2.874 ( -3.657 3.790 -3.394) 6.266 3.274 ( -9.082 0.320 -3.256) 9.653 3.855 ( -7.216 -4.812 11.023) 14.026 3.946 ( -0.525 -8.675 -9.550) 12.912 4.761 ( 6.969 5.959 0.528) 9.184 6.469 ( 5.831 9.238 3.339) 11.423 6.761 ( 3.795 -0.234 -0.504) 3.836 6.788 ( -4.161 -2.538 -0.311) 4.883 7.446 ( 4.477 1.965 2.000) 5.282 7.631 ( 6.425 0.541 -2.643) 6.969 7.803 ( 1.932 -2.803 6.602) 7.428 8.745 ( -6.623 1.961 -4.375) 8.177 9.473 ( -2.086 -7.632 -0.015) 7.912 9.578 ( -2.733 2.405 -1.499) 3.937 16.800 ( -3.240 -1.666 -3.879) 5.322 16.987 ( -3.058 -8.382 4.183) 9.854 17.347 ( 1.969 3.252 -3.513) 5.176 17.471 ( -0.349 1.782 1.079) 2.112 17.812 ( 1.345 1.191 1.243) 2.185 18.100 ( 5.432 7.961 3.248) 10.170 ======================= Grid point 231 (128/294) ======================= q-point: (-0.17 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.248 ( 12.229 0.604 -10.787) 16.318 1.700 ( 6.918 0.054 8.132) 10.677 1.763 ( 3.036 6.906 2.230) 7.867 2.553 ( -0.876 1.810 0.744) 2.144 2.727 ( -12.527 3.592 -7.734) 15.154 3.106 ( -10.784 -7.476 7.139) 14.938 3.780 ( -2.004 -10.192 -8.687) 13.541 3.829 ( 0.377 0.099 4.772) 4.788 4.931 ( 6.410 5.996 1.681) 8.937 6.632 ( -1.615 -0.835 -0.972) 2.062 6.713 ( 3.850 7.242 -1.452) 8.329 6.825 ( 1.948 1.853 0.575) 2.749 7.506 ( 0.793 0.166 2.083) 2.235 7.753 ( 2.942 4.323 0.855) 5.298 7.870 ( 7.902 -2.486 4.334) 9.349 8.625 ( -7.285 1.504 -3.371) 8.167 9.344 ( -2.569 -10.114 -1.446) 10.534 9.558 ( -1.867 1.898 0.202) 2.670 16.721 ( -1.722 -2.231 -2.980) 4.101 16.888 ( -2.732 -7.541 3.936) 8.935 17.386 ( 1.508 2.927 -2.828) 4.340 17.485 ( 0.298 1.051 -0.552) 1.224 17.843 ( 0.250 2.027 0.674) 2.151 18.286 ( 4.854 8.635 3.048) 10.364 ======================= Grid point 232 (129/294) ======================= q-point: (-0.08 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( 15.950 5.110 -10.845) 19.953 1.744 ( -2.155 4.579 -1.024) 5.164 1.971 ( 9.505 2.662 4.183) 10.720 2.486 ( -10.780 2.229 -5.788) 12.437 2.617 ( -2.126 0.056 7.706) 7.994 2.886 ( -10.050 -8.149 11.346) 17.209 3.588 ( -2.070 -11.066 -10.089) 15.117 3.891 ( 2.818 1.401 1.218) 3.374 5.095 ( 5.392 5.928 1.228) 8.107 6.505 ( -4.726 -5.253 -2.126) 7.378 6.865 ( 0.687 1.565 0.615) 1.816 6.910 ( 6.927 10.857 -3.265) 13.286 7.514 ( -1.513 0.542 1.876) 2.470 7.783 ( -2.422 2.118 2.584) 4.127 8.061 ( 10.342 3.376 1.988) 11.059 8.504 ( -6.122 -0.816 -0.981) 6.253 9.196 ( -2.111 -10.514 -2.258) 10.959 9.554 ( -0.736 0.887 1.162) 1.636 16.673 ( -0.158 -2.231 -0.916) 2.417 16.804 ( -2.466 -5.597 2.897) 6.767 17.414 ( 0.651 1.527 -1.365) 2.150 17.499 ( 1.148 1.132 -1.609) 2.278 17.867 ( 0.030 2.399 -0.316) 2.420 18.438 ( 3.188 6.893 1.087) 7.672 ======================= Grid point 236 (130/294) ======================= q-point: ( 0.17 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( -5.133 1.013 -5.571) 7.643 1.847 ( -3.936 -10.243 -0.993) 11.018 1.928 ( -7.110 2.617 -1.650) 7.754 2.353 ( 12.226 8.007 -5.031) 15.456 2.618 ( -2.613 -6.420 -1.586) 7.110 2.868 ( 10.179 -3.381 13.737) 17.429 3.628 ( 0.886 10.088 9.528) 13.905 3.889 ( -0.606 -2.228 -1.018) 2.523 5.072 ( -4.682 -2.790 -8.134) 9.791 6.482 ( 3.250 3.980 3.827) 6.407 6.877 ( -1.804 -0.727 -1.231) 2.302 7.030 ( -1.681 -3.502 -7.107) 8.099 7.476 ( -2.744 0.470 0.817) 2.901 7.693 ( 1.550 -3.200 -7.613) 8.403 8.055 ( -7.946 -1.485 -3.208) 8.697 8.578 ( 8.908 -3.072 2.964) 9.878 9.122 ( -1.933 8.844 7.337) 11.652 9.581 ( 1.691 -1.737 1.357) 2.778 16.687 ( 0.131 -0.894 1.149) 1.462 16.768 ( 0.228 3.013 7.071) 7.689 17.427 ( -0.735 1.110 -0.480) 1.416 17.544 ( 1.420 -1.201 0.095) 1.863 17.864 ( -1.206 0.069 -2.652) 2.914 18.422 ( -1.673 -3.807 -8.782) 9.717 ======================= Grid point 237 (131/294) ======================= q-point: ( 0.25 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( -9.939 2.568 -2.566) 10.581 1.622 ( -11.079 -8.340 6.727) 15.413 1.873 ( 0.947 -6.893 -3.334) 7.715 2.543 ( 1.246 -1.485 -0.880) 2.129 2.628 ( 14.683 8.544 -11.021) 20.250 3.080 ( 8.336 -1.456 9.918) 13.038 3.722 ( -2.513 5.292 2.526) 6.380 3.912 ( 3.577 -0.017 7.576) 8.378 4.925 ( -4.121 -3.261 -7.035) 8.781 6.579 ( 0.511 3.921 0.562) 3.994 6.801 ( -3.296 -3.077 -4.142) 6.123 6.908 ( -2.818 -6.009 -1.408) 6.785 7.441 ( -3.167 2.172 0.134) 3.843 7.658 ( 2.206 -1.988 -7.328) 7.907 7.890 ( -9.577 -2.076 1.704) 9.946 8.710 ( 9.382 -2.433 0.021) 9.692 9.230 ( -0.396 9.585 5.766) 11.193 9.605 ( 2.376 -1.649 1.194) 3.128 16.705 ( 1.333 1.971 -0.133) 2.383 16.850 ( 1.202 2.499 8.194) 8.651 17.418 ( -1.399 1.356 -0.976) 2.180 17.540 ( -0.061 -2.406 0.534) 2.465 17.825 ( -1.393 -0.304 -2.883) 3.216 18.292 ( -1.901 -6.779 -8.587) 11.104 ======================= Grid point 238 (132/294) ======================= q-point: ( 0.33 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( -8.618 3.022 0.396) 9.141 1.455 ( -9.099 -3.760 12.823) 16.167 1.776 ( 2.029 -11.121 -6.828) 13.206 2.602 ( 4.104 1.287 1.174) 4.458 2.787 ( 4.957 1.571 -12.132) 13.199 3.234 ( 9.389 3.268 -1.744) 10.093 3.775 ( 2.419 2.480 7.489) 8.252 4.028 ( 2.274 2.796 7.833) 8.622 4.801 ( -3.269 -3.457 -4.698) 6.686 6.475 ( -8.336 -5.087 -7.586) 12.366 6.766 ( -0.167 1.488 1.073) 1.842 6.834 ( -0.099 -4.213 1.722) 4.552 7.416 ( -2.578 1.961 0.005) 3.239 7.641 ( 1.724 -0.712 -5.135) 5.463 7.732 ( -9.584 -1.610 4.337) 10.642 8.830 ( 8.006 -1.883 -1.032) 8.289 9.342 ( 0.700 8.146 2.682) 8.604 9.640 ( 2.537 -0.842 1.040) 2.868 16.767 ( 3.126 3.879 -0.628) 5.021 16.945 ( 2.150 2.154 7.791) 8.364 17.390 ( -2.979 1.486 -1.553) 3.674 17.505 ( -0.876 -3.143 -0.477) 3.298 17.782 ( -1.897 -0.071 -2.318) 2.996 18.146 ( -1.614 -8.733 -5.914) 10.670 ======================= Grid point 239 (133/294) ======================= q-point: ( 0.42 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( -5.069 1.416 1.928) 5.605 1.399 ( -5.614 -0.185 14.682) 15.720 1.684 ( 3.127 -8.473 -6.194) 10.951 2.580 ( -5.308 -6.034 -4.345) 9.135 2.799 ( 4.355 3.748 -4.392) 7.232 3.458 ( 14.891 6.787 -9.024) 18.688 3.897 ( 3.309 1.278 7.747) 8.521 4.115 ( -0.107 3.883 5.267) 6.544 4.690 ( -3.896 -4.283 -1.775) 6.055 6.244 ( -7.511 -6.251 -4.492) 10.755 6.737 ( -2.637 -1.172 0.343) 2.906 6.865 ( 2.924 0.002 2.011) 3.549 7.376 ( -4.000 -1.306 1.924) 4.627 7.611 ( -5.787 0.643 1.647) 6.051 7.646 ( 0.512 0.639 -0.632) 1.035 8.916 ( 5.263 -1.618 -1.144) 5.624 9.430 ( 1.399 5.652 -0.823) 5.881 9.681 ( 2.087 0.187 0.849) 2.261 16.867 ( 4.622 4.504 -0.760) 6.499 17.048 ( 3.085 2.027 6.594) 7.557 17.327 ( -5.554 1.736 -1.779) 6.085 17.459 ( 0.285 -3.330 -2.271) 4.041 17.729 ( -3.152 -0.899 -1.324) 3.535 18.024 ( -0.798 -7.667 -1.774) 7.910 ======================= Grid point 240 (134/294) ======================= q-point: ( 0.50 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( -2.843 -0.245 2.055) 3.516 1.405 ( -3.594 -1.807 11.060) 11.769 1.647 ( 2.577 -3.214 -4.357) 5.996 2.412 ( -3.250 -4.426 -2.007) 5.846 2.889 ( 2.303 4.339 -0.502) 4.938 3.706 ( 15.123 5.472 -11.905) 20.010 3.948 ( -1.662 0.199 0.198) 1.686 4.160 ( -0.431 2.314 1.471) 2.775 4.579 ( -5.642 -3.223 3.911) 7.584 6.103 ( -2.587 -3.771 2.245) 5.095 6.690 ( -1.604 -1.283 -0.432) 2.099 6.918 ( 2.175 0.249 0.887) 2.362 7.288 ( -5.110 -3.892 3.989) 7.561 7.566 ( -2.564 2.259 0.053) 3.418 7.671 ( 1.021 1.140 1.433) 2.097 8.955 ( 2.112 -1.263 -1.668) 2.973 9.486 ( 1.657 3.388 -2.796) 4.694 9.713 ( 0.880 0.298 0.024) 0.930 16.983 ( 4.950 3.730 -0.507) 6.219 17.152 ( 3.180 1.435 4.233) 5.485 17.225 ( -6.966 1.388 -2.162) 7.425 17.440 ( 2.639 -2.186 -2.408) 4.188 17.648 ( -4.026 -2.683 0.852) 4.912 17.963 ( -0.457 -3.048 1.121) 3.279 ======================= Grid point 241 (135/294) ======================= q-point: (-0.42 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( 0.444 -2.391 2.796) 3.705 1.318 ( -6.502 -7.209 2.651) 10.064 1.658 ( 1.585 2.208 -1.918) 3.327 2.430 ( 5.122 2.378 5.404) 7.816 2.933 ( -1.824 4.024 0.530) 4.449 3.815 ( -2.667 -2.467 -14.805) 15.244 3.913 ( 5.543 2.903 -5.613) 8.406 4.151 ( 0.217 -2.694 -3.173) 4.168 4.524 ( -5.013 2.871 10.257) 11.772 6.120 ( 2.992 -0.437 8.455) 8.979 6.660 ( -0.203 -0.705 -1.372) 1.556 6.938 ( -0.064 -0.788 -0.141) 0.803 7.218 ( -1.076 -3.136 3.475) 4.803 7.553 ( -1.103 1.082 -0.625) 1.667 7.715 ( 0.987 1.480 3.927) 4.311 8.944 ( -0.549 -0.610 -3.219) 3.322 9.517 ( 1.275 1.438 -2.452) 3.115 9.708 ( -0.899 -0.430 -1.404) 1.722 17.072 ( -0.601 2.408 -3.218) 4.064 17.095 ( -3.013 -0.507 -1.182) 3.277 17.227 ( 1.616 -1.211 3.455) 4.002 17.466 ( 3.137 -2.565 -1.961) 4.501 17.605 ( -0.227 2.161 4.097) 4.638 17.955 ( -0.823 1.343 2.207) 2.711 ======================= Grid point 242 (136/294) ======================= q-point: (-0.33 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.137 ( -5.221 -9.478 -0.532) 10.834 1.199 ( 5.551 -7.017 2.360) 9.254 1.724 ( 0.555 8.781 1.016) 8.857 2.620 ( 6.293 6.049 6.800) 11.065 2.919 ( -4.321 4.171 1.042) 6.096 3.581 ( -7.977 -4.854 -17.276) 19.638 3.947 ( 1.229 -1.990 -6.654) 7.053 4.091 ( -3.371 -3.799 2.153) 5.516 4.591 ( 0.847 7.230 6.824) 9.978 6.265 ( 6.168 2.826 10.032) 12.111 6.657 ( 1.746 -0.445 -2.127) 2.787 6.898 ( -2.551 -2.353 -0.241) 3.479 7.250 ( 4.948 -0.634 2.359) 5.518 7.539 ( -0.140 -0.678 -1.054) 1.261 7.772 ( 0.596 1.794 5.990) 6.281 8.893 ( -2.441 0.258 -5.243) 5.789 9.520 ( -0.265 -1.704 -0.464) 1.786 9.664 ( -2.226 -0.157 -2.928) 3.681 16.944 ( -5.922 -0.826 -6.489) 8.823 17.102 ( -2.418 -3.515 5.132) 6.673 17.257 ( 2.998 -0.255 -0.300) 3.024 17.461 ( 1.426 -2.635 -1.025) 3.166 17.719 ( 3.975 5.574 4.290) 8.079 17.996 ( 0.455 5.935 2.990) 6.661 ======================= Grid point 243 (137/294) ======================= q-point: (-0.25 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.995 ( 1.314 -9.085 -5.104) 10.503 1.287 ( 11.734 -8.120 5.826) 15.413 1.834 ( -1.445 12.231 2.621) 12.592 2.723 ( -5.049 5.829 3.204) 8.351 2.930 ( -0.629 4.826 -0.394) 4.883 3.315 ( -5.134 -6.857 -14.856) 17.149 3.869 ( -2.950 -1.502 -6.513) 7.306 3.993 ( -7.444 -5.055 9.142) 12.827 4.739 ( 4.469 7.735 3.343) 9.539 6.461 ( 6.902 5.541 5.935) 10.656 6.677 ( 3.112 -1.897 -2.977) 4.705 6.829 ( -2.687 -1.814 0.315) 3.257 7.377 ( 7.651 0.359 4.033) 8.656 7.534 ( 2.707 -1.429 -1.963) 3.636 7.832 ( -0.391 2.385 6.943) 7.352 8.813 ( -3.853 1.049 -6.841) 7.922 9.455 ( -3.406 -6.035 0.887) 6.986 9.620 ( -1.744 1.597 -2.765) 3.638 16.810 ( -4.316 -1.658 -6.412) 7.905 17.022 ( -4.992 -6.641 7.378) 11.111 17.312 ( 3.295 2.284 -2.966) 4.987 17.459 ( 1.456 -1.900 -0.808) 2.527 17.829 ( 1.195 3.582 3.641) 5.246 18.130 ( 3.958 10.125 3.509) 11.424 ======================= Grid point 244 (138/294) ======================= q-point: (-0.17 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.983 ( 10.617 -3.818 -10.084) 15.132 1.494 ( 15.926 -6.052 9.753) 19.632 1.902 ( -4.860 9.862 1.174) 11.057 2.685 ( -7.328 8.391 0.335) 11.146 2.853 ( -6.432 -3.050 -8.840) 11.350 3.163 ( -2.837 -4.344 -2.281) 5.667 3.759 ( -6.736 -0.816 -3.460) 7.616 3.889 ( -4.663 -3.585 8.547) 10.375 4.910 ( 5.424 7.567 2.910) 9.754 6.610 ( 0.977 -3.389 -0.696) 3.595 6.681 ( 5.072 4.936 -3.521) 7.905 6.819 ( 1.304 1.397 0.739) 2.049 7.465 ( 2.622 -3.839 2.588) 5.321 7.657 ( 12.129 1.559 1.820) 12.363 7.877 ( -2.168 3.497 6.193) 7.435 8.711 ( -5.099 1.440 -7.443) 9.136 9.324 ( -5.293 -7.239 1.559) 9.102 9.599 ( -1.495 1.287 -1.122) 2.270 16.706 ( -2.288 -1.728 -5.022) 5.783 16.920 ( -4.828 -6.686 7.582) 11.202 17.366 ( 2.520 3.068 -3.724) 5.443 17.460 ( 1.316 -1.498 -1.195) 2.325 17.881 ( -0.480 2.926 2.807) 4.083 18.316 ( 4.278 9.902 2.478) 11.068 ======================= Grid point 245 (139/294) ======================= q-point: (-0.08 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( 17.286 3.393 -12.917) 21.844 1.767 ( 13.426 -3.198 10.476) 17.327 1.887 ( -3.946 5.814 0.253) 7.032 2.584 ( -7.295 -0.097 -13.665) 15.491 2.714 ( -3.762 -1.255 1.686) 4.309 3.047 ( -9.129 -1.588 8.017) 12.253 3.587 ( -10.078 -3.172 0.368) 10.572 3.886 ( 0.526 1.084 2.415) 2.699 5.080 ( 4.928 6.969 1.999) 8.766 6.505 ( -3.400 -6.176 -2.109) 7.358 6.835 ( 6.386 3.548 -1.835) 7.532 6.876 ( 3.239 5.887 -4.019) 7.829 7.478 ( 3.050 -4.316 0.792) 5.344 7.855 ( 3.884 -3.386 3.852) 6.433 7.936 ( 5.784 7.091 3.919) 9.955 8.591 ( -6.241 1.296 -6.566) 9.151 9.183 ( -5.797 -5.691 3.326) 8.778 9.581 ( -1.232 0.386 0.089) 1.294 16.651 ( -0.394 -1.000 -2.166) 2.418 16.832 ( -3.874 -5.550 6.604) 9.456 17.407 ( 1.457 2.478 -2.503) 3.812 17.463 ( 1.695 -0.525 -2.293) 2.899 17.905 ( -1.137 2.444 1.397) 3.036 18.461 ( 2.546 7.205 -0.046) 7.642 ======================= Grid point 248 (140/294) ======================= q-point: ( 0.17 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 5.955 1.767 -12.655) 14.097 1.679 ( 5.227 -12.766 -10.190) 17.150 1.992 ( -1.800 6.238 -10.073) 11.984 2.395 ( -8.102 3.000 9.734) 13.015 2.596 ( 11.346 -4.325 15.935) 20.034 2.823 ( -8.687 -2.913 5.655) 10.767 3.803 ( -1.811 11.493 8.803) 14.590 3.896 ( -2.383 0.067 -1.482) 2.807 5.087 ( -5.411 -1.756 -8.035) 9.845 6.475 ( 4.177 2.710 3.878) 6.311 6.869 ( -0.669 -2.445 -3.308) 4.168 6.943 ( 1.675 -4.920 -8.236) 9.739 7.464 ( 3.540 -1.977 0.317) 4.067 7.631 ( -0.765 0.470 -7.465) 7.518 8.097 ( 0.356 -0.792 -5.379) 5.449 8.497 ( -0.502 -1.768 6.634) 6.884 9.296 ( -3.470 8.171 8.178) 12.070 9.544 ( 0.841 -2.476 0.464) 2.656 16.675 ( -0.181 -2.475 2.588) 3.586 16.857 ( -0.343 4.995 7.608) 9.107 17.438 ( -0.205 0.129 -0.455) 0.516 17.487 ( 2.821 -1.740 -2.387) 4.084 17.892 ( -2.651 1.460 -1.291) 3.290 18.381 ( -3.200 -2.441 -9.148) 9.994 ======================= Grid point 249 (141/294) ======================= q-point: ( 0.25 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( 4.739 -11.719 -10.340) 16.331 1.626 ( -5.078 1.036 -4.279) 6.721 1.895 ( -6.603 -1.942 -3.010) 7.512 2.456 ( 6.126 4.026 -1.825) 7.555 2.639 ( -6.443 5.577 7.428) 11.305 2.940 ( 12.584 -4.492 12.259) 18.134 3.785 ( -3.663 -1.958 -2.054) 4.633 3.975 ( 0.681 8.304 8.615) 11.985 4.936 ( -5.117 -1.460 -7.681) 9.344 6.585 ( 2.876 2.053 1.465) 3.825 6.760 ( -1.718 -6.372 -7.686) 10.130 6.885 ( -0.791 -3.828 -0.344) 3.924 7.490 ( 0.335 -0.069 0.919) 0.980 7.606 ( -0.680 4.989 -7.594) 9.112 8.014 ( -6.073 -0.771 -1.902) 6.411 8.557 ( 6.187 -2.906 3.779) 7.810 9.369 ( -1.997 7.517 6.120) 9.897 9.547 ( 2.469 -3.059 0.562) 3.971 16.680 ( 1.682 -1.234 1.387) 2.505 16.943 ( -0.898 5.634 8.118) 9.922 17.428 ( 0.054 -0.828 -2.200) 2.351 17.487 ( 1.749 -3.884 -0.884) 4.351 17.857 ( -2.712 1.940 -1.246) 3.559 18.243 ( -4.051 -3.071 -8.503) 9.907 ======================= Grid point 250 (142/294) ======================= q-point: ( 0.33 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.426 ( 4.268 -10.748 -7.287) 13.669 1.509 ( -7.285 4.222 -1.018) 8.482 1.742 ( -8.243 -5.839 5.975) 11.736 2.582 ( 6.852 6.924 -7.569) 12.336 2.680 ( -0.037 2.423 1.359) 2.779 3.123 ( 7.061 -0.891 4.767) 8.566 3.745 ( 2.988 -4.336 5.259) 7.442 4.091 ( 0.723 4.800 5.066) 7.016 4.815 ( -4.131 -0.083 -5.612) 6.968 6.506 ( -6.393 -4.839 -6.674) 10.432 6.749 ( 3.933 0.168 1.718) 4.296 6.829 ( -2.358 -2.503 -0.082) 3.440 7.483 ( -2.659 2.288 -0.534) 3.548 7.609 ( 0.074 4.316 -4.611) 6.316 7.887 ( -8.052 -1.771 3.032) 8.784 8.667 ( 8.461 -1.997 -0.116) 8.694 9.433 ( -1.187 5.625 3.055) 6.510 9.575 ( 3.820 -2.742 0.876) 4.783 16.725 ( 3.683 0.068 0.792) 3.767 17.025 ( -0.992 5.708 7.477) 9.459 17.395 ( 0.921 -3.509 -4.704) 5.941 17.465 ( -0.262 -3.348 0.494) 3.394 17.823 ( -2.849 1.527 -1.079) 3.408 18.107 ( -4.351 -2.116 -5.373) 7.231 ======================= Grid point 251 (143/294) ======================= q-point: ( 0.42 0.67 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( -3.174 -2.230 -1.878) 4.310 1.498 ( 2.876 -0.264 -2.234) 3.651 1.612 ( -7.732 -3.208 10.770) 13.641 2.598 ( -6.274 -5.215 -4.339) 9.241 2.738 ( 7.431 8.282 -6.011) 12.647 3.267 ( 9.372 3.606 -2.582) 10.368 3.846 ( 7.015 -4.025 9.786) 12.696 4.136 ( 0.930 -1.386 -0.239) 1.687 4.736 ( -4.106 1.995 -1.600) 4.837 6.318 ( -8.595 -1.151 -3.605) 9.391 6.759 ( -2.040 -3.702 0.057) 4.228 6.828 ( 2.895 1.390 1.089) 3.391 7.438 ( -4.124 0.371 -0.645) 4.191 7.637 ( 0.541 3.786 -1.005) 3.954 7.765 ( -7.999 -0.886 4.972) 9.460 8.780 ( 7.989 -1.410 -2.254) 8.419 9.470 ( -0.650 4.077 -0.224) 4.135 9.623 ( 4.208 -2.524 0.882) 4.985 16.806 ( 5.291 0.705 0.570) 5.368 17.105 ( -0.416 5.634 6.189) 8.379 17.349 ( 2.602 -5.602 -5.590) 8.331 17.416 ( -3.385 -1.375 -0.094) 3.654 17.769 ( -3.416 -1.238 -1.040) 3.779 18.020 ( -3.512 1.350 -0.404) 3.784 ======================= Grid point 252 (144/294) ======================= q-point: (-0.50 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( -4.269 1.498 -0.605) 4.565 1.530 ( 1.768 -2.251 -1.443) 3.206 1.557 ( -4.088 -0.128 10.886) 11.628 2.413 ( -4.424 -5.110 -3.506) 7.614 2.898 ( 4.570 8.463 -1.311) 9.707 3.447 ( 12.731 2.071 -9.352) 15.932 3.946 ( 2.222 -2.772 4.661) 5.861 4.104 ( 2.385 -6.359 -3.622) 7.697 4.704 ( -4.730 4.662 4.400) 7.966 6.189 ( -6.989 2.850 1.349) 7.668 6.693 ( -1.728 -2.888 -0.935) 3.493 6.884 ( 2.557 0.069 0.719) 2.657 7.348 ( -5.088 -3.911 1.650) 6.626 7.667 ( -5.257 3.498 1.937) 6.604 7.692 ( -0.374 1.564 3.435) 3.793 8.864 ( 5.655 -1.347 -3.220) 6.646 9.490 ( -0.067 3.412 -2.695) 4.349 9.666 ( 3.484 -2.855 0.242) 4.511 16.909 ( 6.141 0.538 0.450) 6.181 17.185 ( 0.012 4.887 4.438) 6.601 17.309 ( 0.910 -6.626 -4.097) 7.843 17.337 ( -2.476 0.732 -2.857) 3.851 17.692 ( -3.476 -2.157 1.854) 4.491 18.008 ( -2.582 4.349 2.442) 5.616 ======================= Grid point 253 (145/294) ======================= q-point: (-0.42 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( -4.489 -1.465 -3.893) 6.120 1.430 ( -10.409 -5.884 7.778) 14.264 1.625 ( 4.812 4.073 0.756) 6.349 2.398 ( 4.686 2.024 3.582) 6.236 3.011 ( 0.073 6.945 1.320) 7.070 3.560 ( 10.481 -6.481 -17.076) 21.058 3.917 ( -1.269 -0.389 -2.113) 2.495 4.090 ( 2.010 -2.323 -2.211) 3.785 4.713 ( -5.225 5.957 9.004) 11.994 6.172 ( -1.967 4.216 6.726) 8.178 6.642 ( -0.561 -2.251 -2.062) 3.104 6.917 ( 1.504 -0.815 -0.067) 1.712 7.236 ( -3.913 -5.763 2.984) 7.578 7.614 ( -4.455 1.393 1.530) 4.912 7.753 ( 0.626 3.867 4.526) 5.986 8.897 ( 2.572 -1.362 -4.375) 5.254 9.504 ( 0.533 2.445 -3.333) 4.168 9.680 ( 1.695 -2.718 -0.788) 3.299 17.014 ( 6.052 0.121 -0.102) 6.054 17.168 ( -6.776 0.310 -4.828) 8.326 17.252 ( -1.048 -0.582 4.840) 4.986 17.337 ( 4.890 -3.941 -3.839) 7.361 17.670 ( -1.217 2.655 5.248) 6.006 18.033 ( -2.230 5.738 3.200) 6.938 ======================= Grid point 254 (146/294) ======================= q-point: (-0.33 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.071 ( -0.277 -6.957 -5.677) 8.984 1.201 ( -11.789 -11.158 6.189) 17.371 1.789 ( 4.336 11.225 3.348) 12.491 2.595 ( 8.743 7.075 6.067) 12.779 3.034 ( -3.097 1.915 0.129) 3.644 3.449 ( -0.069 -9.540 -17.894) 20.279 3.925 ( 0.264 3.007 -2.848) 4.151 4.086 ( 0.743 0.453 -2.981) 3.105 4.747 ( -4.539 6.700 10.022) 12.882 6.270 ( 3.253 3.462 9.794) 10.886 6.610 ( 0.843 -1.835 -3.153) 3.744 6.905 ( -1.223 -2.196 -0.621) 2.589 7.182 ( 1.995 -4.246 2.785) 5.456 7.563 ( -3.316 -0.270 0.557) 3.374 7.830 ( 0.422 4.140 6.020) 7.318 8.876 ( 0.054 -0.896 -6.064) 6.130 9.509 ( -0.022 0.007 -1.466) 1.466 9.663 ( -0.293 -1.146 -2.218) 2.514 17.011 ( -7.143 -0.455 -6.560) 9.709 17.101 ( 2.916 0.088 0.036) 2.917 17.237 ( -1.356 -3.555 5.407) 6.611 17.362 ( 4.701 -4.003 -1.819) 6.437 17.760 ( 1.972 6.718 5.245) 8.748 18.084 ( -0.996 7.462 3.330) 8.232 ======================= Grid point 255 (147/294) ======================= q-point: (-0.25 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.929 ( -7.895 -12.915 0.763) 15.157 1.053 ( 8.778 -9.610 1.697) 13.126 1.980 ( 1.048 13.568 4.220) 14.248 2.813 ( 4.388 6.829 3.059) 8.674 2.950 ( -1.040 -7.266 -7.841) 10.740 3.260 ( -6.731 2.005 -9.265) 11.626 3.911 ( -2.840 3.266 -3.472) 5.548 4.076 ( -2.162 -1.745 2.576) 3.789 4.816 ( -1.224 7.864 7.618) 11.017 6.429 ( 5.862 2.195 8.048) 10.195 6.596 ( 2.094 -2.005 -4.166) 5.075 6.846 ( -2.098 -2.630 -0.363) 3.384 7.257 ( 8.193 -2.196 3.423) 9.147 7.507 ( -2.075 -1.943 -0.585) 2.903 7.908 ( 0.134 3.881 5.855) 7.026 8.820 ( -1.710 0.355 -7.081) 7.293 9.473 ( -2.838 -3.052 1.368) 4.386 9.637 ( -0.867 1.180 -3.067) 3.399 16.854 ( -6.818 -0.394 -6.157) 9.195 17.083 ( -3.763 -4.600 4.832) 7.660 17.254 ( 3.452 0.117 -0.386) 3.476 17.390 ( 3.488 -3.296 -0.032) 4.799 17.874 ( 1.162 5.058 4.063) 6.591 18.194 ( 2.263 10.094 2.940) 10.755 ======================= Grid point 256 (148/294) ======================= q-point: (-0.17 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.750 ( 3.097 -10.232 -5.466) 12.007 1.214 ( 16.605 -7.862 8.353) 20.182 2.089 ( -4.116 9.546 2.598) 10.715 2.739 ( -1.023 -14.885 -14.683) 20.934 2.890 ( -6.034 10.031 -2.728) 12.019 3.222 ( -3.465 9.692 1.139) 10.356 3.874 ( -4.562 4.751 -1.414) 6.736 3.997 ( -6.865 -5.041 7.762) 11.523 4.941 ( 2.387 8.410 5.127) 10.135 6.542 ( 2.351 -4.336 0.277) 4.940 6.612 ( 5.252 2.564 -2.658) 6.421 6.812 ( 0.472 -0.275 -0.139) 0.564 7.396 ( 4.726 -5.110 5.661) 8.971 7.490 ( 7.045 -0.667 -1.652) 7.267 7.963 ( -0.370 2.013 3.082) 3.700 8.752 ( -3.570 2.648 -6.307) 7.716 9.386 ( -5.590 -2.823 3.375) 7.114 9.619 ( -0.964 1.078 -2.025) 2.489 16.723 ( -4.688 -0.393 -4.605) 6.583 16.989 ( -5.328 -5.806 7.296) 10.739 17.314 ( 3.878 1.987 -4.239) 6.079 17.412 ( 2.244 -2.440 0.882) 3.430 17.936 ( -0.510 3.105 3.092) 4.411 18.357 ( 3.621 10.063 1.325) 10.776 ======================= Grid point 257 (149/294) ======================= q-point: (-0.08 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.813 ( 16.382 -0.322 -12.004) 20.312 1.505 ( 19.279 -6.403 12.339) 23.769 2.062 ( -6.692 3.244 0.508) 7.455 2.476 ( -3.437 -12.653 -16.230) 20.865 2.856 ( -7.888 10.053 -3.585) 13.272 3.252 ( -6.966 7.972 6.704) 12.531 3.792 ( -11.586 1.842 4.358) 12.515 3.917 ( -1.660 -0.873 4.057) 4.470 5.093 ( 3.499 7.683 3.146) 9.010 6.477 ( -1.553 -6.253 -1.662) 6.654 6.734 ( 7.203 2.960 -3.968) 8.740 6.852 ( 2.926 3.145 -2.244) 4.846 7.384 ( 2.086 -6.413 0.571) 6.767 7.681 ( 12.756 -2.202 4.112) 13.582 7.958 ( -0.227 -2.554 -1.965) 3.231 8.684 ( -5.988 5.458 -4.024) 9.046 9.296 ( -6.823 0.118 5.999) 9.086 9.600 ( -1.090 0.024 -0.841) 1.377 16.652 ( -1.685 0.462 -1.676) 2.421 16.894 ( -5.003 -5.446 7.661) 10.648 17.366 ( 3.609 2.419 -5.800) 7.246 17.428 ( 1.207 -1.303 1.212) 2.150 17.958 ( -1.435 2.103 1.869) 3.159 18.487 ( 2.043 7.122 -1.473) 7.555 ======================= Grid point 260 (150/294) ======================= q-point: ( 0.17 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 7.834 -18.674 -16.857) 26.348 1.383 ( 17.480 7.218 -15.200) 24.263 2.073 ( -0.714 3.053 1.265) 3.381 2.436 ( 8.685 -1.985 13.287) 15.997 2.646 ( -12.009 0.325 10.338) 15.849 3.091 ( -17.776 2.302 4.986) 18.605 3.927 ( -3.792 1.882 -3.279) 5.354 3.985 ( -1.336 7.660 7.022) 10.477 5.123 ( -6.022 -0.676 -7.663) 9.770 6.444 ( 4.480 1.064 3.886) 6.026 6.785 ( 1.307 -5.300 -12.283) 13.442 6.844 ( 2.246 -2.292 0.185) 3.214 7.381 ( 5.710 0.993 0.773) 5.847 7.577 ( 3.278 -0.611 -7.077) 7.823 7.996 ( 6.501 -2.526 0.753) 7.015 8.614 ( -8.507 1.551 3.349) 9.273 9.461 ( -3.543 4.113 6.988) 8.848 9.522 ( -1.111 -1.086 -1.368) 2.070 16.684 ( -2.070 -2.647 2.768) 4.353 16.945 ( 0.984 4.992 8.021) 9.499 17.387 ( 2.461 -3.454 -4.731) 6.354 17.445 ( 0.608 0.489 -1.007) 1.273 17.953 ( -2.963 2.007 -0.244) 3.587 18.378 ( -3.959 -0.313 -7.258) 8.273 ======================= Grid point 261 (151/294) ======================= q-point: ( 0.25 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.163 ( 9.546 -16.093 -12.968) 22.766 1.616 ( 9.364 8.756 -11.044) 16.921 1.977 ( -9.312 1.908 -6.025) 11.254 2.495 ( -4.720 -4.639 11.931) 13.643 2.752 ( 13.145 -2.735 13.761) 19.226 2.904 ( -12.815 6.542 5.792) 15.510 3.823 ( -5.716 -2.025 -3.499) 7.002 4.075 ( 0.269 4.771 4.153) 6.331 4.975 ( -5.813 0.490 -7.790) 9.732 6.549 ( 4.032 0.476 2.662) 4.855 6.676 ( -0.418 -5.002 -6.777) 8.434 6.855 ( 1.090 -1.850 -0.373) 2.179 7.459 ( 2.998 -0.771 2.525) 3.995 7.629 ( 2.594 8.371 -8.208) 12.007 8.027 ( 0.466 -1.328 -3.676) 3.936 8.541 ( -3.198 -1.806 6.778) 7.709 9.468 ( -0.100 -3.004 2.175) 3.710 9.508 ( -1.302 3.446 1.684) 4.050 16.658 ( 0.112 -1.925 1.815) 2.648 17.049 ( 0.287 5.254 7.318) 9.014 17.344 ( 1.751 -6.115 -5.885) 8.666 17.454 ( 0.605 -0.281 0.102) 0.675 17.920 ( -3.076 1.965 -0.802) 3.737 18.271 ( -5.193 1.434 -5.321) 7.572 ======================= Grid point 262 (152/294) ======================= q-point: ( 0.33 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( 10.110 -9.248 -7.401) 15.573 1.680 ( -6.603 5.965 -1.873) 9.094 1.827 ( -4.047 -1.318 -2.198) 4.791 2.488 ( 2.574 1.881 -0.847) 3.299 2.796 ( -6.006 1.048 1.491) 6.276 3.032 ( 8.763 0.218 12.948) 15.636 3.707 ( -1.962 -4.570 1.047) 5.082 4.111 ( 0.764 -1.244 -1.215) 1.899 4.871 ( -4.591 3.502 -5.155) 7.740 6.535 ( -4.027 -0.703 -1.803) 4.468 6.679 ( 4.530 -2.412 1.974) 5.498 6.842 ( -0.821 -0.094 -1.208) 1.464 7.506 ( 1.481 0.261 1.685) 2.258 7.679 ( -2.698 10.307 -6.588) 12.527 7.967 ( -2.920 -1.828 -1.924) 3.946 8.556 ( 3.020 -2.495 4.658) 6.087 9.457 ( 2.867 -4.891 0.676) 5.710 9.534 ( -0.851 2.955 1.284) 3.333 16.675 ( 2.432 -0.960 1.356) 2.945 17.134 ( -0.034 4.820 5.369) 7.215 17.270 ( 1.425 -7.336 -6.028) 9.601 17.459 ( 0.142 -0.759 1.162) 1.395 17.876 ( -3.211 0.593 -1.593) 3.633 18.184 ( -5.952 4.252 -2.167) 7.629 ======================= Grid point 263 (153/294) ======================= q-point: ( 0.42 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.218 ( 7.964 -2.385 -1.871) 8.521 1.575 ( -7.890 2.866 0.093) 8.395 1.772 ( -5.473 0.497 7.034) 8.926 2.579 ( 3.770 0.948 -7.516) 8.462 2.692 ( -2.382 2.032 -4.876) 5.794 3.190 ( 4.501 0.148 5.017) 6.741 3.734 ( 7.026 -5.456 9.117) 12.738 4.063 ( 0.768 -6.415 -6.365) 9.069 4.833 ( -3.713 6.140 -0.916) 7.234 6.453 ( -7.299 4.006 0.588) 8.347 6.715 ( 2.205 -5.311 1.656) 5.984 6.829 ( -0.372 2.354 -1.472) 2.801 7.505 ( -3.362 0.569 -0.782) 3.499 7.683 ( -1.829 6.465 -2.103) 7.040 7.895 ( -5.152 -0.428 3.005) 5.979 8.630 ( 6.692 -1.720 -0.637) 6.939 9.480 ( 4.087 -3.596 1.039) 5.542 9.545 ( 0.190 0.398 -0.894) 0.996 16.731 ( 4.351 -0.500 1.124) 4.522 17.179 ( 3.971 -6.853 -6.398) 10.182 17.217 ( -1.864 3.988 4.517) 6.308 17.453 ( -1.350 -0.465 1.137) 1.825 17.809 ( -3.651 -0.857 -1.107) 3.910 18.139 ( -5.433 6.639 0.732) 8.609 ======================= Grid point 264 (154/294) ======================= q-point: (-0.50 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( 2.352 4.258 1.319) 5.040 1.502 ( -3.223 2.737 -1.661) 4.543 1.730 ( -6.748 -0.358 11.487) 13.327 2.422 ( -6.088 -5.930 -5.016) 9.868 2.843 ( 10.435 10.054 -7.048) 16.113 3.249 ( 5.123 -5.108 -4.523) 8.532 3.874 ( 7.207 -4.968 9.554) 12.957 3.976 ( 1.752 -5.367 -6.418) 8.548 4.847 ( -3.252 7.135 3.179) 8.461 6.380 ( -8.925 7.211 1.888) 11.629 6.677 ( -0.857 -4.239 -0.495) 4.353 6.854 ( 1.570 0.885 -0.377) 1.842 7.408 ( -5.932 -2.884 -0.449) 6.611 7.726 ( 0.601 3.122 2.763) 4.212 7.822 ( -7.127 2.445 3.837) 8.455 8.720 ( 7.446 -1.274 -4.182) 8.635 9.513 ( -0.331 2.300 -1.647) 2.848 9.553 ( 5.143 -5.361 -0.005) 7.429 16.814 ( 5.658 -0.605 0.599) 5.722 17.133 ( 4.819 -8.453 -5.660) 11.256 17.272 ( -1.209 5.347 3.991) 6.781 17.411 ( -4.092 0.630 -1.114) 4.288 17.746 ( -3.108 -0.344 2.408) 3.947 18.136 ( -4.260 7.415 2.158) 8.820 ======================= Grid point 265 (155/294) ======================= q-point: (-0.42 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( -9.379 0.991 -8.379) 12.616 1.579 ( 0.753 5.921 4.818) 7.670 1.640 ( -6.524 -3.382 10.563) 12.867 2.356 ( 3.833 0.903 1.093) 4.086 3.048 ( 3.906 7.021 -1.878) 8.251 3.214 ( 10.179 -10.410 -15.950) 21.596 3.906 ( 0.633 -0.415 -0.367) 0.841 4.020 ( 4.772 -1.589 2.671) 5.695 4.889 ( -3.336 7.020 6.498) 10.131 6.332 ( -6.845 7.149 3.805) 10.603 6.618 ( -1.266 -2.753 -2.228) 3.761 6.881 ( 1.737 -0.658 -0.284) 1.879 7.271 ( -5.718 -6.109 1.782) 8.555 7.720 ( -5.305 -1.005 3.914) 6.668 7.818 ( -0.611 5.852 3.749) 6.977 8.788 ( 5.560 -1.270 -5.742) 8.093 9.504 ( -0.290 1.630 -3.777) 4.124 9.599 ( 4.428 -3.416 0.897) 5.664 16.904 ( 6.297 -0.774 -1.146) 6.447 17.119 ( 5.528 -7.611 -2.674) 9.779 17.295 ( -4.924 3.524 -1.051) 6.146 17.334 ( -3.155 0.560 0.913) 3.332 17.747 ( -0.993 3.064 5.642) 6.497 18.158 ( -3.294 7.264 2.713) 8.425 ======================= Grid point 266 (156/294) ======================= q-point: (-0.33 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -8.035 -4.244 -12.172) 15.190 1.365 ( -15.561 -12.125 9.739) 22.000 1.840 ( 6.431 13.402 5.583) 15.879 2.536 ( 9.920 6.395 3.852) 12.415 2.952 ( 0.897 -15.411 -12.412) 19.808 3.330 ( 6.160 8.732 -4.614) 11.640 3.930 ( 0.778 2.208 0.041) 2.341 4.064 ( 1.063 1.179 -2.166) 2.685 4.939 ( -3.997 6.794 8.677) 11.723 6.346 ( -1.879 4.596 6.902) 8.502 6.564 ( -0.404 -2.165 -3.803) 4.395 6.888 ( 0.510 -1.684 -0.853) 1.955 7.150 ( -2.535 -6.557 2.787) 7.562 7.638 ( -5.448 -1.171 2.218) 5.998 7.889 ( 0.679 3.246 4.387) 5.499 8.811 ( 2.673 -0.372 -6.200) 6.762 9.499 ( 0.485 0.298 -2.073) 2.149 9.633 ( 1.799 -0.585 -0.547) 1.969 16.977 ( 4.924 -0.734 -5.613) 7.503 17.121 ( -0.511 -2.332 1.334) 2.735 17.204 ( -1.227 -1.819 -3.996) 4.559 17.322 ( -1.971 -1.135 5.378) 5.840 17.827 ( 1.084 5.928 5.234) 7.982 18.198 ( -2.058 7.409 2.954) 8.237 ======================= Grid point 267 (157/294) ======================= q-point: (-0.25 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.857 ( 2.080 -7.831 -6.593) 10.446 1.023 ( -15.928 -15.800 7.754) 23.737 2.080 ( 4.234 10.761 2.818) 11.902 2.683 ( 4.865 -9.980 -12.383) 16.632 2.854 ( 5.707 4.673 1.545) 7.536 3.431 ( -4.629 12.052 0.427) 12.917 3.950 ( -0.402 2.317 -1.651) 2.873 4.077 ( 0.828 1.251 -2.147) 2.619 4.987 ( -4.105 7.174 8.961) 12.191 6.425 ( 2.082 1.465 8.218) 8.604 6.522 ( 1.081 -2.659 -4.705) 5.511 6.848 ( -1.816 -2.610 -0.937) 3.315 7.132 ( 4.944 -4.265 2.715) 7.072 7.547 ( -4.888 -2.408 0.738) 5.499 7.940 ( 1.350 -0.345 1.931) 2.381 8.810 ( 0.232 2.743 -4.842) 5.569 9.493 ( -0.777 -1.047 1.243) 1.802 9.642 ( -0.180 1.623 -2.208) 2.746 16.936 ( -5.458 1.159 -7.178) 9.091 17.087 ( -0.418 -0.175 -2.530) 2.571 17.209 ( 3.237 -4.368 4.330) 6.950 17.317 ( 0.842 -2.833 4.191) 5.129 17.926 ( 1.066 4.990 3.490) 6.182 18.275 ( 0.608 8.656 2.524) 9.037 ======================= Grid point 268 (158/294) ======================= q-point: (-0.17 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.674 ( -10.592 -16.360 3.523) 19.805 0.913 ( 14.861 -9.179 4.523) 18.043 2.129 ( 1.862 -8.761 -8.255) 12.181 2.609 ( -1.479 2.801 -4.902) 5.837 3.005 ( 0.843 9.886 -2.423) 10.214 3.448 ( -7.433 14.584 2.216) 16.518 3.955 ( -1.431 3.198 -0.102) 3.505 4.069 ( -2.140 -2.256 2.425) 3.943 5.053 ( -1.986 8.010 7.302) 11.019 6.471 ( 0.915 -3.633 -2.064) 4.277 6.537 ( 4.694 -0.733 2.552) 5.393 6.801 ( -0.440 -0.947 -0.792) 1.310 7.247 ( 10.279 -3.645 4.557) 11.820 7.445 ( -3.466 -3.479 -1.906) 5.268 7.939 ( 1.683 -5.058 -2.604) 5.933 8.822 ( -2.127 7.110 -2.018) 7.691 9.467 ( -3.119 -0.336 3.713) 4.861 9.634 ( -1.089 1.589 -2.042) 2.808 16.801 ( -7.301 1.729 -5.143) 9.097 17.047 ( -2.664 -3.571 2.783) 5.253 17.247 ( 2.761 -0.276 -0.899) 2.916 17.350 ( 3.487 -3.227 3.800) 6.084 17.986 ( -0.185 2.821 2.392) 3.704 18.400 ( 2.767 8.980 0.492) 9.410 ======================= Grid point 269 (159/294) ======================= q-point: (-0.08 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.509 ( 8.278 -7.673 -6.064) 12.813 1.177 ( 20.820 -8.536 11.343) 25.199 1.956 ( 3.241 -19.629 -14.224) 24.457 2.545 ( -11.852 8.139 -0.886) 14.405 3.045 ( -4.748 11.588 -5.715) 13.766 3.503 ( -6.849 14.869 4.910) 17.091 3.958 ( -1.807 0.490 2.861) 3.419 3.990 ( -7.144 -0.938 4.394) 8.440 5.154 ( 0.556 7.816 4.720) 9.148 6.423 ( 0.091 -5.352 -1.789) 5.644 6.623 ( 5.883 -0.321 -1.524) 6.086 6.819 ( 2.502 2.405 -1.732) 3.879 7.312 ( -0.919 -7.581 1.000) 7.702 7.469 ( 12.663 -1.862 1.287) 12.864 7.867 ( 0.972 -9.399 -5.797) 11.085 8.836 ( -5.199 9.098 -0.759) 10.506 9.444 ( -4.443 3.263 5.897) 8.072 9.612 ( -1.461 -0.076 -0.900) 1.718 16.701 ( -4.121 2.033 -1.783) 4.929 16.972 ( -4.944 -4.673 6.963) 9.735 17.286 ( 3.892 1.249 -5.683) 7.001 17.399 ( 2.538 -1.808 3.454) 4.652 18.006 ( -1.081 1.647 1.558) 2.512 18.509 ( 1.759 6.594 -2.668) 7.328 ======================= Grid point 272 (160/294) ======================= q-point: ( 0.17 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.848 ( 9.182 -22.803 -15.451) 29.035 1.079 ( 20.229 11.786 -14.047) 27.303 1.922 ( 19.273 -6.739 14.145) 24.838 2.563 ( -12.983 5.174 1.610) 14.068 2.897 ( -11.478 0.901 9.455) 14.898 3.451 ( -19.407 4.403 1.563) 19.961 3.983 ( -3.083 1.720 -2.867) 4.548 4.072 ( 0.077 1.888 2.060) 2.795 5.182 ( -6.574 0.485 -6.972) 9.595 6.401 ( 4.021 -0.009 4.191) 5.808 6.644 ( 3.845 -2.740 -7.973) 9.266 6.802 ( 0.473 -1.222 -1.001) 1.649 7.312 ( 7.402 6.046 0.213) 9.560 7.439 ( 5.247 -5.453 -4.031) 8.574 7.866 ( 8.828 -2.816 5.098) 10.576 8.801 ( -10.076 2.703 0.650) 10.453 9.510 ( -2.168 -1.911 -0.171) 2.895 9.598 ( -3.846 2.641 1.299) 4.843 16.726 ( -4.281 -2.922 3.021) 5.999 17.007 ( 1.708 4.097 6.215) 7.637 17.286 ( 1.951 -3.916 -4.655) 6.388 17.420 ( 1.842 0.519 -3.278) 3.796 18.010 ( -2.180 1.118 -0.326) 2.471 18.425 ( -4.159 2.457 -2.784) 5.575 ======================= Grid point 273 (161/294) ======================= q-point: ( 0.25 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( 12.094 -12.955 -8.677) 19.733 1.413 ( 16.776 12.300 -14.349) 25.271 2.108 ( -2.781 -1.058 1.324) 3.257 2.476 ( 4.444 -8.310 13.388) 16.372 2.791 ( -9.697 1.103 9.054) 13.313 3.218 ( -15.255 5.608 1.959) 16.371 3.890 ( -6.447 -1.163 -3.013) 7.210 4.081 ( 1.086 -2.895 -1.910) 3.634 5.047 ( -6.286 2.871 -6.739) 9.653 6.499 ( 4.898 -0.156 3.789) 6.194 6.622 ( 0.013 -0.451 -3.095) 3.127 6.817 ( 1.768 -0.053 -0.422) 1.818 7.414 ( 3.298 -2.487 3.593) 5.475 7.557 ( 9.434 9.273 -8.704) 15.835 7.971 ( 3.819 -2.034 1.871) 4.714 8.666 ( -8.650 -0.289 3.545) 9.352 9.436 ( -2.176 -4.154 -2.207) 5.183 9.583 ( -1.783 1.632 2.010) 3.143 16.664 ( -1.907 -2.198 1.975) 3.517 17.079 ( 2.391 -0.916 -0.635) 2.638 17.256 ( 0.467 -1.640 -0.067) 1.706 17.438 ( 1.250 0.417 -1.581) 2.058 17.974 ( -2.700 0.668 -1.245) 3.047 18.372 ( -5.352 4.794 -0.766) 7.225 ======================= Grid point 274 (162/294) ======================= q-point: ( 0.33 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.890 ( 11.625 -0.869 -0.001) 11.658 1.681 ( 11.199 11.441 -11.266) 19.576 1.931 ( -11.832 -1.566 -2.251) 12.145 2.540 ( -3.545 -5.022 12.190) 13.652 2.775 ( 4.819 -4.387 4.752) 8.066 3.100 ( -6.470 3.935 4.296) 8.706 3.738 ( -6.512 -4.093 -1.169) 7.780 4.029 ( 1.403 -6.903 -6.566) 9.630 4.969 ( -4.880 6.275 -3.907) 8.858 6.584 ( 4.825 -3.886 2.051) 6.526 6.616 ( -2.825 5.187 3.367) 6.799 6.839 ( 0.743 1.160 -1.259) 1.866 7.473 ( 3.785 -0.466 1.664) 4.160 7.739 ( 5.284 11.853 -6.780) 14.641 7.960 ( -2.181 -1.689 -3.159) 4.194 8.579 ( -3.845 -2.744 7.064) 8.498 9.358 ( 0.938 -6.633 -2.196) 7.049 9.581 ( -1.217 0.961 0.914) 1.800 16.648 ( 0.584 -1.215 1.640) 2.123 17.056 ( 3.398 -7.168 -7.675) 11.038 17.281 ( -1.358 3.654 5.525) 6.762 17.451 ( 0.869 -0.191 0.151) 0.902 17.921 ( -3.163 0.115 -1.761) 3.622 18.332 ( -5.995 6.569 0.381) 8.902 ======================= Grid point 275 (163/294) ======================= q-point: ( 0.42 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.104 ( 8.622 6.723 5.319) 12.158 1.738 ( -9.430 -0.125 0.663) 9.454 1.848 ( 2.801 7.695 -3.516) 8.912 2.511 ( 0.330 -0.285 1.727) 1.781 2.735 ( -5.316 -3.074 -5.364) 8.154 3.131 ( 4.056 -4.822 4.770) 7.903 3.647 ( 1.800 -6.211 4.820) 8.065 3.943 ( 1.008 -5.719 -7.193) 9.244 4.954 ( -3.666 7.877 -1.051) 8.752 6.595 ( -0.111 -2.895 2.911) 4.106 6.663 ( -1.912 5.630 3.962) 7.145 6.848 ( -0.323 2.071 -1.834) 2.785 7.527 ( 1.148 0.421 0.282) 1.255 7.797 ( -6.392 6.571 -4.566) 10.242 7.931 ( 2.781 2.794 -2.058) 4.447 8.556 ( 0.188 -3.323 4.115) 5.292 9.334 ( 5.549 -7.591 -0.399) 9.411 9.567 ( -1.378 0.431 -0.758) 1.631 16.675 ( 2.626 -0.815 1.516) 3.140 16.995 ( 3.746 -8.099 -7.620) 11.735 17.323 ( -1.864 4.564 4.583) 6.731 17.465 ( 0.304 -0.133 1.500) 1.536 17.858 ( -3.482 0.081 -1.042) 3.635 18.305 ( -5.816 7.530 0.803) 9.549 ======================= Grid point 276 (164/294) ======================= q-point: (-0.50 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 5.412 11.004 6.839) 14.041 1.623 ( -7.120 2.478 0.228) 7.542 1.885 ( -4.438 3.141 5.369) 7.641 2.443 ( -6.967 -6.885 -3.824) 10.515 2.702 ( 9.100 6.531 -8.417) 14.011 3.093 ( 1.672 -12.145 -6.497) 13.874 3.741 ( 9.433 -6.276 11.013) 15.801 3.897 ( 1.019 -0.058 -3.852) 3.985 4.979 ( -2.683 7.963 1.223) 8.491 6.563 ( -2.658 -2.503 2.544) 4.450 6.686 ( -4.593 6.660 1.805) 8.289 6.851 ( -0.219 1.813 -1.657) 2.466 7.477 ( -5.771 -2.013 -1.845) 6.385 7.757 ( -0.469 1.188 1.366) 1.870 7.972 ( -3.961 5.668 1.925) 7.178 8.573 ( 5.110 -2.408 -3.056) 6.423 9.384 ( 7.896 -6.979 1.764) 10.685 9.540 ( -1.400 0.915 -2.200) 2.764 16.729 ( 4.114 -0.968 0.504) 4.256 16.950 ( 4.375 -7.542 -4.802) 9.954 17.358 ( -1.346 3.773 2.921) 4.958 17.464 ( -1.949 0.869 0.387) 2.169 17.810 ( -2.773 0.953 1.733) 3.406 18.294 ( -4.979 7.753 0.876) 9.256 ======================= Grid point 277 (165/294) ======================= q-point: (-0.42 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.409 ( -11.285 4.062 -8.949) 14.964 1.644 ( 3.726 11.767 7.227) 14.303 1.821 ( -10.220 -4.869 12.110) 16.578 2.307 ( 1.363 -1.014 -2.273) 2.837 2.865 ( 7.826 -14.342 -13.448) 21.161 2.990 ( 7.919 6.402 -5.635) 11.639 3.886 ( 4.654 -2.059 7.156) 8.781 3.940 ( 4.748 1.541 1.393) 5.183 5.027 ( -1.913 7.387 3.275) 8.304 6.496 ( -3.919 -1.987 1.511) 4.646 6.661 ( -6.525 6.917 -0.860) 9.548 6.855 ( 0.458 0.471 -1.330) 1.483 7.328 ( -6.942 -5.344 0.537) 8.778 7.775 ( -0.462 -1.756 4.040) 4.429 7.940 ( -5.852 4.068 2.330) 7.499 8.639 ( 7.266 -0.219 -6.196) 9.552 9.448 ( 5.031 -5.334 0.899) 7.387 9.536 ( 1.351 2.188 -1.261) 2.864 16.790 ( 5.200 -1.063 -2.804) 6.003 16.948 ( 5.475 -6.786 0.145) 8.721 17.381 ( -1.190 1.489 3.101) 3.640 17.411 ( -5.461 2.420 -3.122) 6.740 17.819 ( -0.627 2.865 4.832) 5.652 18.299 ( -3.930 7.408 1.037) 8.450 ======================= Grid point 278 (166/294) ======================= q-point: (-0.33 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.116 ( -15.056 -0.620 -16.489) 22.337 1.572 ( -16.129 -12.462 11.920) 23.612 1.899 ( 5.417 12.048 5.819) 14.435 2.430 ( 9.222 3.914 -2.943) 10.442 2.685 ( 4.091 -15.750 -8.440) 18.331 3.273 ( 12.259 13.216 -2.197) 18.159 3.951 ( 0.592 2.100 2.978) 3.691 4.036 ( 3.302 0.533 1.118) 3.527 5.089 ( -1.697 6.725 5.136) 8.631 6.435 ( -1.791 -2.475 1.971) 3.636 6.601 ( -6.763 5.695 -2.481) 9.183 6.857 ( 0.737 -0.628 -1.472) 1.762 7.174 ( -5.877 -6.765 3.110) 9.486 7.726 ( -5.075 -2.993 3.623) 6.916 7.912 ( -0.756 -0.990 0.117) 1.251 8.722 ( 5.341 2.812 -4.850) 7.743 9.465 ( 2.037 -1.686 -0.512) 2.693 9.597 ( 2.980 1.840 0.162) 3.506 16.844 ( 5.796 -0.586 -6.725) 8.897 17.002 ( 6.638 -6.027 4.764) 10.153 17.300 ( -7.650 2.653 -5.192) 9.619 17.384 ( -2.276 -0.206 4.704) 5.230 17.887 ( 1.003 4.327 4.723) 6.483 18.318 ( -2.735 6.928 1.535) 7.605 ======================= Grid point 279 (167/294) ======================= q-point: (-0.25 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.786 ( -9.206 -4.707 -15.631) 18.741 1.218 ( -18.823 -15.814 11.107) 26.977 2.018 ( 4.245 -8.293 -8.813) 12.824 2.504 ( 5.468 5.461 -5.349) 9.399 2.804 ( 10.553 6.325 7.024) 14.167 3.558 ( 5.975 14.562 0.948) 15.769 3.971 ( -1.462 0.970 1.102) 2.071 4.069 ( 0.524 2.122 -2.659) 3.442 5.152 ( -2.270 6.452 6.376) 9.351 6.421 ( 2.126 -4.093 1.977) 5.018 6.529 ( -5.412 2.893 -0.986) 6.215 6.845 ( -0.584 -0.947 -1.419) 1.803 7.069 ( -1.255 -5.583 3.546) 6.732 7.618 ( -6.148 -3.525 1.890) 7.335 7.874 ( 1.651 -7.004 -3.471) 7.989 8.812 ( 2.724 6.579 -1.817) 7.349 9.487 ( 1.462 -0.660 1.487) 2.188 9.650 ( 0.829 3.030 -1.024) 3.304 16.890 ( 4.856 0.821 -8.123) 9.499 17.094 ( 6.987 -5.204 5.093) 10.092 17.163 ( -8.202 2.969 -4.941) 10.025 17.359 ( -3.173 -2.342 6.544) 7.640 17.968 ( 1.127 3.792 2.837) 4.868 18.362 ( -0.787 6.863 1.859) 7.153 ======================= Grid point 280 (168/294) ======================= q-point: (-0.17 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.633 ( 7.763 -9.327 -4.451) 12.925 0.808 ( -19.230 -17.833 10.427) 28.223 1.835 ( 3.732 -22.534 -16.746) 28.322 2.706 ( 3.928 17.498 0.641) 17.945 3.049 ( 4.568 9.245 2.859) 10.701 3.708 ( -4.957 14.571 1.954) 15.515 3.978 ( 1.442 2.372 -0.386) 2.802 4.073 ( -0.272 -0.333 -0.214) 0.480 5.209 ( -2.745 6.786 6.459) 9.762 6.412 ( 0.811 -2.790 -5.034) 5.812 6.497 ( 0.346 -3.218 6.477) 7.241 6.810 ( -1.745 -0.062 -0.118) 1.750 7.090 ( 6.652 -3.531 2.744) 8.016 7.481 ( -6.369 -4.857 -1.052) 8.079 7.799 ( 2.847 -10.412 -6.156) 12.426 8.911 ( 0.602 9.356 0.171) 9.377 9.511 ( 0.058 -0.027 3.584) 3.584 9.669 ( -1.354 3.419 -1.246) 3.883 16.898 ( -2.823 3.736 -7.265) 8.643 17.038 ( -2.112 -0.062 -5.078) 5.500 17.197 ( 4.533 -2.787 4.962) 7.276 17.322 ( -1.686 -3.996 7.414) 8.590 18.020 ( 0.260 2.174 1.470) 2.637 18.441 ( 1.486 6.784 0.494) 6.963 ======================= Grid point 281 (169/294) ======================= q-point: (-0.08 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.417 ( -12.288 -17.727 8.251) 23.093 0.804 ( 20.937 -10.459 8.550) 24.917 1.580 ( 4.686 -25.063 -17.057) 30.677 2.844 ( -9.349 14.331 1.310) 17.161 3.147 ( 0.191 11.023 -6.759) 12.931 3.787 ( -4.870 16.762 4.471) 18.018 4.001 ( -2.495 -1.890 3.320) 4.563 4.061 ( -0.511 0.723 1.236) 1.520 5.268 ( -1.992 6.972 5.091) 8.860 6.362 ( 0.261 -3.227 -3.504) 4.771 6.524 ( 3.723 -4.628 2.771) 6.554 6.808 ( 0.555 2.273 -0.073) 2.341 7.227 ( 10.209 -4.824 5.906) 12.743 7.315 ( -3.728 -5.577 -7.194) 9.836 7.707 ( 2.407 -11.069 -5.471) 12.580 8.987 ( -2.671 9.249 -0.387) 9.635 9.537 ( -0.210 2.730 2.382) 3.629 9.660 ( -3.180 2.021 2.287) 4.408 16.802 ( -6.675 3.683 -3.490) 8.384 17.021 ( -0.364 -1.363 0.937) 1.694 17.221 ( 0.752 -1.340 -0.879) 1.771 17.351 ( 3.557 -3.155 6.280) 7.877 18.039 ( -0.449 1.117 0.884) 1.493 18.523 ( 1.527 5.395 -2.757) 6.249 ======================= Grid point 321 (170/294) ======================= q-point: ( 0.17 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.731 ( 0.000 0.000 20.861) 20.861 0.731 ( 0.000 0.000 20.861) 20.861 1.053 ( 0.000 0.000 29.962) 29.962 3.097 ( -0.000 -0.000 -14.883) 14.883 3.097 ( -0.000 -0.000 -14.883) 14.883 3.909 ( -0.000 0.000 -2.525) 2.525 3.909 ( -0.000 0.000 -2.525) 2.525 4.328 ( -0.000 -0.000 -18.666) 18.666 5.492 ( -0.000 -0.000 -3.555) 3.555 6.340 ( 0.000 0.000 3.823) 3.823 6.340 ( 0.000 0.000 3.823) 3.823 7.147 ( 0.000 0.000 13.355) 13.355 7.201 ( 0.000 0.000 8.266) 8.266 7.201 ( 0.000 0.000 8.266) 8.266 7.409 ( 0.000 0.000 0.646) 0.646 9.327 ( -0.000 -0.000 -3.776) 3.776 9.470 ( -0.000 -0.000 -6.496) 6.496 9.470 ( -0.000 -0.000 -6.496) 6.496 16.821 ( -0.000 -0.000 -6.028) 6.028 16.821 ( -0.000 -0.000 -6.028) 6.028 17.307 ( 0.000 0.000 5.061) 5.061 17.307 ( 0.000 0.000 5.061) 5.061 18.005 ( -0.000 -0.000 -2.868) 2.868 18.864 ( 0.000 0.000 2.027) 2.027 ======================= Grid point 322 (171/294) ======================= q-point: ( 0.25 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.717 ( 0.324 -2.435 16.980) 17.157 1.027 ( 2.597 14.144 20.867) 25.343 1.349 ( 12.770 0.197 27.058) 29.921 2.823 ( -7.843 -7.725 -15.579) 19.075 3.142 ( 2.636 0.323 -13.476) 13.735 3.834 ( -1.607 -0.952 -4.982) 5.321 3.942 ( -0.763 2.391 -6.062) 6.561 4.122 ( -6.672 -3.795 -13.653) 15.663 5.410 ( -4.728 -2.818 -4.320) 6.996 6.316 ( -0.996 -1.539 3.821) 4.238 6.463 ( 5.361 4.296 3.853) 7.876 7.046 ( -5.889 -5.098 6.772) 10.321 7.307 ( -1.498 6.259 12.887) 14.404 7.392 ( 7.550 0.441 9.667) 12.274 7.441 ( 5.167 0.285 1.288) 5.333 9.224 ( -4.737 -4.982 -3.051) 7.521 9.387 ( -2.538 0.036 -10.022) 10.338 9.521 ( 3.649 3.340 -5.436) 7.350 16.706 ( -3.995 -0.724 -6.011) 7.253 16.947 ( 9.884 4.844 -6.833) 12.956 17.228 ( -7.922 -3.612 6.274) 10.731 17.374 ( 2.188 0.907 4.324) 4.930 17.991 ( 0.118 -0.079 -3.019) 3.022 18.827 ( -3.497 -2.912 2.802) 5.344 ======================= Grid point 323 (172/294) ======================= q-point: ( 0.33 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.877 ( 8.024 4.404 7.951) 12.124 1.331 ( 1.167 19.548 19.948) 27.954 1.719 ( 15.117 -2.050 22.318) 27.033 2.543 ( -6.247 -8.921 -12.805) 16.810 3.018 ( -3.092 -9.375 -9.739) 13.867 3.688 ( -14.666 -1.595 -14.226) 20.494 3.801 ( -1.568 -0.355 -7.836) 7.999 4.073 ( 1.587 1.644 -1.392) 2.676 5.267 ( -5.172 -3.145 -5.614) 8.255 6.325 ( 0.773 -0.733 3.833) 3.978 6.609 ( 4.916 4.346 2.196) 6.920 6.976 ( -1.749 -2.590 3.124) 4.419 7.378 ( -1.968 1.156 11.005) 11.239 7.515 ( 3.115 6.008 1.848) 7.015 7.639 ( 11.494 -1.005 9.611) 15.016 9.073 ( -5.624 -5.672 -2.627) 8.408 9.260 ( -5.468 0.398 -11.141) 12.417 9.577 ( 2.848 2.137 -3.146) 4.751 16.619 ( -2.652 0.772 -4.831) 5.565 17.089 ( -6.939 -1.727 4.125) 8.255 17.116 ( 7.427 2.578 -3.386) 8.560 17.444 ( 2.558 1.218 3.218) 4.288 17.965 ( -0.711 -0.792 -3.339) 3.505 18.743 ( -4.104 -4.152 1.426) 6.010 ======================= Grid point 324 (173/294) ======================= q-point: ( 0.42 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 10.585 8.153 1.010) 13.399 1.641 ( 1.324 18.297 15.800) 24.211 1.987 ( 5.529 -1.925 11.056) 12.510 2.356 ( 1.937 -10.119 -3.844) 10.997 2.814 ( -2.397 -12.149 -4.474) 13.167 3.332 ( -16.243 -1.344 -11.925) 20.195 3.721 ( -3.228 -0.759 -7.078) 7.816 4.080 ( -2.649 -0.106 2.544) 3.675 5.141 ( -2.601 -1.295 -8.082) 8.589 6.367 ( 2.019 -0.252 3.815) 4.323 6.718 ( 3.923 2.513 -0.407) 4.676 6.976 ( 1.480 0.482 0.164) 1.566 7.409 ( -1.300 0.455 7.348) 7.476 7.629 ( 4.285 2.698 1.479) 5.276 7.862 ( 8.740 2.216 6.838) 11.317 8.911 ( -6.443 -5.334 -1.020) 8.426 9.110 ( -5.763 0.543 -9.068) 10.758 9.614 ( 1.380 0.707 -0.673) 1.691 16.585 ( -0.394 2.056 -2.651) 3.378 16.969 ( -7.749 -2.600 7.313) 10.967 17.246 ( 6.823 2.585 -4.546) 8.597 17.513 ( 2.492 1.360 1.829) 3.377 17.917 ( -1.226 -1.483 -3.762) 4.226 18.635 ( -4.140 -4.073 -1.857) 6.098 ======================= Grid point 325 (174/294) ======================= q-point: ( 0.50 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( 10.553 9.427 -3.383) 14.549 1.809 ( 0.515 0.316 1.411) 1.535 2.036 ( -4.500 5.809 6.439) 9.770 2.304 ( 3.286 -10.032 -2.613) 10.875 2.747 ( 2.045 -3.791 6.143) 7.503 3.048 ( -10.309 -0.183 -3.889) 11.020 3.606 ( -4.451 -3.483 -2.455) 6.162 4.018 ( -5.473 -1.882 3.946) 7.005 5.070 ( 0.210 1.086 -10.091) 10.151 6.419 ( 1.839 -0.894 4.245) 4.712 6.786 ( 4.179 0.848 -3.637) 5.605 7.012 ( 1.725 1.459 -2.277) 3.207 7.438 ( 0.243 1.120 4.052) 4.211 7.710 ( 3.242 0.046 -0.271) 3.254 8.014 ( 3.124 4.830 -0.829) 5.812 8.767 ( -5.028 -5.905 2.314) 8.093 9.007 ( -2.948 1.520 -2.331) 4.054 9.627 ( -0.189 -0.206 1.179) 1.212 16.614 ( 1.881 2.885 0.122) 3.447 16.876 ( -6.291 -1.816 7.570) 10.009 17.333 ( 4.546 1.176 -2.979) 5.561 17.561 ( 1.096 0.318 0.593) 1.286 17.864 ( -0.570 -1.497 -3.890) 4.207 18.518 ( -3.375 -2.663 -5.894) 7.295 ======================= Grid point 326 (175/294) ======================= q-point: ( 0.58 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( 4.040 4.554 -5.081) 7.930 1.781 ( 4.612 -7.002 -9.706) 12.826 1.950 ( -2.376 -6.529 -1.126) 7.038 2.311 ( -3.425 6.364 1.324) 7.348 2.770 ( -3.565 8.264 4.630) 10.121 2.976 ( -2.927 -4.171 10.597) 11.758 3.533 ( 1.658 -5.185 5.310) 7.605 3.937 ( -4.065 -1.506 2.061) 4.800 5.045 ( 1.697 2.673 -10.497) 10.965 6.452 ( 0.784 -1.966 4.666) 5.124 6.828 ( 4.221 -0.483 -6.978) 8.170 7.012 ( -0.385 -0.560 -3.517) 3.582 7.485 ( 1.369 2.103 1.336) 2.843 7.715 ( -1.626 0.649 -4.461) 4.793 8.053 ( 0.554 4.220 -7.466) 8.594 8.656 ( -5.301 -4.617 5.436) 8.886 9.044 ( 4.058 1.456 6.334) 7.662 9.619 ( -1.531 -0.347 2.093) 2.616 16.694 ( 2.968 3.389 2.850) 5.330 16.817 ( -4.518 -1.372 7.772) 9.094 17.387 ( 3.013 0.389 -1.875) 3.570 17.552 ( -1.044 -2.223 -0.606) 2.530 17.836 ( 0.962 -0.198 -3.637) 3.768 18.417 ( -1.721 -0.421 -9.359) 9.525 ======================= Grid point 327 (176/294) ======================= q-point: (-0.33 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -4.616 -13.346 -10.212) 17.427 1.783 ( 9.314 -0.979 -10.015) 13.711 1.877 ( -8.903 4.089 -7.605) 12.403 2.346 ( 5.204 2.846 3.407) 6.840 2.826 ( -10.302 -2.980 18.893) 21.725 2.947 ( -0.481 9.805 4.451) 10.779 3.639 ( 9.870 -3.709 8.697) 13.668 3.896 ( -0.847 0.102 0.676) 1.088 5.051 ( 2.453 3.615 -9.796) 10.726 6.462 ( -0.201 -2.548 4.546) 5.215 6.822 ( 2.941 -2.582 -11.732) 12.368 6.957 ( -2.691 -1.628 -1.492) 3.481 7.492 ( -2.668 -1.697 -1.791) 3.634 7.651 ( -3.454 5.397 -6.756) 9.312 8.049 ( 1.631 0.709 -8.374) 8.561 8.590 ( -3.747 -1.258 8.688) 9.544 9.203 ( 7.737 0.851 8.749) 11.711 9.598 ( -2.405 0.249 2.101) 3.203 16.770 ( -3.278 4.041 5.280) 7.413 16.819 ( 3.187 -1.779 7.632) 8.460 17.419 ( 1.762 0.147 -1.253) 2.167 17.486 ( -2.080 -4.268 -2.242) 5.250 17.850 ( 2.465 1.290 -3.213) 4.250 18.352 ( 0.180 1.560 -10.928) 11.040 ======================= Grid point 328 (177/294) ======================= q-point: (-0.25 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.147 ( -4.837 -17.485 -11.249) 21.346 1.607 ( -19.867 5.999 -14.804) 25.492 1.932 ( 11.770 2.111 -3.922) 12.584 2.515 ( 3.912 -6.836 11.494) 13.934 2.693 ( -4.951 -0.396 12.135) 13.112 3.149 ( 5.079 14.238 5.037) 15.934 3.821 ( 9.027 -1.373 4.866) 10.346 3.923 ( 2.516 0.951 2.799) 3.882 5.080 ( 3.056 4.399 -8.662) 10.184 6.453 ( -1.043 -2.377 4.276) 5.002 6.736 ( 0.133 -4.188 -14.458) 15.053 6.895 ( -3.290 -0.778 0.539) 3.423 7.359 ( -5.400 -4.834 -5.375) 9.023 7.625 ( -3.684 5.118 -4.006) 7.471 8.014 ( -1.152 -1.857 -3.794) 4.378 8.622 ( 1.787 1.771 7.032) 7.469 9.385 ( 7.883 0.635 6.733) 10.386 9.574 ( -2.580 1.241 1.719) 3.340 16.778 ( -2.754 2.812 6.395) 7.510 16.912 ( 3.075 -0.465 7.687) 8.292 17.389 ( -2.143 -4.770 -3.937) 6.546 17.431 ( 0.324 0.241 -1.752) 1.797 17.901 ( 3.849 1.819 -2.459) 4.916 18.328 ( 1.888 2.593 -10.078) 10.576 ======================= Grid point 329 (178/294) ======================= q-point: (-0.17 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( -4.758 -16.950 -6.406) 18.734 1.218 ( -24.216 6.656 -14.285) 28.892 2.059 ( -1.672 -5.416 6.169) 8.378 2.467 ( 2.888 -4.082 10.276) 11.428 2.863 ( 10.428 3.980 1.253) 11.231 3.420 ( 9.654 12.939 2.586) 16.349 3.927 ( 3.377 0.782 0.492) 3.501 4.021 ( 4.858 -0.299 4.191) 6.423 5.133 ( 3.583 5.256 -7.654) 9.952 6.435 ( -1.975 -1.663 4.648) 5.317 6.608 ( -1.387 -3.685 -11.981) 12.611 6.840 ( -3.061 0.002 0.007) 3.061 7.203 ( -2.805 -7.096 -4.980) 9.112 7.566 ( -6.386 3.787 -1.818) 7.644 7.933 ( -4.718 -4.773 2.601) 7.198 8.746 ( 6.361 3.641 2.520) 7.751 9.514 ( 3.068 0.078 -0.775) 3.165 9.581 ( 1.134 2.615 4.554) 5.373 16.815 ( -0.718 3.397 6.624) 7.478 16.989 ( 1.365 -0.044 7.459) 7.583 17.288 ( -1.643 -4.616 -4.972) 6.981 17.407 ( -1.682 0.097 -4.241) 4.563 17.970 ( 3.735 1.447 -1.603) 4.314 18.352 ( 4.082 2.703 -6.468) 8.112 ======================= Grid point 334 (179/294) ======================= q-point: ( 0.25 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.791 ( -2.811 -8.029 19.768) 21.520 1.066 ( 8.091 0.722 21.575) 23.053 1.567 ( -3.180 17.562 25.049) 30.757 2.775 ( -2.856 -6.205 -16.512) 17.869 3.048 ( -0.659 3.553 -14.817) 15.251 3.798 ( 0.255 -4.303 -7.057) 8.269 3.910 ( 2.682 1.658 -4.476) 5.475 4.037 ( -0.694 -5.477 -15.254) 16.222 5.377 ( -0.160 -6.433 -4.818) 8.039 6.364 ( -1.394 0.490 3.775) 4.054 6.462 ( 1.649 4.123 4.969) 6.664 7.148 ( -6.134 -8.250 10.684) 14.827 7.209 ( 7.058 -4.846 9.063) 12.468 7.428 ( 0.673 0.650 1.493) 1.762 7.560 ( -2.583 13.498 10.130) 17.073 9.188 ( -1.805 -7.909 -5.647) 9.884 9.348 ( 2.288 0.039 -6.217) 6.625 9.495 ( -0.000 5.812 -7.610) 9.576 16.741 ( 2.570 2.857 -7.070) 8.047 16.849 ( -2.040 5.150 -5.360) 7.708 17.320 ( 5.089 -4.529 5.043) 8.476 17.338 ( -4.673 -1.728 4.960) 7.031 17.976 ( -0.129 0.370 -3.227) 3.251 18.832 ( -0.628 -5.785 2.646) 6.392 ======================= Grid point 335 (180/294) ======================= q-point: ( 0.33 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.851 ( 4.211 -0.901 13.553) 14.221 1.383 ( 13.636 0.169 19.603) 23.879 1.838 ( -0.803 17.186 22.212) 28.096 2.517 ( -8.564 -5.431 -13.714) 17.056 2.933 ( -3.339 -6.632 -11.888) 14.016 3.738 ( 1.504 -3.275 -9.782) 10.425 3.794 ( -9.975 -1.142 -12.259) 15.846 4.012 ( 5.888 2.393 -5.078) 8.135 5.250 ( -3.059 -7.714 -5.369) 9.884 6.359 ( -1.645 0.872 4.276) 4.664 6.590 ( 4.288 4.195 3.579) 6.985 7.025 ( -5.351 -5.059 6.981) 10.146 7.345 ( 7.933 -9.885 12.407) 17.736 7.476 ( 3.129 2.305 -0.182) 3.890 7.690 ( -0.822 10.566 7.448) 12.954 9.052 ( -2.485 -6.761 -3.673) 8.086 9.311 ( -4.074 2.220 -6.794) 8.228 9.527 ( 3.051 4.080 -6.640) 8.369 16.689 ( -5.515 4.888 -5.148) 8.990 16.957 ( 9.709 4.597 -6.798) 12.713 17.235 ( -7.399 -3.500 6.491) 10.447 17.399 ( 4.526 -2.081 3.426) 6.046 17.950 ( -0.709 -0.651 -3.690) 3.814 18.750 ( -2.733 -8.033 2.295) 8.790 ======================= Grid point 336 (181/294) ======================= q-point: ( 0.42 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( 8.689 4.933 5.840) 11.573 1.681 ( 10.367 -1.512 12.718) 16.477 2.056 ( 0.687 2.717 9.274) 9.688 2.321 ( -6.465 5.949 -1.495) 8.912 2.737 ( -3.066 -9.301 -3.389) 10.363 3.486 ( -13.260 -2.291 -13.186) 18.839 3.701 ( -0.758 -0.545 -7.942) 7.997 4.094 ( 2.763 2.048 -1.491) 3.749 5.097 ( -2.382 -6.581 -7.232) 10.064 6.383 ( 0.001 1.393 4.633) 4.838 6.686 ( 2.200 1.514 0.697) 2.760 6.976 ( -0.717 -1.420 3.714) 4.040 7.406 ( 3.434 -8.532 8.610) 12.598 7.562 ( 4.960 0.960 0.133) 5.054 7.832 ( 4.317 5.905 4.787) 8.742 8.936 ( -3.982 -4.817 -0.774) 6.297 9.203 ( -7.261 4.716 -7.142) 11.224 9.580 ( 3.053 1.924 -3.122) 4.772 16.637 ( -3.545 5.175 -2.672) 6.819 17.106 ( 1.997 2.387 -3.070) 4.371 17.128 ( -1.005 -1.192 4.073) 4.361 17.470 ( 4.103 -1.063 1.868) 4.632 17.897 ( -1.275 -2.138 -4.213) 4.894 18.629 ( -3.249 -8.446 -0.010) 9.049 ======================= Grid point 337 (182/294) ======================= q-point: ( 0.50 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( 9.869 7.257 0.011) 12.250 1.762 ( 0.064 -5.580 -1.048) 5.678 1.989 ( 0.765 -16.258 -3.375) 16.623 2.405 ( -2.546 15.113 7.772) 17.184 2.723 ( 3.284 0.523 11.791) 12.251 3.192 ( -12.093 -0.204 -10.119) 15.770 3.623 ( -3.024 -1.383 -4.759) 5.806 4.099 ( -3.205 -1.521 3.357) 4.884 4.986 ( 1.018 -3.480 -10.168) 10.795 6.430 ( 0.530 1.366 4.871) 5.087 6.705 ( 1.942 -1.503 -3.834) 4.553 6.996 ( 1.062 0.352 1.006) 1.505 7.423 ( 2.746 -4.744 3.929) 6.744 7.642 ( 4.244 -0.110 -0.234) 4.252 7.971 ( 5.451 1.997 0.381) 5.818 8.818 ( -5.526 -3.801 1.315) 6.835 9.113 ( -6.322 6.675 -2.589) 9.551 9.621 ( 1.661 0.570 -0.193) 1.766 16.644 ( -0.746 5.217 0.116) 5.271 17.020 ( -7.287 -1.091 7.646) 10.619 17.237 ( 6.529 2.018 -4.592) 8.233 17.527 ( 2.849 -0.801 0.095) 2.961 17.829 ( -0.714 -3.039 -4.162) 5.203 18.494 ( -2.876 -7.110 -3.761) 8.543 ======================= Grid point 338 (183/294) ======================= q-point: ( 0.58 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( 8.594 5.690 -4.995) 11.454 1.628 ( -4.042 -11.356 -7.388) 14.138 1.843 ( 2.764 -11.497 0.968) 11.864 2.498 ( -6.148 10.509 -1.389) 12.254 2.889 ( 2.980 5.068 12.708) 14.002 3.030 ( -3.251 0.391 -0.103) 3.276 3.545 ( -3.592 -0.776 2.946) 4.710 4.018 ( -5.894 -3.386 5.303) 8.621 4.947 ( 3.743 -0.483 -11.332) 11.944 6.470 ( -0.238 0.327 4.834) 4.851 6.691 ( 3.469 -3.031 -9.061) 10.165 7.004 ( -0.211 -1.061 -0.099) 1.086 7.463 ( 3.289 -0.547 0.672) 3.401 7.691 ( 2.397 0.038 -1.540) 2.850 8.025 ( 1.417 1.157 -6.727) 6.971 8.717 ( -4.072 -4.174 4.695) 7.486 9.106 ( -2.692 6.906 3.783) 8.322 9.641 ( 0.068 -0.105 1.724) 1.728 16.708 ( 1.696 4.450 2.989) 5.623 16.949 ( -6.346 0.279 7.977) 10.197 17.317 ( 4.576 0.942 -3.360) 5.754 17.530 ( -0.137 -3.148 -1.632) 3.549 17.789 ( 1.391 -1.408 -3.296) 3.844 18.370 ( -1.454 -4.415 -7.762) 9.047 ======================= Grid point 339 (184/294) ======================= q-point: (-0.33 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( -7.307 -13.746 -6.920) 17.036 1.592 ( 7.806 1.528 -7.151) 10.695 1.890 ( 5.718 -1.182 0.769) 5.889 2.407 ( -8.180 6.125 -6.505) 12.114 3.011 ( -3.421 -2.838 6.191) 7.622 3.032 ( 1.759 3.380 9.209) 9.966 3.569 ( 2.056 1.772 10.346) 10.696 3.944 ( -3.503 -0.407 4.457) 5.683 4.959 ( 4.616 1.334 -10.207) 11.281 6.481 ( -0.720 -0.915 2.949) 3.171 6.655 ( 3.330 -4.100 -11.216) 12.398 6.975 ( -1.434 -1.705 0.088) 2.229 7.493 ( 0.011 -0.782 -2.048) 2.192 7.708 ( -0.362 4.167 -3.935) 5.743 7.987 ( -0.038 1.003 -9.860) 9.911 8.664 ( -2.258 -4.212 8.046) 9.359 9.191 ( 2.091 4.771 7.223) 8.906 9.642 ( -1.205 -0.285 2.420) 2.718 16.801 ( 2.696 0.659 5.948) 6.564 16.916 ( -4.998 3.935 7.372) 9.737 17.369 ( 3.314 0.275 -2.459) 4.136 17.453 ( -1.785 -5.879 -2.847) 6.772 17.804 ( 2.334 1.144 -2.967) 3.944 18.284 ( 0.701 -1.290 -10.219) 10.324 ======================= Grid point 340 (185/294) ======================= q-point: (-0.25 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.086 ( -8.741 -10.606 -2.885) 14.043 1.717 ( 10.446 2.276 -7.145) 12.858 1.861 ( -9.735 5.041 -9.964) 14.814 2.396 ( 6.075 -1.365 2.788) 6.822 2.896 ( -11.272 -6.846 15.361) 20.245 3.146 ( 6.969 1.768 -0.637) 7.218 3.731 ( 6.853 2.702 8.683) 11.387 3.953 ( -1.037 3.730 4.543) 5.969 5.002 ( 4.782 2.733 -8.203) 9.880 6.472 ( 0.046 -0.757 -0.228) 0.792 6.594 ( 1.056 -4.223 -8.796) 9.814 6.931 ( -2.117 -1.623 0.104) 2.670 7.400 ( -6.345 -2.252 -5.262) 8.545 7.715 ( -2.912 7.180 -4.493) 8.956 7.960 ( 2.175 -0.194 -7.122) 7.449 8.655 ( -0.298 -3.114 8.749) 9.292 9.327 ( 5.052 2.282 6.848) 8.811 9.627 ( -1.765 -0.288 2.053) 2.723 16.840 ( -0.010 -4.172 8.017) 9.038 16.971 ( -1.120 8.220 6.535) 10.560 17.338 ( -1.566 -7.421 -3.597) 8.394 17.407 ( 1.757 0.687 -2.536) 3.161 17.845 ( 3.016 2.262 -3.547) 5.177 18.253 ( 2.486 1.361 -9.750) 10.154 ======================= Grid point 341 (186/294) ======================= q-point: (-0.17 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.870 ( -9.519 -4.027 5.186) 11.564 1.572 ( -20.135 7.711 -13.817) 25.608 1.927 ( 13.027 1.718 -4.050) 13.749 2.490 ( 2.232 -8.815 10.824) 14.136 2.764 ( -2.748 -4.279 6.256) 8.062 3.311 ( 12.840 1.090 -1.164) 12.939 3.900 ( 5.324 2.897 3.758) 7.132 4.008 ( 0.273 3.133 4.176) 5.228 5.070 ( 4.695 4.169 -6.621) 9.125 6.480 ( 0.696 2.059 -0.475) 2.225 6.512 ( -1.218 -3.811 -5.866) 7.101 6.880 ( -2.287 -1.509 0.279) 2.754 7.225 ( -7.927 -1.805 -5.706) 9.933 7.685 ( -5.075 5.258 -3.397) 8.059 7.947 ( -0.362 -1.847 -1.991) 2.740 8.702 ( 3.467 -1.092 5.928) 6.954 9.454 ( 4.483 0.368 3.423) 5.653 9.612 ( -0.514 -0.037 1.648) 1.727 16.850 ( 0.760 -3.982 7.989) 8.959 17.070 ( -1.006 7.898 6.797) 10.469 17.219 ( -1.185 -7.732 -4.959) 9.262 17.410 ( -0.477 0.938 -3.844) 3.986 17.904 ( 4.203 2.013 -3.567) 5.869 18.278 ( 3.719 3.230 -6.624) 8.255 ======================= Grid point 346 (187/294) ======================= q-point: ( 0.25 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.892 ( -3.284 -2.879 16.653) 17.216 1.147 ( -6.102 -6.006 21.673) 23.302 1.922 ( -3.124 16.962 18.913) 25.596 2.613 ( 5.734 -0.813 -12.586) 13.855 3.031 ( -1.620 2.046 -13.817) 14.061 3.617 ( 6.425 -10.845 -13.233) 18.276 3.795 ( 5.375 -0.573 -7.167) 8.977 4.008 ( -4.492 0.851 -5.256) 6.966 5.259 ( 2.842 -7.207 -4.845) 9.137 6.387 ( 1.957 1.964 4.285) 5.103 6.551 ( -4.508 2.470 3.517) 6.228 7.066 ( 6.101 -4.375 7.442) 10.571 7.308 ( -8.777 -6.275 10.716) 15.207 7.443 ( -1.558 0.318 1.056) 1.909 7.764 ( -1.969 10.837 6.982) 13.041 9.081 ( 1.595 -7.815 -4.970) 9.398 9.248 ( 5.598 1.575 -7.894) 9.805 9.534 ( -2.698 4.185 -4.526) 6.729 16.639 ( 5.354 2.195 -4.995) 7.644 16.984 ( -8.534 5.748 -6.128) 11.976 17.202 ( 6.648 -5.123 6.338) 10.517 17.418 ( -3.602 -0.916 3.766) 5.292 17.956 ( 0.479 -0.339 -3.569) 3.617 18.775 ( 1.936 -6.617 1.463) 7.048 ======================= Grid point 347 (188/294) ======================= q-point: ( 0.33 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.895 ( -1.446 -3.577 17.733) 18.148 1.290 ( 9.381 -2.175 20.339) 22.503 2.107 ( -2.055 9.737 8.893) 13.346 2.562 ( -4.851 3.885 -3.834) 7.302 2.883 ( -5.504 -3.601 -13.141) 14.696 3.570 ( 6.152 -6.171 -11.186) 14.179 3.869 ( -1.490 1.050 -9.252) 9.430 3.886 ( 1.902 2.449 -6.644) 7.332 5.169 ( -0.689 -9.374 -4.538) 10.437 6.424 ( -1.733 0.864 3.774) 4.242 6.593 ( 2.525 3.566 4.541) 6.302 7.107 ( -3.003 -9.695 10.802) 14.822 7.221 ( 1.478 -4.356 8.496) 9.661 7.457 ( 1.549 1.328 0.232) 2.054 7.825 ( -2.320 5.275 1.822) 6.044 9.006 ( -0.479 -4.414 -1.660) 4.740 9.316 ( 3.188 2.808 -4.463) 6.162 9.508 ( -1.308 4.915 -7.456) 9.025 16.747 ( 5.104 5.508 -5.791) 9.483 16.888 ( -4.142 5.493 -5.214) 8.632 17.279 ( 3.706 -5.435 5.526) 8.591 17.368 ( -3.016 -0.896 4.127) 5.189 17.928 ( -0.347 -1.381 -4.194) 4.429 18.709 ( -1.089 -10.157 1.909) 10.392 ======================= Grid point 348 (189/294) ======================= q-point: ( 0.42 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( 5.007 2.436 11.682) 12.941 1.550 ( 11.374 -4.185 16.249) 20.271 2.052 ( -4.812 -7.169 -7.792) 11.630 2.578 ( -7.917 10.544 2.957) 13.513 2.711 ( -1.771 0.250 1.764) 2.512 3.523 ( -1.631 -3.410 -10.426) 11.090 3.702 ( -6.385 1.842 -8.618) 10.882 4.010 ( 7.954 3.860 -6.471) 10.957 5.024 ( -2.440 -9.619 -4.736) 10.996 6.431 ( -0.850 1.056 4.505) 4.704 6.680 ( 1.459 0.975 2.495) 3.050 7.013 ( -3.531 -5.148 6.645) 9.117 7.278 ( 5.345 -9.643 9.203) 14.362 7.512 ( 3.214 2.265 -1.074) 4.076 7.843 ( 1.059 1.779 -0.971) 2.286 8.956 ( -2.449 -2.013 1.189) 3.386 9.324 ( -4.340 6.098 -3.546) 8.282 9.521 ( 3.221 3.090 -6.000) 7.478 16.755 ( -5.385 6.932 -2.955) 9.262 16.964 ( 8.847 4.387 -6.528) 11.838 17.246 ( -5.117 -2.915 6.075) 8.461 17.398 ( 3.981 -1.695 3.132) 5.341 17.868 ( -1.235 -3.023 -4.825) 5.826 18.585 ( -2.378 -11.457 1.141) 11.757 ======================= Grid point 349 (190/294) ======================= q-point: ( 0.50 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( 7.209 5.556 5.489) 10.628 1.695 ( 3.863 -7.071 5.724) 9.883 1.828 ( -3.957 -12.725 -8.151) 15.621 2.517 ( 0.318 -0.601 3.011) 3.087 2.851 ( -0.912 13.064 9.955) 16.450 3.318 ( -11.528 0.162 -10.916) 15.877 3.638 ( -1.441 2.478 -2.421) 3.752 4.108 ( 3.167 1.500 -1.911) 3.991 4.878 ( -0.750 -7.736 -6.768) 10.307 6.467 ( 0.364 1.067 4.972) 5.098 6.664 ( -1.567 -3.596 -1.440) 4.179 6.989 ( 0.389 -1.599 2.437) 2.940 7.318 ( 5.050 -7.485 5.494) 10.570 7.581 ( 3.615 1.527 -1.283) 4.129 7.892 ( 4.641 -0.635 -0.765) 4.746 8.885 ( -4.985 -1.823 0.656) 5.349 9.283 ( -6.591 8.727 -1.630) 11.057 9.580 ( 3.646 1.426 -1.968) 4.381 16.734 ( -3.476 6.436 -0.358) 7.323 17.107 ( 7.594 3.620 -5.862) 10.253 17.170 ( -5.800 -1.145 6.696) 8.932 17.464 ( 3.800 -1.265 1.362) 4.231 17.784 ( -1.100 -4.341 -4.507) 6.354 18.440 ( -2.499 -10.590 -1.406) 10.971 ======================= Grid point 350 (191/294) ======================= q-point: ( 0.58 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( 5.462 3.981 -1.319) 6.886 1.585 ( -5.617 -9.549 -4.697) 12.033 1.690 ( 3.911 -10.034 1.901) 10.936 2.604 ( 2.524 2.858 3.910) 5.462 2.959 ( -0.306 4.548 1.047) 4.677 3.100 ( -8.280 1.485 -5.560) 10.084 3.661 ( -3.041 6.850 7.221) 10.407 4.104 ( -3.700 -2.410 4.467) 6.281 4.800 ( 3.891 -3.650 -9.763) 11.126 6.493 ( -0.126 -2.793 1.847) 3.350 6.596 ( -0.157 -1.210 -3.815) 4.006 6.990 ( 0.298 -2.007 0.602) 2.117 7.379 ( 5.540 -2.237 1.429) 6.143 7.639 ( 3.160 0.688 -1.388) 3.519 7.950 ( 4.054 -1.603 -2.240) 4.901 8.779 ( -5.484 -2.330 0.918) 6.028 9.267 ( -5.302 8.607 1.731) 10.256 9.632 ( 1.991 0.301 0.791) 2.163 16.759 ( -0.768 4.914 2.056) 5.382 17.104 ( -6.069 1.468 6.783) 9.219 17.221 ( 5.949 1.682 -4.105) 7.421 17.486 ( 0.468 -3.099 -1.500) 3.475 17.730 ( 1.698 -2.357 -2.349) 3.736 18.299 ( -1.581 -7.971 -4.967) 9.524 ======================= Grid point 351 (192/294) ======================= q-point: ( 0.67 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( -5.423 -6.866 -3.947) 9.599 1.482 ( 2.806 -1.302 -2.882) 4.228 1.753 ( 8.525 -3.320 3.781) 9.899 2.581 ( -9.012 6.194 -7.596) 13.314 2.955 ( 2.441 -3.186 -7.256) 8.292 3.073 ( 1.383 -1.010 9.554) 9.706 3.718 ( -5.379 5.007 13.435) 15.313 4.041 ( -4.325 -0.042 6.116) 7.491 4.816 ( 6.499 -0.178 -9.468) 11.485 6.433 ( 1.088 -5.052 -7.352) 8.986 6.600 ( -0.742 2.019 1.600) 2.681 6.969 ( -0.330 -2.550 -0.159) 2.576 7.450 ( 3.429 -0.135 -1.681) 3.821 7.689 ( 3.293 1.873 -1.984) 4.277 7.952 ( 0.096 -0.108 -5.944) 5.946 8.694 ( -2.841 -4.003 4.367) 6.570 9.291 ( -2.722 6.739 4.096) 8.342 9.656 ( 0.265 -0.900 1.892) 2.112 16.810 ( 0.752 1.066 4.193) 4.391 17.081 ( -4.849 4.824 6.831) 9.666 17.292 ( 4.253 0.025 -2.971) 5.189 17.410 ( -1.942 -5.730 -3.196) 6.843 17.762 ( 2.906 1.445 -1.184) 3.455 18.195 ( 0.636 -4.164 -7.759) 8.829 ======================= Grid point 352 (193/294) ======================= q-point: (-0.25 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.175 ( -8.177 -1.879 3.055) 8.929 1.537 ( 7.853 0.174 -5.543) 9.613 1.880 ( 5.618 0.401 -1.531) 5.837 2.423 ( -8.813 3.588 -6.147) 11.329 2.944 ( 6.546 -4.668 -6.170) 10.135 3.098 ( -4.763 -6.394 13.472) 15.655 3.750 ( -0.379 0.815 10.721) 10.759 4.050 ( -1.929 4.306 3.762) 6.035 4.887 ( 6.660 2.079 -6.825) 9.760 6.387 ( 2.882 -0.954 -8.671) 9.187 6.601 ( -2.749 1.201 2.896) 4.170 6.932 ( -0.790 -2.664 -0.854) 2.907 7.437 ( -2.751 -0.828 -3.401) 4.451 7.767 ( 3.144 5.774 -3.193) 7.308 7.899 ( -1.343 0.643 -7.628) 7.772 8.662 ( -0.084 -5.521 7.483) 9.299 9.351 ( 0.363 4.264 5.153) 6.698 9.646 ( -0.825 -2.293 1.409) 2.815 16.836 ( 0.365 -3.590 5.726) 6.768 17.123 ( -2.503 8.377 6.281) 10.766 17.267 ( -1.221 -8.425 -2.790) 8.958 17.364 ( 2.224 1.177 -3.185) 4.059 17.810 ( 1.815 2.436 -2.743) 4.093 18.164 ( 3.294 0.334 -7.398) 8.105 ======================= Grid point 353 (194/294) ======================= q-point: (-0.17 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( -8.981 5.804 10.415) 14.927 1.681 ( 12.147 2.405 -7.119) 14.284 1.841 ( -9.766 5.851 -11.381) 16.098 2.363 ( 3.789 -4.144 1.120) 5.726 2.930 ( -12.869 -8.308 14.132) 20.841 3.054 ( 13.382 -6.493 -1.174) 14.920 3.855 ( 5.063 1.928 4.742) 7.200 4.061 ( -1.279 0.865 -0.548) 1.638 4.986 ( 6.029 3.735 -4.866) 8.601 6.417 ( 3.346 4.765 -6.055) 8.400 6.569 ( -3.735 0.427 3.184) 4.927 6.887 ( -1.064 -2.429 -0.690) 2.740 7.323 ( -7.576 0.259 -4.081) 8.609 7.794 ( -4.725 5.742 -4.654) 8.772 7.890 ( 4.014 0.742 -4.416) 6.014 8.669 ( 2.020 -5.255 7.654) 9.502 9.432 ( 2.125 1.809 4.606) 5.386 9.608 ( -0.507 -3.422 -0.111) 3.461 16.833 ( 0.667 -5.266 6.365) 8.288 17.138 ( -1.715 -8.493 -4.106) 9.588 17.212 ( -1.527 8.700 6.204) 10.794 17.391 ( 1.382 1.177 -3.238) 3.712 17.842 ( 2.623 2.154 -4.869) 5.936 18.216 ( 4.270 4.028 -4.406) 7.340 ======================= Grid point 358 (195/294) ======================= q-point: ( 0.25 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.035 ( -5.768 1.753 9.334) 11.111 1.375 ( -15.140 -9.774 20.254) 27.110 2.105 ( 2.959 4.651 1.812) 5.803 2.539 ( 3.916 11.501 1.844) 12.288 2.953 ( 5.157 2.897 -10.041) 11.654 3.293 ( 9.362 -11.905 -11.476) 19.002 3.685 ( 2.275 -1.499 -7.156) 7.657 4.064 ( -2.881 -0.004 -0.945) 3.032 5.114 ( 3.180 -6.012 -5.715) 8.884 6.408 ( 0.559 2.471 3.768) 4.541 6.663 ( -4.747 1.678 1.305) 5.202 6.998 ( 2.589 -2.115 3.854) 5.102 7.400 ( -2.207 -4.380 7.180) 8.695 7.537 ( -8.181 -0.446 3.641) 8.966 7.891 ( -1.668 4.369 0.755) 4.737 8.962 ( 3.440 -4.041 -0.534) 5.334 9.118 ( 6.457 1.750 -7.643) 10.157 9.592 ( -2.396 2.671 -2.117) 4.166 16.578 ( 2.017 2.389 -2.416) 3.951 17.050 ( 4.087 -3.733 4.165) 6.927 17.173 ( -5.140 4.347 -2.457) 7.166 17.484 ( -3.145 -0.263 2.307) 3.909 17.913 ( 1.176 -1.167 -4.038) 4.365 18.664 ( 3.796 -6.960 -1.198) 8.018 ======================= Grid point 359 (196/294) ======================= q-point: ( 0.33 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.024 ( -4.944 -2.455 16.188) 17.103 1.291 ( 0.037 -4.225 19.323) 19.779 2.139 ( 0.762 -2.632 -7.049) 7.563 2.708 ( 0.551 11.898 6.287) 13.468 2.889 ( -6.203 -0.888 -10.463) 12.196 3.317 ( 10.582 -4.223 -8.597) 14.273 3.724 ( 7.206 1.702 -6.888) 10.113 3.974 ( -6.926 1.708 -5.300) 8.887 5.054 ( 1.188 -8.650 -4.155) 9.670 6.457 ( 0.536 -0.258 3.793) 3.840 6.636 ( -1.579 2.504 2.966) 4.191 7.038 ( 3.253 -7.609 7.033) 10.860 7.330 ( -7.321 -3.855 9.383) 12.510 7.463 ( -1.775 1.025 0.561) 2.125 7.864 ( -1.207 -1.379 -5.005) 5.330 8.979 ( 0.875 -0.668 2.453) 2.689 9.226 ( 7.343 4.236 -5.331) 10.014 9.561 ( -3.157 4.182 -4.315) 6.788 16.664 ( 5.762 5.106 -2.905) 8.229 17.024 ( -6.610 5.127 -4.478) 9.489 17.188 ( 4.252 -3.533 5.403) 7.730 17.439 ( -3.492 -0.771 2.842) 4.568 17.885 ( 0.351 -2.388 -4.552) 5.153 18.614 ( 1.126 -11.216 0.042) 11.272 ======================= Grid point 360 (197/294) ======================= q-point: ( 0.42 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( 0.172 0.497 15.243) 15.252 1.441 ( 7.952 -4.342 16.135) 18.505 2.006 ( -4.121 -7.797 -9.621) 13.052 2.656 ( -7.206 -5.885 -8.880) 12.862 2.876 ( -0.262 11.019 5.978) 12.539 3.434 ( 5.991 4.607 -1.485) 7.702 3.806 ( -6.808 3.018 -8.774) 11.508 3.859 ( 6.824 3.695 -8.074) 11.199 4.944 ( -1.489 -9.747 -2.987) 10.303 6.463 ( -0.094 -2.502 4.355) 5.023 6.679 ( 1.133 0.543 2.727) 3.003 7.018 ( -0.173 -9.912 6.834) 12.041 7.250 ( -3.960 -2.874 8.486) 9.796 7.483 ( 1.935 1.824 -0.977) 2.833 7.807 ( 0.863 -2.309 -5.289) 5.835 8.989 ( -1.391 -0.306 2.380) 2.774 9.362 ( 5.605 5.755 -1.657) 8.203 9.519 ( -3.478 5.087 -6.068) 8.648 16.810 ( 7.038 6.291 -2.875) 9.868 16.938 ( -6.419 6.115 -4.771) 10.068 17.253 ( 3.455 -3.897 5.179) 7.345 17.399 ( -2.405 -0.208 3.262) 4.059 17.825 ( -0.828 -3.857 -4.939) 6.321 18.502 ( -0.799 -13.264 0.764) 13.310 ======================= Grid point 361 (198/294) ======================= q-point: ( 0.50 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.197 ( 4.559 3.075 10.732) 12.059 1.569 ( 5.114 -8.573 6.603) 11.968 1.792 ( -6.466 -7.682 -6.136) 11.767 2.501 ( -0.948 -3.846 0.026) 3.962 2.966 ( 0.768 3.599 -2.059) 4.217 3.491 ( -10.500 8.805 -4.178) 14.326 3.700 ( -1.150 6.670 1.286) 6.890 4.001 ( 9.118 3.902 -7.794) 12.614 4.798 ( -2.734 -9.800 -2.472) 10.470 6.472 ( 1.483 -4.425 5.062) 6.885 6.662 ( -2.443 -3.614 0.326) 4.374 6.976 ( 0.236 -3.774 2.973) 4.810 7.240 ( 0.964 -3.756 6.667) 7.713 7.534 ( 3.003 1.664 -1.570) 3.775 7.804 ( 3.698 -2.053 -1.899) 4.637 8.947 ( -3.884 -0.866 0.065) 3.980 9.455 ( -4.884 8.494 -0.175) 9.800 9.511 ( 4.753 2.513 -4.041) 6.726 16.866 ( -5.605 6.511 -1.131) 8.665 16.982 ( 8.017 4.864 -4.554) 10.424 17.263 ( -2.014 -1.454 3.949) 4.666 17.415 ( 2.012 -0.245 3.295) 3.869 17.735 ( -1.441 -5.059 -4.218) 6.743 18.359 ( -1.599 -12.888 -0.080) 12.987 ======================= Grid point 362 (199/294) ======================= q-point: ( 0.58 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( 3.799 1.950 5.409) 6.892 1.516 ( -0.082 -10.184 -2.181) 10.415 1.621 ( -3.782 -5.300 0.481) 6.529 2.559 ( 6.267 -0.698 6.301) 8.914 2.946 ( -0.210 -1.647 -7.735) 7.912 3.293 ( -13.956 6.455 -8.842) 17.738 3.832 ( -1.068 10.740 10.615) 15.138 4.113 ( 3.983 1.887 -1.847) 4.779 4.668 ( 0.231 -7.558 -4.408) 8.753 6.442 ( -0.492 -9.013 0.693) 9.052 6.614 ( -0.803 1.752 1.168) 2.253 6.967 ( 0.229 -2.292 0.760) 2.425 7.287 ( 4.334 -1.604 3.107) 5.569 7.587 ( 3.071 0.854 -1.661) 3.594 7.852 ( 4.724 -2.529 0.653) 5.398 8.855 ( -5.615 -0.927 -1.576) 5.905 9.433 ( -5.005 7.232 -1.224) 8.880 9.597 ( 3.302 1.476 0.538) 3.657 16.844 ( -3.155 4.600 0.022) 5.578 17.119 ( 6.342 3.115 -2.886) 7.632 17.234 ( -3.692 1.569 3.556) 5.361 17.451 ( 0.255 -1.869 0.749) 2.030 17.668 ( 1.416 -2.955 -1.142) 3.470 18.216 ( -1.434 -10.476 -2.321) 10.825 ======================= Grid point 363 (200/294) ======================= q-point: ( 0.67 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.357 ( -2.470 -1.863 -1.379) 3.387 1.432 ( -0.900 -4.165 0.453) 4.285 1.626 ( 6.152 -2.926 5.478) 8.742 2.658 ( 1.254 0.794 -1.443) 2.070 2.867 ( -1.360 -2.715 -8.606) 9.126 3.133 ( -5.684 4.161 -1.600) 7.223 3.921 ( -4.986 3.403 10.739) 12.320 4.133 ( -2.723 0.135 4.469) 5.235 4.651 ( 6.785 -1.188 -6.701) 9.610 6.346 ( -0.605 -4.570 -3.985) 6.094 6.653 ( -0.010 2.975 3.310) 4.450 6.942 ( -0.248 -3.128 -0.491) 3.176 7.372 ( 5.127 0.491 -0.254) 5.157 7.634 ( 3.376 0.670 -1.922) 3.943 7.899 ( 3.035 -2.105 0.406) 3.716 8.745 ( -5.180 -1.547 -0.542) 5.433 9.422 ( -3.719 5.979 0.477) 7.058 9.642 ( 1.210 -1.104 1.222) 2.044 16.841 ( -1.250 1.201 1.142) 2.076 17.197 ( 2.131 0.436 -0.927) 2.364 17.235 ( -1.128 3.690 2.740) 4.733 17.387 ( -2.971 -3.825 -0.959) 4.938 17.722 ( 4.059 2.166 0.872) 4.683 18.103 ( 0.132 -6.386 -4.522) 7.826 ======================= Grid point 364 (201/294) ======================= q-point: (-0.25 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( -3.208 2.095 1.072) 3.978 1.418 ( 2.363 -0.753 -0.547) 2.540 1.759 ( 8.121 -1.466 4.365) 9.335 2.589 ( -8.555 4.180 -7.732) 12.266 2.756 ( 1.539 -6.330 -7.609) 10.017 3.161 ( 0.532 0.113 6.826) 6.848 3.869 ( -6.860 -3.484 12.014) 14.266 4.106 ( -1.638 -1.101 -1.024) 2.224 4.758 ( 7.978 3.159 -4.290) 9.594 6.321 ( 1.656 3.142 -3.989) 5.341 6.682 ( -2.304 2.454 3.413) 4.794 6.900 ( -0.020 -3.715 -1.730) 4.098 7.433 ( 1.459 0.994 -1.517) 2.328 7.700 ( 5.429 1.880 -3.090) 6.524 7.907 ( -0.525 0.370 -1.921) 2.026 8.664 ( -2.460 -3.672 2.908) 5.291 9.432 ( -1.997 4.533 2.118) 5.387 9.630 ( -0.313 -4.022 0.599) 4.078 16.830 ( -0.463 -2.555 1.863) 3.196 17.193 ( -0.797 -7.433 0.259) 7.480 17.252 ( -0.752 4.889 0.864) 5.021 17.348 ( -0.562 3.165 0.246) 3.224 17.796 ( 1.477 2.333 -1.063) 2.959 18.075 ( 3.724 0.177 -4.025) 5.487 ======================= Grid point 365 (202/294) ======================= q-point: (-0.17 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( -2.332 6.913 4.696) 8.677 1.491 ( 6.913 2.462 -3.194) 8.003 1.871 ( 3.620 1.797 -3.373) 5.264 2.410 ( -10.618 1.900 -4.220) 11.583 2.773 ( 11.217 -7.258 -0.668) 13.377 3.120 ( -8.995 -6.406 10.829) 15.467 3.847 ( 0.353 -0.645 7.141) 7.179 4.033 ( -0.672 -5.722 -6.754) 8.878 4.896 ( 6.841 4.494 -2.712) 8.622 6.412 ( 3.306 10.091 -1.983) 10.802 6.655 ( -4.350 0.395 2.078) 4.837 6.863 ( 0.407 -2.547 -1.276) 2.878 7.413 ( -4.183 1.658 -1.283) 4.678 7.790 ( 4.952 0.453 -4.502) 6.708 7.887 ( -1.908 5.607 -3.290) 6.776 8.630 ( 0.609 -5.983 5.931) 8.447 9.465 ( -0.263 2.832 3.397) 4.430 9.567 ( -0.819 -6.513 -1.066) 6.650 16.805 ( 0.272 -4.591 2.463) 5.217 17.078 ( -2.713 -8.884 -0.139) 9.290 17.319 ( 1.729 5.587 0.044) 5.848 17.379 ( -0.738 3.655 0.918) 3.841 17.808 ( 0.551 1.558 -4.081) 4.403 18.166 ( 5.085 5.568 -1.691) 7.728 ======================= Grid point 370 (203/294) ======================= q-point: ( 0.25 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( -9.154 2.840 3.129) 10.082 1.645 ( -15.430 -9.600 15.282) 23.744 2.024 ( 4.620 -1.188 -3.764) 6.076 2.565 ( 10.652 11.983 -4.414) 16.629 2.801 ( 7.359 -4.498 -8.366) 12.015 3.089 ( 2.719 0.315 5.015) 5.713 3.611 ( 0.943 -0.639 -4.748) 4.882 4.068 ( 1.974 -2.778 3.838) 5.133 4.994 ( 0.825 -3.859 -7.851) 8.787 6.458 ( -0.955 3.135 2.737) 4.270 6.743 ( -3.233 1.651 -1.637) 3.982 6.979 ( -0.486 -1.598 0.805) 1.854 7.422 ( -1.384 -2.733 3.868) 4.934 7.678 ( -5.292 0.277 2.579) 5.894 7.906 ( -2.837 -4.016 -5.567) 7.427 8.883 ( 6.060 -0.475 1.554) 6.274 9.024 ( 2.792 3.838 -0.898) 4.830 9.630 ( -0.831 1.071 -0.182) 1.368 16.591 ( -1.134 3.075 0.275) 3.289 16.961 ( 5.260 -3.965 7.154) 9.725 17.287 ( -4.773 4.374 -3.461) 7.341 17.540 ( -2.531 0.048 0.866) 2.676 17.857 ( 1.079 -1.307 -4.323) 4.643 18.515 ( 4.160 -6.843 -4.877) 9.376 ======================= Grid point 371 (204/294) ======================= q-point: ( 0.33 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( -4.289 0.450 9.444) 10.382 1.437 ( -10.277 -6.956 17.873) 21.759 2.028 ( 2.324 -4.196 -8.527) 9.784 2.731 ( 4.073 1.737 -3.538) 5.668 2.852 ( 6.712 -1.171 -12.338) 14.094 3.177 ( 3.770 6.437 4.177) 8.549 3.631 ( 2.998 3.438 -1.009) 4.671 4.055 ( -3.447 0.246 -0.782) 3.543 4.932 ( 1.604 -6.544 -4.869) 8.313 6.467 ( -1.059 -0.885 1.597) 2.110 6.705 ( -2.603 1.605 0.684) 3.134 6.971 ( 1.428 -5.198 3.475) 6.413 7.398 ( -1.196 -2.462 3.899) 4.764 7.582 ( -8.473 -0.169 5.137) 9.910 7.794 ( 0.017 -5.542 -8.718) 10.330 8.967 ( 3.672 -0.439 1.319) 3.926 9.144 ( 5.143 7.557 -0.534) 9.157 9.620 ( -1.878 2.703 -1.776) 3.740 16.641 ( 2.149 5.433 0.015) 5.843 17.048 ( 4.310 -2.261 5.228) 7.143 17.221 ( -5.640 4.058 -2.967) 7.555 17.498 ( -2.994 -0.372 1.260) 3.270 17.826 ( 0.527 -2.616 -4.554) 5.279 18.466 ( 2.940 -11.286 -2.770) 11.987 ======================= Grid point 372 (205/294) ======================= q-point: ( 0.42 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.167 ( -2.660 -0.509 12.458) 12.750 1.415 ( 0.860 -4.170 15.881) 16.441 1.927 ( -1.281 -7.117 -8.869) 11.444 2.663 ( -5.755 -5.117 -7.698) 10.889 2.869 ( 5.396 -0.889 -5.480) 7.742 3.413 ( 10.407 12.644 0.503) 16.384 3.744 ( 3.884 6.564 1.523) 7.777 3.953 ( -8.517 3.017 -5.650) 10.656 4.856 ( -0.045 -8.142 -2.733) 8.588 6.429 ( 0.363 -7.623 2.862) 8.151 6.698 ( -1.117 1.126 1.036) 1.895 6.959 ( 1.135 -6.138 3.976) 7.401 7.367 ( -4.536 -2.649 7.267) 8.967 7.497 ( -3.656 1.363 1.249) 4.097 7.721 ( 1.777 -3.376 -6.226) 7.302 9.005 ( 0.883 -0.809 0.763) 1.420 9.302 ( 5.999 7.026 -1.550) 9.368 9.602 ( -2.890 4.662 -2.455) 6.009 16.755 ( 4.934 6.518 -0.706) 8.206 17.079 ( -4.554 4.933 -2.404) 7.131 17.190 ( 2.050 -2.154 3.983) 4.971 17.456 ( -2.638 -0.042 1.440) 3.006 17.772 ( -0.506 -3.679 -4.245) 5.640 18.371 ( 1.217 -13.737 -0.738) 13.811 ======================= Grid point 373 (206/294) ======================= q-point: ( 0.50 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 1.688 -0.592 10.553) 10.704 1.485 ( 2.045 -5.443 9.274) 10.946 1.781 ( -3.439 -6.468 -4.758) 8.735 2.490 ( -3.379 -4.490 -2.547) 6.170 2.907 ( 3.391 -1.076 -5.485) 6.538 3.695 ( 4.604 13.261 -5.134) 14.947 3.786 ( -5.065 4.319 -5.721) 8.777 3.882 ( 2.003 7.505 2.425) 8.137 4.744 ( -2.353 -9.234 -0.833) 9.566 6.386 ( 2.744 -11.408 5.016) 12.760 6.677 ( -1.925 -0.963 -0.091) 2.154 6.952 ( 0.794 -2.334 2.501) 3.512 7.296 ( -5.256 -2.913 8.284) 10.234 7.502 ( 1.511 1.791 -1.570) 2.821 7.718 ( 3.228 -1.632 -1.645) 3.974 8.987 ( -1.965 -1.015 -0.737) 2.331 9.434 ( 5.225 4.145 -4.008) 7.781 9.593 ( -3.347 6.469 -0.519) 7.303 16.899 ( 5.757 6.117 -2.821) 8.861 17.017 ( -6.277 5.843 -1.156) 8.653 17.245 ( 3.297 -2.332 3.190) 5.146 17.438 ( -1.045 0.998 2.243) 2.669 17.694 ( -1.717 -4.452 -2.682) 5.474 18.248 ( -0.066 -13.648 0.144) 13.649 ======================= Grid point 374 (207/294) ======================= q-point: ( 0.58 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( 4.566 -3.192 7.602) 9.425 1.460 ( -2.320 -5.981 3.790) 7.451 1.647 ( -4.126 -4.043 -2.108) 6.149 2.489 ( 4.924 -0.725 4.505) 6.713 2.886 ( -0.107 -1.464 -6.564) 6.727 3.528 ( -14.183 6.495 -11.847) 19.589 3.977 ( 6.519 3.033 -5.633) 9.133 4.013 ( 4.373 12.334 6.723) 14.712 4.606 ( -3.220 -9.394 1.000) 9.981 6.354 ( 2.000 -10.590 5.401) 12.055 6.644 ( -0.925 0.829 0.130) 1.249 6.955 ( -0.156 -1.209 0.801) 1.459 7.263 ( -0.505 -1.753 5.369) 5.670 7.540 ( 2.401 0.872 -1.591) 3.010 7.766 ( 4.121 -1.592 1.970) 4.837 8.917 ( -4.278 -0.655 -2.659) 5.079 9.494 ( 1.722 3.051 -5.453) 6.481 9.612 ( -1.506 4.640 1.745) 5.181 16.931 ( -3.519 3.974 -4.761) 7.131 17.060 ( 3.824 4.038 1.894) 5.875 17.274 ( 0.730 0.079 -0.110) 0.743 17.464 ( -0.373 1.144 3.237) 3.453 17.624 ( -0.112 -3.097 0.557) 3.149 18.123 ( -0.668 -11.189 -0.318) 11.213 ======================= Grid point 375 (208/294) ======================= q-point: ( 0.67 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( -1.678 -7.745 3.051) 8.492 1.423 ( 2.920 -1.070 5.010) 5.897 1.580 ( -0.362 -1.059 1.524) 1.891 2.607 ( 3.929 0.291 1.858) 4.356 2.826 ( -0.467 -0.277 -5.688) 5.714 3.305 ( -11.996 6.123 -9.279) 16.355 4.025 ( -0.040 0.661 0.578) 0.879 4.170 ( 0.711 1.041 0.644) 1.416 4.532 ( 2.635 -2.203 1.588) 3.784 6.320 ( -0.532 -3.340 3.591) 4.933 6.674 ( 1.998 1.649 1.837) 3.176 6.926 ( -1.484 -2.491 -0.287) 2.914 7.307 ( 3.696 0.494 2.145) 4.302 7.575 ( 2.739 -0.002 -1.767) 3.259 7.833 ( 3.834 -2.114 3.905) 5.866 8.814 ( -5.390 -0.196 -3.642) 6.508 9.505 ( -0.930 3.889 -3.227) 5.138 9.628 ( -0.463 -0.339 0.855) 1.029 16.879 ( -2.776 0.801 -3.241) 4.342 17.147 ( 2.739 0.790 0.656) 2.925 17.279 ( -0.332 0.521 -0.888) 1.082 17.440 ( -3.858 0.070 3.269) 5.057 17.683 ( 4.762 2.819 2.592) 6.111 18.025 ( -0.215 -6.653 -0.996) 6.731 ======================= Grid point 376 (209/294) ======================= q-point: (-0.25 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.259 ( 0.998 -7.429 -0.873) 7.546 1.494 ( -1.821 7.772 3.403) 8.678 1.646 ( 7.631 -3.513 7.263) 11.105 2.589 ( -1.359 -1.575 -5.492) 5.872 2.787 ( -5.279 2.401 -5.309) 7.862 3.202 ( -2.261 4.214 -1.196) 4.930 3.996 ( -3.653 -2.948 3.922) 6.117 4.076 ( -3.956 -8.986 -1.693) 9.963 4.656 ( 7.345 5.059 0.355) 8.926 6.341 ( 0.492 5.303 2.013) 5.694 6.738 ( 1.402 2.124 2.692) 3.704 6.859 ( -1.892 -4.248 -1.827) 4.997 7.401 ( 4.160 2.787 1.119) 5.130 7.615 ( 4.062 -0.015 -2.348) 4.692 7.887 ( 2.287 -1.824 3.567) 4.613 8.707 ( -4.835 -0.682 -2.677) 5.569 9.507 ( -1.641 3.845 -0.959) 4.289 9.595 ( -0.806 -4.839 -0.123) 4.908 16.820 ( -1.407 -2.169 -2.875) 3.866 17.157 ( -1.150 -5.720 3.897) 7.016 17.264 ( 0.269 2.009 -3.581) 4.115 17.430 ( -1.992 3.546 3.027) 5.070 17.788 ( 2.180 2.348 0.702) 3.280 18.012 ( 3.212 1.618 0.007) 3.597 ======================= Grid point 377 (210/294) ======================= q-point: (-0.17 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.241 ( 5.957 -4.145 -4.457) 8.517 1.563 ( -1.991 9.763 2.448) 10.260 1.794 ( 7.044 -0.240 4.388) 8.302 2.548 ( 0.767 -1.172 -3.500) 3.770 2.643 ( -8.308 1.336 -1.431) 8.536 3.213 ( -2.213 -1.297 2.859) 3.841 3.912 ( -0.798 -8.766 -8.835) 12.471 3.919 ( -5.096 -5.337 8.171) 11.010 4.824 ( 6.792 5.778 -0.110) 8.918 6.458 ( 3.125 11.107 0.147) 11.539 6.734 ( -4.908 -1.838 0.261) 5.247 6.815 ( 2.400 -1.194 -0.516) 2.730 7.475 ( -0.328 3.456 1.670) 3.853 7.692 ( 5.766 1.700 -2.449) 6.491 7.916 ( 0.949 0.572 0.907) 1.433 8.622 ( -2.637 -2.777 0.112) 3.832 9.506 ( -1.247 -4.470 -1.719) 4.949 9.522 ( -1.380 -0.790 1.660) 2.298 16.764 ( -0.079 -3.774 -2.067) 4.304 17.066 ( -3.970 -8.411 5.273) 10.691 17.299 ( 2.591 3.954 -4.199) 6.323 17.451 ( -1.136 2.974 1.419) 3.485 17.808 ( -0.556 1.566 -1.004) 1.941 18.140 ( 5.216 7.588 0.573) 9.225 ======================= Grid point 383 (211/294) ======================= q-point: ( 0.25 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -9.848 2.393 -1.110) 10.195 1.810 ( -4.942 -4.217 2.338) 6.904 1.924 ( 2.107 -5.497 -4.381) 7.339 2.420 ( 11.626 8.537 -3.762) 14.906 2.630 ( -0.554 -8.124 -1.898) 8.361 3.136 ( 3.384 2.072 9.895) 10.661 3.617 ( -0.687 5.586 1.626) 5.858 4.003 ( 5.134 -3.866 6.489) 9.133 4.928 ( -2.262 -2.092 -9.675) 10.154 6.517 ( -0.152 3.307 2.858) 4.373 6.781 ( -2.204 1.672 -6.213) 6.801 6.977 ( -1.235 -2.421 -1.279) 3.004 7.447 ( -2.365 -1.557 1.797) 3.354 7.676 ( 1.941 -3.693 -6.402) 7.641 7.924 ( -6.148 -1.780 -2.853) 7.007 8.759 ( 6.945 -2.648 0.940) 7.492 9.100 ( -1.380 7.893 7.389) 10.900 9.635 ( 0.758 -0.687 1.147) 1.538 16.664 ( -2.853 2.667 2.431) 4.600 16.899 ( 3.850 -2.203 8.098) 9.233 17.365 ( -2.689 3.178 -2.480) 4.846 17.567 ( -0.339 -0.315 -0.065) 0.467 17.813 ( -0.052 -0.511 -4.230) 4.261 18.360 ( 2.369 -5.753 -8.693) 10.690 ======================= Grid point 384 (212/294) ======================= q-point: ( 0.33 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( -6.585 1.566 3.781) 7.753 1.635 ( -9.965 -7.808 10.870) 16.686 1.894 ( 2.405 -5.479 -8.739) 10.591 2.607 ( 7.509 -2.980 -4.288) 9.146 2.657 ( 8.219 5.657 -5.718) 11.500 3.201 ( 1.007 0.494 0.556) 1.252 3.695 ( -0.058 8.810 7.264) 11.418 4.072 ( 1.774 -1.635 4.672) 5.258 4.835 ( -0.071 -3.782 -6.862) 7.835 6.498 ( -4.069 -1.123 -2.488) 4.900 6.744 ( -0.728 1.108 -1.588) 2.069 6.930 ( -0.179 -4.508 1.429) 4.732 7.409 ( -1.145 -1.449 0.788) 2.008 7.642 ( 1.983 -2.532 -5.564) 6.427 7.788 ( -8.498 -1.853 2.556) 9.066 8.852 ( 7.340 -1.584 -2.197) 7.824 9.208 ( -0.083 8.553 5.857) 10.367 9.645 ( 0.176 0.660 -0.029) 0.684 16.685 ( -0.323 4.728 2.095) 5.182 16.990 ( 4.089 -1.676 7.321) 8.552 17.326 ( -4.306 3.758 -3.298) 6.599 17.539 ( -2.093 -0.799 -0.307) 2.262 17.778 ( -0.267 -1.339 -3.979) 4.206 18.290 ( 3.011 -9.808 -5.848) 11.810 ======================= Grid point 385 (213/294) ======================= q-point: ( 0.42 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.257 ( -3.003 -0.312 5.983) 6.702 1.518 ( -5.923 -3.834 13.947) 15.630 1.806 ( 1.414 -7.842 -8.499) 11.650 2.659 ( -3.370 -3.894 -4.126) 6.599 2.714 ( 7.769 0.932 -6.381) 10.096 3.296 ( 10.104 5.490 -5.162) 12.605 3.842 ( 0.621 9.186 9.280) 13.072 4.072 ( -4.129 2.887 0.295) 5.047 4.766 ( 0.436 -5.606 -4.125) 6.974 6.371 ( -2.875 -8.540 -1.700) 9.170 6.736 ( -1.718 1.169 -0.606) 2.164 6.913 ( 1.406 -3.659 2.908) 4.881 7.397 ( 0.009 -0.544 0.923) 1.071 7.635 ( 1.995 -1.486 -3.892) 4.620 7.646 ( -9.430 -0.841 6.199) 11.316 8.933 ( 5.683 -1.297 -2.822) 6.476 9.312 ( 1.112 6.929 1.582) 7.194 9.656 ( -0.398 2.592 -0.533) 2.676 16.763 ( 2.198 6.081 1.340) 6.604 17.082 ( 4.064 -0.843 5.731) 7.076 17.258 ( -5.845 3.667 -3.204) 7.608 17.491 ( -1.858 -1.252 -0.924) 2.424 17.736 ( -0.945 -1.492 -2.709) 3.234 18.207 ( 2.417 -12.156 -2.388) 12.622 ======================= Grid point 386 (214/294) ======================= q-point: ( 0.50 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -0.842 -2.423 4.976) 5.598 1.517 ( -1.921 -2.195 13.524) 13.835 1.714 ( 0.543 -6.690 -5.596) 8.738 2.493 ( -4.838 -5.226 -4.065) 8.200 2.816 ( 4.879 1.861 -2.480) 5.781 3.524 ( 14.272 6.932 -9.191) 18.337 3.908 ( -5.670 2.988 -2.798) 6.993 4.055 ( -3.895 10.192 5.186) 12.080 4.688 ( -1.002 -6.873 -1.270) 7.061 6.265 ( 1.139 -10.864 3.597) 11.501 6.701 ( -2.079 -0.311 -1.322) 2.483 6.933 ( 1.475 -1.186 2.485) 3.124 7.387 ( -2.595 -3.134 5.384) 6.748 7.532 ( -4.906 0.832 1.261) 5.134 7.663 ( 2.048 0.560 0.722) 2.242 8.969 ( 2.036 -1.459 -2.523) 3.555 9.389 ( 2.396 4.840 -3.426) 6.395 9.674 ( -0.942 3.730 -0.169) 3.851 16.875 ( 3.636 6.502 -0.477) 7.465 17.154 ( -3.047 4.396 0.158) 5.352 17.188 ( 0.505 -1.797 1.520) 2.407 17.458 ( -0.056 -0.742 -0.752) 1.059 17.686 ( -2.215 -1.739 -0.466) 2.854 18.117 ( 1.204 -11.749 0.331) 11.815 ======================= Grid point 387 (215/294) ======================= q-point: ( 0.58 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.257 ( 2.635 -3.251 5.638) 7.022 1.501 ( -5.056 -7.270 10.191) 13.501 1.635 ( -0.466 -2.260 -4.693) 5.230 2.438 ( 2.983 -0.526 1.772) 3.510 2.864 ( 0.172 2.321 -2.167) 3.180 3.701 ( -3.019 4.604 -14.413) 15.429 3.797 ( 4.632 4.916 -7.089) 9.792 4.130 ( -0.657 4.984 3.171) 5.944 4.600 ( -3.074 -5.403 3.860) 7.317 6.255 ( 3.844 -8.040 8.929) 12.615 6.660 ( -1.200 -0.200 -1.629) 2.033 6.953 ( 0.317 -0.643 1.150) 1.356 7.318 ( -4.320 -4.229 7.173) 9.381 7.518 ( 0.212 1.795 -1.181) 2.159 7.719 ( 2.725 0.565 3.178) 4.224 8.942 ( -1.603 -1.203 -3.411) 3.956 9.446 ( 2.997 3.596 -5.484) 7.210 9.684 ( -1.683 2.608 -0.310) 3.119 16.966 ( 0.469 5.680 -5.117) 7.660 17.095 ( -2.720 0.986 0.906) 3.032 17.243 ( 2.617 0.336 1.409) 2.991 17.478 ( 2.231 0.526 1.062) 2.526 17.632 ( -2.509 -1.759 2.553) 3.988 18.036 ( -0.032 -8.509 1.869) 8.712 ======================= Grid point 388 (216/294) ======================= q-point: (-0.33 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( 0.310 -5.173 9.353) 10.693 1.357 ( 0.234 -10.130 5.163) 11.372 1.607 ( -1.458 2.869 -2.218) 3.909 2.561 ( 6.282 3.387 3.239) 7.838 2.843 ( -3.605 3.064 -2.718) 5.456 3.488 ( -11.680 3.549 -13.790) 18.417 3.933 ( 7.444 0.663 -7.982) 10.934 4.144 ( 0.989 -2.055 -3.189) 3.921 4.562 ( -2.571 0.655 9.401) 9.768 6.322 ( 2.669 -2.314 10.968) 11.523 6.651 ( 1.487 0.023 -1.239) 1.936 6.936 ( -1.689 -1.626 0.254) 2.358 7.290 ( 0.506 -1.546 4.965) 5.225 7.533 ( 1.131 0.347 -1.360) 1.802 7.792 ( 2.848 -0.051 5.251) 5.974 8.863 ( -3.802 -0.454 -5.142) 6.411 9.493 ( 2.449 2.859 -4.464) 5.839 9.658 ( -2.564 -0.128 -1.139) 2.808 16.914 ( -4.330 0.723 -6.091) 7.508 17.124 ( 2.337 1.470 -0.501) 2.806 17.279 ( 0.241 -0.273 2.092) 2.124 17.499 ( -1.004 -1.232 1.314) 2.062 17.658 ( 3.409 2.954 4.325) 6.249 17.986 ( -0.599 -3.293 2.935) 4.452 ======================= Grid point 389 (217/294) ======================= q-point: (-0.25 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( -3.063 -11.437 3.470) 12.338 1.488 ( 10.211 -7.634 10.204) 16.330 1.630 ( -1.801 9.862 0.345) 10.031 2.635 ( -4.112 3.797 -1.999) 5.943 2.826 ( -0.156 4.742 -2.804) 5.511 3.285 ( -6.498 1.374 -10.161) 12.139 3.917 ( 0.675 -6.486 -8.537) 10.743 4.107 ( -2.110 -3.380 2.120) 4.514 4.641 ( 2.471 5.277 6.848) 8.991 6.408 ( 0.569 3.763 7.658) 8.552 6.693 ( 4.333 -0.875 -0.603) 4.462 6.874 ( -3.356 -2.485 0.129) 4.177 7.368 ( 5.062 2.475 4.307) 7.092 7.546 ( 2.151 -0.913 -1.774) 2.934 7.862 ( 2.016 -0.815 6.112) 6.487 8.759 ( -4.591 0.188 -6.281) 7.782 9.526 ( 1.311 1.300 -1.897) 2.647 9.586 ( -3.292 -2.441 -2.179) 4.642 16.811 ( -3.138 -1.902 -5.484) 6.598 17.153 ( 0.197 -1.580 1.469) 2.166 17.267 ( -1.193 -0.718 0.664) 1.543 17.479 ( -0.623 -0.309 0.716) 0.998 17.780 ( 3.204 3.657 2.714) 5.568 18.010 ( 1.595 3.991 3.885) 5.794 ======================= Grid point 390 (218/294) ======================= q-point: (-0.17 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 2.471 -9.722 -0.659) 10.053 1.648 ( 9.831 -2.046 5.064) 11.246 1.720 ( -1.038 8.038 5.608) 9.856 2.553 ( -5.199 3.738 -4.898) 8.062 2.806 ( -6.392 3.761 -1.721) 7.613 3.203 ( 0.983 -1.867 -6.500) 6.834 3.787 ( -2.165 -6.591 -7.891) 10.507 4.030 ( -5.982 -4.605 8.090) 11.065 4.792 ( 5.076 6.624 3.431) 9.023 6.509 ( 2.188 7.642 1.559) 8.100 6.723 ( 1.096 -4.989 -2.863) 5.856 6.812 ( -1.443 0.584 2.020) 2.550 7.501 ( 2.282 2.165 3.115) 4.427 7.605 ( 7.455 2.953 0.524) 8.036 7.906 ( 0.603 -1.371 5.085) 5.301 8.652 ( -4.227 -0.077 -6.012) 7.350 9.468 ( -3.169 -7.381 -0.521) 8.050 9.554 ( -0.256 2.672 -1.220) 2.949 16.723 ( -1.256 -2.880 -4.116) 5.178 17.099 ( -4.161 -7.169 7.355) 11.082 17.274 ( 1.719 3.660 -4.672) 6.178 17.474 ( -0.047 -0.295 -0.479) 0.564 17.841 ( -0.410 2.714 2.087) 3.448 18.148 ( 4.322 8.899 2.308) 10.159 ======================= Grid point 395 (219/294) ======================= q-point: ( 0.25 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.522 ( -1.146 0.287 -3.394) 3.594 1.742 ( 0.377 -10.543 -9.758) 14.371 1.786 ( 5.397 4.384 -13.222) 14.939 2.397 ( 0.764 6.574 7.859) 10.275 2.682 ( -10.708 -5.979 7.393) 14.320 3.084 ( 8.994 -3.474 10.995) 14.624 3.733 ( -2.187 7.950 3.245) 8.860 3.939 ( 3.613 -0.480 6.746) 7.667 4.911 ( -4.402 -1.205 -10.227) 11.199 6.549 ( 2.071 2.744 3.700) 5.051 6.767 ( -1.068 0.057 -11.560) 11.610 6.952 ( 0.235 -3.100 -1.193) 3.330 7.491 ( -3.184 -0.613 0.325) 3.258 7.549 ( 3.063 -3.222 -8.310) 9.425 7.985 ( -3.201 1.601 -4.955) 6.112 8.652 ( 3.856 -4.159 5.674) 8.022 9.261 ( -2.920 8.077 8.312) 11.952 9.608 ( 1.618 -2.500 1.678) 3.418 16.728 ( -1.616 -1.779 3.718) 4.427 16.909 ( 0.780 2.767 8.818) 9.275 17.406 ( -1.188 1.665 -2.198) 3.002 17.536 ( 2.831 -1.519 -0.902) 3.337 17.808 ( -1.845 1.381 -3.765) 4.415 18.248 ( -1.028 -3.323 -10.816) 11.361 ======================= Grid point 396 (220/294) ======================= q-point: ( 0.33 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -7.389 2.343 0.756) 7.788 1.600 ( 3.246 -12.254 -8.165) 15.078 1.815 ( 0.068 -0.550 -5.181) 5.210 2.488 ( 2.740 0.534 0.008) 2.792 2.631 ( 0.688 4.204 5.928) 7.299 3.175 ( 1.373 -2.679 1.866) 3.541 3.803 ( 1.561 4.132 7.377) 8.598 4.050 ( 3.351 1.414 7.265) 8.125 4.788 ( -2.487 -1.370 -8.750) 9.199 6.535 ( -5.045 -2.293 -6.134) 8.267 6.729 ( 2.345 1.318 -2.423) 3.620 6.906 ( -0.939 -4.193 0.517) 4.328 7.426 ( -2.349 0.646 -2.783) 3.699 7.560 ( 2.657 -0.038 -2.939) 3.963 7.913 ( -5.443 0.318 0.428) 5.469 8.713 ( 5.722 -2.954 0.964) 6.511 9.338 ( -2.014 7.143 6.269) 9.715 9.624 ( 2.034 -1.739 0.912) 2.827 16.732 ( 0.330 0.657 3.131) 3.216 16.993 ( 0.779 2.271 8.113) 8.461 17.384 ( -1.701 1.626 -3.277) 4.034 17.532 ( 0.223 -3.132 -1.403) 3.440 17.776 ( -1.696 1.824 -2.824) 3.766 18.144 ( 0.257 -5.696 -7.927) 9.765 ======================= Grid point 397 (221/294) ======================= q-point: ( 0.42 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.351 ( -6.130 0.130 1.704) 6.364 1.545 ( 4.755 -6.670 -4.191) 9.201 1.732 ( -4.977 -4.009 2.986) 7.054 2.580 ( 7.047 3.610 -5.560) 9.675 2.669 ( -2.384 -2.048 1.905) 3.675 3.189 ( 4.115 2.307 -2.422) 5.303 3.927 ( 2.807 2.293 8.354) 9.106 4.136 ( 0.913 2.151 4.448) 5.025 4.704 ( -1.036 -1.389 -6.350) 6.582 6.356 ( -6.093 -5.633 -5.475) 9.942 6.763 ( -0.683 1.724 -1.504) 2.388 6.873 ( 1.409 -3.664 2.657) 4.740 7.401 ( -0.708 1.711 -1.731) 2.535 7.591 ( 1.705 1.096 -0.631) 2.123 7.815 ( -7.952 -1.039 4.917) 9.407 8.792 ( 7.037 -1.615 -2.789) 7.740 9.390 ( -1.788 5.037 2.505) 5.903 9.653 ( 2.139 -0.202 0.455) 2.196 16.785 ( 2.236 2.565 2.386) 4.156 17.072 ( 1.350 1.856 6.741) 7.121 17.344 ( -2.759 2.014 -3.798) 5.108 17.474 ( -1.147 -4.321 -2.998) 5.383 17.753 ( -2.058 1.866 -1.166) 3.013 18.064 ( 1.169 -6.867 -3.127) 7.635 ======================= Grid point 398 (222/294) ======================= q-point: ( 0.50 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( -3.384 -1.716 1.005) 3.925 1.558 ( 4.477 -3.171 -3.697) 6.615 1.658 ( -4.552 -2.916 10.094) 11.451 2.502 ( -5.647 -5.581 -4.345) 9.051 2.754 ( 6.498 4.964 0.014) 8.177 3.330 ( 10.276 5.103 -5.794) 12.853 3.983 ( -1.884 0.552 1.104) 2.252 4.168 ( -0.403 0.473 0.735) 0.962 4.658 ( -1.062 0.238 -1.191) 1.613 6.215 ( -2.814 -4.946 1.538) 5.894 6.721 ( -2.433 -0.812 -2.340) 3.472 6.905 ( 2.432 -1.294 2.686) 3.847 7.401 ( -0.416 -0.472 1.024) 1.202 7.618 ( -1.173 1.522 1.155) 2.242 7.713 ( -6.124 -0.195 6.173) 8.697 8.868 ( 5.955 -1.297 -4.268) 7.441 9.407 ( -1.074 3.844 -2.006) 4.467 9.689 ( 1.576 0.499 -0.000) 1.653 16.873 ( 3.571 3.763 0.787) 5.247 17.148 ( 1.866 1.444 4.717) 5.274 17.282 ( -5.538 2.800 -3.207) 6.985 17.405 ( 1.535 -5.117 -3.351) 6.306 17.724 ( -2.689 0.386 0.618) 2.786 18.019 ( 0.796 -5.154 1.457) 5.415 ======================= Grid point 399 (223/294) ======================= q-point: (-0.42 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( -0.231 -3.108 1.783) 3.590 1.551 ( -0.327 -4.244 -2.306) 4.841 1.629 ( -3.843 -1.726 10.761) 11.556 2.402 ( 0.882 -1.126 -0.620) 1.559 2.885 ( 2.486 5.949 0.851) 6.504 3.509 ( 11.788 2.479 -11.126) 16.398 3.890 ( -7.288 1.284 -6.546) 9.881 4.138 ( -0.219 -3.585 -3.713) 5.166 4.663 ( -2.336 3.364 6.015) 7.277 6.204 ( 1.993 -2.760 9.136) 9.750 6.663 ( -1.554 -1.214 -2.781) 3.410 6.940 ( 1.366 -1.063 1.617) 2.369 7.368 ( -2.693 -5.254 4.970) 7.718 7.578 ( -4.880 2.504 1.822) 5.780 7.726 ( 0.899 2.132 4.754) 5.287 8.899 ( 2.479 -1.621 -4.759) 5.605 9.418 ( 0.855 3.891 -5.068) 6.446 9.704 ( 0.216 -0.158 -1.004) 1.039 16.969 ( 3.435 4.528 -1.982) 6.019 17.140 ( -4.839 -1.296 -4.499) 6.733 17.249 ( 0.149 3.012 3.936) 4.958 17.404 ( 4.691 -3.907 -1.206) 6.223 17.685 ( -2.866 -0.433 3.304) 4.395 18.008 ( -0.462 -1.642 4.310) 4.635 ======================= Grid point 400 (224/294) ======================= q-point: (-0.33 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.219 ( 4.150 -9.062 2.387) 10.249 1.432 ( -9.204 -7.580 9.842) 15.461 1.645 ( 0.814 4.491 1.337) 4.756 2.501 ( 7.202 5.120 1.053) 8.899 2.945 ( -2.804 6.059 1.366) 6.815 3.509 ( -1.382 -6.092 -19.517) 20.492 3.823 ( 1.648 5.218 -5.014) 7.422 4.075 ( 0.687 -3.013 -5.636) 6.427 4.700 ( -3.684 4.584 10.078) 11.668 6.314 ( 4.726 -0.767 13.525) 14.347 6.622 ( 0.006 -1.100 -3.020) 3.214 6.941 ( -0.491 -1.686 0.508) 1.828 7.302 ( -1.608 -5.571 6.190) 8.482 7.548 ( -2.539 1.920 0.213) 3.190 7.801 ( 1.572 2.538 5.962) 6.667 8.863 ( -1.037 -1.483 -6.148) 6.409 9.453 ( 2.446 3.660 -5.100) 6.737 9.677 ( -1.614 -1.310 -2.185) 3.016 16.974 ( -6.399 1.518 -6.350) 9.142 17.072 ( 3.769 0.368 -3.980) 5.494 17.300 ( -0.134 0.570 4.983) 5.017 17.441 ( 4.332 -4.597 -0.508) 6.336 17.692 ( -0.088 3.224 5.571) 6.437 18.021 ( -1.302 1.648 5.861) 6.226 ======================= Grid point 401 (225/294) ======================= q-point: (-0.25 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.185 ( -3.777 -12.322 6.502) 14.435 1.300 ( 4.164 -12.114 8.791) 15.536 1.755 ( 0.693 11.989 3.110) 12.406 2.676 ( 4.794 7.436 -1.543) 8.981 2.930 ( -5.974 6.368 0.302) 8.737 3.254 ( -4.568 -8.308 -20.215) 22.328 3.848 ( -0.633 0.723 -4.029) 4.142 4.075 ( 3.269 0.792 -3.435) 4.807 4.748 ( -2.839 5.162 10.437) 11.985 6.461 ( 3.095 0.630 12.579) 12.969 6.610 ( 2.399 -1.610 -3.331) 4.410 6.899 ( -2.231 -2.653 0.293) 3.479 7.322 ( 4.753 -1.911 5.881) 7.799 7.525 ( -1.334 -0.097 -0.585) 1.460 7.883 ( 0.982 2.282 6.698) 7.143 8.779 ( -2.877 -0.566 -7.859) 8.388 9.497 ( 2.007 1.728 -2.467) 3.619 9.606 ( -3.044 -1.442 -3.448) 4.820 16.834 ( -5.643 -1.108 -6.128) 8.404 17.118 ( 3.014 1.173 -4.449) 5.500 17.299 ( -2.283 -2.820 5.645) 6.711 17.451 ( 2.122 -3.297 0.047) 3.921 17.794 ( 2.615 5.519 4.162) 7.391 18.073 ( -0.102 5.220 6.327) 8.203 ======================= Grid point 402 (226/294) ======================= q-point: (-0.17 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.998 ( -4.525 -14.480 5.467) 16.125 1.428 ( 14.364 -8.704 10.211) 19.656 1.887 ( -2.364 12.524 4.081) 13.382 2.691 ( -7.827 7.068 -8.359) 13.457 2.893 ( -3.357 -1.565 -3.018) 4.777 3.068 ( 2.768 -1.221 -13.406) 13.743 3.799 ( -4.152 1.822 -1.272) 4.709 4.093 ( -1.320 -1.653 2.260) 3.095 4.836 ( 0.721 6.458 7.685) 10.064 6.550 ( 0.635 2.756 4.244) 5.100 6.625 ( 3.522 -3.986 -2.241) 5.772 6.842 ( -1.723 -1.914 0.970) 2.752 7.484 ( 8.310 0.974 7.945) 11.538 7.499 ( 2.259 -1.742 -2.125) 3.557 7.944 ( -0.488 1.759 5.890) 6.166 8.678 ( -3.719 0.698 -8.474) 9.281 9.470 ( -3.691 -4.659 0.726) 5.988 9.565 ( 0.334 2.979 -3.637) 4.713 16.714 ( -3.452 -1.583 -4.589) 5.957 17.123 ( -0.676 -3.173 1.486) 3.568 17.266 ( -0.874 -0.248 0.342) 0.970 17.453 ( 1.002 -1.748 0.030) 2.015 17.887 ( 0.482 3.913 2.897) 4.892 18.192 ( 2.616 8.534 3.944) 9.759 ======================= Grid point 407 (227/294) ======================= q-point: ( 0.25 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.351 ( 10.033 -4.427 -12.137) 16.358 1.482 ( 11.136 -8.228 -11.836) 18.215 1.841 ( -8.901 7.223 -7.071) 13.469 2.570 ( -6.742 6.241 9.493) 13.210 2.892 ( -10.858 -4.035 12.699) 17.189 2.925 ( 10.354 -5.354 10.389) 15.614 3.823 ( -3.084 1.341 -0.933) 3.490 3.985 ( 0.285 6.791 7.024) 9.774 4.928 ( -5.801 -0.695 -10.188) 11.745 6.545 ( 3.684 1.853 4.107) 5.820 6.687 ( 0.602 -1.667 -13.426) 13.542 6.904 ( 1.531 -3.012 -0.266) 3.389 7.432 ( 5.466 2.054 -5.486) 8.012 7.530 ( -2.468 -1.505 -2.331) 3.714 7.996 ( -0.900 1.381 -6.324) 6.535 8.633 ( -0.545 -3.009 8.703) 9.225 9.423 ( -3.063 6.396 6.196) 9.417 9.561 ( 1.146 -4.054 1.669) 4.532 16.739 ( -1.211 -4.460 4.750) 6.627 16.998 ( -0.073 4.923 8.329) 9.675 17.395 ( 0.925 -2.301 -4.655) 5.274 17.459 ( 3.251 -0.440 -0.797) 3.376 17.856 ( -3.338 3.365 -2.921) 5.568 18.213 ( -3.825 0.030 -9.647) 10.377 ======================= Grid point 408 (228/294) ======================= q-point: ( 0.33 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( 8.326 -12.313 -10.017) 17.924 1.582 ( 0.071 2.436 -1.395) 2.808 1.744 ( -0.204 5.268 -11.918) 13.031 2.535 ( -6.014 -2.622 8.063) 10.395 2.760 ( -6.477 4.029 5.490) 9.398 3.124 ( 5.853 -3.230 9.348) 11.492 3.798 ( 1.671 -2.908 4.217) 5.388 4.086 ( 1.075 4.239 4.096) 5.992 4.788 ( -4.171 0.810 -9.264) 10.192 6.543 ( -3.767 -2.567 -7.134) 8.466 6.681 ( 4.458 2.327 -0.122) 5.030 6.880 ( -0.277 -3.675 -0.408) 3.708 7.466 ( -2.097 5.105 -6.500) 8.527 7.520 ( 2.534 1.198 0.854) 2.930 7.957 ( -1.012 0.813 -4.671) 4.848 8.647 ( 0.877 -3.698 6.398) 7.442 9.466 ( -2.531 4.966 4.891) 7.415 9.560 ( 2.834 -4.270 1.003) 5.222 16.727 ( 0.899 -2.750 4.003) 4.939 17.080 ( -0.850 4.583 7.328) 8.685 17.351 ( 1.221 -4.209 -6.110) 7.519 17.484 ( 1.275 -1.749 0.035) 2.165 17.825 ( -2.641 3.538 -2.385) 5.018 18.105 ( -3.763 0.810 -7.106) 8.081 ======================= Grid point 409 (229/294) ======================= q-point: ( 0.42 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( 7.597 -8.235 -5.676) 12.560 1.510 ( -7.713 3.331 0.572) 8.421 1.769 ( 1.215 1.774 -4.307) 4.814 2.508 ( 2.053 0.756 1.624) 2.725 2.723 ( -4.886 -1.878 2.339) 5.733 3.178 ( 0.260 1.889 2.143) 2.868 3.886 ( 6.805 -3.983 9.673) 12.479 4.126 ( 1.471 -2.439 -1.243) 3.108 4.712 ( -2.564 4.218 -5.624) 7.483 6.402 ( -6.684 -0.315 -5.027) 8.369 6.770 ( 2.261 2.866 -0.235) 3.658 6.829 ( -0.167 -5.009 0.884) 5.089 7.443 ( -2.580 4.418 -3.355) 6.118 7.583 ( 1.935 3.028 1.012) 3.734 7.918 ( -2.988 -0.240 0.113) 3.000 8.673 ( 3.612 -2.822 1.126) 4.720 9.479 ( -2.745 2.730 2.263) 4.484 9.589 ( 4.157 -3.115 0.620) 5.231 16.761 ( 2.904 -1.184 3.252) 4.518 17.144 ( -0.982 4.350 5.829) 7.339 17.293 ( 2.181 -5.893 -6.369) 8.947 17.464 ( -1.953 -1.029 -0.901) 2.384 17.802 ( -2.174 1.600 -1.141) 2.930 18.037 ( -2.782 2.446 -2.772) 4.627 ======================= Grid point 410 (230/294) ======================= q-point: (-0.50 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( 0.147 -1.968 -0.796) 2.128 1.453 ( -0.401 0.750 -2.713) 2.843 1.767 ( -2.389 1.495 4.863) 5.621 2.526 ( -5.437 -5.051 -1.516) 7.575 2.682 ( 6.732 2.897 0.429) 7.341 3.238 ( 3.520 3.339 -2.155) 5.309 3.986 ( 1.931 -2.617 3.331) 4.655 4.086 ( 3.511 -8.356 -3.281) 9.639 4.719 ( -1.617 7.243 0.224) 7.425 6.285 ( -6.499 2.446 0.032) 6.944 6.738 ( -2.787 -1.864 -2.573) 4.226 6.860 ( 3.436 -1.305 2.531) 4.463 7.424 ( -1.933 1.159 -0.429) 2.294 7.652 ( 1.119 4.380 2.259) 5.054 7.849 ( -6.221 -1.096 4.532) 7.774 8.725 ( 6.188 -1.773 -3.803) 7.476 9.460 ( -2.689 2.206 -1.107) 3.650 9.633 ( 4.038 -2.738 0.206) 4.883 16.829 ( 4.298 -0.195 1.473) 4.547 17.200 ( -0.748 4.295 4.245) 6.085 17.251 ( 4.118 -6.567 -4.743) 9.087 17.390 ( -5.237 0.208 -2.803) 5.944 17.771 ( -2.196 -0.284 1.269) 2.552 18.029 ( -1.602 3.925 1.442) 4.477 ======================= Grid point 411 (231/294) ======================= q-point: (-0.42 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( -4.884 -1.851 -3.246) 6.149 1.489 ( 4.107 2.331 -0.352) 4.736 1.768 ( -5.212 -0.705 10.876) 12.081 2.385 ( -2.058 -3.579 -0.364) 4.144 2.874 ( 7.857 7.356 0.613) 10.780 3.297 ( 6.546 -2.940 -9.423) 11.844 3.914 ( -1.769 -3.774 -7.569) 8.641 4.080 ( 0.818 -3.059 0.013) 3.166 4.783 ( -1.424 7.602 5.162) 9.299 6.254 ( -2.576 3.234 6.124) 7.389 6.659 ( -2.214 -2.413 -3.057) 4.479 6.907 ( 2.324 -1.475 1.735) 3.254 7.384 ( -2.467 -3.824 2.651) 5.267 7.710 ( -3.990 4.991 3.172) 7.134 7.778 ( -2.445 -0.125 6.182) 6.650 8.782 ( 5.771 -1.659 -6.181) 8.617 9.431 ( -1.511 2.925 -4.140) 5.290 9.663 ( 2.655 -2.578 -0.579) 3.746 16.905 ( 5.104 0.071 -1.846) 5.428 17.209 ( -5.169 1.990 -3.065) 6.330 17.254 ( 5.741 -6.222 -1.367) 8.576 17.313 ( -2.200 2.507 1.640) 3.717 17.749 ( -2.224 0.443 4.062) 4.652 18.063 ( -1.316 4.337 4.330) 6.268 ======================= Grid point 412 (232/294) ======================= q-point: (-0.33 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.105 ( -1.741 -8.356 -4.342) 9.576 1.584 ( -5.025 0.918 8.763) 10.143 1.693 ( -2.571 -0.125 7.684) 8.103 2.438 ( 6.889 5.092 -0.297) 8.572 3.022 ( 1.009 4.479 0.086) 4.592 3.270 ( 6.683 -8.626 -15.647) 19.076 3.850 ( -0.705 3.768 -5.358) 6.588 4.036 ( -2.024 -0.181 -4.331) 4.784 4.860 ( -2.459 6.715 8.308) 10.962 6.329 ( 2.252 2.168 11.008) 11.444 6.593 ( -0.716 -2.417 -3.367) 4.206 6.924 ( 0.858 -2.041 0.670) 2.313 7.307 ( -2.745 -7.212 5.122) 9.262 7.651 ( -6.421 1.531 2.936) 7.225 7.846 ( 1.292 3.833 6.128) 7.343 8.796 ( 2.571 -1.939 -7.267) 7.949 9.431 ( 0.959 3.909 -5.216) 6.588 9.659 ( 0.369 -2.190 -1.640) 2.761 16.967 ( 5.049 -1.074 -5.799) 7.763 17.077 ( -8.043 2.500 -5.741) 10.193 17.295 ( 6.143 -6.198 0.925) 8.776 17.346 ( -0.136 1.674 4.284) 4.601 17.766 ( -0.934 3.492 5.497) 6.580 18.112 ( -1.560 4.442 6.347) 7.902 ======================= Grid point 413 (233/294) ======================= q-point: (-0.25 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.030 ( 6.191 -11.596 2.002) 13.296 1.368 ( -14.323 -13.936 12.435) 23.537 1.857 ( 3.921 13.067 4.459) 14.353 2.634 ( 8.346 8.447 -2.283) 12.093 2.940 ( -0.103 -12.420 -12.735) 17.789 3.222 ( -4.977 7.274 -6.370) 10.875 3.872 ( -0.305 4.655 -2.902) 5.494 4.010 ( 2.345 2.511 -5.436) 6.430 4.920 ( -3.823 5.979 9.904) 12.184 6.463 ( 4.091 0.093 10.157) 10.951 6.557 ( 0.835 -2.478 -0.862) 2.753 6.900 ( -1.138 -2.915 -0.151) 3.132 7.257 ( 1.898 -6.267 5.684) 8.671 7.580 ( -4.867 -0.125 1.576) 5.117 7.932 ( 0.955 2.839 5.598) 6.349 8.754 ( -0.414 -0.518 -7.813) 7.841 9.470 ( 2.187 3.502 -3.328) 5.303 9.616 ( -1.914 -1.232 -2.958) 3.732 16.894 ( -6.186 -0.795 -6.959) 9.345 17.039 ( 3.181 2.000 -6.443) 7.458 17.323 ( 1.364 -4.921 4.036) 6.509 17.380 ( 1.733 -1.270 3.446) 4.060 17.843 ( 1.069 5.657 4.266) 7.165 18.173 ( -1.036 5.211 7.298) 9.027 ======================= Grid point 414 (234/294) ======================= q-point: (-0.17 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( -10.039 -15.718 11.146) 21.727 1.159 ( 12.040 -12.514 10.263) 20.172 2.046 ( 0.774 12.076 3.250) 12.529 2.706 ( 2.222 -16.286 -16.442) 23.249 2.796 ( -0.555 9.786 -6.312) 11.659 3.169 ( -8.098 14.144 -3.849) 16.746 3.885 ( -1.944 4.033 0.777) 4.544 4.071 ( 3.380 1.957 -2.812) 4.813 4.971 ( -3.268 6.095 9.615) 11.844 6.516 ( 2.873 -3.218 -4.124) 5.968 6.590 ( 0.788 -1.247 9.969) 10.078 6.845 ( -1.407 -3.165 0.092) 3.465 7.339 ( 9.498 -3.212 5.167) 11.279 7.506 ( -3.401 -2.644 1.062) 4.436 7.983 ( 0.622 -0.195 2.619) 2.699 8.700 ( -2.421 3.237 -6.437) 7.601 9.497 ( -1.665 -0.860 1.419) 2.351 9.566 ( -0.454 2.896 -5.143) 5.920 16.754 ( -5.689 -0.022 -5.185) 7.697 17.071 ( 3.354 0.257 -5.754) 6.665 17.298 ( -2.314 -3.655 5.203) 6.766 17.415 ( 2.094 -1.854 2.217) 3.569 17.930 ( 0.850 4.497 2.376) 5.157 18.265 ( 0.788 6.833 5.497) 8.804 ======================= Grid point 480 (235/294) ======================= q-point: ( 0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.080 ( 0.000 0.000 19.843) 19.843 1.080 ( 0.000 0.000 19.843) 19.843 1.554 ( 0.000 0.000 28.388) 28.388 2.828 ( -0.000 -0.000 -16.165) 16.165 2.828 ( -0.000 -0.000 -16.165) 16.165 3.836 ( -0.000 -0.000 -5.693) 5.693 3.836 ( -0.000 -0.000 -5.693) 5.693 3.988 ( -0.000 -0.000 -20.560) 20.560 5.409 ( -0.000 -0.000 -5.871) 5.871 6.417 ( 0.000 0.000 5.000) 5.000 6.417 ( 0.000 0.000 5.000) 5.000 7.354 ( 0.000 0.000 6.681) 6.681 7.359 ( 0.000 0.000 9.854) 9.854 7.359 ( 0.000 0.000 9.854) 9.854 7.458 ( 0.000 0.000 8.614) 8.614 9.250 ( -0.000 -0.000 -5.188) 5.188 9.340 ( -0.000 -0.000 -8.550) 8.550 9.340 ( -0.000 -0.000 -8.550) 8.550 16.724 ( -0.000 -0.000 -5.211) 5.211 16.724 ( -0.000 -0.000 -5.211) 5.211 17.386 ( 0.000 0.000 4.098) 4.098 17.386 ( 0.000 0.000 4.098) 4.098 17.953 ( -0.000 -0.000 -3.043) 3.043 18.900 ( 0.000 0.000 2.066) 2.066 ======================= Grid point 481 (236/294) ======================= q-point: ( 0.33 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.023 ( -4.056 -5.753 18.213) 19.526 1.370 ( 4.268 11.208 19.116) 22.567 1.800 ( 8.183 1.309 25.255) 26.580 2.560 ( -6.740 -6.803 -14.893) 17.706 2.887 ( 5.045 2.115 -15.493) 16.431 3.723 ( -7.890 0.517 -10.118) 12.841 3.756 ( -3.154 -4.367 -12.188) 13.325 3.932 ( 4.985 2.484 -8.810) 10.423 5.321 ( -4.437 -2.791 -5.858) 7.861 6.397 ( -1.153 -1.823 5.475) 5.885 6.531 ( 4.089 3.765 3.864) 6.769 7.186 ( -8.564 -6.882 9.182) 14.318 7.440 ( 1.639 2.135 0.753) 2.795 7.521 ( -3.448 10.079 11.326) 15.549 7.586 ( 11.749 -5.539 10.764) 16.870 9.150 ( -2.934 -5.634 -5.166) 8.188 9.214 ( -5.568 2.380 -9.771) 11.495 9.420 ( 6.561 2.802 -6.581) 9.706 16.619 ( -3.526 -0.582 -3.953) 5.328 16.837 ( 8.993 4.133 -6.005) 11.576 17.326 ( -6.346 -2.670 5.094) 8.565 17.438 ( 1.779 0.395 3.119) 3.613 17.937 ( -0.048 -0.203 -3.231) 3.237 18.865 ( -3.792 -2.652 1.804) 4.967 ======================= Grid point 482 (237/294) ======================= q-point: ( 0.42 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.063 ( 1.662 -1.254 13.165) 13.328 1.644 ( 2.115 13.705 15.944) 21.131 2.056 ( 4.381 1.255 15.157) 15.827 2.352 ( 0.662 -9.089 -8.331) 12.347 2.841 ( 0.870 -4.584 -9.339) 10.440 3.441 ( -13.561 -1.419 -14.134) 19.639 3.665 ( -1.043 -0.855 -7.359) 7.482 4.016 ( 5.736 3.808 -5.534) 8.833 5.166 ( -5.900 -4.128 -5.873) 9.292 6.408 ( 0.091 -1.046 5.665) 5.761 6.644 ( 3.210 3.352 1.762) 4.964 7.065 ( -5.278 -4.576 6.922) 9.834 7.474 ( -0.062 1.242 0.926) 1.550 7.607 ( -0.007 3.262 7.997) 8.637 7.783 ( 8.830 -0.114 6.269) 10.830 9.020 ( -4.038 -4.837 -3.137) 7.039 9.089 ( -5.321 1.909 -8.081) 9.862 9.514 ( 5.590 2.535 -4.319) 7.505 16.562 ( -1.664 1.135 -1.748) 2.667 16.995 ( 9.222 4.279 -6.513) 12.073 17.218 ( -7.069 -2.893 6.555) 10.065 17.487 ( 1.936 0.525 1.732) 2.650 17.903 ( -0.954 -1.028 -3.772) 4.024 18.755 ( -6.089 -4.515 0.255) 7.584 ======================= Grid point 483 (238/294) ======================= q-point: ( 0.50 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.189 ( 5.215 3.037 7.039) 9.272 1.815 ( 0.255 2.444 2.980) 3.863 2.118 ( -5.661 10.112 5.943) 13.024 2.309 ( 6.119 -13.508 -2.713) 15.075 2.801 ( 1.496 -2.604 2.608) 3.978 3.158 ( -9.605 -1.489 -6.669) 11.787 3.602 ( -1.567 -0.009 -6.115) 6.312 4.097 ( 2.278 2.383 -1.490) 3.618 5.005 ( -4.413 -3.519 -7.159) 9.116 6.444 ( 1.079 0.055 5.165) 5.277 6.704 ( 1.607 0.412 -1.058) 1.968 7.011 ( -1.784 -1.273 3.430) 4.071 7.476 ( -0.981 0.345 1.049) 1.477 7.674 ( 2.624 -0.720 2.991) 4.044 7.914 ( 2.975 3.380 -1.340) 4.697 8.902 ( -3.850 -4.378 0.256) 5.835 9.010 ( -2.569 2.212 -1.895) 3.884 9.592 ( 3.662 1.692 -1.939) 4.476 16.570 ( 0.877 2.569 0.892) 2.857 17.074 ( -3.558 -0.168 2.914) 4.602 17.181 ( 4.693 0.976 -1.208) 4.943 17.529 ( 1.917 0.585 0.063) 2.006 17.848 ( -1.321 -1.553 -4.184) 4.654 18.593 ( -7.251 -5.068 -2.704) 9.250 ======================= Grid point 484 (239/294) ======================= q-point: ( 0.58 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( 6.744 5.163 1.108) 8.566 1.765 ( -0.857 -7.037 -5.500) 8.972 2.053 ( -6.031 -5.772 -3.879) 9.205 2.319 ( -0.081 3.480 2.897) 4.528 2.785 ( -5.178 6.506 0.418) 8.326 3.118 ( 4.025 -3.380 9.853) 11.168 3.558 ( 0.174 -0.549 -1.972) 2.055 4.099 ( -3.606 -1.295 4.039) 5.567 4.893 ( -0.690 -0.715 -9.631) 9.682 6.496 ( 1.438 0.236 4.683) 4.904 6.697 ( 1.563 -2.475 -6.027) 6.701 7.004 ( -0.751 0.533 0.545) 1.070 7.474 ( 0.209 0.245 0.631) 0.709 7.694 ( -0.372 -0.927 -2.178) 2.396 7.930 ( -0.680 3.764 -7.936) 8.810 8.816 ( -3.747 -3.235 3.412) 6.012 9.043 ( 2.759 1.993 5.933) 6.840 9.640 ( 1.281 0.847 0.189) 1.547 16.645 ( 3.095 3.575 3.394) 5.821 17.008 ( -5.783 -1.325 7.245) 9.364 17.275 ( 5.796 1.295 -3.719) 7.008 17.554 ( 1.131 -0.425 -1.290) 1.767 17.794 ( -0.556 -1.135 -4.185) 4.372 18.407 ( -6.734 -3.929 -6.516) 10.161 ======================= Grid point 485 (240/294) ======================= q-point: ( 0.67 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( 5.513 4.219 -1.975) 7.218 1.582 ( -3.560 -13.379 -10.627) 17.453 1.894 ( -6.639 0.519 -7.540) 10.059 2.334 ( 1.106 -0.818 3.586) 3.841 2.849 ( -0.260 11.929 3.165) 12.344 3.191 ( -1.671 -2.978 13.755) 14.173 3.604 ( 6.020 -1.200 3.830) 7.236 4.022 ( -5.832 -3.359 6.752) 9.533 4.857 ( 2.167 2.431 -10.794) 11.275 6.536 ( 0.441 -1.635 4.838) 5.126 6.651 ( 2.595 -3.021 -12.170) 12.806 6.989 ( -1.626 0.096 -0.512) 1.708 7.495 ( 1.177 0.284 0.056) 1.212 7.609 ( -6.381 2.643 -7.660) 10.314 7.913 ( 2.040 0.677 -7.934) 8.220 8.759 ( -4.033 -1.217 6.338) 7.610 9.181 ( 6.330 1.007 8.844) 10.922 9.652 ( -1.027 0.407 1.672) 2.004 16.765 ( 3.415 4.462 5.198) 7.654 16.957 ( -3.985 -1.527 8.044) 9.106 17.344 ( 4.061 0.545 -3.250) 5.230 17.532 ( -0.794 -3.310 -1.597) 3.760 17.768 ( 0.843 0.474 -4.241) 4.350 18.246 ( -3.857 -1.128 -9.869) 10.656 ======================= Grid point 486 (241/294) ======================= q-point: (-0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( -7.511 -13.600 -6.575) 16.871 1.612 ( 1.348 3.410 -10.172) 10.813 1.726 ( -5.446 3.922 -8.161) 10.566 2.446 ( 9.750 -1.786 6.400) 11.798 2.976 ( 2.346 7.427 -1.068) 7.861 3.165 ( -9.101 -2.100 20.270) 22.318 3.743 ( 7.548 0.072 4.486) 8.781 3.966 ( -1.714 -1.711 6.442) 6.882 4.874 ( 3.083 4.630 -10.411) 11.804 6.522 ( 0.608 -4.846 -2.098) 5.316 6.599 ( 0.993 -1.250 -8.529) 8.677 6.950 ( -2.465 -0.454 -0.349) 2.530 7.418 ( -5.958 -2.888 -6.639) 9.376 7.567 ( -0.774 5.768 -2.501) 6.334 7.915 ( 3.115 0.014 -7.255) 7.895 8.738 ( -2.909 -0.226 8.244) 8.745 9.344 ( 6.736 0.273 7.488) 10.075 9.637 ( -2.647 0.534 2.371) 3.593 16.866 ( -2.315 6.083 6.065) 8.896 16.961 ( 2.381 -3.068 8.168) 9.044 17.378 ( 1.761 0.454 -3.660) 4.087 17.452 ( -2.348 -5.799 -1.509) 6.436 17.782 ( 2.886 1.727 -4.689) 5.771 18.162 ( 0.353 1.882 -10.322) 10.498 ======================= Grid point 493 (242/294) ======================= q-point: ( 0.33 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( -3.433 -8.713 18.967) 21.153 1.419 ( 6.625 2.007 19.527) 20.717 1.976 ( -1.477 10.495 21.401) 23.881 2.516 ( -2.829 -3.803 -12.752) 13.604 2.781 ( -0.392 5.024 -15.848) 16.630 3.629 ( 2.742 -7.276 -13.053) 15.193 3.793 ( -1.917 1.039 -11.836) 12.035 3.810 ( 0.848 1.812 -6.935) 7.218 5.284 ( -0.180 -5.581 -5.815) 8.062 6.442 ( -1.369 -0.463 5.072) 5.274 6.542 ( 1.563 4.028 4.159) 5.997 7.325 ( -8.856 -6.331 9.046) 14.154 7.372 ( 9.274 -4.336 8.360) 13.218 7.472 ( 1.359 -2.925 5.688) 6.539 7.717 ( -2.592 8.516 7.367) 11.555 9.084 ( -0.751 -6.120 -5.688) 8.388 9.243 ( 3.305 1.825 -6.164) 7.228 9.352 ( -1.965 6.316 -8.985) 11.157 16.646 ( 2.119 1.739 -3.944) 4.803 16.758 ( -1.857 5.079 -5.111) 7.441 17.395 ( 4.160 -3.189 3.757) 6.449 17.413 ( -3.876 -1.664 3.642) 5.573 17.920 ( -0.156 -0.202 -3.246) 3.256 18.870 ( -0.318 -5.565 1.777) 5.850 ======================= Grid point 494 (243/294) ======================= q-point: ( 0.42 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( -1.099 -4.571 16.563) 17.217 1.687 ( 9.331 0.763 15.642) 18.230 2.117 ( 0.896 -1.886 3.998) 4.510 2.368 ( -8.630 8.666 0.978) 12.269 2.738 ( 1.572 -1.458 -8.951) 9.204 3.506 ( -4.893 -2.769 -15.533) 16.519 3.640 ( -3.728 -0.041 -6.398) 7.405 3.897 ( 7.859 3.440 -8.109) 11.805 5.159 ( -3.544 -7.175 -5.099) 9.489 6.445 ( -1.130 0.116 5.436) 5.554 6.643 ( 2.624 3.757 2.389) 5.168 7.172 ( -8.333 -6.303 9.766) 14.302 7.471 ( 1.608 1.246 -0.171) 2.042 7.542 ( 7.651 -10.827 9.975) 16.591 7.779 ( 0.494 5.348 2.682) 6.004 9.004 ( -1.625 -3.131 -1.553) 3.854 9.189 ( -6.465 4.999 -6.911) 10.703 9.413 ( 6.467 4.195 -6.772) 10.261 16.628 ( -3.927 4.674 -1.926) 6.401 16.846 ( 8.675 4.247 -6.148) 11.449 17.334 ( -5.800 -2.770 4.975) 8.128 17.449 ( 3.218 -1.825 2.357) 4.387 17.884 ( -0.832 -1.485 -3.778) 4.144 18.780 ( -3.636 -8.099 1.259) 8.966 ======================= Grid point 495 (244/294) ======================= q-point: ( 0.50 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( 2.591 0.431 11.620) 11.913 1.814 ( -0.785 -3.008 1.959) 3.675 2.050 ( 4.405 -14.206 -3.791) 15.349 2.401 ( -5.184 13.948 4.235) 15.471 2.771 ( 3.592 1.708 7.826) 8.779 3.262 ( -10.618 -1.224 -12.050) 16.107 3.590 ( -0.626 0.753 -4.263) 4.374 4.021 ( 7.611 4.340 -6.956) 11.187 4.993 ( -4.547 -7.288 -4.702) 9.793 6.473 ( 0.031 0.890 5.717) 5.786 6.695 ( -0.209 0.303 0.182) 0.411 7.062 ( -4.422 -4.035 6.135) 8.572 7.472 ( 0.173 -3.213 -0.314) 3.233 7.598 ( 4.900 -5.314 3.052) 7.846 7.874 ( 4.409 2.168 0.051) 4.913 8.931 ( -3.762 -2.761 -0.092) 4.667 9.115 ( -5.550 7.448 -2.184) 9.542 9.520 ( 5.874 3.071 -3.876) 7.678 16.621 ( -1.929 5.228 0.596) 5.604 16.998 ( 8.873 4.135 -6.362) 11.675 17.242 ( -6.053 -2.355 6.133) 8.933 17.492 ( 2.562 -0.981 0.640) 2.817 17.824 ( -1.176 -2.665 -4.074) 5.008 18.623 ( -5.726 -9.085 -0.544) 10.753 ======================= Grid point 496 (245/294) ======================= q-point: ( 0.58 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 3.867 2.778 4.915) 6.843 1.707 ( -3.538 -6.324 -4.543) 8.552 1.938 ( 1.702 -15.022 -2.030) 15.254 2.478 ( -4.248 10.749 0.269) 11.561 2.891 ( -0.001 4.418 2.986) 5.333 3.094 ( -0.929 -1.824 2.646) 3.345 3.580 ( -1.512 3.831 0.826) 4.201 4.118 ( 2.913 2.082 -2.170) 4.187 4.841 ( -2.369 -5.367 -5.903) 8.322 6.521 ( 0.386 1.297 5.602) 5.764 6.639 ( -2.277 -4.648 -3.816) 6.431 7.020 ( -1.024 -1.265 1.403) 2.148 7.446 ( 1.539 -3.302 -0.536) 3.683 7.642 ( 3.401 -2.002 -0.123) 3.948 7.921 ( 0.604 1.952 -6.078) 6.413 8.849 ( -2.720 -3.691 2.517) 5.230 9.125 ( -2.839 7.707 3.522) 8.937 9.609 ( 3.768 2.030 -1.163) 4.435 16.672 ( 0.929 5.255 2.891) 6.069 17.106 ( 0.829 2.299 -0.736) 2.552 17.189 ( 0.545 -0.612 2.083) 2.238 17.515 ( 1.507 -1.107 -1.404) 2.338 17.762 ( -0.389 -2.517 -3.456) 4.293 18.429 ( -6.403 -8.223 -3.522) 11.001 ======================= Grid point 497 (246/294) ======================= q-point: ( 0.67 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( 2.757 -1.088 -4.857) 5.690 1.553 ( -4.370 -7.005 -0.577) 8.277 1.862 ( 2.544 -6.570 -0.856) 7.097 2.424 ( -8.089 5.614 -4.181) 10.697 2.911 ( 0.751 3.562 -4.605) 5.870 3.193 ( 6.524 -3.947 12.451) 14.600 3.636 ( -1.696 8.146 7.867) 11.451 4.114 ( -3.859 -2.031 4.472) 6.246 4.769 ( 2.344 -0.964 -8.486) 8.856 6.508 ( -0.976 -7.037 -7.141) 10.073 6.577 ( 0.036 1.720 2.802) 3.288 7.000 ( -0.727 -1.063 -0.720) 1.475 7.458 ( 2.533 -1.344 -0.854) 2.993 7.655 ( -0.225 0.463 -2.727) 2.775 7.874 ( -2.064 2.650 -9.883) 10.439 8.808 ( -0.930 -4.182 5.722) 7.148 9.200 ( 0.642 5.669 6.510) 8.657 9.664 ( 1.307 0.935 0.885) 1.834 16.776 ( 3.365 4.496 4.595) 7.256 17.076 ( -5.369 0.540 6.289) 8.286 17.255 ( 5.146 1.121 -3.558) 6.355 17.492 ( -0.290 -3.859 -2.484) 4.599 17.737 ( 0.942 0.034 -2.705) 2.864 18.239 ( -4.858 -5.263 -6.894) 9.941 ======================= Grid point 498 (247/294) ======================= q-point: (-0.25 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.273 ( -5.671 -7.893 -3.716) 10.405 1.521 ( 3.478 -0.115 -0.842) 3.580 1.823 ( -3.685 2.190 -9.100) 10.059 2.369 ( 0.043 0.588 1.891) 1.981 2.942 ( 4.360 1.196 -5.312) 6.976 3.299 ( 1.633 -6.332 14.069) 15.514 3.745 ( -0.585 6.876 9.783) 11.972 4.046 ( -4.585 -1.546 6.439) 8.054 4.791 ( 4.735 2.967 -8.909) 10.517 6.392 ( 1.293 -5.477 -11.703) 12.986 6.602 ( -1.150 0.820 3.580) 3.849 6.966 ( -1.161 -1.525 -1.189) 2.255 7.444 ( -2.639 -2.014 -3.680) 4.956 7.633 ( -2.036 6.171 -4.318) 7.802 7.832 ( 1.406 0.960 -7.737) 7.922 8.796 ( -0.698 -3.666 7.084) 8.006 9.315 ( 3.403 2.917 6.880) 8.211 9.679 ( -0.790 -0.222 1.863) 2.036 16.903 ( 4.514 1.294 5.443) 7.189 17.041 ( -5.040 2.946 6.834) 8.988 17.316 ( 3.728 0.929 -3.658) 5.305 17.411 ( -1.655 -7.095 -1.797) 7.504 17.748 ( 0.855 2.119 -3.615) 4.276 18.118 ( -0.714 -0.575 -8.493) 8.543 ======================= Grid point 505 (248/294) ======================= q-point: ( 0.33 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( 1.482 -3.553 16.821) 17.256 1.505 ( -5.695 -5.704 19.703) 21.288 2.121 ( 1.041 0.736 0.114) 1.280 2.504 ( 2.815 11.721 2.684) 12.349 2.794 ( -4.785 3.562 -12.353) 13.718 3.389 ( 7.305 -8.780 -12.907) 17.235 3.673 ( 4.780 0.217 -6.460) 8.039 3.891 ( -7.762 2.773 -8.252) 11.663 5.169 ( 3.090 -6.328 -5.392) 8.869 6.475 ( 1.360 0.932 5.721) 5.954 6.604 ( -2.667 2.281 2.359) 4.228 7.208 ( 9.185 -5.246 8.921) 13.838 7.455 ( -1.720 0.159 0.771) 1.892 7.502 ( -8.163 -7.303 11.177) 15.649 7.832 ( -1.635 3.394 0.418) 3.790 9.013 ( 0.960 -2.885 -1.995) 3.636 9.128 ( 7.061 2.542 -6.310) 9.805 9.440 ( -5.588 5.341 -6.375) 10.020 16.582 ( 3.672 2.036 -1.664) 4.517 16.882 ( -7.982 6.214 -5.855) 11.688 17.302 ( 5.388 -4.554 5.303) 8.825 17.469 ( -2.483 -0.699 2.103) 3.328 17.892 ( 0.553 -1.010 -3.701) 3.876 18.793 ( 3.197 -7.325 0.716) 8.024 ======================= Grid point 506 (249/294) ======================= q-point: ( 0.42 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.201 ( -2.918 -5.256 17.639) 18.636 1.619 ( 7.819 -3.476 17.972) 19.905 2.064 ( -1.731 -5.188 -10.103) 11.489 2.641 ( -8.934 4.888 -5.927) 11.783 2.691 ( 1.906 10.063 5.814) 11.777 3.381 ( 5.782 -2.235 -10.874) 12.517 3.710 ( -5.139 1.955 -8.218) 9.888 3.760 ( 3.665 2.068 -7.606) 8.693 5.092 ( -0.552 -8.127 -4.323) 9.222 6.501 ( -1.589 0.254 4.893) 5.151 6.651 ( 2.160 3.343 2.109) 4.504 7.300 ( -3.263 -10.903 10.995) 15.824 7.379 ( 1.852 -5.482 9.715) 11.308 7.459 ( 0.599 -0.929 0.085) 1.108 7.804 ( -0.522 -0.347 -3.821) 3.872 9.006 ( -0.726 -0.349 1.316) 1.543 9.242 ( 5.400 5.024 -3.834) 8.313 9.368 ( -3.761 6.388 -8.540) 11.308 16.686 ( 5.073 5.357 -1.460) 7.521 16.797 ( -4.677 5.605 -5.283) 9.011 17.361 ( 3.022 -4.476 3.981) 6.710 17.428 ( -2.362 -0.883 2.849) 3.804 17.856 ( -0.462 -2.316 -3.961) 4.611 18.734 ( -0.541 -10.502 1.081) 10.571 ======================= Grid point 507 (250/294) ======================= q-point: ( 0.50 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( 0.320 -0.821 15.428) 15.453 1.780 ( 6.089 -7.920 10.031) 14.157 1.886 ( -4.672 -7.398 -10.056) 13.330 2.524 ( -1.936 1.263 -4.414) 4.982 2.855 ( 0.097 8.927 8.069) 12.034 3.337 ( -6.424 3.011 -10.752) 12.882 3.607 ( -1.602 3.111 -1.255) 3.717 3.872 ( 9.348 4.303 -8.917) 13.617 4.959 ( -3.155 -8.707 -2.886) 9.700 6.517 ( -0.366 0.762 5.204) 5.273 6.704 ( 0.129 0.497 0.068) 0.518 7.145 ( -7.204 -9.342 8.349) 14.452 7.394 ( 2.022 -8.893 3.012) 9.605 7.504 ( 4.104 0.298 1.049) 4.246 7.813 ( 3.786 -0.068 -1.697) 4.149 8.969 ( -3.426 -1.424 -0.283) 3.721 9.280 ( -5.743 9.346 -1.494) 11.070 9.420 ( 7.352 4.311 -5.311) 10.042 16.731 ( -4.419 6.884 -0.490) 8.195 16.863 ( 8.460 4.899 -4.718) 10.855 17.330 ( -3.570 -2.986 3.524) 5.838 17.445 ( 2.336 -1.120 2.372) 3.512 17.791 ( -1.155 -3.534 -3.769) 5.294 18.599 ( -3.369 -11.986 0.586) 12.464 ======================= Grid point 508 (251/294) ======================= q-point: ( 0.58 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( 0.712 2.097 10.321) 10.556 1.687 ( -3.537 -8.920 -7.004) 11.879 1.771 ( 0.839 -10.077 2.947) 10.533 2.564 ( 2.726 3.469 1.062) 4.538 2.918 ( -0.306 0.854 -2.854) 2.995 3.168 ( -8.686 2.614 -4.300) 10.038 3.684 ( -0.224 9.618 7.321) 12.089 4.019 ( 8.997 4.594 -7.986) 12.877 4.807 ( -3.747 -8.269 -1.726) 9.241 6.557 ( 0.248 0.214 5.162) 5.172 6.636 ( -4.433 -5.060 -1.897) 6.990 7.032 ( -2.275 -4.492 2.301) 5.536 7.368 ( 2.213 -5.060 0.977) 5.609 7.571 ( 3.630 -0.275 0.044) 3.641 7.873 ( 3.590 0.032 -1.763) 4.000 8.880 ( -4.121 -2.447 -0.600) 4.830 9.279 ( -4.280 8.641 0.553) 9.659 9.548 ( 5.664 3.516 -1.555) 6.845 16.742 ( -1.501 5.894 0.565) 6.108 17.022 ( 7.647 5.030 -3.446) 9.780 17.262 ( -4.312 -1.857 3.651) 5.947 17.477 ( 1.324 -0.902 0.229) 1.618 17.723 ( -0.461 -3.517 -2.256) 4.204 18.417 ( -5.025 -11.514 -1.058) 12.607 ======================= Grid point 509 (252/294) ======================= q-point: ( 0.67 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.372 ( -2.823 -0.486 -0.133) 2.867 1.547 ( -2.295 -6.624 0.936) 7.072 1.740 ( 4.116 -6.568 3.021) 8.319 2.579 ( -5.744 4.872 -4.714) 8.886 2.866 ( 0.188 -1.826 -8.124) 8.329 3.124 ( 2.506 -1.949 5.311) 6.188 3.823 ( -1.879 11.340 10.035) 15.258 4.132 ( 3.391 2.433 -1.883) 4.578 4.687 ( -0.491 -5.420 -2.651) 6.054 6.444 ( -4.709 -8.218 -4.976) 10.699 6.625 ( -0.020 2.411 4.596) 5.190 6.988 ( -0.523 -2.328 -0.911) 2.554 7.386 ( 3.453 -1.997 -0.012) 3.989 7.618 ( 2.717 -0.117 -1.128) 2.944 7.885 ( -0.825 1.986 -5.418) 5.830 8.806 ( -1.580 -4.071 2.609) 5.087 9.307 ( -2.291 6.839 2.277) 7.564 9.641 ( 3.150 1.640 0.294) 3.563 16.796 ( 1.431 4.097 1.540) 4.605 17.156 ( 5.071 4.422 -1.686) 6.936 17.203 ( -3.543 -0.677 2.982) 4.680 17.457 ( -1.277 -3.127 -1.239) 3.598 17.705 ( 1.647 -0.321 -0.574) 1.773 18.223 ( -4.907 -8.847 -3.477) 10.697 ======================= Grid point 510 (253/294) ======================= q-point: (-0.25 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.291 ( -3.877 -0.991 -1.539) 4.287 1.486 ( -0.307 -4.692 2.905) 5.527 1.784 ( 3.270 -0.598 -2.242) 4.010 2.473 ( -8.117 4.186 -2.578) 9.490 2.818 ( 3.708 -3.959 -7.023) 8.874 3.226 ( 6.633 -3.511 7.326) 10.488 3.918 ( -3.721 5.907 8.569) 11.052 4.136 ( -3.695 -1.269 4.264) 5.783 4.685 ( 5.169 1.067 -4.939) 7.228 6.294 ( -1.792 -3.604 -7.197) 8.246 6.662 ( -1.399 2.059 4.212) 4.892 6.949 ( -0.409 -2.611 -2.072) 3.358 7.421 ( 1.765 -0.682 -1.458) 2.389 7.651 ( 2.180 1.728 -2.309) 3.615 7.834 ( -3.607 3.863 -7.464) 9.146 8.781 ( 0.849 -5.493 5.443) 7.780 9.359 ( -0.047 4.700 3.554) 5.892 9.681 ( 0.819 -0.879 0.950) 1.532 16.868 ( 3.068 0.208 1.948) 3.641 17.175 ( -2.693 2.750 3.060) 4.917 17.251 ( 3.383 2.818 -1.082) 4.534 17.373 ( -2.884 -6.002 -0.314) 6.666 17.742 ( 1.123 2.457 -1.222) 2.966 18.078 ( -1.724 -3.539 -5.382) 6.668 ======================= Grid point 517 (254/294) ======================= q-point: ( 0.33 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.227 ( 0.520 -0.340 12.526) 12.541 1.686 ( -10.717 -8.037 15.025) 20.129 2.032 ( 2.210 -3.308 -8.019) 8.951 2.558 ( 7.526 12.006 -3.272) 14.543 2.835 ( 0.693 0.788 -2.108) 2.355 3.157 ( 3.753 -3.396 -3.725) 6.285 3.586 ( 2.332 0.325 -3.567) 4.274 4.004 ( -7.359 2.916 -6.179) 10.042 5.017 ( 4.579 -5.594 -5.206) 8.909 6.490 ( 1.368 0.537 5.690) 5.877 6.677 ( -2.824 1.306 0.063) 3.113 7.084 ( 5.891 -4.081 5.898) 9.281 7.460 ( -0.549 -1.771 0.817) 2.026 7.645 ( -6.606 -2.457 7.398) 10.218 7.834 ( -1.289 -3.236 -6.891) 7.721 8.977 ( 3.992 -0.308 0.116) 4.006 9.026 ( 3.194 4.012 -0.704) 5.176 9.540 ( -4.661 4.024 -3.896) 7.287 16.568 ( 0.484 2.631 1.190) 2.928 17.028 ( -6.353 4.920 -5.080) 9.506 17.214 ( 3.917 -3.096 5.478) 7.412 17.508 ( -1.986 -0.104 0.481) 2.047 17.841 ( 1.263 -1.639 -4.124) 4.614 18.641 ( 6.028 -8.370 -1.383) 10.407 ======================= Grid point 518 (255/294) ======================= q-point: ( 0.42 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( -1.042 -3.902 14.368) 14.925 1.611 ( -0.579 -6.209 17.264) 18.355 1.967 ( 0.505 -3.768 -11.779) 12.377 2.648 ( -1.837 1.752 -10.238) 10.548 2.851 ( 0.974 2.799 2.395) 3.811 3.228 ( 7.270 5.448 -2.256) 9.361 3.648 ( 3.985 3.713 -0.907) 5.521 3.849 ( -9.731 3.302 -8.825) 13.545 4.983 ( 1.896 -7.454 -3.844) 8.599 6.537 ( 0.431 -1.741 5.230) 5.529 6.666 ( -0.115 2.427 0.365) 2.457 7.160 ( 6.014 -10.467 6.805) 13.858 7.441 ( 0.174 -1.562 0.145) 1.578 7.528 ( -9.643 -2.994 9.892) 14.135 7.748 ( 0.764 -3.614 -7.505) 8.365 9.019 ( 1.123 -0.346 0.444) 1.256 9.158 ( 6.409 7.056 -1.467) 9.645 9.479 ( -5.352 6.151 -4.898) 9.512 16.646 ( 3.862 4.982 0.562) 6.329 16.939 ( -7.295 6.762 -5.009) 11.137 17.281 ( 4.332 -4.012 5.030) 7.757 17.472 ( -2.305 -0.735 1.048) 2.637 17.810 ( 0.279 -2.875 -3.895) 4.849 18.613 ( 2.804 -11.892 -0.143) 12.219 ======================= Grid point 519 (256/294) ======================= q-point: ( 0.50 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.321 ( 0.056 -2.588 14.616) 14.843 1.658 ( 2.248 -8.185 5.867) 10.319 1.867 ( -1.619 -4.465 -2.859) 5.544 2.523 ( -3.398 -1.368 -6.808) 7.731 2.902 ( 2.193 -0.375 -1.549) 2.711 3.419 ( 3.188 12.968 -3.967) 13.931 3.680 ( -5.915 2.984 -6.181) 9.061 3.758 ( 3.830 6.117 -0.232) 7.221 4.899 ( -0.930 -8.300 -2.136) 8.621 6.545 ( 0.250 -2.295 4.904) 5.420 6.694 ( 0.776 -0.160 -1.040) 1.308 7.121 ( 0.297 -14.205 4.213) 14.820 7.413 ( -7.095 -3.453 9.952) 12.700 7.463 ( 2.445 1.190 -0.539) 2.772 7.732 ( 3.684 -1.203 -2.663) 4.702 9.003 ( -2.145 -1.160 -0.878) 2.592 9.315 ( 6.689 5.469 -5.559) 10.274 9.444 ( -4.432 8.832 -0.704) 9.906 16.773 ( 5.299 5.301 -3.020) 8.081 16.880 ( -5.205 7.847 -0.548) 9.433 17.321 ( 1.887 -3.905 2.307) 4.912 17.446 ( -0.850 -0.263 2.339) 2.503 17.754 ( -0.821 -3.710 -2.853) 4.752 18.512 ( -0.328 -13.694 0.576) 13.710 ======================= Grid point 520 (257/294) ======================= q-point: ( 0.58 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( 2.583 -0.878 13.757) 14.025 1.569 ( -1.781 -7.415 -5.686) 9.513 1.777 ( -4.546 -7.574 4.306) 9.827 2.512 ( 4.648 0.368 -0.024) 4.663 2.883 ( -0.137 -2.336 -6.282) 6.704 3.351 ( -12.040 6.012 -8.805) 16.082 3.804 ( 9.259 10.639 0.673) 14.120 3.876 ( 2.941 6.711 0.285) 7.333 4.779 ( -2.963 -8.600 -0.062) 9.096 6.560 ( 0.736 -5.178 4.857) 7.137 6.647 ( -2.453 -2.551 -2.016) 4.073 7.022 ( -1.291 -6.699 2.088) 7.135 7.345 ( -2.840 -3.072 5.856) 7.197 7.519 ( 3.067 0.437 0.104) 3.100 7.795 ( 4.935 -0.581 0.649) 5.011 8.924 ( -4.387 -1.602 -2.377) 5.240 9.376 ( 0.643 5.349 -7.240) 9.024 9.519 ( 1.848 6.841 2.951) 7.676 16.811 ( -1.194 5.152 -5.500) 7.630 16.972 ( 4.059 6.987 3.257) 8.712 17.295 ( -1.163 -2.633 -0.540) 2.928 17.467 ( 0.722 0.347 2.754) 2.868 17.691 ( -0.936 -3.676 -0.494) 3.826 18.361 ( -2.695 -13.470 0.450) 13.744 ======================= Grid point 521 (258/294) ======================= q-point: ( 0.67 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( -5.054 -1.020 -1.064) 5.265 1.506 ( 1.551 -5.853 7.236) 9.436 1.675 ( -0.108 -5.809 5.125) 7.748 2.601 ( 3.019 0.793 -1.887) 3.648 2.805 ( -0.550 -1.823 -7.979) 8.203 3.181 ( -7.950 2.681 -3.120) 8.952 3.971 ( 1.680 4.958 0.028) 5.235 4.052 ( 7.661 9.765 0.063) 12.412 4.655 ( -2.902 -7.660 2.268) 8.499 6.443 ( -5.690 -7.966 0.062) 9.790 6.658 ( 1.503 1.701 3.362) 4.056 6.970 ( -0.993 -2.873 -0.394) 3.066 7.334 ( 1.110 -1.694 2.801) 3.457 7.566 ( 2.752 -0.040 -0.701) 2.840 7.864 ( 2.812 0.358 0.182) 2.840 8.823 ( -3.792 -2.424 -1.465) 4.733 9.394 ( -0.659 5.522 -3.560) 6.603 9.614 ( 2.379 2.656 1.301) 3.796 16.817 ( -0.020 3.608 -3.424) 4.975 17.109 ( 4.090 3.710 1.186) 5.648 17.255 ( -1.215 0.452 -0.662) 1.455 17.473 ( -2.274 -0.740 2.129) 3.201 17.675 ( 1.684 -0.680 1.695) 2.484 18.190 ( -3.794 -10.983 -0.404) 11.627 ======================= Grid point 522 (259/294) ======================= q-point: ( 0.75 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.360 ( -4.728 0.756 0.787) 4.853 1.461 ( -0.700 -5.978 3.323) 6.875 1.727 ( 3.513 -1.000 4.602) 5.875 2.574 ( -1.590 0.096 -4.922) 5.174 2.739 ( -3.030 -0.777 -5.869) 6.651 3.152 ( 2.642 0.574 2.223) 3.500 4.015 ( -0.079 1.507 -0.559) 1.609 4.175 ( 0.025 0.240 0.061) 0.249 4.613 ( 2.255 -0.771 2.713) 3.611 6.307 ( -4.819 -1.109 0.066) 4.945 6.717 ( 0.541 2.118 3.629) 4.236 6.917 ( -1.121 -3.223 -2.256) 4.091 7.375 ( 2.958 0.456 0.898) 3.125 7.603 ( 2.783 0.021 -1.527) 3.175 7.883 ( -1.356 2.639 -2.574) 3.928 8.752 ( -0.962 -4.342 1.512) 4.698 9.420 ( -0.415 4.713 -0.867) 4.810 9.655 ( 1.216 -1.301 0.322) 1.810 16.831 ( 1.384 -0.041 -2.255) 2.646 17.164 ( 2.197 0.700 -3.626) 4.297 17.277 ( 0.191 2.065 3.169) 3.788 17.414 ( -4.690 -1.279 3.467) 5.971 17.737 ( 2.470 2.916 0.826) 3.910 18.049 ( -2.458 -5.607 -1.348) 6.268 ======================= Grid point 530 (260/294) ======================= q-point: ( 0.33 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( -3.057 0.811 6.968) 7.652 1.803 ( -1.954 -1.622 -0.110) 2.542 1.943 ( -2.389 -9.652 -4.057) 10.739 2.475 ( 9.705 8.975 -3.309) 13.627 2.715 ( 3.590 -7.323 -0.457) 8.168 3.192 ( -2.234 2.636 4.326) 5.537 3.582 ( 0.433 5.373 2.424) 5.910 4.093 ( -3.540 0.881 -1.664) 4.009 4.870 ( 3.703 -3.934 -6.050) 8.111 6.511 ( -0.547 -0.191 3.583) 3.630 6.706 ( 0.108 1.320 -2.668) 2.979 7.009 ( 2.161 -2.978 2.088) 4.230 7.457 ( -0.900 -2.100 0.470) 2.333 7.676 ( 1.626 -4.204 -5.252) 6.921 7.818 ( -4.941 -1.124 -2.017) 5.454 8.875 ( 4.751 -2.179 -0.777) 5.284 9.098 ( -0.879 7.006 7.534) 10.326 9.614 ( -2.742 2.134 -1.693) 3.865 16.626 ( -2.375 3.164 3.647) 5.380 17.067 ( 2.366 -1.890 3.896) 4.934 17.229 ( -3.720 3.619 -2.215) 5.643 17.538 ( -1.657 0.387 -1.017) 1.983 17.782 ( 1.086 -1.449 -4.298) 4.664 18.435 ( 7.207 -8.484 -4.120) 11.870 ======================= Grid point 531 (261/294) ======================= q-point: ( 0.42 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( -0.037 -2.457 9.457) 9.771 1.698 ( -5.907 -7.133 11.469) 14.742 1.848 ( 1.864 -3.183 -12.080) 12.631 2.619 ( 2.548 3.021 -7.806) 8.749 2.747 ( 6.079 -4.320 0.723) 7.493 3.201 ( 2.631 2.938 -1.265) 4.142 3.701 ( 0.702 10.169 8.044) 12.985 3.991 ( -8.516 3.807 -6.558) 11.403 4.854 ( 3.258 -6.139 -3.897) 7.968 6.513 ( 1.155 -5.284 3.690) 6.547 6.697 ( -1.131 1.910 -1.669) 2.777 7.029 ( 3.421 -6.752 2.902) 8.106 7.422 ( -0.006 -2.129 -0.968) 2.339 7.639 ( 2.022 -2.196 -4.657) 5.532 7.714 ( -7.972 -1.847 5.666) 9.953 8.935 ( 5.620 -1.032 -3.481) 6.691 9.197 ( -0.088 7.098 4.967) 8.664 9.580 ( -3.367 4.488 -2.633) 6.197 16.669 ( 0.464 5.004 2.979) 5.842 17.071 ( -3.841 4.728 -2.916) 6.753 17.222 ( 1.480 -1.678 3.491) 4.147 17.502 ( -1.954 -0.483 -0.676) 2.123 17.755 ( 0.621 -2.324 -3.496) 4.243 18.426 ( 5.399 -11.989 -1.764) 13.267 ======================= Grid point 532 (262/294) ======================= q-point: ( 0.50 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 0.377 -4.436 7.683) 8.880 1.642 ( -2.103 -4.994 6.917) 8.787 1.803 ( 2.354 -4.290 -1.950) 5.268 2.536 ( -4.730 -2.440 -6.829) 8.659 2.811 ( 4.731 -2.272 -0.312) 5.257 3.350 ( 10.665 7.049 -6.036) 14.138 3.814 ( -9.808 3.764 -7.472) 12.892 3.869 ( -1.729 12.560 7.787) 14.879 4.810 ( 1.266 -7.245 -2.250) 7.692 6.495 ( 2.547 -9.297 4.425) 10.606 6.685 ( -0.899 0.733 -2.564) 2.814 7.016 ( 1.601 -7.153 2.390) 7.710 7.428 ( 2.236 0.086 0.079) 2.239 7.587 ( -9.385 -3.285 8.401) 13.017 7.655 ( 2.874 0.227 -0.598) 2.944 8.978 ( 2.833 -1.324 -3.385) 4.609 9.273 ( 1.331 5.499 -2.571) 6.215 9.573 ( -2.649 6.778 -0.510) 7.295 16.756 ( 2.288 5.785 -0.101) 6.221 17.032 ( -5.195 7.367 -1.623) 9.160 17.258 ( 2.774 -3.616 2.661) 5.278 17.467 ( -1.035 -0.548 0.261) 1.200 17.720 ( -0.313 -2.535 -1.580) 3.003 18.365 ( 2.612 -13.756 0.176) 14.003 ======================= Grid point 533 (263/294) ======================= q-point: ( 0.58 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( 3.382 -4.942 5.203) 7.934 1.597 ( -3.122 -0.351 3.019) 4.358 1.773 ( -1.584 -9.974 5.974) 11.733 2.449 ( 1.475 -0.656 -3.234) 3.615 2.835 ( 0.514 -0.782 -2.450) 2.623 3.509 ( -1.501 7.370 -12.442) 14.538 3.667 ( 1.813 4.194 -6.951) 8.318 4.016 ( -0.619 10.157 8.288) 13.124 4.736 ( -0.958 -7.522 0.153) 7.584 6.482 ( 3.301 -10.079 5.946) 12.159 6.649 ( -1.246 -0.136 -3.006) 3.257 6.992 ( 0.072 -3.417 1.861) 3.892 7.454 ( -7.328 -4.760 9.835) 13.156 7.480 ( 1.833 1.409 -0.731) 2.425 7.724 ( 4.242 0.602 2.211) 4.821 8.950 ( -2.066 -1.739 -3.336) 4.292 9.326 ( 3.292 4.901 -7.996) 9.939 9.607 ( -1.480 5.949 1.595) 6.334 16.823 ( 0.748 5.845 -5.631) 8.151 17.046 ( -1.586 5.946 3.705) 7.183 17.260 ( 1.103 -2.590 -1.477) 3.179 17.476 ( 1.053 0.537 2.486) 2.753 17.682 ( -1.195 -2.426 1.201) 2.959 18.261 ( -0.088 -13.402 1.622) 13.500 ======================= Grid point 534 (264/294) ======================= q-point: ( 0.67 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.419 ( 3.298 -1.107 2.986) 4.585 1.573 ( -4.724 -2.039 9.388) 10.705 1.644 ( -1.762 -10.877 3.606) 11.593 2.522 ( 6.369 1.527 -1.635) 6.750 2.783 ( -3.406 0.573 -5.673) 6.642 3.344 ( -10.768 4.097 -8.637) 14.399 3.828 ( 11.258 4.700 -8.808) 15.047 4.118 ( 0.226 4.798 2.841) 5.581 4.655 ( -2.382 -5.490 4.643) 7.575 6.459 ( -1.508 -6.176 6.471) 9.072 6.643 ( 2.152 0.248 -0.139) 2.171 6.967 ( -1.256 -1.855 0.604) 2.321 7.364 ( -4.040 -2.686 6.388) 8.021 7.522 ( 2.280 -0.006 -0.331) 2.304 7.817 ( 4.164 0.442 3.604) 5.524 8.857 ( -4.213 -1.759 -4.059) 6.109 9.382 ( 3.285 4.849 -7.490) 9.508 9.638 ( -0.816 2.483 1.073) 2.826 16.831 ( -1.010 4.175 -6.292) 7.619 17.097 ( 1.271 1.072 0.038) 1.663 17.263 ( 0.848 2.038 0.542) 2.273 17.514 ( -0.215 0.769 2.577) 2.698 17.665 ( 0.301 -0.880 3.752) 3.866 18.140 ( -2.051 -10.639 2.654) 11.155 ======================= Grid point 536 (265/294) ======================= q-point: (-0.25 -0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -4.757 -11.003 7.725) 14.261 1.470 ( -2.640 6.306 0.182) 6.839 1.672 ( 5.945 -4.887 9.227) 12.015 2.563 ( -2.279 1.189 -5.820) 6.363 2.734 ( 1.229 2.301 -5.572) 6.153 3.202 ( -5.718 2.456 -2.871) 6.853 3.944 ( 5.113 -0.455 -7.931) 9.447 4.144 ( 1.786 -1.154 -3.609) 4.189 4.635 ( -1.065 -0.035 8.578) 8.644 6.411 ( -5.044 0.514 6.914) 8.573 6.704 ( 3.983 -0.081 1.365) 4.211 6.916 ( -2.804 -2.148 -0.653) 3.592 7.359 ( 1.066 0.643 3.926) 4.119 7.551 ( 2.284 -0.628 -0.913) 2.538 7.894 ( 1.833 0.972 2.688) 3.396 8.751 ( -3.301 -2.561 -3.302) 5.325 9.435 ( 2.082 4.661 -4.927) 7.094 9.634 ( -0.550 -1.677 -0.138) 1.770 16.804 ( -0.746 0.115 -4.808) 4.867 17.113 ( 2.148 1.125 -5.265) 5.797 17.311 ( -0.089 1.136 4.413) 4.557 17.495 ( -3.225 -0.615 2.837) 4.339 17.729 ( 2.990 2.949 2.704) 4.995 18.043 ( -2.396 -4.984 3.471) 6.530 ======================= Grid point 543 (266/294) ======================= q-point: ( 0.33 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( -5.659 2.013 1.628) 6.223 1.733 ( 7.380 2.391 -8.726) 11.676 1.789 ( 3.168 -12.679 -10.476) 16.749 2.448 ( 3.248 6.581 5.242) 9.018 2.680 ( -4.861 -5.531 6.017) 9.509 3.244 ( -1.877 -2.824 4.077) 5.303 3.690 ( -0.029 10.275 6.896) 12.375 4.104 ( 2.430 -1.711 4.116) 5.077 4.768 ( 0.080 -1.907 -8.398) 8.613 6.540 ( -2.477 -1.017 -1.294) 2.974 6.670 ( 3.426 2.494 -4.775) 6.384 6.972 ( 0.178 -2.689 -0.003) 2.694 7.452 ( -1.989 -3.849 -2.072) 4.802 7.556 ( 3.083 -2.440 -5.698) 6.923 7.876 ( -1.946 2.676 -3.055) 4.503 8.792 ( 2.448 -4.069 3.090) 5.666 9.243 ( -2.381 7.329 8.575) 11.529 9.646 ( -0.673 -0.216 0.122) 0.718 16.730 ( -3.637 1.989 5.126) 6.592 17.031 ( 2.758 -1.417 6.720) 7.401 17.310 ( -3.264 3.710 -3.746) 6.200 17.551 ( -0.304 0.120 -1.691) 1.722 17.738 ( 0.014 -0.154 -4.455) 4.457 18.222 ( 5.536 -6.845 -6.814) 11.133 ======================= Grid point 544 (267/294) ======================= q-point: ( 0.42 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.374 ( -2.877 -0.863 4.834) 5.691 1.675 ( 3.109 -9.840 -8.464) 13.347 1.759 ( 0.039 -0.158 -4.193) 4.196 2.548 ( 3.170 0.389 1.253) 3.430 2.689 ( 1.809 0.609 5.261) 5.597 3.177 ( -1.325 -2.404 -1.698) 3.228 3.849 ( 0.736 10.488 9.392) 14.098 4.104 ( -3.843 2.825 -1.274) 4.936 4.725 ( 2.769 -4.473 -5.552) 7.649 6.458 ( -1.124 -7.009 -1.756) 7.312 6.710 ( 0.530 2.460 -2.524) 3.564 6.956 ( 1.290 -3.825 1.272) 4.233 7.388 ( 0.208 -2.052 -3.009) 3.648 7.571 ( 2.127 0.457 -1.826) 2.840 7.843 ( -4.549 0.785 2.674) 5.334 8.819 ( 4.292 -2.647 -1.042) 5.149 9.312 ( -2.331 5.788 5.750) 8.485 9.636 ( -0.975 1.898 -1.024) 2.367 16.744 ( -1.372 3.601 4.372) 5.828 17.095 ( 2.030 0.091 4.136) 4.608 17.265 ( -3.750 3.271 -2.914) 5.766 17.515 ( -1.576 -1.524 -2.311) 3.186 17.717 ( 0.092 0.127 -3.046) 3.050 18.211 ( 5.973 -9.931 -2.984) 11.967 ======================= Grid point 545 (268/294) ======================= q-point: ( 0.50 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -1.470 -4.036 3.519) 5.553 1.615 ( 2.704 -5.311 -4.852) 7.685 1.743 ( 0.553 -1.584 2.893) 3.344 2.548 ( -3.471 -2.515 -3.133) 5.309 2.744 ( 3.258 -1.003 5.469) 6.444 3.213 ( 7.284 3.515 -4.737) 9.373 3.944 ( -4.907 3.432 -1.132) 6.094 4.069 ( -4.174 10.368 2.554) 11.465 4.699 ( 2.791 -5.533 -3.102) 6.930 6.377 ( 1.677 -10.270 2.373) 10.673 6.699 ( -1.641 1.156 -3.552) 4.080 6.959 ( 1.719 -2.931 2.315) 4.111 7.392 ( 2.134 0.648 -0.747) 2.352 7.605 ( 1.581 0.868 0.020) 1.804 7.770 ( -7.402 -1.227 7.582) 10.667 8.867 ( 5.540 -1.476 -4.181) 7.096 9.329 ( -2.953 3.745 -0.045) 4.769 9.647 ( -0.532 3.828 -0.449) 3.891 16.794 ( 0.249 4.831 1.630) 5.104 17.143 ( -0.395 4.089 0.848) 4.194 17.223 ( -1.957 -0.421 -0.292) 2.023 17.463 ( -0.340 -2.560 -1.718) 3.102 17.707 ( -0.433 0.445 -0.771) 0.990 18.189 ( 4.254 -11.127 0.447) 11.920 ======================= Grid point 546 (269/294) ======================= q-point: ( 0.58 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 1.239 -3.891 3.876) 5.630 1.593 ( 1.952 -3.224 -4.014) 5.506 1.763 ( -0.765 -4.543 10.006) 11.016 2.423 ( -3.081 -2.658 -3.524) 5.383 2.827 ( 1.992 1.650 3.786) 4.586 3.374 ( 10.754 5.191 -8.925) 14.908 3.791 ( -11.076 4.014 -9.124) 14.901 4.135 ( -0.960 4.154 2.408) 4.896 4.682 ( 1.083 -3.313 1.583) 3.829 6.364 ( 4.310 -8.540 7.649) 12.248 6.652 ( -1.701 0.150 -4.088) 4.430 6.975 ( 0.885 -1.579 2.136) 2.799 7.440 ( 2.482 0.104 1.331) 2.819 7.593 ( -5.565 -2.345 4.621) 7.604 7.723 ( -1.171 1.275 6.605) 6.828 8.902 ( 3.059 -1.715 -4.979) 6.090 9.309 ( -1.023 4.193 -5.806) 7.235 9.672 ( -0.590 3.177 -0.169) 3.236 16.848 ( 0.242 5.988 -3.150) 6.770 17.142 ( -4.116 1.531 -1.170) 4.545 17.214 ( 2.037 0.501 0.982) 2.316 17.457 ( 2.376 -1.718 1.164) 3.155 17.699 ( -1.244 0.099 1.680) 2.093 18.148 ( 1.682 -9.982 3.523) 10.718 ======================= Grid point 548 (270/294) ======================= q-point: (-0.33 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 5.544 -1.956 8.606) 10.422 1.552 ( 0.366 -5.471 -3.393) 6.448 1.709 ( -7.109 -6.353 12.365) 15.614 2.420 ( 5.390 2.214 -4.340) 7.265 2.857 ( -3.587 3.916 0.962) 5.397 3.443 ( -2.877 1.582 -15.291) 15.640 3.686 ( 3.318 5.615 -5.758) 8.700 4.121 ( -0.152 -3.383 -3.818) 5.104 4.696 ( -1.315 0.777 7.609) 7.760 6.438 ( 4.536 -4.157 11.984) 13.471 6.613 ( -0.115 -0.040 -3.776) 3.778 6.975 ( -0.558 -1.350 1.215) 1.900 7.453 ( -3.145 -5.872 7.833) 10.282 7.508 ( -2.541 1.941 0.551) 3.245 7.796 ( 2.710 1.876 5.709) 6.592 8.863 ( -1.704 -2.204 -5.540) 6.201 9.328 ( 2.795 5.264 -8.037) 10.006 9.674 ( -1.267 0.830 -0.873) 1.748 16.865 ( -2.008 5.538 -6.213) 8.562 17.071 ( -0.487 -2.547 -4.521) 5.212 17.281 ( 1.526 3.505 3.491) 5.178 17.503 ( 3.068 -1.398 1.740) 3.794 17.694 ( -1.146 0.208 4.283) 4.439 18.104 ( -0.766 -6.609 6.229) 9.114 ======================= Grid point 549 (271/294) ======================= q-point: (-0.25 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( -2.767 -10.965 5.588) 12.614 1.542 ( 7.562 -2.028 13.564) 15.661 1.603 ( -5.492 0.038 3.933) 6.755 2.534 ( 5.989 4.761 -6.217) 9.858 2.793 ( -8.089 6.195 -4.210) 11.025 3.266 ( -5.096 -2.714 -11.458) 12.830 3.806 ( 6.223 2.276 -6.073) 8.988 4.060 ( 2.041 -3.367 -6.392) 7.507 4.733 ( -2.542 2.768 10.332) 10.995 6.530 ( -1.387 0.635 11.944) 12.041 6.621 ( 4.513 -1.577 -1.405) 4.983 6.942 ( -2.214 -1.768 0.434) 2.867 7.397 ( -1.944 -2.020 7.476) 7.984 7.514 ( 0.715 0.122 -0.896) 1.153 7.890 ( 2.481 1.430 5.888) 6.547 8.760 ( -3.586 -2.171 -6.553) 7.779 9.394 ( 3.968 5.279 -6.929) 9.572 9.635 ( -1.997 -1.994 -1.478) 3.186 16.810 ( -3.486 0.684 -5.648) 6.672 17.050 ( 2.631 1.027 -7.087) 7.629 17.348 ( 0.345 1.392 4.516) 4.739 17.518 ( 0.104 -2.998 1.070) 3.185 17.737 ( 1.622 2.897 4.546) 5.629 18.080 ( -2.057 -1.716 8.035) 8.470 ======================= Grid point 641 (272/294) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 0.000 0.000 18.150) 18.150 1.407 ( 0.000 0.000 18.150) 18.150 2.021 ( 0.000 0.000 25.955) 25.955 2.554 ( -0.000 -0.000 -15.601) 15.601 2.554 ( -0.000 -0.000 -15.601) 15.601 3.635 ( -0.000 -0.000 -20.410) 20.410 3.727 ( -0.000 -0.000 -6.530) 6.530 3.727 ( -0.000 -0.000 -6.530) 6.530 5.302 ( -0.000 -0.000 -6.113) 6.113 6.502 ( 0.000 0.000 4.533) 4.533 6.502 ( 0.000 0.000 4.533) 4.533 7.391 ( 0.000 0.000 0.516) 0.516 7.528 ( 0.000 0.000 9.521) 9.521 7.528 ( 0.000 0.000 9.521) 9.521 7.671 ( 0.000 0.000 12.836) 12.836 9.155 ( -0.000 -0.000 -5.649) 5.649 9.187 ( -0.000 -0.000 -8.820) 8.820 9.187 ( -0.000 -0.000 -8.820) 8.820 16.646 ( -0.000 -0.000 -3.790) 3.790 16.646 ( -0.000 -0.000 -3.790) 3.790 17.446 ( 0.000 0.000 2.828) 2.828 17.446 ( 0.000 0.000 2.828) 2.828 17.905 ( -0.000 -0.000 -2.458) 2.458 18.932 ( 0.000 0.000 1.606) 1.606 ======================= Grid point 642 (273/294) ======================= q-point: ( 0.42 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( -5.833 -6.547 17.766) 19.812 1.673 ( 4.403 8.232 15.679) 18.248 2.183 ( -1.005 3.143 16.085) 16.420 2.327 ( -1.155 -8.366 -10.648) 13.591 2.645 ( 7.868 4.527 -10.721) 14.048 3.450 ( -7.084 -1.340 -17.214) 18.663 3.634 ( -1.850 -2.645 -5.190) 6.112 3.785 ( 5.809 3.633 -8.386) 10.829 5.221 ( -4.130 -2.507 -5.437) 7.273 6.493 ( -0.503 -1.658 5.302) 5.578 6.588 ( 2.765 3.095 2.527) 4.859 7.337 ( -6.824 -4.972 6.982) 10.956 7.470 ( -1.344 -0.964 3.986) 4.315 7.682 ( -0.707 7.599 7.007) 10.360 7.751 ( 4.906 -4.729 7.749) 10.319 9.058 ( -1.505 -4.200 -5.476) 7.063 9.073 ( -5.111 2.084 -5.710) 7.942 9.297 ( 8.370 3.773 -7.628) 11.936 16.573 ( -2.311 -0.032 -1.402) 2.703 16.741 ( 7.773 3.355 -5.117) 9.892 17.402 ( -4.698 -1.878 3.737) 6.290 17.480 ( 1.130 0.095 1.703) 2.046 17.885 ( -0.615 -0.547 -2.688) 2.811 18.890 ( -4.375 -2.746 1.150) 5.292 ======================= Grid point 643 (274/294) ======================= q-point: ( 0.50 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( -2.443 -4.075 15.456) 16.170 1.829 ( -0.834 2.746 2.998) 4.151 2.159 ( -6.761 11.565 1.151) 13.446 2.300 ( 7.046 -13.500 -1.983) 15.357 2.782 ( 6.774 1.927 4.590) 8.407 3.219 ( -8.286 -1.082 -11.398) 14.133 3.568 ( -1.144 -1.072 -3.548) 3.879 3.887 ( 7.939 4.826 -8.991) 12.929 5.075 ( -6.127 -3.979 -4.466) 8.562 6.510 ( 0.224 -1.230 5.904) 6.035 6.664 ( 1.792 2.652 0.392) 3.225 7.202 ( -8.280 -5.769 8.784) 13.379 7.476 ( 0.074 0.383 -0.181) 0.430 7.714 ( -0.865 -1.157 3.764) 4.032 7.828 ( 2.360 1.574 -1.434) 3.179 8.981 ( -2.390 -2.817 -1.076) 3.848 9.007 ( -1.734 2.184 -0.907) 2.933 9.427 ( 7.828 3.735 -5.737) 10.399 16.559 ( -0.212 1.624 1.403) 2.157 16.885 ( 9.210 3.951 -6.267) 11.820 17.319 ( -5.811 -2.248 5.157) 8.088 17.504 ( 1.029 0.085 0.263) 1.065 17.841 ( -1.514 -1.368 -3.299) 3.880 18.756 ( -7.823 -4.978 -0.062) 9.273 ======================= Grid point 644 (275/294) ======================= q-point: ( 0.58 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( -0.180 -1.155 10.383) 10.449 1.764 ( -1.992 -3.310 -7.309) 8.267 2.136 ( -6.759 -0.324 -5.788) 8.905 2.313 ( 4.136 -0.202 4.526) 6.135 2.844 ( -4.964 1.477 1.719) 5.457 3.149 ( 4.786 -0.158 5.135) 7.021 3.538 ( -0.200 0.146 -0.731) 0.771 4.017 ( 7.570 4.966 -7.502) 11.758 4.911 ( -6.136 -4.280 -3.648) 8.323 6.541 ( 0.138 -0.159 5.855) 5.859 6.680 ( -0.807 -1.003 -1.896) 2.291 7.079 ( -5.521 -3.599 4.123) 7.773 7.472 ( 0.125 -0.273 -0.944) 0.990 7.700 ( -0.184 -2.931 -0.493) 2.978 7.822 ( -1.698 3.463 -8.284) 9.138 8.922 ( -2.719 -1.682 2.056) 3.801 9.050 ( 2.577 1.966 5.926) 6.754 9.546 ( 5.839 3.154 -3.393) 7.454 16.613 ( 2.241 2.852 3.876) 5.308 17.025 ( 7.375 3.451 -5.725) 9.954 17.243 ( -4.441 -1.865 5.387) 7.227 17.518 ( 1.046 -0.050 -1.346) 1.705 17.780 ( -1.691 -1.510 -3.534) 4.198 18.551 ( -9.989 -6.099 -2.024) 11.877 ======================= Grid point 645 (276/294) ======================= q-point: ( 0.67 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 1.644 -0.475 1.879) 2.542 1.658 ( -1.987 -4.696 -5.610) 7.581 1.933 ( -9.266 -3.012 -9.792) 13.814 2.376 ( 1.152 -1.280 4.347) 4.676 2.810 ( -2.310 5.065 1.473) 5.758 3.303 ( 4.780 1.757 11.344) 12.435 3.571 ( 3.428 0.203 3.681) 5.035 4.116 ( 3.064 2.541 -2.640) 4.776 4.769 ( -3.978 -2.687 -4.377) 6.497 6.566 ( -1.996 -0.120 0.734) 2.131 6.603 ( -0.655 -4.771 -2.352) 5.359 7.010 ( -2.197 -0.722 -0.228) 2.323 7.475 ( 1.154 -0.272 -0.104) 1.190 7.613 ( -6.828 1.725 -7.624) 10.379 7.795 ( 2.272 -0.626 -6.375) 6.797 8.883 ( -3.113 -0.300 4.181) 5.222 9.177 ( 5.479 1.054 8.883) 10.490 9.632 ( 3.024 2.333 -1.077) 3.968 16.724 ( 4.126 3.672 5.522) 7.810 17.091 ( -0.587 0.933 0.733) 1.323 17.229 ( 2.462 -0.016 -0.076) 2.463 17.521 ( 1.125 -0.939 -2.462) 2.865 17.726 ( -1.134 -0.547 -3.545) 3.762 18.311 ( -9.953 -5.556 -4.347) 12.200 ======================= Grid point 654 (277/294) ======================= q-point: ( 0.42 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( -2.848 -8.581 17.266) 19.489 1.730 ( 4.477 3.397 16.499) 17.430 2.140 ( 1.289 -9.522 -6.632) 11.675 2.478 ( -10.723 9.697 5.923) 15.624 2.530 ( 6.698 8.266 -6.619) 12.530 3.365 ( 1.902 -3.507 -16.797) 17.264 3.645 ( -2.568 0.519 -5.669) 6.245 3.690 ( 1.716 1.270 -6.618) 6.954 5.190 ( -0.073 -4.903 -4.683) 6.781 6.527 ( -1.393 -0.302 4.480) 4.701 6.597 ( 1.483 3.250 2.085) 4.136 7.397 ( -0.351 0.249 1.009) 1.097 7.528 ( -2.020 -5.148 9.861) 11.306 7.629 ( 4.121 -6.572 10.025) 12.675 7.792 ( -2.289 -0.482 1.010) 2.548 9.019 ( 0.091 -1.318 -1.366) 1.901 9.138 ( 3.673 3.001 -5.825) 7.512 9.196 ( -3.308 6.232 -8.897) 11.355 16.605 ( 2.131 2.298 -0.945) 3.274 16.676 ( -2.028 4.170 -4.393) 6.388 17.449 ( 2.752 -2.397 2.472) 4.408 17.462 ( -2.535 -1.214 2.035) 3.471 17.870 ( -0.160 -1.190 -2.382) 2.668 18.894 ( -0.143 -5.675 1.054) 5.774 ======================= Grid point 655 (278/294) ======================= q-point: ( 0.50 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -3.262 -5.813 16.969) 18.231 1.879 ( -2.207 0.750 2.394) 3.341 2.037 ( 6.529 -12.128 -3.236) 14.149 2.391 ( -5.851 8.840 -4.689) 11.592 2.757 ( 5.137 7.801 11.430) 14.761 3.241 ( -3.960 -0.187 -15.015) 15.529 3.570 ( -1.837 0.137 -1.514) 2.384 3.751 ( 6.813 3.188 -8.192) 11.122 5.083 ( -3.440 -6.254 -3.372) 7.894 6.535 ( -0.398 0.101 4.843) 4.860 6.665 ( 1.660 2.970 0.026) 3.403 7.341 ( -8.029 -4.558 8.855) 12.792 7.477 ( -1.563 -2.485 1.611) 3.349 7.658 ( 2.491 -11.432 2.271) 11.919 7.791 ( 3.347 1.609 -0.297) 3.726 8.994 ( -2.236 -1.427 -0.481) 2.696 9.104 ( -4.701 7.812 -1.844) 9.302 9.296 ( 8.791 4.998 -6.529) 12.037 16.619 ( -2.602 4.744 0.536) 5.437 16.751 ( 7.631 4.056 -4.613) 9.796 17.402 ( -3.939 -2.494 2.875) 5.477 17.479 ( 1.650 -1.227 1.110) 2.337 17.828 ( -1.123 -2.362 -2.474) 3.601 18.796 ( -4.324 -8.218 0.639) 9.308 ======================= Grid point 656 (279/294) ======================= q-point: ( 0.58 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -2.366 -2.445 12.927) 13.367 1.757 ( -4.849 -2.962 -6.579) 8.693 1.999 ( 2.958 -13.160 -3.476) 13.929 2.434 ( -1.136 10.263 1.213) 10.397 2.906 ( -0.258 0.324 3.546) 3.570 3.125 ( -0.543 1.465 -1.564) 2.211 3.577 ( -0.773 4.593 2.982) 5.531 3.873 ( 9.364 5.126 -9.651) 14.391 4.937 ( -5.023 -6.466 -1.768) 8.376 6.569 ( 0.394 0.718 5.089) 5.154 6.683 ( -1.156 -0.520 -1.788) 2.192 7.176 ( -9.077 -7.631 6.662) 13.602 7.442 ( 0.662 -2.682 -2.483) 3.714 7.627 ( 2.976 -5.449 0.577) 6.235 7.831 ( 0.034 2.216 -5.078) 5.541 8.935 ( -1.532 -3.087 1.210) 3.652 9.131 ( -2.150 7.792 2.913) 8.592 9.451 ( 7.662 5.007 -3.779) 9.903 16.648 ( 0.064 4.525 2.062) 4.973 16.901 ( 8.151 5.194 -4.422) 10.628 17.327 ( -4.404 -2.602 3.433) 6.160 17.492 ( 0.825 -0.743 -0.611) 1.267 17.769 ( -1.413 -2.681 -2.059) 3.664 18.615 ( -7.536 -9.528 -0.368) 12.154 ======================= Grid point 657 (280/294) ======================= q-point: ( 0.67 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.396 ( -3.057 -2.112 2.484) 4.470 1.645 ( -2.748 -2.750 -1.014) 4.018 1.889 ( 0.185 -9.271 -5.200) 10.631 2.464 ( -5.311 5.405 0.679) 7.608 2.850 ( -1.447 -0.865 -3.933) 4.279 3.226 ( 7.839 -3.385 8.502) 12.050 3.662 ( -1.599 10.433 8.007) 13.249 4.023 ( 8.670 5.384 -8.162) 13.068 4.791 ( -4.898 -5.699 -0.401) 7.526 6.570 ( -5.273 -6.887 -4.037) 9.567 6.617 ( -0.247 1.148 4.923) 5.062 7.035 ( -3.621 -3.578 0.095) 5.091 7.430 ( 2.010 -2.380 -0.708) 3.195 7.635 ( 1.452 -2.251 -0.553) 2.735 7.778 ( -3.978 4.161 -9.947) 11.493 8.908 ( 0.105 -4.008 4.229) 5.827 9.205 ( 0.629 5.720 5.008) 7.629 9.585 ( 5.212 3.953 -1.463) 6.703 16.728 ( 3.000 3.984 3.039) 5.840 17.048 ( 6.135 5.354 -3.261) 8.771 17.255 ( -3.585 -2.492 2.955) 5.272 17.484 ( 0.197 -1.057 -1.830) 2.122 17.719 ( -0.898 -1.440 -1.371) 2.182 18.382 ( -9.141 -9.152 -1.867) 13.069 ======================= Grid point 667 (281/294) ======================= q-point: ( 0.42 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( 2.948 -4.905 15.598) 16.615 1.802 ( -0.913 -2.412 12.850) 13.107 1.991 ( -0.517 -8.349 -9.814) 12.896 2.487 ( 3.244 8.747 -9.229) 13.123 2.774 ( -6.446 8.785 11.067) 15.531 3.182 ( 4.754 -3.225 -11.472) 12.830 3.594 ( 3.173 1.172 -2.189) 4.029 3.742 ( -7.644 2.671 -8.479) 11.724 5.088 ( 3.220 -5.834 -3.692) 7.618 6.571 ( 0.323 1.061 5.131) 5.249 6.625 ( -1.465 1.612 0.002) 2.178 7.353 ( 7.564 -3.854 6.852) 10.909 7.478 ( 2.098 -3.590 2.661) 4.937 7.675 ( -5.636 -4.911 8.347) 11.205 7.776 ( -0.528 -4.085 -6.482) 7.681 9.022 ( 1.090 0.424 0.754) 1.392 9.038 ( 4.783 4.153 -1.901) 6.614 9.323 ( -7.503 6.588 -6.847) 12.107 16.580 ( 1.967 2.487 1.340) 3.443 16.786 ( -6.852 6.099 -5.141) 10.516 17.382 ( 3.920 -3.666 3.826) 6.592 17.491 ( -1.356 -0.630 0.486) 1.572 17.836 ( 0.882 -1.894 -2.686) 3.403 18.801 ( 4.140 -7.896 0.291) 8.920 ======================= Grid point 668 (282/294) ======================= q-point: ( 0.50 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -1.541 -5.967 15.564) 16.740 1.834 ( 0.132 -9.835 -9.641) 13.773 1.921 ( 3.212 -0.630 10.912) 11.392 2.452 ( -3.040 3.579 -10.533) 11.532 2.881 ( -0.231 6.214 9.824) 11.627 3.189 ( 2.312 5.747 -11.770) 13.300 3.614 ( -4.148 0.869 -4.120) 5.911 3.660 ( 3.286 3.661 -1.439) 5.126 5.032 ( -0.193 -7.250 -2.266) 7.598 6.579 ( -1.373 0.420 3.674) 3.944 6.663 ( 1.640 2.501 -0.610) 3.052 7.423 ( -0.002 1.298 0.596) 1.428 7.464 ( 2.264 -18.020 1.695) 18.240 7.561 ( -5.981 -4.417 11.007) 13.283 7.734 ( 3.299 -0.668 -2.603) 4.255 9.018 ( -1.829 -0.871 -0.825) 2.187 9.175 ( 6.629 5.555 -6.261) 10.677 9.262 ( -4.548 9.948 -0.547) 10.952 16.671 ( 4.076 3.889 -2.499) 6.163 16.732 ( -3.971 7.250 -0.139) 8.267 17.407 ( 1.003 -3.975 0.984) 4.216 17.468 ( -0.578 -0.639 1.980) 2.159 17.803 ( -0.342 -3.004 -1.866) 3.552 18.748 ( -0.185 -10.650 0.554) 10.667 ======================= Grid point 669 (283/294) ======================= q-point: ( 0.58 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.515 ( -2.363 -1.958 14.528) 14.849 1.683 ( 1.295 -9.023 -10.976) 14.267 1.931 ( -5.023 -5.463 5.504) 9.239 2.462 ( 4.533 4.141 -2.596) 6.666 2.912 ( -1.022 -3.255 -1.462) 3.712 3.189 ( -4.339 7.631 -5.400) 10.307 3.642 ( 5.006 6.365 1.012) 8.161 3.751 ( 3.233 5.928 -1.188) 6.856 4.928 ( -2.755 -7.546 -0.538) 8.051 6.599 ( 0.349 0.960 4.019) 4.147 6.678 ( -0.464 -0.438 -3.062) 3.128 7.250 ( -6.215 -15.141 1.118) 16.405 7.409 ( -2.146 -0.615 2.047) 3.029 7.554 ( 1.659 -3.221 4.424) 5.718 7.795 ( 3.679 0.391 -0.836) 3.793 8.948 ( -3.183 -2.090 -1.441) 4.071 9.226 ( 0.549 6.179 -5.950) 8.596 9.390 ( 4.468 8.548 2.545) 9.975 16.692 ( -0.147 4.166 -4.404) 6.064 16.846 ( 4.383 7.956 3.030) 9.575 17.356 ( -1.855 -3.961 -0.808) 4.448 17.480 ( 0.369 -0.203 1.698) 1.750 17.754 ( -1.061 -3.267 -0.314) 3.449 18.608 ( -3.992 -12.071 0.554) 12.726 ======================= Grid point 670 (284/294) ======================= q-point: ( 0.67 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( -5.313 -2.236 -2.771) 6.396 1.652 ( 1.346 -4.801 7.623) 9.109 1.802 ( -3.578 -5.412 -0.807) 6.538 2.556 ( 1.208 3.006 -0.236) 3.248 2.815 ( -1.485 -4.144 -6.382) 7.753 3.166 ( -0.433 -0.449 2.113) 2.203 3.844 ( 0.652 12.780 9.573) 15.982 3.861 ( 9.726 5.289 -9.426) 14.540 4.806 ( -3.843 -7.068 1.473) 8.179 6.579 ( -5.510 -6.337 -3.360) 9.045 6.648 ( 1.089 1.522 3.781) 4.219 7.056 ( -4.451 -7.178 0.065) 8.446 7.387 ( -0.115 -2.001 1.952) 2.798 7.581 ( 2.257 -1.733 1.448) 3.192 7.818 ( -1.084 2.997 -4.882) 5.830 8.886 ( -0.699 -4.003 1.665) 4.391 9.268 ( 0.757 5.721 -2.537) 6.304 9.543 ( 4.422 5.679 1.212) 7.299 16.725 ( 2.118 3.703 -2.734) 5.067 17.012 ( 4.751 7.413 2.375) 9.119 17.279 ( -2.096 -3.438 -1.777) 4.401 17.484 ( -0.857 0.199 0.923) 1.275 17.714 ( -0.744 -2.201 1.116) 2.577 18.409 ( -6.736 -11.761 0.210) 13.555 ======================= Grid point 680 (285/294) ======================= q-point: ( 0.42 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 3.538 -3.217 12.939) 13.794 1.767 ( 3.822 0.268 -9.301) 10.059 1.954 ( -6.382 -11.723 2.010) 13.498 2.468 ( 4.480 9.104 -4.094) 10.941 2.855 ( 3.741 -5.086 3.295) 7.122 3.144 ( -3.732 3.919 0.985) 5.500 3.583 ( 1.546 5.229 3.226) 6.335 3.865 ( -9.397 4.455 -9.309) 13.957 4.947 ( 4.935 -5.639 -2.736) 7.977 6.591 ( 1.499 0.126 5.429) 5.634 6.661 ( -1.704 0.320 -1.792) 2.493 7.189 ( 9.015 -7.237 5.950) 13.002 7.454 ( -0.849 -1.750 -1.526) 2.473 7.673 ( 1.386 -5.575 -8.557) 10.306 7.760 ( -2.933 0.203 3.381) 4.480 8.944 ( 3.074 -1.791 -1.273) 3.778 9.107 ( -0.885 6.134 6.978) 9.333 9.462 ( -6.447 5.582 -4.887) 9.829 16.614 ( -1.078 2.926 4.021) 5.089 16.929 ( -6.972 6.471 -5.857) 11.171 17.306 ( 3.921 -3.601 4.615) 7.046 17.503 ( -0.918 -0.148 -0.944) 1.325 17.779 ( 1.649 -2.101 -2.893) 3.937 18.621 ( 7.663 -9.309 -0.924) 12.093 ======================= Grid point 681 (286/294) ======================= q-point: ( 0.50 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 1.208 -6.643 7.664) 10.214 1.746 ( -2.366 -4.671 -8.663) 10.122 1.880 ( 5.901 -3.691 10.117) 12.280 2.495 ( -4.167 3.224 -6.608) 8.451 2.886 ( 3.016 -4.728 2.468) 6.127 3.181 ( 2.978 8.307 -4.258) 9.799 3.673 ( -5.411 6.108 -4.557) 9.346 3.729 ( -2.506 6.157 3.313) 7.428 4.935 ( 2.448 -7.113 -1.468) 7.665 6.616 ( -1.094 -1.403 2.500) 3.069 6.652 ( 1.271 1.165 -0.934) 1.960 7.242 ( 5.409 -14.958 1.004) 15.938 7.419 ( 0.809 0.241 -0.996) 1.306 7.649 ( 3.709 -0.856 -3.019) 4.858 7.704 ( -6.800 -2.808 9.296) 11.855 8.979 ( 3.724 -0.979 -3.519) 5.217 9.166 ( -1.536 4.886 -0.030) 5.122 9.419 ( -4.042 9.010 -0.984) 9.924 16.664 ( 0.677 4.040 0.652) 4.148 16.874 ( -4.818 8.204 -1.685) 9.663 17.344 ( 2.503 -4.111 1.705) 5.107 17.481 ( -0.723 -0.610 0.358) 1.011 17.762 ( 0.765 -2.859 -1.364) 3.259 18.611 ( 3.871 -12.042 0.038) 12.649 ======================= Grid point 682 (287/294) ======================= q-point: ( 0.58 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 3.793 -6.920 -1.470) 8.027 1.629 ( -3.885 -1.988 2.998) 5.295 1.981 ( 0.717 -6.636 10.617) 12.540 2.412 ( -0.422 2.161 -6.324) 6.697 2.871 ( -0.413 -4.407 -1.610) 4.711 3.285 ( 0.487 9.951 -9.470) 13.746 3.577 ( 0.043 1.530 -4.820) 5.057 3.864 ( -0.160 10.924 9.399) 14.411 4.879 ( -0.111 -7.696 0.151) 7.698 6.612 ( 0.478 0.019 0.883) 1.005 6.654 ( 0.243 -2.693 -1.669) 3.178 7.138 ( 0.425 -12.209 -2.044) 12.386 7.454 ( 0.849 0.959 0.791) 1.505 7.606 ( -6.719 -4.749 10.541) 13.372 7.723 ( 4.946 0.461 1.648) 5.234 8.967 ( -1.759 -1.921 -2.873) 3.878 9.182 ( 2.398 5.077 -8.632) 10.298 9.482 ( -0.744 8.847 3.721) 9.626 16.694 ( 0.069 4.366 -5.291) 6.860 16.927 ( -0.213 8.879 5.030) 10.207 17.318 ( -0.095 -4.525 -2.716) 5.279 17.486 ( 0.518 0.023 2.279) 2.337 17.738 ( -0.235 -2.884 0.989) 3.058 18.525 ( -0.019 -13.342 1.047) 13.383 ======================= Grid point 684 (288/294) ======================= q-point: (-0.33 -0.42 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( -0.261 -2.968 -7.943) 8.484 1.657 ( 1.526 -1.282 12.965) 13.117 1.874 ( -8.390 -7.735 5.675) 12.745 2.482 ( 7.393 1.136 -2.733) 7.964 2.773 ( -3.303 -3.761 -5.985) 7.802 3.243 ( -5.905 3.481 -3.535) 7.712 3.682 ( 10.436 5.075 -7.988) 14.089 4.008 ( -0.454 9.643 7.765) 12.389 4.797 ( -1.905 -7.193 2.419) 7.824 6.577 ( -2.826 -4.084 -3.561) 6.111 6.652 ( 2.091 -0.391 3.484) 4.082 7.035 ( -1.547 -6.119 -0.621) 6.341 7.436 ( -4.319 -1.001 3.559) 5.685 7.557 ( -0.200 -3.024 5.365) 6.162 7.809 ( 2.909 1.730 0.563) 3.431 8.884 ( -2.893 -2.919 -1.777) 4.477 9.239 ( 4.259 5.160 -8.426) 10.759 9.573 ( 0.674 5.685 2.984) 6.456 16.709 ( 0.940 4.463 -5.781) 7.363 17.050 ( 1.784 6.162 4.598) 7.893 17.252 ( -0.529 -2.502 -3.588) 4.406 17.510 ( -0.056 0.958 2.148) 2.353 17.716 ( -0.670 -2.244 3.024) 3.825 18.381 ( -3.393 -12.847 2.085) 13.450 ======================= Grid point 805 (289/294) ======================= q-point: ( 0.42 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( 0.000 0.000 15.189) 15.189 1.696 ( 0.000 0.000 15.189) 15.189 2.300 ( -0.000 -0.000 -13.685) 13.685 2.300 ( -0.000 -0.000 -13.685) 13.685 2.435 ( 0.000 0.000 21.818) 21.818 3.296 ( -0.000 -0.000 -18.750) 18.750 3.630 ( -0.000 -0.000 -4.397) 4.397 3.630 ( -0.000 -0.000 -4.397) 4.397 5.213 ( -0.000 -0.000 -3.942) 3.942 6.565 ( 0.000 0.000 2.636) 2.636 6.565 ( 0.000 0.000 2.636) 2.636 7.395 ( 0.000 0.000 0.127) 0.127 7.669 ( 0.000 0.000 6.376) 6.376 7.669 ( 0.000 0.000 6.376) 6.376 7.856 ( 0.000 0.000 8.093) 8.093 9.054 ( -0.000 -0.000 -6.100) 6.100 9.054 ( -0.000 -0.000 -6.100) 6.100 9.068 ( -0.000 -0.000 -4.117) 4.117 16.596 ( -0.000 -0.000 -1.989) 1.989 16.596 ( -0.000 -0.000 -1.989) 1.989 17.483 ( 0.000 0.000 1.436) 1.436 17.483 ( 0.000 0.000 1.436) 1.436 17.872 ( -0.000 -0.000 -1.358) 1.358 18.953 ( 0.000 0.000 0.864) 0.864 ======================= Grid point 806 (290/294) ======================= q-point: ( 0.50 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -5.946 -5.919 16.371) 18.395 1.855 ( -1.301 1.483 1.607) 2.544 2.152 ( -3.349 5.967 -1.516) 7.009 2.262 ( 2.871 -6.515 -9.819) 12.129 2.692 ( 10.290 5.665 14.175) 18.409 3.164 ( -3.169 -0.810 -15.436) 15.778 3.577 ( -1.285 -1.486 -1.228) 2.317 3.658 ( 3.593 2.521 -5.887) 7.343 5.148 ( -3.992 -2.331 -2.700) 5.354 6.569 ( 0.572 -1.071 3.317) 3.532 6.612 ( 1.624 2.380 0.293) 2.897 7.396 ( -0.478 -0.270 1.059) 1.193 7.596 ( -6.797 -4.762 8.958) 12.211 7.744 ( 0.334 2.032 -0.056) 2.060 7.830 ( -3.410 -3.294 1.101) 4.867 9.001 ( -0.786 1.343 -0.249) 1.576 9.018 ( -0.891 -1.330 -0.957) 1.865 9.167 ( 8.758 4.358 -7.118) 12.099 16.571 ( -0.494 0.700 1.074) 1.374 16.664 ( 6.030 2.547 -3.759) 7.548 17.453 ( -3.101 -1.370 2.129) 4.003 17.496 ( 0.364 -0.059 0.205) 0.422 17.849 ( -1.358 -0.906 -1.330) 2.106 18.904 ( -4.794 -2.842 0.459) 5.592 ======================= Grid point 807 (291/294) ======================= q-point: ( 0.58 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( -4.879 -5.877 14.707) 16.572 1.736 ( -5.408 -0.721 -10.500) 11.833 2.136 ( -4.134 0.317 -9.853) 10.689 2.293 ( 5.862 1.011 7.168) 9.315 2.943 ( 0.235 0.106 9.643) 9.646 3.061 ( 5.156 3.211 -5.422) 8.142 3.553 ( -0.588 -0.435 1.804) 1.947 3.733 ( 6.916 4.077 -8.029) 11.354 5.023 ( -6.097 -3.591 -1.340) 7.202 6.593 ( 0.892 -0.572 2.944) 3.129 6.657 ( 1.194 1.786 -0.808) 2.295 7.350 ( -8.481 -4.877 7.692) 12.446 7.474 ( -3.532 -2.953 0.018) 4.604 7.733 ( 1.342 -3.850 -1.606) 4.382 7.738 ( -5.144 2.399 -7.901) 9.728 8.988 ( -1.978 -0.062 1.705) 2.612 9.055 ( 3.340 1.174 5.868) 6.854 9.325 ( 9.215 5.165 -5.784) 12.044 16.605 ( 1.605 1.712 3.738) 4.414 16.786 ( 8.002 3.915 -4.989) 10.210 17.390 ( -4.252 -1.980 2.840) 5.483 17.496 ( 0.135 -0.225 -1.144) 1.174 17.799 ( -2.335 -1.507 -1.323) 3.078 18.754 ( -8.892 -5.235 -0.233) 10.322 ======================= Grid point 819 (292/294) ======================= q-point: ( 0.50 0.50 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -1.483 -7.853 14.036) 16.152 1.873 ( 0.817 -2.570 -8.932) 9.330 2.057 ( 2.597 -4.977 8.822) 10.457 2.285 ( -2.147 6.773 -11.824) 13.795 2.768 ( -0.219 11.189 12.644) 16.885 3.090 ( 0.537 -1.716 -12.554) 12.682 3.593 ( -2.002 -0.154 -1.854) 2.733 3.606 ( 1.867 1.376 -1.261) 2.640 5.136 ( -0.011 -4.631 -1.363) 4.828 6.586 ( -1.055 0.409 1.999) 2.297 6.612 ( 1.076 2.272 -0.242) 2.525 7.403 ( 0.013 0.704 -0.019) 0.705 7.676 ( -0.840 -3.347 6.295) 7.179 7.729 ( 1.155 -0.989 -3.221) 3.562 7.792 ( -0.460 -12.006 3.928) 12.641 9.025 ( -1.415 -0.066 -0.238) 1.436 9.052 ( 4.668 3.422 -4.904) 7.587 9.084 ( -3.139 8.020 -0.275) 8.617 16.603 ( 2.221 2.078 -1.405) 3.350 16.621 ( -2.200 4.345 0.053) 4.870 17.472 ( 0.361 -2.438 0.024) 2.465 17.488 ( -0.289 -0.424 1.133) 1.244 17.843 ( -0.059 -1.882 -0.646) 1.991 18.905 ( -0.032 -5.727 0.296) 5.734 ======================= Grid point 820 (293/294) ======================= q-point: ( 0.58 0.50 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( -5.513 -6.231 4.738) 9.574 1.763 ( 0.021 -4.355 -2.830) 5.194 2.036 ( -4.137 -5.064 -4.950) 8.201 2.348 ( 4.876 7.111 3.788) 9.417 2.978 ( 5.015 7.476 10.122) 13.546 2.998 ( -1.514 -0.840 -11.123) 11.257 3.584 ( 1.039 1.033 1.493) 2.092 3.652 ( 1.854 3.783 -1.111) 4.357 5.054 ( -3.326 -5.783 0.097) 6.672 6.602 ( 0.429 0.786 2.712) 2.856 6.641 ( 1.027 1.810 -2.837) 3.518 7.410 ( 0.363 0.274 -0.258) 0.523 7.537 ( -9.415 -13.488 0.083) 16.449 7.656 ( 0.195 -4.250 3.284) 5.375 7.775 ( -0.952 0.445 -2.775) 2.967 8.986 ( -0.375 -2.258 0.657) 2.382 9.095 ( 1.277 4.753 -2.502) 5.521 9.234 ( 5.794 9.076 1.588) 10.884 16.615 ( 1.106 1.976 -1.868) 2.936 16.719 ( 3.968 6.800 1.779) 8.072 17.423 ( -1.931 -3.491 -0.684) 4.048 17.490 ( -0.209 -0.165 0.356) 0.444 17.808 ( -1.389 -2.440 0.276) 2.821 18.802 ( -4.677 -8.102 0.142) 9.356 ======================= Grid point 976 (294/294) ======================= q-point: (-0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.72e-04 3.39e-05 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( 0.000 0.000 0.000) 0.000 1.869 ( 0.000 0.000 0.000) 0.000 2.140 ( -0.000 0.000 -0.000) 0.000 2.140 ( -0.000 0.000 -0.000) 0.000 2.684 ( 0.000 0.000 0.000) 0.000 3.074 ( -0.000 -0.000 -0.000) 0.000 3.590 ( 0.000 0.000 0.000) 0.000 3.590 ( 0.000 0.000 0.000) 0.000 5.178 ( 0.000 0.000 0.000) 0.000 6.588 ( 0.000 0.000 0.000) 0.000 6.588 ( 0.000 0.000 0.000) 0.000 7.396 ( 0.000 0.000 0.000) 0.000 7.727 ( 0.000 0.000 0.000) 0.000 7.727 ( 0.000 0.000 0.000) 0.000 7.929 ( 0.000 0.000 0.000) 0.000 8.999 ( 0.000 0.000 0.000) 0.000 8.999 ( 0.000 0.000 0.000) 0.000 9.029 ( 0.000 0.000 0.000) 0.000 16.579 ( 0.000 0.000 0.000) 0.000 16.579 ( 0.000 0.000 0.000) 0.000 17.495 ( 0.000 0.000 0.000) 0.000 17.495 ( 0.000 0.000 0.000) 0.000 17.860 ( 0.000 0.000 0.000) 0.000 18.960 ( 0.000 0.000 0.000) 0.000 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/41472 10.0 210.821 210.821 269.225 0.000 -0.000 -0.000 3/41472 20.0 82.049 82.049 105.844 0.000 -0.000 -0.000 3/41472 30.0 44.670 44.670 57.850 0.000 -0.000 -0.000 3/41472 40.0 29.725 29.725 38.428 0.000 -0.000 -0.000 3/41472 50.0 21.990 21.990 28.395 0.000 -0.000 -0.000 3/41472 60.0 17.264 17.264 22.292 0.000 -0.000 -0.000 3/41472 70.0 14.091 14.091 18.205 0.000 -0.000 -0.000 3/41472 80.0 11.834 11.834 15.301 0.000 -0.000 -0.000 3/41472 90.0 10.163 10.163 13.152 0.000 -0.000 -0.000 3/41472 100.0 8.888 8.888 11.511 0.000 -0.000 -0.000 3/41472 110.0 7.888 7.888 10.223 0.000 -0.000 -0.000 3/41472 120.0 7.087 7.087 9.191 0.000 -0.000 -0.000 3/41472 130.0 6.434 6.434 8.347 0.000 -0.000 -0.000 3/41472 140.0 5.891 5.891 7.646 0.000 -0.000 -0.000 3/41472 150.0 5.434 5.434 7.056 0.000 -0.000 -0.000 3/41472 160.0 5.045 5.045 6.552 0.000 -0.000 -0.000 3/41472 170.0 4.709 4.709 6.116 0.000 -0.000 -0.000 3/41472 180.0 4.416 4.416 5.737 0.000 -0.000 -0.000 3/41472 190.0 4.159 4.159 5.403 0.000 -0.000 -0.000 3/41472 200.0 3.931 3.931 5.107 0.000 -0.000 -0.000 3/41472 210.0 3.728 3.728 4.843 0.000 -0.000 -0.000 3/41472 220.0 3.545 3.545 4.606 0.000 -0.000 -0.000 3/41472 230.0 3.380 3.380 4.392 0.000 -0.000 -0.000 3/41472 240.0 3.230 3.230 4.197 0.000 -0.000 -0.000 3/41472 250.0 3.094 3.094 4.020 0.000 -0.000 -0.000 3/41472 260.0 2.969 2.969 3.857 0.000 -0.000 -0.000 3/41472 270.0 2.854 2.854 3.707 0.000 -0.000 -0.000 3/41472 280.0 2.747 2.747 3.569 0.000 -0.000 -0.000 3/41472 290.0 2.649 2.649 3.441 0.000 -0.000 -0.000 3/41472 300.0 2.558 2.558 3.322 0.000 -0.000 -0.000 3/41472 310.0 2.472 2.472 3.212 0.000 -0.000 -0.000 3/41472 320.0 2.393 2.393 3.108 0.000 -0.000 -0.000 3/41472 330.0 2.318 2.318 3.011 0.000 -0.000 -0.000 3/41472 340.0 2.249 2.249 2.920 0.000 -0.000 -0.000 3/41472 350.0 2.183 2.183 2.835 0.000 -0.000 -0.000 3/41472 360.0 2.121 2.121 2.754 0.000 -0.000 -0.000 3/41472 370.0 2.063 2.063 2.678 0.000 -0.000 -0.000 3/41472 380.0 2.007 2.007 2.607 0.000 -0.000 -0.000 3/41472 390.0 1.955 1.955 2.539 0.000 -0.000 -0.000 3/41472 400.0 1.905 1.905 2.474 0.000 -0.000 -0.000 3/41472 410.0 1.858 1.858 2.413 0.000 -0.000 -0.000 3/41472 420.0 1.813 1.813 2.354 0.000 -0.000 -0.000 3/41472 430.0 1.771 1.771 2.299 0.000 -0.000 -0.000 3/41472 440.0 1.730 1.730 2.246 0.000 -0.000 -0.000 3/41472 450.0 1.691 1.691 2.196 0.000 -0.000 -0.000 3/41472 460.0 1.654 1.654 2.147 0.000 -0.000 -0.000 3/41472 470.0 1.619 1.619 2.101 0.000 -0.000 -0.000 3/41472 480.0 1.585 1.585 2.057 0.000 -0.000 -0.000 3/41472 490.0 1.552 1.552 2.015 0.000 -0.000 -0.000 3/41472 500.0 1.521 1.521 1.974 0.000 -0.000 -0.000 3/41472 510.0 1.491 1.491 1.935 0.000 -0.000 -0.000 3/41472 520.0 1.462 1.462 1.897 0.000 -0.000 -0.000 3/41472 530.0 1.434 1.434 1.861 0.000 -0.000 -0.000 3/41472 540.0 1.407 1.407 1.827 0.000 -0.000 -0.000 3/41472 550.0 1.382 1.382 1.793 0.000 -0.000 -0.000 3/41472 560.0 1.357 1.357 1.761 0.000 -0.000 -0.000 3/41472 570.0 1.333 1.333 1.730 0.000 -0.000 -0.000 3/41472 580.0 1.310 1.310 1.700 0.000 -0.000 -0.000 3/41472 590.0 1.288 1.288 1.671 0.000 -0.000 -0.000 3/41472 600.0 1.266 1.266 1.643 0.000 -0.000 -0.000 3/41472 610.0 1.245 1.245 1.616 0.000 -0.000 -0.000 3/41472 620.0 1.225 1.225 1.590 0.000 -0.000 -0.000 3/41472 630.0 1.205 1.205 1.564 0.000 -0.000 -0.000 3/41472 640.0 1.187 1.187 1.540 0.000 -0.000 -0.000 3/41472 650.0 1.168 1.168 1.516 0.000 -0.000 -0.000 3/41472 660.0 1.151 1.151 1.493 0.000 -0.000 -0.000 3/41472 670.0 1.133 1.133 1.470 0.000 -0.000 -0.000 3/41472 680.0 1.117 1.117 1.449 0.000 -0.000 -0.000 3/41472 690.0 1.100 1.100 1.428 0.000 -0.000 -0.000 3/41472 700.0 1.085 1.085 1.407 0.000 -0.000 -0.000 3/41472 710.0 1.069 1.069 1.387 0.000 -0.000 -0.000 3/41472 720.0 1.054 1.054 1.368 0.000 -0.000 -0.000 3/41472 730.0 1.040 1.040 1.349 0.000 -0.000 -0.000 3/41472 740.0 1.026 1.026 1.331 0.000 -0.000 -0.000 3/41472 750.0 1.012 1.012 1.313 0.000 -0.000 -0.000 3/41472 760.0 0.999 0.999 1.296 0.000 -0.000 -0.000 3/41472 770.0 0.986 0.986 1.279 0.000 -0.000 -0.000 3/41472 780.0 0.973 0.973 1.262 0.000 -0.000 -0.000 3/41472 790.0 0.961 0.961 1.246 0.000 -0.000 -0.000 3/41472 800.0 0.949 0.949 1.231 0.000 -0.000 -0.000 3/41472 810.0 0.937 0.937 1.216 0.000 -0.000 -0.000 3/41472 820.0 0.926 0.926 1.201 0.000 -0.000 -0.000 3/41472 830.0 0.914 0.914 1.186 0.000 -0.000 -0.000 3/41472 840.0 0.904 0.904 1.172 0.000 -0.000 -0.000 3/41472 850.0 0.893 0.893 1.158 0.000 -0.000 -0.000 3/41472 860.0 0.882 0.882 1.145 0.000 -0.000 -0.000 3/41472 870.0 0.872 0.872 1.132 0.000 -0.000 -0.000 3/41472 880.0 0.862 0.862 1.119 0.000 -0.000 -0.000 3/41472 890.0 0.853 0.853 1.106 0.000 -0.000 -0.000 3/41472 900.0 0.843 0.843 1.094 0.000 -0.000 -0.000 3/41472 910.0 0.834 0.834 1.082 0.000 -0.000 -0.000 3/41472 920.0 0.825 0.825 1.070 0.000 -0.000 -0.000 3/41472 930.0 0.816 0.816 1.058 0.000 -0.000 -0.000 3/41472 940.0 0.807 0.807 1.047 0.000 -0.000 -0.000 3/41472 950.0 0.799 0.799 1.036 0.000 -0.000 -0.000 3/41472 960.0 0.790 0.790 1.025 0.000 -0.000 -0.000 3/41472 970.0 0.782 0.782 1.015 0.000 -0.000 -0.000 3/41472 980.0 0.774 0.774 1.004 0.000 -0.000 -0.000 3/41472 990.0 0.767 0.767 0.994 0.000 -0.000 -0.000 3/41472 1000.0 0.759 0.759 0.984 0.000 -0.000 -0.000 3/41472 Thermal conductivity related properties were written into "kappa-m121212.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 21:07:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|