----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 00:13:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.999396310493636 -4.567501715000000 0.000000000000000 b 4.999396310493636 4.567501715000000 0.000000000000000 c -1.392682146924214 0.000000000000000 5.048624349558696 Atomic positions (fractional): *1 Li 0.91036605744038 0.08963394255962 0.25000000000000 6.941 2 Li 0.08963394255962 0.91036605744038 0.75000000000000 6.941 *3 Si 0.81150844631587 0.62468525228107 0.27187407905081 28.085 4 Si 0.62468525228107 0.81150844631587 0.77187407905081 28.085 5 Si 0.37531474771893 0.18849155368413 0.22812592094919 28.085 6 Si 0.18849155368413 0.37531474771893 0.72812592094919 28.085 *7 Bi 0.27938234507717 0.72061765492283 0.25000000000000 208.980 8 Bi 0.72061765492283 0.27938234507717 0.75000000000000 208.980 *9 O 0.98267486583966 0.79128623246091 0.35643152227254 15.999 10 O 0.79128623246091 0.98267486583966 0.85643152227254 15.999 *11 O 0.88756686484455 0.39420169662452 0.17727780103256 15.999 *12 O 0.68550777589840 0.63866241712710 0.51796597524304 15.999 13 O 0.39420169662452 0.88756686484455 0.67727780103256 15.999 14 O 0.63866241712710 0.68550777589840 0.01796597524304 15.999 15 O 0.36133758287290 0.31449222410160 0.98203402475696 15.999 16 O 0.60579830337548 0.11243313515545 0.32272219896744 15.999 17 O 0.31449222410160 0.36133758287290 0.48203402475696 15.999 18 O 0.11243313515545 0.60579830337548 0.82272219896744 15.999 19 O 0.20871376753909 0.01732513416034 0.14356847772746 15.999 20 O 0.01732513416034 0.20871376753909 0.64356847772746 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.998792620987272 0.000000000000000 0.000000000000000 b 0.000000000000000 9.135003429999999 0.000000000000000 c -1.392682146924214 0.000000000000000 5.048624349558696 Atomic positions (fractional): *1 Li 0.00000000000000 0.08963394255962 0.25000000000000 6.941 > 1 2 Li 0.00000000000000 0.91036605744038 0.75000000000000 6.941 > 2 3 Li 0.50000000000000 0.58963394255962 0.25000000000000 6.941 > 1 4 Li 0.50000000000000 0.41036605744038 0.75000000000000 6.941 > 2 *5 Si 0.21809684929847 0.40658840298260 0.27187407905081 28.085 > 3 6 Si 0.21809684929847 0.59341159701740 0.77187407905081 28.085 > 4 7 Si 0.78190315070153 0.40658840298260 0.22812592094919 28.085 > 5 8 Si 0.78190315070153 0.59341159701740 0.72812592094919 28.085 > 6 9 Si 0.71809684929847 0.90658840298260 0.27187407905081 28.085 > 3 10 Si 0.71809684929847 0.09341159701740 0.77187407905081 28.085 > 4 11 Si 0.28190315070153 0.90658840298260 0.22812592094919 28.085 > 5 12 Si 0.28190315070153 0.09341159701740 0.72812592094919 28.085 > 6 *13 Bi 0.00000000000000 0.72061765492283 0.25000000000000 208.980 > 7 14 Bi 0.00000000000000 0.27938234507717 0.75000000000000 208.980 > 8 15 Bi 0.50000000000000 0.22061765492283 0.25000000000000 208.980 > 7 16 Bi 0.50000000000000 0.77938234507717 0.75000000000000 208.980 > 8 *17 O 0.38698054915029 0.40430568331062 0.35643152227254 15.999 > 9 18 O 0.38698054915029 0.59569431668938 0.85643152227254 15.999 > 10 *19 O 0.14088428073454 0.25331741588999 0.17727780103256 15.999 > 11 *20 O 0.16208509651275 0.47657732061435 0.51796597524304 15.999 > 12 21 O 0.14088428073454 0.74668258411001 0.67727780103256 15.999 > 13 22 O 0.16208509651275 0.52342267938565 0.01796597524304 15.999 > 14 23 O 0.83791490348725 0.47657732061435 0.98203402475696 15.999 > 15 24 O 0.85911571926546 0.25331741588999 0.32272219896744 15.999 > 16 25 O 0.83791490348725 0.52342267938565 0.48203402475696 15.999 > 17 26 O 0.85911571926546 0.74668258411001 0.82272219896744 15.999 > 18 27 O 0.61301945084971 0.40430568331062 0.14356847772746 15.999 > 19 28 O 0.61301945084971 0.59569431668938 0.64356847772746 15.999 > 20 29 O 0.88698054915029 0.90430568331062 0.35643152227254 15.999 > 9 30 O 0.88698054915029 0.09569431668938 0.85643152227254 15.999 > 10 31 O 0.64088428073454 0.75331741588999 0.17727780103256 15.999 > 11 32 O 0.66208509651275 0.97657732061435 0.51796597524304 15.999 > 12 33 O 0.64088428073454 0.24668258411001 0.67727780103256 15.999 > 13 34 O 0.66208509651275 0.02342267938565 0.01796597524304 15.999 > 14 35 O 0.33791490348725 0.97657732061435 0.98203402475696 15.999 > 15 36 O 0.35911571926546 0.75331741588999 0.32272219896744 15.999 > 16 37 O 0.33791490348725 0.02342267938565 0.48203402475696 15.999 > 17 38 O 0.35911571926546 0.24668258411001 0.82272219896744 15.999 > 18 39 O 0.11301945084971 0.90430568331062 0.14356847772746 15.999 > 19 40 O 0.11301945084971 0.09569431668938 0.64356847772746 15.999 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.998792620987272 0.000000000000000 0.000000000000000 b 0.000000000000000 9.135003429999999 0.000000000000000 c -2.785364293848428 0.000000000000000 10.097248699117392 Atomic positions (fractional): *1 Li 0.00000000000000 0.08963394255962 0.12500000000000 6.941 > 1 2 Li 0.00000000000000 0.08963394255962 0.62500000000000 6.941 > 1 3 Li 0.00000000000000 0.91036605744038 0.37500000000000 6.941 > 2 4 Li 0.00000000000000 0.91036605744038 0.87500000000000 6.941 > 2 5 Li 0.50000000000000 0.58963394255962 0.12500000000000 6.941 > 1 6 Li 0.50000000000000 0.58963394255962 0.62500000000000 6.941 > 1 7 Li 0.50000000000000 0.41036605744038 0.37500000000000 6.941 > 2 8 Li 0.50000000000000 0.41036605744038 0.87500000000000 6.941 > 2 *9 Si 0.21809684929847 0.40658840298260 0.13593703952541 28.085 > 3 10 Si 0.21809684929847 0.40658840298260 0.63593703952541 28.085 > 3 11 Si 0.21809684929847 0.59341159701740 0.38593703952541 28.085 > 4 12 Si 0.21809684929847 0.59341159701740 0.88593703952541 28.085 > 4 13 Si 0.78190315070153 0.40658840298260 0.11406296047459 28.085 > 5 14 Si 0.78190315070153 0.40658840298260 0.61406296047459 28.085 > 5 15 Si 0.78190315070153 0.59341159701740 0.36406296047459 28.085 > 6 16 Si 0.78190315070153 0.59341159701740 0.86406296047459 28.085 > 6 17 Si 0.71809684929847 0.90658840298260 0.13593703952541 28.085 > 3 18 Si 0.71809684929847 0.90658840298260 0.63593703952541 28.085 > 3 19 Si 0.71809684929847 0.09341159701740 0.38593703952541 28.085 > 4 20 Si 0.71809684929847 0.09341159701740 0.88593703952541 28.085 > 4 21 Si 0.28190315070153 0.90658840298260 0.11406296047459 28.085 > 5 22 Si 0.28190315070153 0.90658840298260 0.61406296047459 28.085 > 5 23 Si 0.28190315070153 0.09341159701740 0.36406296047459 28.085 > 6 24 Si 0.28190315070153 0.09341159701740 0.86406296047459 28.085 > 6 *25 Bi 0.00000000000000 0.72061765492283 0.12500000000000 208.980 > 7 26 Bi 0.00000000000000 0.72061765492283 0.62500000000000 208.980 > 7 27 Bi 0.00000000000000 0.27938234507717 0.37500000000000 208.980 > 8 28 Bi 0.00000000000000 0.27938234507717 0.87500000000000 208.980 > 8 29 Bi 0.50000000000000 0.22061765492283 0.12500000000000 208.980 > 7 30 Bi 0.50000000000000 0.22061765492283 0.62500000000000 208.980 > 7 31 Bi 0.50000000000000 0.77938234507717 0.37500000000000 208.980 > 8 32 Bi 0.50000000000000 0.77938234507717 0.87500000000000 208.980 > 8 *33 O 0.38698054915029 0.40430568331062 0.17821576113627 15.999 > 9 34 O 0.38698054915029 0.40430568331062 0.67821576113627 15.999 > 9 35 O 0.38698054915029 0.59569431668938 0.42821576113627 15.999 > 10 36 O 0.38698054915029 0.59569431668938 0.92821576113627 15.999 > 10 *37 O 0.14088428073454 0.25331741588999 0.08863890051628 15.999 > 11 38 O 0.14088428073454 0.25331741588999 0.58863890051628 15.999 > 11 *39 O 0.16208509651275 0.47657732061435 0.25898298762152 15.999 > 12 40 O 0.16208509651275 0.47657732061435 0.75898298762152 15.999 > 12 41 O 0.14088428073454 0.74668258411001 0.33863890051628 15.999 > 13 42 O 0.14088428073454 0.74668258411001 0.83863890051628 15.999 > 13 43 O 0.16208509651275 0.52342267938565 0.00898298762152 15.999 > 14 44 O 0.16208509651275 0.52342267938565 0.50898298762152 15.999 > 14 45 O 0.83791490348725 0.47657732061435 0.49101701237848 15.999 > 15 46 O 0.83791490348725 0.47657732061435 0.99101701237848 15.999 > 15 47 O 0.85911571926546 0.25331741588999 0.16136109948372 15.999 > 16 48 O 0.85911571926546 0.25331741588999 0.66136109948372 15.999 > 16 49 O 0.83791490348725 0.52342267938565 0.24101701237848 15.999 > 17 50 O 0.83791490348725 0.52342267938565 0.74101701237848 15.999 > 17 51 O 0.85911571926546 0.74668258411001 0.41136109948372 15.999 > 18 52 O 0.85911571926546 0.74668258411001 0.91136109948372 15.999 > 18 53 O 0.61301945084971 0.40430568331062 0.07178423886373 15.999 > 19 54 O 0.61301945084971 0.40430568331062 0.57178423886373 15.999 > 19 55 O 0.61301945084971 0.59569431668938 0.32178423886373 15.999 > 20 56 O 0.61301945084971 0.59569431668938 0.82178423886373 15.999 > 20 57 O 0.88698054915029 0.90430568331062 0.17821576113627 15.999 > 9 58 O 0.88698054915029 0.90430568331062 0.67821576113627 15.999 > 9 59 O 0.88698054915029 0.09569431668938 0.42821576113627 15.999 > 10 60 O 0.88698054915029 0.09569431668938 0.92821576113627 15.999 > 10 61 O 0.64088428073454 0.75331741588999 0.08863890051628 15.999 > 11 62 O 0.64088428073454 0.75331741588999 0.58863890051628 15.999 > 11 63 O 0.66208509651275 0.97657732061435 0.25898298762152 15.999 > 12 64 O 0.66208509651275 0.97657732061435 0.75898298762152 15.999 > 12 65 O 0.64088428073454 0.24668258411001 0.33863890051628 15.999 > 13 66 O 0.64088428073454 0.24668258411001 0.83863890051628 15.999 > 13 67 O 0.66208509651275 0.02342267938565 0.00898298762152 15.999 > 14 68 O 0.66208509651275 0.02342267938565 0.50898298762152 15.999 > 14 69 O 0.33791490348725 0.97657732061435 0.49101701237848 15.999 > 15 70 O 0.33791490348725 0.97657732061435 0.99101701237848 15.999 > 15 71 O 0.35911571926546 0.75331741588999 0.16136109948372 15.999 > 16 72 O 0.35911571926546 0.75331741588999 0.66136109948372 15.999 > 16 73 O 0.33791490348725 0.02342267938565 0.24101701237848 15.999 > 17 74 O 0.33791490348725 0.02342267938565 0.74101701237848 15.999 > 17 75 O 0.35911571926546 0.24668258411001 0.41136109948372 15.999 > 18 76 O 0.35911571926546 0.24668258411001 0.91136109948372 15.999 > 18 77 O 0.11301945084971 0.90430568331062 0.07178423886373 15.999 > 19 78 O 0.11301945084971 0.90430568331062 0.57178423886373 15.999 > 19 79 O 0.11301945084971 0.09569431668938 0.32178423886373 15.999 > 20 80 O 0.11301945084971 0.09569431668938 0.82178423886373 15.999 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7518318 0.0000000 0.1997576 0.0000000 3.5792364 0.0000000 0.1997577 0.0000000 3.8781011 -------------------------- Born effective charges -------------------------- 1 Li 1.0111467 0.0000000 -0.0164171 0.0000000 1.2736553 0.0000000 0.0035975 0.0000000 1.1822734 2 Li 1.0111467 0.0000000 -0.0164171 0.0000000 1.2736553 0.0000000 0.0035975 0.0000000 1.1822734 3 Si 3.6063474 0.1779360 0.1220762 -0.6983759 3.0288145 -0.1295885 0.0361576 0.5235973 3.4907734 4 Si 3.6063474 -0.1779360 0.1220762 0.6983759 3.0288145 0.1295885 0.0361576 -0.5235973 3.4907734 5 Si 3.6063474 -0.1779360 0.1220762 0.6983759 3.0288145 0.1295885 0.0361576 -0.5235973 3.4907734 6 Si 3.6063474 0.1779360 0.1220762 -0.6983759 3.0288145 -0.1295885 0.0361576 0.5235973 3.4907734 7 Bi 3.9664571 0.0000000 0.6221140 0.0000000 3.8915044 0.0000000 0.6098336 0.0000000 4.6019633 8 Bi 3.9664571 0.0000000 0.6221140 0.0000000 3.8915044 0.0000000 0.6098336 0.0000000 4.6019633 9 O -2.6257323 0.6674890 -0.1012816 0.8683539 -1.8624022 -0.0661211 -0.0848360 -0.2527420 -1.3413987 10 O -2.6257323 -0.6674890 -0.1012816 -0.8683539 -1.8624022 0.0661211 -0.0848360 0.2527420 -1.3413987 11 O -1.6766199 -0.3206707 -0.6441595 -0.1682714 -1.6523986 -0.1423915 -0.6640139 -0.2386852 -2.6161315 12 O -1.7927971 0.0892594 0.3205165 0.1672065 -2.0965936 -0.5379126 0.4059767 -0.5220854 -2.4253615 13 O -1.6766199 0.3206707 -0.6441595 0.1682714 -1.6523986 0.1423915 -0.6640139 0.2386852 -2.6161315 14 O -1.7927971 -0.0892594 0.3205165 -0.1672065 -2.0965936 0.5379126 0.4059767 0.5220854 -2.4253615 15 O -1.7927971 -0.0892594 0.3205165 -0.1672065 -2.0965936 0.5379126 0.4059767 0.5220854 -2.4253615 16 O -1.6766199 0.3206707 -0.6441595 0.1682714 -1.6523986 0.1423915 -0.6640139 0.2386852 -2.6161315 17 O -1.7927971 0.0892594 0.3205165 0.1672065 -2.0965936 -0.5379126 0.4059767 -0.5220854 -2.4253615 18 O -1.6766199 -0.3206707 -0.6441595 -0.1682714 -1.6523986 -0.1423915 -0.6640139 -0.2386852 -2.6161315 19 O -2.6257323 -0.6674890 -0.1012816 -0.8683539 -1.8624022 0.0661211 -0.0848360 0.2527420 -1.3413987 20 O -2.6257323 0.6674890 -0.1012816 0.8683539 -1.8624022 -0.0661211 -0.0848360 -0.2527420 -1.3413987 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 8772/8772 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.197 Solver_block: 200 / 640 - Time: 2.214 Solver_block: 300 / 640 - Time: 2.207 Solver_block: 400 / 640 - Time: 2.210 Solver_block: 500 / 640 - Time: 2.208 Solver_block: 600 / 640 - Time: 2.204 Solver_block: 640 / 640 - Time: 0.956 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.245 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) Permutation basis: 240/240 Permutation basis: 8772/8772 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1894 Number of blocks in projector: 1894 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 408 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 234 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 234 Use standard eigh solver. Tree of FC basis block matrices: - (1894, 1849), data: False |-- (234, 228), data: True |-- (234, 228), data: True |-- (234, 228), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (408, 397), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 00:13:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:13:53]------------------------- 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): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.999396310493636 -4.567501715000000 0.000000000000000 b 4.999396310493636 4.567501715000000 0.000000000000000 c -1.392682146924214 0.000000000000000 5.048624349558696 Atomic positions (fractional): 1 Li 0.91036605744038 0.08963394255962 0.25000000000000 6.941 2 Li 0.08963394255962 0.91036605744038 0.75000000000000 6.941 3 Si 0.81150844631587 0.62468525228107 0.27187407905081 28.085 4 Si 0.62468525228107 0.81150844631587 0.77187407905081 28.085 5 Si 0.37531474771893 0.18849155368413 0.22812592094919 28.085 6 Si 0.18849155368413 0.37531474771893 0.72812592094919 28.085 7 Bi 0.27938234507717 0.72061765492283 0.25000000000000 208.980 8 Bi 0.72061765492283 0.27938234507717 0.75000000000000 208.980 9 O 0.98267486583966 0.79128623246091 0.35643152227254 15.999 10 O 0.79128623246091 0.98267486583966 0.85643152227254 15.999 11 O 0.88756686484455 0.39420169662452 0.17727780103256 15.999 12 O 0.68550777589840 0.63866241712710 0.51796597524304 15.999 13 O 0.39420169662452 0.88756686484455 0.67727780103256 15.999 14 O 0.63866241712710 0.68550777589840 0.01796597524304 15.999 15 O 0.36133758287290 0.31449222410160 0.98203402475696 15.999 16 O 0.60579830337548 0.11243313515545 0.32272219896744 15.999 17 O 0.31449222410160 0.36133758287290 0.48203402475696 15.999 18 O 0.11243313515545 0.60579830337548 0.82272219896744 15.999 19 O 0.20871376753909 0.01732513416034 0.14356847772746 15.999 20 O 0.01732513416034 0.20871376753909 0.64356847772746 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.998792620987272 0.000000000000000 0.000000000000000 b 0.000000000000000 9.135003429999999 0.000000000000000 c -2.785364293848428 0.000000000000000 10.097248699117392 Atomic positions (fractional): 1 Li 0.00000000000000 0.08963394255962 0.12500000000000 6.941 > 1 2 Li 0.00000000000000 0.08963394255962 0.62500000000000 6.941 > 1 3 Li 0.00000000000000 0.91036605744038 0.37500000000000 6.941 > 3 4 Li 0.00000000000000 0.91036605744038 0.87500000000000 6.941 > 3 5 Li 0.50000000000000 0.58963394255962 0.12500000000000 6.941 > 1 6 Li 0.50000000000000 0.58963394255962 0.62500000000000 6.941 > 1 7 Li 0.50000000000000 0.41036605744038 0.37500000000000 6.941 > 3 8 Li 0.50000000000000 0.41036605744038 0.87500000000000 6.941 > 3 9 Si 0.21809684929847 0.40658840298260 0.13593703952541 28.085 > 9 10 Si 0.21809684929847 0.40658840298260 0.63593703952541 28.085 > 9 11 Si 0.21809684929847 0.59341159701740 0.38593703952541 28.085 > 11 12 Si 0.21809684929847 0.59341159701740 0.88593703952541 28.085 > 11 13 Si 0.78190315070153 0.40658840298260 0.11406296047459 28.085 > 13 14 Si 0.78190315070153 0.40658840298260 0.61406296047459 28.085 > 13 15 Si 0.78190315070153 0.59341159701740 0.36406296047459 28.085 > 15 16 Si 0.78190315070153 0.59341159701740 0.86406296047459 28.085 > 15 17 Si 0.71809684929847 0.90658840298260 0.13593703952541 28.085 > 9 18 Si 0.71809684929847 0.90658840298260 0.63593703952541 28.085 > 9 19 Si 0.71809684929847 0.09341159701740 0.38593703952541 28.085 > 11 20 Si 0.71809684929847 0.09341159701740 0.88593703952541 28.085 > 11 21 Si 0.28190315070153 0.90658840298260 0.11406296047459 28.085 > 13 22 Si 0.28190315070153 0.90658840298260 0.61406296047459 28.085 > 13 23 Si 0.28190315070153 0.09341159701740 0.36406296047459 28.085 > 15 24 Si 0.28190315070153 0.09341159701740 0.86406296047459 28.085 > 15 25 Bi 0.00000000000000 0.72061765492283 0.12500000000000 208.980 > 25 26 Bi 0.00000000000000 0.72061765492283 0.62500000000000 208.980 > 25 27 Bi 0.00000000000000 0.27938234507717 0.37500000000000 208.980 > 27 28 Bi 0.00000000000000 0.27938234507717 0.87500000000000 208.980 > 27 29 Bi 0.50000000000000 0.22061765492283 0.12500000000000 208.980 > 25 30 Bi 0.50000000000000 0.22061765492283 0.62500000000000 208.980 > 25 31 Bi 0.50000000000000 0.77938234507717 0.37500000000000 208.980 > 27 32 Bi 0.50000000000000 0.77938234507717 0.87500000000000 208.980 > 27 33 O 0.38698054915029 0.40430568331062 0.17821576113627 15.999 > 33 34 O 0.38698054915029 0.40430568331062 0.67821576113627 15.999 > 33 35 O 0.38698054915029 0.59569431668938 0.42821576113627 15.999 > 35 36 O 0.38698054915029 0.59569431668938 0.92821576113627 15.999 > 35 37 O 0.14088428073454 0.25331741588999 0.08863890051628 15.999 > 37 38 O 0.14088428073454 0.25331741588999 0.58863890051628 15.999 > 37 39 O 0.16208509651275 0.47657732061435 0.25898298762152 15.999 > 39 40 O 0.16208509651275 0.47657732061435 0.75898298762152 15.999 > 39 41 O 0.14088428073454 0.74668258411001 0.33863890051628 15.999 > 41 42 O 0.14088428073454 0.74668258411001 0.83863890051628 15.999 > 41 43 O 0.16208509651275 0.52342267938565 0.00898298762152 15.999 > 43 44 O 0.16208509651275 0.52342267938565 0.50898298762152 15.999 > 43 45 O 0.83791490348725 0.47657732061435 0.49101701237848 15.999 > 45 46 O 0.83791490348725 0.47657732061435 0.99101701237848 15.999 > 45 47 O 0.85911571926546 0.25331741588999 0.16136109948372 15.999 > 47 48 O 0.85911571926546 0.25331741588999 0.66136109948372 15.999 > 47 49 O 0.83791490348725 0.52342267938565 0.24101701237848 15.999 > 49 50 O 0.83791490348725 0.52342267938565 0.74101701237848 15.999 > 49 51 O 0.85911571926546 0.74668258411001 0.41136109948372 15.999 > 51 52 O 0.85911571926546 0.74668258411001 0.91136109948372 15.999 > 51 53 O 0.61301945084971 0.40430568331062 0.07178423886373 15.999 > 53 54 O 0.61301945084971 0.40430568331062 0.57178423886373 15.999 > 53 55 O 0.61301945084971 0.59569431668938 0.32178423886373 15.999 > 55 56 O 0.61301945084971 0.59569431668938 0.82178423886373 15.999 > 55 57 O 0.88698054915029 0.90430568331062 0.17821576113627 15.999 > 33 58 O 0.88698054915029 0.90430568331062 0.67821576113627 15.999 > 33 59 O 0.88698054915029 0.09569431668938 0.42821576113627 15.999 > 35 60 O 0.88698054915029 0.09569431668938 0.92821576113627 15.999 > 35 61 O 0.64088428073454 0.75331741588999 0.08863890051628 15.999 > 37 62 O 0.64088428073454 0.75331741588999 0.58863890051628 15.999 > 37 63 O 0.66208509651275 0.97657732061435 0.25898298762152 15.999 > 39 64 O 0.66208509651275 0.97657732061435 0.75898298762152 15.999 > 39 65 O 0.64088428073454 0.24668258411001 0.33863890051628 15.999 > 41 66 O 0.64088428073454 0.24668258411001 0.83863890051628 15.999 > 41 67 O 0.66208509651275 0.02342267938565 0.00898298762152 15.999 > 43 68 O 0.66208509651275 0.02342267938565 0.50898298762152 15.999 > 43 69 O 0.33791490348725 0.97657732061435 0.49101701237848 15.999 > 45 70 O 0.33791490348725 0.97657732061435 0.99101701237848 15.999 > 45 71 O 0.35911571926546 0.75331741588999 0.16136109948372 15.999 > 47 72 O 0.35911571926546 0.75331741588999 0.66136109948372 15.999 > 47 73 O 0.33791490348725 0.02342267938565 0.24101701237848 15.999 > 49 74 O 0.33791490348725 0.02342267938565 0.74101701237848 15.999 > 49 75 O 0.35911571926546 0.24668258411001 0.41136109948372 15.999 > 51 76 O 0.35911571926546 0.24668258411001 0.91136109948372 15.999 > 51 77 O 0.11301945084971 0.90430568331062 0.07178423886373 15.999 > 53 78 O 0.11301945084971 0.90430568331062 0.57178423886373 15.999 > 53 79 O 0.11301945084971 0.09569431668938 0.32178423886373 15.999 > 55 80 O 0.11301945084971 0.09569431668938 0.82178423886373 15.999 > 55 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7518318 0.0000000 0.1997576 0.0000000 3.5792364 0.0000000 0.1997577 0.0000000 3.8781011 -------------------------- Born effective charges -------------------------- 1 Li 1.0111467 0.0000000 -0.0164171 0.0000000 1.2736553 0.0000000 0.0035975 0.0000000 1.1822734 2 Li 1.0111467 0.0000000 -0.0164171 0.0000000 1.2736553 0.0000000 0.0035975 0.0000000 1.1822734 3 Si 3.6063474 0.1779360 0.1220762 -0.6983759 3.0288145 -0.1295885 0.0361576 0.5235973 3.4907734 4 Si 3.6063474 -0.1779360 0.1220762 0.6983759 3.0288145 0.1295885 0.0361576 -0.5235973 3.4907734 5 Si 3.6063474 -0.1779360 0.1220762 0.6983759 3.0288145 0.1295885 0.0361576 -0.5235973 3.4907734 6 Si 3.6063474 0.1779360 0.1220762 -0.6983759 3.0288145 -0.1295885 0.0361576 0.5235973 3.4907734 7 Bi 3.9664571 0.0000000 0.6221140 0.0000000 3.8915044 0.0000000 0.6098336 0.0000000 4.6019633 8 Bi 3.9664571 0.0000000 0.6221140 0.0000000 3.8915044 0.0000000 0.6098336 0.0000000 4.6019633 9 O -2.6257323 0.6674890 -0.1012816 0.8683539 -1.8624022 -0.0661211 -0.0848360 -0.2527420 -1.3413987 10 O -2.6257323 -0.6674890 -0.1012816 -0.8683539 -1.8624022 0.0661211 -0.0848360 0.2527420 -1.3413987 11 O -1.6766199 -0.3206707 -0.6441595 -0.1682714 -1.6523986 -0.1423915 -0.6640139 -0.2386852 -2.6161315 12 O -1.7927971 0.0892594 0.3205165 0.1672065 -2.0965936 -0.5379126 0.4059767 -0.5220854 -2.4253615 13 O -1.6766199 0.3206707 -0.6441595 0.1682714 -1.6523986 0.1423915 -0.6640139 0.2386852 -2.6161315 14 O -1.7927971 -0.0892594 0.3205165 -0.1672065 -2.0965936 0.5379126 0.4059767 0.5220854 -2.4253615 15 O -1.7927971 -0.0892594 0.3205165 -0.1672065 -2.0965936 0.5379126 0.4059767 0.5220854 -2.4253615 16 O -1.6766199 0.3206707 -0.6441595 0.1682714 -1.6523986 0.1423915 -0.6640139 0.2386852 -2.6161315 17 O -1.7927971 0.0892594 0.3205165 0.1672065 -2.0965936 -0.5379126 0.4059767 -0.5220854 -2.4253615 18 O -1.6766199 -0.3206707 -0.6441595 -0.1682714 -1.6523986 -0.1423915 -0.6640139 -0.2386852 -2.6161315 19 O -2.6257323 -0.6674890 -0.1012816 -0.8683539 -1.8624022 0.0661211 -0.0848360 0.2527420 -1.3413987 20 O -2.6257323 0.6674890 -0.1012816 0.8683539 -1.8624022 -0.0661211 -0.0848360 -0.2527420 -1.3413987 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 39, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000009 (xyx) -0.00000009 (xyx) -0.00000009 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000008 (xz) -0.00000008 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 00:14:08]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:14:09]------------------------- 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): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.999396310493636 -4.567501715000000 0.000000000000000 b 4.999396310493636 4.567501715000000 0.000000000000000 c -1.392682146924214 0.000000000000000 5.048624349558696 Atomic positions (fractional): 1 Li 0.91036605744038 0.08963394255962 0.25000000000000 6.941 2 Li 0.08963394255962 0.91036605744038 0.75000000000000 6.941 3 Si 0.81150844631587 0.62468525228107 0.27187407905081 28.085 4 Si 0.62468525228107 0.81150844631587 0.77187407905081 28.085 5 Si 0.37531474771893 0.18849155368413 0.22812592094919 28.085 6 Si 0.18849155368413 0.37531474771893 0.72812592094919 28.085 7 Bi 0.27938234507717 0.72061765492283 0.25000000000000 208.980 8 Bi 0.72061765492283 0.27938234507717 0.75000000000000 208.980 9 O 0.98267486583966 0.79128623246091 0.35643152227254 15.999 10 O 0.79128623246091 0.98267486583966 0.85643152227254 15.999 11 O 0.88756686484455 0.39420169662452 0.17727780103256 15.999 12 O 0.68550777589840 0.63866241712710 0.51796597524304 15.999 13 O 0.39420169662452 0.88756686484455 0.67727780103256 15.999 14 O 0.63866241712710 0.68550777589840 0.01796597524304 15.999 15 O 0.36133758287290 0.31449222410160 0.98203402475696 15.999 16 O 0.60579830337548 0.11243313515545 0.32272219896744 15.999 17 O 0.31449222410160 0.36133758287290 0.48203402475696 15.999 18 O 0.11243313515545 0.60579830337548 0.82272219896744 15.999 19 O 0.20871376753909 0.01732513416034 0.14356847772746 15.999 20 O 0.01732513416034 0.20871376753909 0.64356847772746 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.998792620987272 0.000000000000000 0.000000000000000 b 0.000000000000000 9.135003429999999 0.000000000000000 c -2.785364293848428 0.000000000000000 10.097248699117392 Atomic positions (fractional): 1 Li 0.00000000000000 0.08963394255962 0.12500000000000 6.941 > 1 2 Li 0.00000000000000 0.08963394255962 0.62500000000000 6.941 > 1 3 Li 0.00000000000000 0.91036605744038 0.37500000000000 6.941 > 3 4 Li 0.00000000000000 0.91036605744038 0.87500000000000 6.941 > 3 5 Li 0.50000000000000 0.58963394255962 0.12500000000000 6.941 > 1 6 Li 0.50000000000000 0.58963394255962 0.62500000000000 6.941 > 1 7 Li 0.50000000000000 0.41036605744038 0.37500000000000 6.941 > 3 8 Li 0.50000000000000 0.41036605744038 0.87500000000000 6.941 > 3 9 Si 0.21809684929847 0.40658840298260 0.13593703952541 28.085 > 9 10 Si 0.21809684929847 0.40658840298260 0.63593703952541 28.085 > 9 11 Si 0.21809684929847 0.59341159701740 0.38593703952541 28.085 > 11 12 Si 0.21809684929847 0.59341159701740 0.88593703952541 28.085 > 11 13 Si 0.78190315070153 0.40658840298260 0.11406296047459 28.085 > 13 14 Si 0.78190315070153 0.40658840298260 0.61406296047459 28.085 > 13 15 Si 0.78190315070153 0.59341159701740 0.36406296047459 28.085 > 15 16 Si 0.78190315070153 0.59341159701740 0.86406296047459 28.085 > 15 17 Si 0.71809684929847 0.90658840298260 0.13593703952541 28.085 > 9 18 Si 0.71809684929847 0.90658840298260 0.63593703952541 28.085 > 9 19 Si 0.71809684929847 0.09341159701740 0.38593703952541 28.085 > 11 20 Si 0.71809684929847 0.09341159701740 0.88593703952541 28.085 > 11 21 Si 0.28190315070153 0.90658840298260 0.11406296047459 28.085 > 13 22 Si 0.28190315070153 0.90658840298260 0.61406296047459 28.085 > 13 23 Si 0.28190315070153 0.09341159701740 0.36406296047459 28.085 > 15 24 Si 0.28190315070153 0.09341159701740 0.86406296047459 28.085 > 15 25 Bi 0.00000000000000 0.72061765492283 0.12500000000000 208.980 > 25 26 Bi 0.00000000000000 0.72061765492283 0.62500000000000 208.980 > 25 27 Bi 0.00000000000000 0.27938234507717 0.37500000000000 208.980 > 27 28 Bi 0.00000000000000 0.27938234507717 0.87500000000000 208.980 > 27 29 Bi 0.50000000000000 0.22061765492283 0.12500000000000 208.980 > 25 30 Bi 0.50000000000000 0.22061765492283 0.62500000000000 208.980 > 25 31 Bi 0.50000000000000 0.77938234507717 0.37500000000000 208.980 > 27 32 Bi 0.50000000000000 0.77938234507717 0.87500000000000 208.980 > 27 33 O 0.38698054915029 0.40430568331062 0.17821576113627 15.999 > 33 34 O 0.38698054915029 0.40430568331062 0.67821576113627 15.999 > 33 35 O 0.38698054915029 0.59569431668938 0.42821576113627 15.999 > 35 36 O 0.38698054915029 0.59569431668938 0.92821576113627 15.999 > 35 37 O 0.14088428073454 0.25331741588999 0.08863890051628 15.999 > 37 38 O 0.14088428073454 0.25331741588999 0.58863890051628 15.999 > 37 39 O 0.16208509651275 0.47657732061435 0.25898298762152 15.999 > 39 40 O 0.16208509651275 0.47657732061435 0.75898298762152 15.999 > 39 41 O 0.14088428073454 0.74668258411001 0.33863890051628 15.999 > 41 42 O 0.14088428073454 0.74668258411001 0.83863890051628 15.999 > 41 43 O 0.16208509651275 0.52342267938565 0.00898298762152 15.999 > 43 44 O 0.16208509651275 0.52342267938565 0.50898298762152 15.999 > 43 45 O 0.83791490348725 0.47657732061435 0.49101701237848 15.999 > 45 46 O 0.83791490348725 0.47657732061435 0.99101701237848 15.999 > 45 47 O 0.85911571926546 0.25331741588999 0.16136109948372 15.999 > 47 48 O 0.85911571926546 0.25331741588999 0.66136109948372 15.999 > 47 49 O 0.83791490348725 0.52342267938565 0.24101701237848 15.999 > 49 50 O 0.83791490348725 0.52342267938565 0.74101701237848 15.999 > 49 51 O 0.85911571926546 0.74668258411001 0.41136109948372 15.999 > 51 52 O 0.85911571926546 0.74668258411001 0.91136109948372 15.999 > 51 53 O 0.61301945084971 0.40430568331062 0.07178423886373 15.999 > 53 54 O 0.61301945084971 0.40430568331062 0.57178423886373 15.999 > 53 55 O 0.61301945084971 0.59569431668938 0.32178423886373 15.999 > 55 56 O 0.61301945084971 0.59569431668938 0.82178423886373 15.999 > 55 57 O 0.88698054915029 0.90430568331062 0.17821576113627 15.999 > 33 58 O 0.88698054915029 0.90430568331062 0.67821576113627 15.999 > 33 59 O 0.88698054915029 0.09569431668938 0.42821576113627 15.999 > 35 60 O 0.88698054915029 0.09569431668938 0.92821576113627 15.999 > 35 61 O 0.64088428073454 0.75331741588999 0.08863890051628 15.999 > 37 62 O 0.64088428073454 0.75331741588999 0.58863890051628 15.999 > 37 63 O 0.66208509651275 0.97657732061435 0.25898298762152 15.999 > 39 64 O 0.66208509651275 0.97657732061435 0.75898298762152 15.999 > 39 65 O 0.64088428073454 0.24668258411001 0.33863890051628 15.999 > 41 66 O 0.64088428073454 0.24668258411001 0.83863890051628 15.999 > 41 67 O 0.66208509651275 0.02342267938565 0.00898298762152 15.999 > 43 68 O 0.66208509651275 0.02342267938565 0.50898298762152 15.999 > 43 69 O 0.33791490348725 0.97657732061435 0.49101701237848 15.999 > 45 70 O 0.33791490348725 0.97657732061435 0.99101701237848 15.999 > 45 71 O 0.35911571926546 0.75331741588999 0.16136109948372 15.999 > 47 72 O 0.35911571926546 0.75331741588999 0.66136109948372 15.999 > 47 73 O 0.33791490348725 0.02342267938565 0.24101701237848 15.999 > 49 74 O 0.33791490348725 0.02342267938565 0.74101701237848 15.999 > 49 75 O 0.35911571926546 0.24668258411001 0.41136109948372 15.999 > 51 76 O 0.35911571926546 0.24668258411001 0.91136109948372 15.999 > 51 77 O 0.11301945084971 0.90430568331062 0.07178423886373 15.999 > 53 78 O 0.11301945084971 0.90430568331062 0.57178423886373 15.999 > 53 79 O 0.11301945084971 0.09569431668938 0.32178423886373 15.999 > 55 80 O 0.11301945084971 0.09569431668938 0.82178423886373 15.999 > 55 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.7518318 0.0000000 0.1997576 0.0000000 3.5792364 0.0000000 0.1997577 0.0000000 3.8781011 -------------------------- Born effective charges -------------------------- 1 Li 1.0111467 0.0000000 -0.0164171 0.0000000 1.2736553 0.0000000 0.0035975 0.0000000 1.1822734 2 Li 1.0111467 0.0000000 -0.0164171 0.0000000 1.2736553 0.0000000 0.0035975 0.0000000 1.1822734 3 Si 3.6063474 0.1779360 0.1220762 -0.6983759 3.0288145 -0.1295885 0.0361576 0.5235973 3.4907734 4 Si 3.6063474 -0.1779360 0.1220762 0.6983759 3.0288145 0.1295885 0.0361576 -0.5235973 3.4907734 5 Si 3.6063474 -0.1779360 0.1220762 0.6983759 3.0288145 0.1295885 0.0361576 -0.5235973 3.4907734 6 Si 3.6063474 0.1779360 0.1220762 -0.6983759 3.0288145 -0.1295885 0.0361576 0.5235973 3.4907734 7 Bi 3.9664571 0.0000000 0.6221140 0.0000000 3.8915044 0.0000000 0.6098336 0.0000000 4.6019633 8 Bi 3.9664571 0.0000000 0.6221140 0.0000000 3.8915044 0.0000000 0.6098336 0.0000000 4.6019633 9 O -2.6257323 0.6674890 -0.1012816 0.8683539 -1.8624022 -0.0661211 -0.0848360 -0.2527420 -1.3413987 10 O -2.6257323 -0.6674890 -0.1012816 -0.8683539 -1.8624022 0.0661211 -0.0848360 0.2527420 -1.3413987 11 O -1.6766199 -0.3206707 -0.6441595 -0.1682714 -1.6523986 -0.1423915 -0.6640139 -0.2386852 -2.6161315 12 O -1.7927971 0.0892594 0.3205165 0.1672065 -2.0965936 -0.5379126 0.4059767 -0.5220854 -2.4253615 13 O -1.6766199 0.3206707 -0.6441595 0.1682714 -1.6523986 0.1423915 -0.6640139 0.2386852 -2.6161315 14 O -1.7927971 -0.0892594 0.3205165 -0.1672065 -2.0965936 0.5379126 0.4059767 0.5220854 -2.4253615 15 O -1.7927971 -0.0892594 0.3205165 -0.1672065 -2.0965936 0.5379126 0.4059767 0.5220854 -2.4253615 16 O -1.6766199 0.3206707 -0.6441595 0.1682714 -1.6523986 0.1423915 -0.6640139 0.2386852 -2.6161315 17 O -1.7927971 0.0892594 0.3205165 0.1672065 -2.0965936 -0.5379126 0.4059767 -0.5220854 -2.4253615 18 O -1.6766199 -0.3206707 -0.6441595 -0.1682714 -1.6523986 -0.1423915 -0.6640139 -0.2386852 -2.6161315 19 O -2.6257323 -0.6674890 -0.1012816 -0.8683539 -1.8624022 0.0661211 -0.0848360 0.2527420 -1.3413987 20 O -2.6257323 0.6674890 -0.1012816 0.8683539 -1.8624022 -0.0661211 -0.0848360 -0.2527420 -1.3413987 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000009 (xyx) -0.00000009 (xyx) -0.00000009 (xxy) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 8 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.68, Number of G-points: 299, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/186) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 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 1.768 ( 0.000 0.000 0.000) 0.000 2.180 ( 0.000 0.000 0.000) 0.000 2.420 ( 0.000 0.000 0.000) 0.000 2.523 ( 0.000 0.000 0.000) 0.000 4.075 ( 0.000 0.000 0.000) 0.000 4.170 ( 0.000 0.000 0.000) 0.000 4.182 ( 0.000 0.000 0.000) 0.000 4.462 ( 0.000 0.000 0.000) 0.000 5.427 ( 0.000 0.000 0.000) 0.000 5.710 ( 0.000 0.000 0.000) 0.000 5.757 ( 0.000 0.000 0.000) 0.000 5.990 ( 0.000 0.000 0.000) 0.000 6.967 ( 0.000 0.000 0.000) 0.000 7.108 ( 0.000 0.000 0.000) 0.000 7.121 ( 0.000 0.000 0.000) 0.000 7.787 ( 0.000 0.000 0.000) 0.000 8.016 ( 0.000 0.000 0.000) 0.000 8.134 ( 0.000 0.000 0.000) 0.000 8.138 ( 0.000 0.000 0.000) 0.000 8.360 ( 0.000 0.000 0.000) 0.000 8.500 ( 0.000 0.000 0.000) 0.000 9.177 ( 0.000 0.000 0.000) 0.000 9.192 ( 0.000 0.000 0.000) 0.000 9.430 ( 0.000 0.000 0.000) 0.000 9.777 ( 0.000 0.000 0.000) 0.000 10.735 ( 0.000 0.000 0.000) 0.000 10.926 ( 0.000 0.000 0.000) 0.000 11.263 ( 0.000 0.000 0.000) 0.000 11.572 ( 0.000 0.000 0.000) 0.000 12.068 ( 0.000 0.000 0.000) 0.000 12.081 ( 0.000 0.000 0.000) 0.000 12.231 ( 0.000 0.000 0.000) 0.000 13.001 ( 0.000 0.000 0.000) 0.000 13.027 ( 0.000 0.000 0.000) 0.000 13.958 ( 0.000 0.000 0.000) 0.000 14.275 ( 0.000 0.000 0.000) 0.000 14.492 ( 0.000 0.000 0.000) 0.000 14.828 ( 0.000 0.000 0.000) 0.000 14.863 ( 0.000 0.000 0.000) 0.000 14.953 ( 0.000 0.000 0.000) 0.000 15.580 ( 0.000 0.000 0.000) 0.000 18.186 ( 0.000 0.000 0.000) 0.000 18.877 ( 0.000 0.000 0.000) 0.000 19.984 ( 0.000 0.000 0.000) 0.000 20.544 ( 0.000 0.000 0.000) 0.000 25.305 ( 0.000 0.000 0.000) 0.000 25.601 ( 0.000 0.000 0.000) 0.000 26.628 ( 0.000 0.000 0.000) 0.000 26.701 ( 0.000 0.000 0.000) 0.000 27.026 ( 0.000 0.000 0.000) 0.000 27.768 ( 0.000 0.000 0.000) 0.000 28.514 ( 0.000 0.000 0.000) 0.000 28.771 ( 0.000 0.000 0.000) 0.000 28.923 ( 0.000 0.000 0.000) 0.000 29.102 ( 0.000 0.000 0.000) 0.000 29.410 ( 0.000 0.000 0.000) 0.000 30.034 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/186) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.546 ( 19.077 -18.411 9.649) 28.213 0.639 ( 21.852 -23.662 8.254) 33.249 0.927 ( 33.442 -30.484 13.836) 47.319 1.802 ( 5.934 0.482 1.677) 6.185 2.299 ( 2.491 8.107 -3.501) 9.176 2.522 ( 0.450 0.337 1.238) 1.360 2.682 ( 35.094 8.353 -13.155) 38.399 4.047 ( -1.317 3.475 3.275) 4.953 4.126 ( -4.194 2.461 4.850) 6.868 4.241 ( 4.599 -1.734 -3.989) 6.330 4.913 ( -29.387 -26.095 -14.657) 41.945 5.447 ( -6.715 4.355 -0.670) 8.032 5.683 ( -7.298 -4.530 4.992) 9.934 5.832 ( 3.696 -2.767 1.346) 4.809 6.021 ( -3.364 -5.892 1.876) 7.039 6.989 ( 1.641 0.556 1.261) 2.143 7.051 ( -2.976 4.067 -2.643) 5.691 7.160 ( 4.530 -2.107 1.825) 5.319 7.776 ( 1.808 4.816 -1.188) 5.280 8.012 ( -7.667 -4.316 -5.045) 10.141 8.129 ( 6.883 6.666 0.640) 9.603 8.315 ( 5.662 2.277 4.825) 7.779 8.533 ( 0.956 -4.712 -5.406) 7.234 8.832 ( 2.436 3.982 -0.223) 4.674 8.899 ( -6.486 14.271 0.403) 15.681 9.306 ( -3.219 -6.185 -0.501) 6.990 9.633 ( 18.430 -2.925 1.447) 18.717 10.227 ( 34.922 26.962 -1.230) 44.136 10.823 ( 0.134 -1.975 -1.588) 2.538 10.923 ( -2.941 -2.428 0.464) 3.841 11.271 ( -1.088 -2.481 0.322) 2.728 11.577 ( 1.250 1.353 1.714) 2.516 12.040 ( -2.944 3.474 1.079) 4.680 12.096 ( 0.170 2.321 6.797) 7.184 12.635 ( -10.257 0.450 37.748) 39.120 13.011 ( -5.382 -1.569 3.238) 6.474 13.354 ( -18.089 -14.833 8.428) 24.865 13.871 ( -9.759 3.254 -5.279) 11.563 14.294 ( -0.531 1.605 11.766) 11.887 14.475 ( -2.180 -0.222 -1.987) 2.958 14.799 ( -4.581 -0.666 -1.913) 5.009 14.983 ( 8.572 4.336 -3.310) 10.161 15.611 ( -0.230 -4.788 0.079) 4.794 15.921 ( -28.924 -33.211 -0.226) 44.041 18.344 ( 10.086 11.065 1.544) 15.052 18.831 ( -3.280 3.832 1.247) 5.196 20.100 ( -5.914 -9.062 -0.634) 10.840 20.533 ( 0.065 1.214 -1.511) 1.939 25.338 ( 3.845 -0.824 1.336) 4.153 25.884 ( -29.620 -26.600 -4.859) 40.106 26.668 ( -3.119 0.085 12.464) 12.849 26.700 ( 0.184 -0.122 -1.583) 1.598 27.682 ( 11.996 10.574 -20.289) 25.833 27.916 ( 30.122 10.551 -22.304) 38.938 28.507 ( 0.405 1.406 -0.468) 1.537 28.731 ( -2.271 2.539 -0.003) 3.406 29.061 ( 8.659 4.979 7.076) 12.241 29.398 ( -0.768 0.570 -1.735) 1.981 29.914 ( 9.786 5.851 8.193) 14.040 31.344 ( 10.891 19.125 18.946) 29.040 ======================= Grid point 2 (3/186) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( 14.532 -13.965 3.708) 20.493 1.232 ( 19.361 -20.684 6.658) 29.104 1.689 ( 15.791 -21.570 11.990) 29.299 1.935 ( 16.478 -2.821 1.069) 16.752 2.250 ( 1.964 2.643 3.195) 4.588 2.552 ( 3.116 -2.532 1.909) 4.446 2.983 ( 28.066 1.751 -3.450) 28.331 3.952 ( -4.160 5.460 -5.507) 8.800 4.055 ( -4.703 3.217 10.773) 12.187 4.329 ( 5.568 -3.506 -3.089) 7.270 4.830 ( -17.206 -10.096 -6.801) 21.077 5.170 ( -17.508 7.311 -12.376) 22.653 5.764 ( -1.592 -8.828 3.881) 9.774 5.929 ( 6.306 -1.561 2.747) 7.053 6.066 ( -4.280 -6.214 3.142) 8.173 6.867 ( -3.989 9.669 -4.004) 11.200 7.055 ( 2.134 -2.090 1.157) 3.203 7.278 ( 7.726 -2.396 -0.245) 8.093 7.700 ( -0.259 6.419 -1.826) 6.679 7.984 ( -9.542 -8.345 -4.241) 13.367 8.142 ( 8.024 5.570 3.207) 10.280 8.338 ( -0.888 -0.977 -1.774) 2.211 8.481 ( -1.289 11.168 -6.489) 12.980 8.765 ( 7.963 1.256 3.978) 8.989 8.853 ( -3.739 -3.682 3.732) 6.439 9.324 ( 0.996 2.275 1.604) 2.956 9.876 ( 14.144 -2.024 -2.093) 14.440 10.318 ( 16.176 6.057 -0.239) 17.275 10.815 ( -2.970 0.244 -1.434) 3.307 10.937 ( -5.269 -5.258 4.858) 8.889 11.320 ( -1.059 -6.714 1.399) 6.940 11.578 ( 1.018 1.611 1.741) 2.582 11.928 ( -3.733 6.696 0.547) 7.686 12.089 ( 0.595 0.176 -3.368) 3.425 12.646 ( -3.407 1.926 28.336) 28.605 12.953 ( -8.607 -1.535 1.254) 8.832 13.346 ( -4.266 -3.904 -9.109) 10.790 13.686 ( -6.305 4.007 -5.954) 9.553 14.275 ( -5.047 2.825 15.510) 16.554 14.442 ( -1.575 -0.459 -3.829) 4.166 14.759 ( -2.505 -0.859 -0.564) 2.708 15.002 ( 6.546 4.868 -5.270) 9.712 15.700 ( 1.581 -6.304 0.027) 6.500 16.024 ( -8.381 -15.060 0.313) 17.238 18.322 ( 4.298 5.320 0.061) 6.839 18.713 ( -5.202 5.887 2.390) 8.212 20.164 ( -1.538 -6.933 0.347) 7.111 20.502 ( 0.018 2.384 -2.211) 3.252 25.427 ( 7.111 -1.058 2.068) 7.481 25.847 ( -16.151 -11.231 -1.591) 19.736 26.672 ( -1.116 0.085 6.082) 6.184 26.699 ( 0.468 -0.275 -3.014) 3.063 27.640 ( 3.163 2.450 -8.686) 9.563 28.068 ( 15.927 2.159 -8.553) 18.207 28.476 ( -0.416 2.823 -1.844) 3.397 28.682 ( -0.775 1.057 1.264) 1.821 29.125 ( 5.936 2.883 5.163) 8.379 29.365 ( -1.939 0.297 -2.928) 3.524 30.016 ( 4.789 -4.004 4.089) 7.462 31.260 ( 2.993 12.301 7.763) 14.851 ======================= Grid point 3 (4/186) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( 7.753 -7.071 -0.804) 10.524 1.692 ( 11.271 -13.774 3.231) 18.089 1.874 ( -0.596 -1.048 5.494) 5.625 2.225 ( 4.242 -0.356 0.858) 4.343 2.353 ( 10.764 -7.442 3.564) 13.563 2.747 ( 11.929 -9.843 5.223) 16.324 3.306 ( 26.552 0.993 0.529) 26.575 3.778 ( -6.657 4.960 -5.873) 10.169 3.976 ( -8.710 2.654 10.091) 13.592 4.434 ( 4.680 -1.378 -0.823) 4.948 4.702 ( -11.413 1.328 -3.623) 12.048 4.828 ( -15.507 0.232 -12.767) 20.088 5.844 ( -1.872 -4.917 0.411) 5.278 6.051 ( 5.681 -2.275 3.598) 7.099 6.102 ( -3.403 -4.318 3.001) 6.263 6.671 ( -3.315 8.589 -4.532) 10.262 7.140 ( 4.351 -3.671 2.002) 6.034 7.395 ( 6.343 -2.038 -2.975) 7.296 7.579 ( -2.698 7.715 -1.440) 8.299 7.940 ( -10.789 -5.562 -1.289) 12.206 8.201 ( 5.202 1.062 6.703) 8.551 8.317 ( 2.582 5.408 -2.242) 6.398 8.332 ( 0.044 2.489 -7.980) 8.359 8.852 ( 3.674 3.752 6.081) 8.034 8.934 ( 0.912 -11.612 -0.541) 11.660 9.272 ( -0.512 6.696 2.264) 7.087 10.018 ( 6.681 -1.025 -2.486) 7.201 10.452 ( 11.872 1.048 -0.430) 11.925 10.751 ( -4.194 0.794 -2.598) 4.997 10.944 ( -5.746 -3.357 5.348) 8.538 11.429 ( -0.805 -8.553 2.905) 9.069 11.574 ( 0.503 0.503 0.844) 1.104 11.787 ( -2.054 7.847 -0.843) 8.155 12.085 ( 0.651 -0.011 -2.834) 2.907 12.685 ( 0.669 2.481 20.044) 20.208 12.859 ( -7.451 -1.031 -3.771) 8.415 13.288 ( -3.454 -0.405 -8.837) 9.497 13.596 ( -0.129 1.104 -4.653) 4.784 14.212 ( -5.332 2.378 10.211) 11.762 14.430 ( -0.145 -0.593 -1.831) 1.930 14.758 ( -0.459 -1.361 1.271) 1.918 14.978 ( 2.572 4.105 -4.645) 6.712 15.802 ( 2.097 -4.378 -0.135) 4.857 16.108 ( -2.520 -6.595 0.122) 7.061 18.314 ( 2.578 1.875 -0.844) 3.297 18.579 ( -4.625 4.915 2.501) 7.197 20.243 ( -0.126 -5.398 0.600) 5.432 20.456 ( -0.118 3.005 -1.827) 3.518 25.548 ( 9.354 -0.208 1.975) 9.562 25.776 ( -12.442 -5.251 -0.963) 13.539 26.678 ( -0.544 0.109 3.529) 3.572 26.700 ( 0.567 -0.343 -2.788) 2.866 27.627 ( 0.798 0.200 -3.699) 3.789 28.180 ( 7.468 0.328 -3.220) 8.139 28.417 ( -1.235 2.478 -1.755) 3.278 28.694 ( 1.374 -0.721 1.334) 2.047 29.153 ( 2.587 2.974 3.417) 5.217 29.334 ( -1.476 -0.591 -2.482) 2.947 30.149 ( 2.994 -5.661 1.868) 6.671 31.152 ( 0.196 8.118 3.180) 8.721 ======================= Grid point 4 (5/186) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 0.000 -0.000 0.000) 0.000 1.828 ( 0.000 -0.000 -0.000) 0.000 1.926 ( 0.000 -0.000 0.000) 0.000 2.226 ( 0.000 -0.000 -0.000) 0.000 2.492 ( 0.000 -0.000 0.000) 0.000 2.956 ( 0.000 -0.000 -0.000) 0.000 3.494 ( -0.000 -0.000 0.000) 0.000 3.745 ( -0.000 -0.000 -0.000) 0.000 3.832 ( 0.000 -0.000 -0.000) 0.000 4.425 ( 0.000 -0.000 0.000) 0.000 4.620 ( 0.000 -0.000 0.000) 0.000 4.717 ( -0.000 -0.000 -0.000) 0.000 5.866 ( -0.000 -0.000 -0.000) 0.000 6.111 ( -0.000 -0.000 0.000) 0.000 6.120 ( 0.000 0.000 -0.000) 0.000 6.572 ( 0.000 -0.000 0.000) 0.000 7.228 ( -0.000 -0.000 -0.000) 0.000 7.453 ( 0.000 -0.000 -0.000) 0.000 7.467 ( 0.000 0.000 0.000) 0.000 7.900 ( 0.000 0.000 -0.000) 0.000 8.259 ( -0.000 -0.000 0.000) 0.000 8.273 ( 0.000 0.000 -0.000) 0.000 8.312 ( -0.000 -0.000 -0.000) 0.000 8.857 ( 0.000 -0.000 0.000) 0.000 9.065 ( 0.000 -0.000 -0.000) 0.000 9.184 ( -0.000 -0.000 -0.000) 0.000 10.062 ( 0.000 -0.000 -0.000) 0.000 10.535 ( -0.000 -0.000 0.000) 0.000 10.701 ( 0.000 -0.000 -0.000) 0.000 10.937 ( 0.000 -0.000 -0.000) 0.000 11.499 ( 0.000 -0.000 -0.000) 0.000 11.591 ( 0.000 -0.000 0.000) 0.000 11.694 ( 0.000 -0.000 -0.000) 0.000 12.084 ( 0.000 -0.000 0.000) 0.000 12.715 ( -0.000 -0.000 -0.000) 0.000 12.802 ( 0.000 -0.000 0.000) 0.000 13.248 ( 0.000 -0.000 -0.000) 0.000 13.586 ( 0.000 -0.000 -0.000) 0.000 14.176 ( -0.000 -0.000 0.000) 0.000 14.432 ( 0.000 -0.000 0.000) 0.000 14.774 ( 0.000 -0.000 0.000) 0.000 14.949 ( 0.000 -0.000 -0.000) 0.000 15.848 ( 0.000 -0.000 0.000) 0.000 16.138 ( 0.000 -0.000 0.000) 0.000 18.321 ( 0.000 0.000 0.000) 0.000 18.512 ( 0.000 -0.000 -0.000) 0.000 20.289 ( 0.000 -0.000 -0.000) 0.000 20.424 ( 0.000 -0.000 -0.000) 0.000 25.659 ( 0.000 0.000 0.000) 0.000 25.686 ( -0.000 -0.000 -0.000) 0.000 26.679 ( 0.000 -0.000 -0.000) 0.000 26.701 ( 0.000 -0.000 0.000) 0.000 27.624 ( 0.000 -0.000 -0.000) 0.000 28.219 ( 0.000 -0.000 0.000) 0.000 28.386 ( 0.000 -0.000 0.000) 0.000 28.716 ( -0.000 -0.000 0.000) 0.000 29.149 ( 0.000 -0.000 -0.000) 0.000 29.326 ( 0.000 -0.000 0.000) 0.000 30.218 ( 0.000 -0.000 -0.000) 0.000 31.097 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 10 (6/186) ======================= q-point: ( 0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( 30.473 0.000 4.967) 30.875 0.867 ( 30.013 0.000 10.687) 31.859 1.284 ( 38.673 0.000 20.676) 43.854 1.909 ( 9.176 0.000 2.439) 9.495 2.344 ( -1.098 -0.000 0.820) 1.370 2.528 ( -0.631 -0.000 3.055) 3.119 3.098 ( 27.162 0.000 -25.513) 37.265 4.013 ( -4.200 -0.000 -2.544) 4.911 4.116 ( -5.334 -0.000 4.759) 7.148 4.325 ( 1.894 0.000 2.562) 3.186 4.430 ( -3.588 -0.000 4.550) 5.795 5.437 ( -14.613 -0.000 -10.754) 18.144 5.473 ( -3.107 -0.000 -0.770) 3.201 5.895 ( 8.544 0.000 3.148) 9.105 5.982 ( -1.558 -0.000 7.926) 8.078 7.001 ( 0.261 0.000 0.413) 0.488 7.111 ( -0.725 -0.000 2.950) 3.038 7.136 ( 2.569 0.000 -1.588) 3.020 7.821 ( -10.811 -0.000 -11.170) 15.545 7.876 ( 6.683 0.000 -2.536) 7.148 8.227 ( 4.661 0.000 -4.094) 6.204 8.346 ( -11.925 -0.000 -0.489) 11.935 8.439 ( 5.775 0.000 1.586) 5.989 8.832 ( -10.504 -0.000 4.718) 11.515 9.038 ( 8.584 0.000 0.170) 8.586 9.265 ( 5.003 0.000 5.819) 7.674 9.894 ( 21.327 0.000 1.710) 21.395 10.691 ( -3.075 -0.000 -0.325) 3.092 10.829 ( 10.603 0.000 -36.152) 37.675 10.875 ( -1.255 -0.000 -7.727) 7.828 11.208 ( -5.151 -0.000 1.027) 5.253 11.624 ( 1.862 0.000 1.554) 2.425 11.962 ( -5.998 -0.000 -4.348) 7.408 12.202 ( -2.571 -0.000 1.493) 2.973 12.575 ( -26.602 -0.000 106.651) 109.918 12.928 ( -7.815 -0.000 2.973) 8.361 13.083 ( 7.397 0.000 -12.189) 14.258 13.689 ( -13.862 -0.000 -8.357) 16.187 14.325 ( -2.971 -0.000 12.512) 12.860 14.417 ( -4.357 -0.000 -4.890) 6.549 14.813 ( 3.654 0.000 -1.960) 4.146 15.261 ( 16.690 0.000 -2.912) 16.942 15.368 ( -1.859 -0.000 -8.428) 8.631 15.675 ( 4.142 0.000 6.764) 7.931 18.467 ( -0.940 -0.000 -0.455) 1.044 18.849 ( -3.126 -0.000 3.136) 4.428 20.007 ( 1.192 0.000 1.926) 2.265 20.533 ( -0.095 -0.000 -2.661) 2.662 25.410 ( 7.732 0.000 2.537) 8.138 25.589 ( -2.197 -0.000 4.045) 4.603 26.673 ( -1.442 -0.000 7.006) 7.152 26.694 ( 0.379 0.000 -3.280) 3.302 27.651 ( -4.636 -0.000 -5.652) 7.310 28.189 ( 15.426 0.000 -25.521) 29.821 28.523 ( 0.881 0.000 -0.666) 1.104 28.720 ( -3.320 -0.000 -2.196) 3.980 29.085 ( -1.189 -0.000 0.552) 1.311 29.356 ( -4.889 -0.000 -4.414) 6.586 30.049 ( 2.143 0.000 1.744) 2.763 31.637 ( -4.402 -0.000 14.735) 15.378 ======================= Grid point 11 (7/186) ======================= q-point: ( 0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( 25.791 -0.513 4.466) 26.180 1.327 ( 24.046 -9.470 7.888) 27.021 1.774 ( 18.702 -3.009 10.553) 21.683 2.093 ( 15.251 -6.052 1.327) 16.461 2.347 ( 4.215 3.121 5.652) 7.710 2.550 ( 1.109 -3.443 3.664) 5.148 3.361 ( 27.914 2.374 -6.039) 28.659 3.918 ( -7.183 2.997 -4.588) 9.035 4.047 ( -8.252 1.591 9.181) 12.446 4.352 ( 7.478 -1.736 -7.330) 10.615 4.499 ( -7.766 -9.579 4.918) 13.276 5.080 ( -13.738 12.751 -12.913) 22.761 5.551 ( -5.172 -13.680 -5.498) 15.624 6.010 ( 3.978 -0.376 8.405) 9.307 6.041 ( 6.932 -1.135 4.368) 8.272 6.945 ( -4.099 9.326 -2.684) 10.535 7.048 ( 2.196 -0.992 1.566) 2.874 7.280 ( 3.742 -8.112 0.371) 8.941 7.665 ( -9.923 -2.941 -10.181) 14.518 7.882 ( 0.533 7.534 -3.194) 8.201 8.213 ( -9.951 -4.513 -0.132) 10.928 8.255 ( 3.460 0.441 -7.337) 8.124 8.549 ( 5.096 -0.868 0.521) 5.195 8.714 ( -3.205 1.744 4.041) 5.445 9.099 ( 10.722 9.089 7.694) 16.024 9.392 ( 6.020 -1.885 3.390) 7.161 10.096 ( 15.709 7.223 -1.097) 17.325 10.614 ( 9.067 7.303 -6.352) 13.262 10.778 ( -6.540 2.488 0.449) 7.011 10.828 ( -1.084 -1.218 -3.538) 3.896 11.197 ( -3.694 -7.177 -2.154) 8.354 11.625 ( 0.453 2.465 2.913) 3.843 11.903 ( -4.754 -2.014 -4.308) 6.725 12.129 ( -0.725 4.766 1.761) 5.132 12.673 ( -10.435 -4.278 52.701) 53.894 12.825 ( -9.645 -0.782 -1.385) 9.775 13.179 ( 0.390 -6.401 -11.154) 12.866 13.516 ( -12.387 -4.176 -5.001) 13.996 14.288 ( -4.927 2.996 5.354) 7.869 14.370 ( -3.661 -2.965 -1.103) 4.838 14.831 ( 5.457 5.016 -0.287) 7.417 15.185 ( 5.815 10.709 -6.704) 13.908 15.607 ( 6.196 -11.726 -3.760) 13.785 15.817 ( 3.935 -9.123 4.410) 10.870 18.426 ( 0.324 3.730 -0.271) 3.754 18.761 ( -4.134 6.700 3.871) 8.773 20.073 ( 0.876 -5.395 2.124) 5.864 20.514 ( -0.158 1.024 -3.439) 3.592 25.543 ( 11.098 -0.136 3.913) 11.768 25.610 ( -5.378 -5.237 3.910) 8.464 26.679 ( -0.873 0.024 4.453) 4.538 26.689 ( 0.605 -0.287 -3.769) 3.828 27.589 ( -4.220 -1.580 -2.967) 5.395 28.263 ( 11.705 3.470 -12.133) 17.212 28.508 ( -0.092 3.309 -1.545) 3.653 28.667 ( -2.426 -0.765 -1.624) 3.018 29.113 ( -1.232 -4.753 0.171) 4.913 29.254 ( -10.070 -2.122 -6.314) 12.074 30.100 ( 6.492 0.511 3.168) 7.242 31.528 ( -0.201 13.772 9.357) 16.652 ======================= Grid point 12 (8/186) ======================= q-point: ( 0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( 19.033 4.943 1.466) 19.719 1.713 ( 13.486 -7.646 4.299) 16.088 1.919 ( 4.482 2.060 6.562) 8.209 2.322 ( 5.661 3.883 1.609) 7.050 2.393 ( 7.033 -4.775 -0.551) 8.519 2.748 ( 8.175 -11.113 5.463) 14.838 3.661 ( 20.460 3.508 -0.212) 20.759 3.720 ( -10.009 4.087 -0.745) 10.837 3.912 ( -10.090 3.604 3.378) 11.234 4.476 ( 0.190 -7.113 -4.284) 8.306 4.519 ( 1.664 1.183 -1.436) 2.496 4.759 ( -3.649 6.498 -4.584) 8.749 5.657 ( -4.818 -13.483 -4.590) 15.036 6.090 ( 3.764 -0.133 7.489) 8.383 6.156 ( 8.174 1.103 3.231) 8.859 6.731 ( -5.085 10.033 -3.851) 11.889 7.140 ( 4.629 -4.567 1.127) 6.599 7.403 ( 2.806 -2.562 -4.706) 6.049 7.599 ( -9.334 -9.523 -4.512) 14.077 7.689 ( -9.046 8.124 -0.952) 12.195 8.198 ( -5.481 -5.594 -1.665) 8.007 8.264 ( 1.875 -0.526 -5.011) 5.377 8.527 ( 4.262 9.370 -0.078) 10.294 8.794 ( 5.926 -4.995 -0.112) 7.751 9.120 ( 8.010 9.471 8.772) 15.192 9.443 ( 6.198 7.308 3.618) 10.243 10.097 ( 4.639 6.706 -3.861) 9.022 10.618 ( -2.185 5.477 3.174) 6.696 10.716 ( 4.933 2.033 -4.655) 7.081 10.842 ( -2.025 -6.970 3.237) 7.948 11.293 ( -0.459 -10.046 0.362) 10.063 11.601 ( -0.195 1.959 1.722) 2.615 11.843 ( -2.538 2.617 -2.173) 4.244 12.082 ( -0.611 1.403 -0.541) 1.623 12.695 ( -9.071 -1.103 -4.085) 10.009 12.790 ( -2.424 -1.891 27.113) 27.287 13.168 ( -5.653 -4.122 -4.091) 8.105 13.484 ( -5.188 -7.039 -2.808) 9.185 14.197 ( -3.925 1.286 -3.914) 5.690 14.379 ( -2.468 -2.914 2.465) 4.546 14.825 ( 4.917 5.026 0.960) 7.096 15.094 ( 2.984 7.799 -5.212) 9.843 15.782 ( 5.821 -4.551 -1.514) 7.543 16.000 ( 3.075 -8.500 1.170) 9.115 18.389 ( 1.835 3.383 0.100) 3.850 18.619 ( -4.098 7.249 3.374) 8.984 20.173 ( 1.004 -6.072 2.004) 6.472 20.478 ( -0.367 2.055 -3.363) 3.959 25.602 ( -6.934 -3.132 2.693) 8.071 25.708 ( 13.440 0.865 4.690) 14.262 26.677 ( -0.201 -0.163 -1.356) 1.381 26.695 ( 0.178 -0.321 0.850) 0.926 27.567 ( -3.943 -3.074 -0.224) 5.005 28.298 ( 6.971 4.311 -5.887) 10.092 28.434 ( -1.661 3.565 -1.201) 4.112 28.678 ( -0.252 -2.691 -1.148) 2.937 29.096 ( -10.448 -2.917 -7.153) 12.993 29.197 ( -4.812 -7.389 -0.809) 8.855 30.211 ( 8.467 -0.478 2.816) 8.936 31.358 ( 1.179 15.168 6.122) 16.399 ======================= Grid point 13 (9/186) ======================= q-point: ( 0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( 11.229 10.850 2.232) 15.773 1.865 ( 4.652 1.229 0.281) 4.820 1.962 ( 2.383 2.309 1.957) 3.852 2.246 ( -3.319 4.778 0.741) 5.864 2.520 ( 4.054 1.076 -2.701) 4.989 2.910 ( -3.576 -1.876 -1.746) 4.399 3.382 ( -20.778 8.808 4.757) 23.063 3.741 ( -1.833 2.259 0.334) 2.928 3.918 ( 8.802 -1.735 -9.372) 12.974 4.429 ( -6.481 -2.156 -4.785) 8.339 4.594 ( 12.542 -0.387 4.001) 13.170 4.861 ( 15.010 -1.188 8.746) 17.413 5.764 ( -2.929 -10.331 -2.529) 11.032 6.148 ( 4.842 3.152 4.436) 7.284 6.218 ( 5.679 3.835 0.302) 6.859 6.566 ( -3.329 2.713 -1.780) 4.649 7.235 ( -0.246 1.646 -0.931) 1.907 7.368 ( -3.977 -2.679 -6.697) 8.237 7.521 ( -3.134 3.093 2.746) 5.190 7.664 ( -7.708 -14.602 -1.243) 16.559 8.199 ( -4.845 -4.622 0.176) 6.698 8.291 ( 1.110 -2.313 -1.019) 2.761 8.434 ( 4.841 11.666 -3.070) 12.999 8.890 ( 4.455 3.477 -2.982) 6.390 9.111 ( 4.274 3.687 3.470) 6.626 9.400 ( 8.374 13.573 6.380) 17.177 10.037 ( -3.206 1.890 -2.958) 4.754 10.487 ( -10.054 2.194 1.203) 10.361 10.733 ( 1.671 -0.088 2.819) 3.278 10.969 ( 9.216 -1.680 -2.769) 9.769 11.425 ( -0.716 -7.966 2.468) 8.370 11.594 ( 1.031 -0.375 0.808) 1.363 11.758 ( -0.173 5.731 -3.186) 6.560 12.066 ( -1.365 -0.807 0.947) 1.847 12.593 ( -7.137 -3.802 -12.357) 14.767 12.866 ( 1.731 -0.255 12.754) 12.873 13.196 ( -3.028 -6.336 10.348) 12.506 13.504 ( -4.812 -4.749 1.087) 6.848 14.151 ( 0.607 -2.303 -13.229) 13.442 14.396 ( -2.141 -2.363 3.345) 4.622 14.823 ( 3.517 3.630 0.435) 5.073 15.019 ( 2.209 5.743 -1.488) 6.330 15.863 ( 2.771 0.173 -0.659) 2.853 16.126 ( 3.085 -4.111 0.115) 5.141 18.369 ( 1.259 4.236 2.340) 5.001 18.523 ( -0.356 1.686 -0.094) 1.726 20.270 ( 1.194 -4.528 2.174) 5.163 20.429 ( -0.701 2.217 -2.756) 3.606 25.545 ( -7.060 -0.620 1.195) 7.187 25.881 ( 15.407 2.684 4.851) 16.374 26.672 ( 0.104 -0.299 -3.068) 3.084 26.703 ( -0.232 -0.085 2.119) 2.133 27.562 ( -5.334 -3.600 2.600) 6.941 28.270 ( 1.819 5.693 -3.138) 6.750 28.389 ( -0.674 0.567 0.902) 1.261 28.691 ( -1.973 -1.142 -1.812) 2.912 28.984 ( -13.056 -7.841 -9.834) 18.128 29.245 ( -2.523 -5.810 0.561) 6.359 30.310 ( 7.219 2.936 1.506) 7.938 31.205 ( 1.751 11.430 3.747) 12.156 ======================= Grid point 14 (10/186) ======================= q-point: (-0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( 4.267 17.335 2.226) 17.991 1.759 ( -9.197 15.345 -5.470) 18.708 1.906 ( 1.981 3.352 -1.573) 4.200 2.199 ( 0.116 -0.749 -1.078) 1.318 2.381 ( -7.406 16.901 -2.714) 18.651 2.708 ( -11.245 8.250 -0.889) 13.975 3.035 ( -20.152 5.792 -1.707) 21.037 3.796 ( 3.079 -4.649 7.738) 9.538 3.966 ( 2.857 -2.858 -12.570) 13.204 4.372 ( -4.877 -1.178 -2.873) 5.782 4.838 ( 13.501 -5.058 6.331) 15.747 5.127 ( 21.410 1.487 12.956) 25.069 5.823 ( -2.760 -4.297 -3.078) 5.963 6.095 ( 0.729 10.270 -3.654) 10.925 6.235 ( 6.405 4.311 1.142) 7.804 6.601 ( 1.555 -8.393 3.379) 9.180 7.103 ( -6.769 2.740 -4.559) 8.608 7.307 ( -10.000 0.042 0.392) 10.008 7.572 ( 5.521 -2.773 2.256) 6.578 7.771 ( -8.774 -16.935 -2.222) 19.202 8.211 ( -3.507 -4.870 1.830) 6.274 8.316 ( 5.526 11.490 -3.793) 13.302 8.357 ( 2.384 -2.701 2.671) 4.485 8.767 ( -5.769 8.652 -2.950) 10.809 9.165 ( 9.326 4.715 -0.373) 10.456 9.341 ( 7.568 11.123 2.667) 13.715 9.931 ( -10.699 1.232 1.807) 10.920 10.328 ( -10.001 2.267 -1.980) 10.444 10.789 ( 2.743 -1.713 4.186) 5.289 11.061 ( 8.503 3.285 -3.681) 9.831 11.465 ( -2.429 -0.736 -2.051) 3.263 11.608 ( 1.095 4.995 -1.459) 5.318 11.730 ( 2.580 -5.003 0.546) 5.655 12.076 ( -0.671 -1.296 3.039) 3.372 12.538 ( -4.327 -5.258 -14.509) 16.027 12.960 ( 6.962 -2.080 2.574) 7.709 13.293 ( -3.777 -5.427 15.672) 17.010 13.517 ( -3.669 -5.306 4.518) 7.876 14.174 ( 3.067 -4.875 -18.329) 19.212 14.420 ( -0.493 -1.877 4.273) 4.693 14.818 ( 3.339 2.487 -1.305) 4.363 14.983 ( 0.786 3.265 2.686) 4.300 15.846 ( 0.034 4.139 -0.366) 4.155 16.198 ( 4.216 -0.231 -0.063) 4.223 18.313 ( -1.253 4.173 2.794) 5.176 18.574 ( 4.842 -4.007 -2.029) 6.604 20.312 ( 1.234 2.714 1.139) 3.191 20.410 ( -0.684 -3.068 -0.674) 3.214 25.460 ( -5.992 1.106 -0.131) 6.094 26.058 ( 18.660 4.751 5.278) 19.966 26.667 ( 0.401 -0.310 -4.228) 4.258 26.706 ( -0.430 0.163 2.302) 2.348 27.531 ( -11.276 -3.939 5.549) 13.170 28.168 ( -2.620 7.186 -1.394) 7.775 28.404 ( 0.104 -2.010 2.085) 2.898 28.656 ( -3.190 -1.111 -2.711) 4.331 28.919 ( -12.129 -9.851 -10.233) 18.678 29.297 ( -1.026 -4.571 0.928) 4.776 30.289 ( 3.787 10.821 0.211) 11.466 31.137 ( 2.164 3.374 1.368) 4.235 ======================= Grid point 15 (11/186) ======================= q-point: (-0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.205 ( -1.507 25.108 -1.856) 25.222 1.326 ( -10.558 22.266 -7.486) 25.755 1.837 ( -3.085 4.261 -1.209) 5.398 1.873 ( -12.603 33.280 -1.462) 35.616 2.240 ( 4.504 0.475 -0.172) 4.532 2.544 ( -3.597 3.144 1.534) 5.017 2.702 ( -18.978 4.897 -3.231) 19.864 3.915 ( 0.155 -5.316 3.655) 6.453 4.023 ( 3.327 -4.721 -5.921) 8.271 4.315 ( -2.874 1.448 -0.516) 3.259 5.072 ( 10.282 -4.622 5.401) 12.501 5.415 ( 18.340 1.170 13.279) 22.673 5.786 ( -5.071 0.060 -8.321) 9.745 5.918 ( -2.419 9.591 -3.472) 10.483 6.241 ( 5.847 7.167 1.219) 9.330 6.802 ( 4.403 -11.349 4.102) 12.845 7.016 ( -2.763 -0.478 -3.239) 4.284 7.171 ( -10.715 -0.508 0.326) 10.732 7.657 ( 2.057 -1.926 0.823) 2.936 7.871 ( -8.040 -13.291 -2.713) 15.769 8.233 ( 6.774 9.948 0.679) 12.054 8.287 ( -0.776 -8.266 2.283) 8.611 8.439 ( 3.330 -1.012 0.198) 3.486 8.568 ( -10.298 1.030 -0.586) 10.366 9.137 ( 8.281 15.836 1.946) 17.976 9.351 ( 7.977 1.088 -4.621) 9.283 9.744 ( -15.867 2.999 5.172) 16.956 10.163 ( -7.235 4.989 -4.239) 9.757 10.852 ( 2.139 -0.436 2.388) 3.235 11.063 ( 4.295 6.403 -2.353) 8.061 11.393 ( -1.450 4.707 -3.341) 5.952 11.556 ( -0.332 1.270 -0.748) 1.511 11.872 ( 3.042 -7.429 0.842) 8.072 12.096 ( -0.079 -0.445 2.995) 3.029 12.529 ( -1.422 -5.655 -12.004) 13.345 13.076 ( 8.397 1.912 -2.709) 9.028 13.352 ( -5.551 -7.475 10.597) 14.107 13.623 ( 0.949 -9.724 4.925) 10.941 14.213 ( 1.179 -4.326 -12.371) 13.158 14.463 ( 1.550 -1.378 2.286) 3.086 14.842 ( 3.914 0.099 -0.980) 4.036 14.951 ( -1.325 2.562 3.199) 4.307 15.767 ( -0.563 6.040 -0.397) 6.079 16.256 ( 7.109 1.268 0.026) 7.221 18.255 ( -2.163 2.201 1.006) 3.246 18.701 ( 4.791 -5.448 -1.137) 7.343 20.269 ( 1.531 4.940 0.186) 5.175 20.461 ( -0.303 -4.002 0.791) 4.091 25.376 ( -3.598 1.785 -0.642) 4.067 26.278 ( 26.172 5.744 7.540) 27.836 26.662 ( 1.159 -0.338 -7.278) 7.378 26.705 ( -0.179 0.196 1.231) 1.259 27.387 ( -26.739 -4.494 7.926) 28.249 28.015 ( -2.913 8.526 -0.500) 9.024 28.441 ( -0.834 -3.042 0.742) 3.240 28.665 ( 1.632 -2.772 -0.046) 3.217 28.862 ( -11.400 -8.275 -9.417) 16.944 29.348 ( -0.107 -3.385 0.748) 3.468 30.132 ( 0.756 14.857 -0.771) 14.896 31.150 ( 0.676 -1.254 -0.965) 1.721 ======================= Grid point 16 (12/186) ======================= q-point: (-0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.796 ( 0.000 28.428 -0.000) 28.428 0.890 ( 0.000 29.309 -0.000) 29.309 1.238 ( 0.000 42.632 -0.000) 42.632 1.765 ( 0.000 1.610 -0.000) 1.610 2.249 ( 0.000 3.833 -0.000) 3.833 2.473 ( 0.000 3.222 -0.000) 3.222 2.518 ( 0.000 0.599 -0.000) 0.599 3.983 ( -0.000 -4.570 0.000) 4.570 4.105 ( -0.000 -4.397 0.000) 4.397 4.262 ( 0.000 3.299 -0.000) 3.299 5.239 ( -0.000 -5.369 0.000) 5.369 5.545 ( 0.000 7.054 -0.000) 7.054 5.716 ( -0.000 -4.807 0.000) 4.807 5.800 ( 0.000 4.113 -0.000) 4.113 6.181 ( 0.000 8.264 -0.000) 8.264 6.969 ( -0.000 -1.855 0.000) 1.855 7.016 ( -0.000 -6.088 0.000) 6.088 7.103 ( -0.000 -1.013 0.000) 1.013 7.706 ( -0.000 -4.141 0.000) 4.141 7.936 ( -0.000 -6.482 0.000) 6.482 8.215 ( 0.000 4.701 -0.000) 4.701 8.239 ( 0.000 7.631 -0.000) 7.631 8.545 ( -0.000 -1.183 0.000) 1.183 8.581 ( -0.000 -19.500 0.000) 19.500 9.000 ( 0.000 11.279 -0.000) 11.279 9.428 ( 0.000 0.059 -0.000) 0.059 9.541 ( 0.000 6.181 -0.000) 6.181 9.979 ( 0.000 11.149 -0.000) 11.149 10.859 ( 0.000 1.827 -0.000) 1.827 10.996 ( 0.000 5.704 -0.000) 5.704 11.317 ( 0.000 4.011 -0.000) 4.011 11.552 ( -0.000 -0.927 0.000) 0.927 11.981 ( -0.000 -5.368 0.000) 5.368 12.101 ( 0.000 0.385 -0.000) 0.385 12.577 ( -0.000 -5.187 0.000) 5.187 13.077 ( 0.000 3.496 -0.000) 3.496 13.448 ( -0.000 -6.337 0.000) 6.337 13.802 ( -0.000 -12.359 0.000) 12.359 14.241 ( -0.000 -2.424 0.000) 2.424 14.493 ( -0.000 -0.423 0.000) 0.423 14.877 ( 0.000 1.370 -0.000) 1.370 14.918 ( -0.000 -0.480 0.000) 0.480 15.678 ( 0.000 5.939 -0.000) 5.939 16.335 ( -0.000 -1.638 0.000) 1.638 18.206 ( 0.000 1.824 -0.000) 1.824 18.805 ( -0.000 -4.751 0.000) 4.751 20.226 ( 0.000 3.579 -0.000) 3.579 20.507 ( -0.000 -2.714 0.000) 2.714 25.327 ( 0.000 1.530 -0.000) 1.530 26.603 ( -0.000 -3.214 0.000) 3.214 26.635 ( 0.000 0.372 -0.000) 0.372 26.705 ( 0.000 0.140 -0.000) 0.140 27.078 ( 0.000 3.637 -0.000) 3.637 27.883 ( 0.000 7.590 -0.000) 7.590 28.476 ( -0.000 -2.669 0.000) 2.669 28.738 ( -0.000 -2.044 0.000) 2.044 28.834 ( -0.000 -6.069 0.000) 6.069 29.387 ( -0.000 -1.978 0.000) 1.978 29.930 ( 0.000 13.420 -0.000) 13.420 31.163 ( -0.000 -1.147 0.000) 1.147 ======================= Grid point 19 (13/186) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( 24.099 0.000 5.219) 24.657 1.577 ( 20.008 0.000 8.015) 21.554 2.061 ( 16.912 0.000 1.684) 16.995 2.169 ( 9.328 0.000 0.698) 9.354 2.494 ( 10.581 0.000 8.869) 13.806 2.509 ( -3.022 -0.000 2.368) 3.839 3.667 ( 20.256 0.000 -3.474) 20.551 3.828 ( -9.127 -0.000 -2.597) 9.490 3.970 ( -8.792 -0.000 3.944) 9.636 4.367 ( -5.153 -0.000 9.674) 10.961 4.489 ( 15.775 0.000 -1.774) 15.874 4.995 ( -10.635 -0.000 -15.093) 18.463 5.336 ( -4.456 -0.000 -8.062) 9.211 6.094 ( 6.175 0.000 9.149) 11.038 6.172 ( 9.594 0.000 4.171) 10.462 6.974 ( -0.840 -0.000 -2.380) 2.524 7.060 ( -7.599 -0.000 4.455) 8.808 7.228 ( 5.953 0.000 -1.832) 6.229 7.491 ( -6.929 -0.000 -11.845) 13.723 7.942 ( -18.296 -0.000 -0.236) 18.298 8.011 ( 5.059 0.000 -6.018) 7.862 8.261 ( 0.430 0.000 -8.842) 8.852 8.645 ( 8.572 0.000 2.581) 8.953 8.739 ( 3.347 0.000 4.313) 5.459 9.317 ( 8.429 0.000 5.744) 10.200 9.463 ( 6.406 0.000 6.085) 8.835 10.381 ( 15.974 0.000 -1.091) 16.011 10.601 ( -4.549 -0.000 1.231) 4.713 10.680 ( -10.358 -0.000 0.752) 10.385 10.946 ( 11.538 0.000 -15.073) 18.982 11.035 ( -7.363 -0.000 3.127) 8.000 11.654 ( -1.419 -0.000 3.610) 3.878 11.795 ( -5.349 -0.000 -3.530) 6.409 12.147 ( -2.564 -0.000 2.147) 3.344 12.675 ( -11.158 -0.000 -5.645) 12.505 12.722 ( -4.369 -0.000 49.893) 50.084 13.105 ( -3.583 -0.000 -11.771) 12.304 13.350 ( -3.427 -0.000 -4.495) 5.653 14.223 ( -7.042 -0.000 -9.178) 11.568 14.327 ( -2.184 -0.000 8.911) 9.175 14.938 ( 5.197 0.000 -0.214) 5.201 15.255 ( -2.695 -0.000 -7.144) 7.636 15.661 ( 16.235 0.000 -3.736) 16.659 15.846 ( 6.086 0.000 4.225) 7.409 18.441 ( -0.664 -0.000 -0.285) 0.722 18.767 ( -5.184 -0.000 3.891) 6.482 20.063 ( 1.644 0.000 3.235) 3.629 20.506 ( -0.040 -0.000 -4.103) 4.103 25.544 ( -3.899 -0.000 5.190) 6.491 25.722 ( 14.534 0.000 5.748) 15.629 26.673 ( -0.092 -0.000 -3.145) 3.146 26.690 ( -0.012 -0.000 2.458) 2.458 27.516 ( -4.184 -0.000 -0.782) 4.257 28.368 ( 6.876 0.000 -6.663) 9.575 28.546 ( 1.309 0.000 -1.266) 1.821 28.593 ( -3.940 -0.000 -5.942) 7.129 29.047 ( -15.212 -0.000 -8.761) 17.555 29.063 ( -1.326 -0.000 1.359) 1.899 30.202 ( 7.903 0.000 3.158) 8.511 31.629 ( -2.098 -0.000 6.622) 6.946 ======================= Grid point 20 (14/186) ======================= q-point: ( 0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( 15.903 3.340 4.203) 16.784 1.839 ( 14.525 -0.824 4.658) 15.275 2.092 ( 7.148 9.429 1.730) 11.958 2.383 ( 2.683 -4.647 -2.529) 5.932 2.436 ( 3.062 1.195 0.860) 3.397 2.734 ( 9.755 -6.811 6.405) 13.512 3.645 ( -12.626 6.673 1.355) 14.345 3.838 ( -2.606 2.507 2.981) 4.686 3.860 ( 2.764 -1.966 -6.811) 7.609 4.338 ( -5.984 -1.356 4.786) 7.782 4.749 ( 15.538 6.412 -6.466) 18.010 4.803 ( 7.348 0.030 2.897) 7.899 5.377 ( -3.042 -14.008 -9.231) 17.050 6.211 ( 8.410 1.540 8.449) 12.020 6.281 ( 6.816 0.771 3.196) 7.568 6.788 ( -7.656 11.401 -1.621) 13.829 7.104 ( -1.041 -10.082 1.003) 10.185 7.347 ( 1.383 -4.583 -1.014) 4.894 7.385 ( -2.946 0.854 -8.944) 9.455 7.680 ( -12.340 4.911 -0.706) 13.300 8.061 ( -1.506 -3.880 -5.180) 6.645 8.234 ( -1.145 -1.811 -6.932) 7.256 8.697 ( 5.715 7.003 1.592) 9.178 8.868 ( 11.599 -2.852 0.537) 11.957 9.357 ( 4.593 8.412 7.126) 11.943 9.571 ( 5.593 -0.738 4.122) 6.987 10.314 ( 3.276 16.890 -4.334) 17.743 10.530 ( -12.913 0.695 2.476) 13.167 10.695 ( -3.295 -7.342 0.158) 8.049 10.928 ( 12.496 3.526 1.395) 13.059 11.166 ( 3.350 -9.683 -0.392) 10.254 11.622 ( -2.022 1.690 2.011) 3.315 11.755 ( -5.674 -4.743 -2.890) 7.939 12.107 ( -1.577 2.553 2.950) 4.208 12.509 ( -11.929 -1.689 -11.823) 16.880 12.860 ( -0.086 0.030 30.447) 30.447 13.022 ( -6.512 -4.767 2.151) 8.352 13.375 ( 2.923 -3.216 -4.739) 6.430 14.101 ( -6.697 -0.986 -12.075) 13.843 14.339 ( -1.853 -1.339 6.477) 6.868 14.962 ( 4.353 4.539 0.024) 6.289 15.171 ( -1.375 3.842 -5.295) 6.685 15.843 ( 10.880 -0.722 -2.205) 11.125 15.973 ( 6.256 -5.006 1.581) 8.167 18.430 ( 0.478 0.710 0.169) 0.872 18.671 ( -4.830 5.617 3.212) 8.075 20.124 ( 1.276 -4.137 2.977) 5.254 20.484 ( -0.000 1.176 -3.886) 4.060 25.518 ( -4.527 -0.951 4.100) 6.181 25.932 ( 16.314 1.007 6.742) 17.681 26.662 ( -0.106 -0.310 -3.530) 3.545 26.700 ( -0.022 -0.083 2.441) 2.442 27.480 ( -3.881 -1.782 0.763) 4.338 28.395 ( 1.956 2.125 -0.651) 2.961 28.468 ( -0.342 5.197 -5.644) 7.679 28.614 ( -0.187 -4.569 -3.569) 5.801 28.823 ( -17.926 -2.835 -9.453) 20.463 29.087 ( -1.109 -4.222 0.736) 4.426 30.320 ( 8.347 -0.601 2.815) 8.829 31.559 ( -0.642 9.431 4.768) 10.587 ======================= Grid point 21 (15/186) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( 8.610 10.020 2.203) 13.394 1.984 ( 9.743 3.478 1.048) 10.398 2.054 ( 2.080 5.950 0.673) 6.339 2.268 ( -4.893 6.406 0.079) 8.062 2.564 ( 2.943 -2.462 -2.946) 4.838 2.870 ( 1.264 1.545 0.218) 2.008 3.338 ( -14.326 14.020 6.258) 20.999 3.743 ( -2.745 0.487 2.229) 3.570 3.913 ( 2.107 -1.302 -11.632) 11.893 4.291 ( -5.214 -2.707 -1.920) 6.181 4.745 ( 6.451 -0.558 1.784) 6.716 5.139 ( 23.681 -1.286 9.862) 25.685 5.537 ( 0.065 -14.950 -6.810) 16.428 6.297 ( 5.160 2.058 5.864) 8.078 6.356 ( 8.465 4.233 2.752) 9.857 6.549 ( -7.817 6.757 -2.483) 10.626 7.192 ( -10.915 -2.826 -8.215) 13.950 7.283 ( 3.916 -2.200 1.048) 4.612 7.349 ( -11.400 -1.754 1.815) 11.676 7.604 ( 4.582 -0.849 -2.142) 5.128 8.062 ( -4.779 -5.032 -2.494) 7.374 8.245 ( -0.642 -4.118 -3.765) 5.617 8.631 ( 3.553 10.639 -0.455) 11.226 9.043 ( 13.028 2.698 -4.475) 14.037 9.264 ( 0.550 10.119 6.784) 12.195 9.648 ( 5.812 3.174 7.358) 9.899 10.081 ( -3.049 13.762 -6.805) 15.652 10.366 ( -12.137 0.732 0.639) 12.175 10.725 ( -0.293 -2.907 4.421) 5.299 11.105 ( 13.183 0.020 -0.770) 13.205 11.325 ( 1.174 -7.823 3.673) 8.722 11.596 ( -0.704 -0.631 0.450) 1.047 11.743 ( -3.865 -2.952 -2.764) 5.594 12.071 ( -0.150 2.246 2.845) 3.628 12.372 ( -9.965 -6.053 -13.711) 17.998 12.879 ( -3.057 -1.582 5.186) 6.224 13.142 ( 1.799 -5.573 21.917) 22.686 13.424 ( 0.006 -1.769 -0.535) 1.848 14.022 ( -3.649 -5.066 -17.246) 18.341 14.361 ( -1.261 -2.034 4.701) 5.275 14.938 ( 3.328 5.655 -0.043) 6.562 15.094 ( -0.193 3.745 -2.441) 4.474 15.926 ( 4.971 2.086 -0.651) 5.430 16.116 ( 4.976 -4.474 -0.075) 6.692 18.442 ( 1.847 1.098 2.079) 2.990 18.548 ( -2.600 4.724 0.428) 5.409 20.216 ( 0.782 -5.770 2.361) 6.283 20.447 ( -0.061 2.437 -3.013) 3.875 25.478 ( -4.397 0.194 2.216) 4.928 26.143 ( 16.822 1.856 6.741) 18.217 26.655 ( -0.119 -0.511 -3.131) 3.175 26.707 ( -0.125 -0.007 1.960) 1.963 27.454 ( -5.847 -1.666 1.883) 6.365 28.365 ( -0.297 4.089 1.449) 4.348 28.389 ( -0.312 3.113 -4.303) 5.320 28.617 ( -10.756 -2.122 -5.110) 12.096 28.667 ( -5.950 -7.243 -7.275) 11.865 29.144 ( -1.070 -5.659 0.352) 5.770 30.429 ( 6.664 0.418 1.703) 6.891 31.413 ( 0.678 13.055 3.309) 13.485 ======================= Grid point 22 (16/186) ======================= q-point: (-0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( 3.147 15.184 -0.204) 15.508 1.846 ( -6.554 16.468 -4.161) 18.206 2.007 ( 2.272 6.409 0.925) 6.863 2.236 ( 6.016 0.467 1.836) 6.307 2.520 ( -2.946 7.274 -2.764) 8.321 2.726 ( -5.067 12.684 1.977) 13.801 2.983 ( -10.252 16.061 -0.812) 19.071 3.777 ( -0.299 -4.390 5.442) 6.999 3.916 ( 1.938 -2.290 -9.226) 9.701 4.280 ( -2.780 -3.420 -1.471) 4.646 4.893 ( 5.539 -6.647 3.229) 9.235 5.447 ( 17.828 -0.483 8.601) 19.800 5.689 ( -0.902 -7.920 -3.541) 8.722 6.277 ( 0.918 12.674 -3.999) 13.322 6.357 ( 5.099 2.763 4.704) 7.467 6.498 ( -1.225 -7.047 1.120) 7.240 7.040 ( -3.786 2.222 -7.042) 8.298 7.174 ( -12.894 1.417 2.712) 13.252 7.452 ( -1.392 -13.437 0.550) 13.520 7.674 ( 5.891 1.520 -0.741) 6.128 8.075 ( -4.554 -6.997 -1.304) 8.450 8.311 ( 0.667 -6.313 0.130) 6.349 8.514 ( 2.300 10.669 -1.148) 10.975 8.925 ( -0.569 18.728 -0.894) 18.758 9.317 ( 11.215 -0.684 -0.960) 11.277 9.643 ( 4.682 13.109 9.043) 16.599 9.834 ( -9.548 6.879 -4.930) 12.759 10.229 ( -7.330 0.294 -1.886) 7.575 10.799 ( 1.921 -3.172 3.893) 5.376 11.207 ( 7.525 3.505 -1.514) 8.438 11.397 ( -2.515 -2.952 0.486) 3.908 11.652 ( 2.237 -4.134 1.829) 5.044 11.703 ( -1.576 1.270 -2.795) 3.451 12.069 ( 0.394 -0.378 2.291) 2.355 12.345 ( -4.771 -8.395 -8.830) 13.084 12.937 ( 0.446 -8.889 0.385) 8.909 13.263 ( -0.572 1.302 13.920) 13.993 13.444 ( -0.984 -3.923 3.299) 5.219 14.034 ( -0.772 -8.282 -14.162) 16.424 14.401 ( 0.192 -2.850 2.746) 3.962 14.897 ( 1.925 4.672 -0.432) 5.072 15.045 ( 0.195 3.245 0.087) 3.252 15.914 ( 1.235 4.584 -0.201) 4.752 16.215 ( 2.753 -3.050 -0.162) 4.112 18.392 ( -0.649 6.807 2.610) 7.319 18.558 ( 2.427 -4.493 -1.450) 5.309 20.311 ( 0.404 -5.636 2.045) 6.009 20.398 ( -0.076 3.248 -2.140) 3.891 25.423 ( -2.909 1.490 0.593) 3.322 26.351 ( 15.882 0.844 5.995) 16.997 26.651 ( -0.072 -0.473 -3.092) 3.129 26.710 ( -0.160 0.134 1.129) 1.148 27.362 ( -11.005 1.267 1.665) 11.202 28.265 ( -0.091 8.861 -1.117) 8.931 28.362 ( -2.946 -2.376 -0.824) 3.873 28.547 ( -4.960 -6.209 -2.762) 8.414 28.677 ( -3.278 -4.176 -4.394) 6.891 29.215 ( -0.511 -5.894 0.193) 5.919 30.459 ( 3.257 5.887 0.518) 6.747 31.266 ( 1.123 10.469 1.675) 10.662 ======================= Grid point 23 (17/186) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( 0.000 21.875 -0.000) 21.875 1.550 ( 0.000 20.136 -0.000) 20.136 1.915 ( 0.000 8.138 -0.000) 8.138 2.242 ( 0.000 27.803 -0.000) 27.803 2.304 ( -0.000 -0.202 0.000) 0.202 2.567 ( 0.000 4.478 -0.000) 4.478 2.687 ( 0.000 13.560 -0.000) 13.560 3.851 ( -0.000 -5.008 0.000) 5.008 3.966 ( -0.000 -4.737 0.000) 4.737 4.295 ( -0.000 -1.453 0.000) 1.453 5.044 ( -0.000 -8.202 0.000) 8.202 5.651 ( -0.000 -1.039 0.000) 1.039 5.658 ( 0.000 0.458 -0.000) 0.458 6.074 ( 0.000 14.838 -0.000) 14.838 6.363 ( 0.000 4.297 -0.000) 4.297 6.649 ( -0.000 -14.374 0.000) 14.374 7.026 ( 0.000 2.082 -0.000) 2.082 7.045 ( -0.000 -2.049 0.000) 2.049 7.628 ( -0.000 -14.302 0.000) 14.302 7.683 ( 0.000 1.948 -0.000) 1.948 8.153 ( -0.000 -9.001 0.000) 9.001 8.390 ( 0.000 5.758 -0.000) 5.758 8.420 ( -0.000 -4.008 0.000) 4.008 8.649 ( 0.000 18.158 -0.000) 18.158 9.412 ( 0.000 5.108 -0.000) 5.108 9.464 ( 0.000 13.619 -0.000) 13.619 9.668 ( 0.000 3.988 -0.000) 3.988 10.169 ( 0.000 2.108 -0.000) 2.108 10.857 ( -0.000 -1.896 0.000) 1.896 11.183 ( 0.000 6.324 -0.000) 6.324 11.396 ( -0.000 -0.449 0.000) 0.449 11.608 ( 0.000 5.935 -0.000) 5.935 11.788 ( -0.000 -8.145 0.000) 8.145 12.091 ( -0.000 -1.166 0.000) 1.166 12.405 ( -0.000 -7.069 0.000) 7.069 13.127 ( -0.000 -15.259 0.000) 15.259 13.206 ( 0.000 5.603 -0.000) 5.603 13.528 ( -0.000 -6.751 0.000) 6.751 14.116 ( -0.000 -7.284 0.000) 7.284 14.450 ( -0.000 -2.714 0.000) 2.714 14.864 ( 0.000 1.627 -0.000) 1.627 15.001 ( 0.000 3.566 -0.000) 3.566 15.846 ( 0.000 5.829 -0.000) 5.829 16.272 ( -0.000 -2.773 0.000) 2.773 18.305 ( 0.000 5.545 -0.000) 5.545 18.651 ( -0.000 -5.975 0.000) 5.975 20.340 ( 0.000 4.220 -0.000) 4.220 20.395 ( -0.000 -5.343 0.000) 5.343 25.379 ( 0.000 2.045 -0.000) 2.045 26.516 ( -0.000 -2.823 0.000) 2.823 26.642 ( 0.000 0.079 -0.000) 0.079 26.709 ( 0.000 0.149 -0.000) 0.149 27.206 ( 0.000 5.318 -0.000) 5.318 28.132 ( 0.000 9.807 -0.000) 9.807 28.383 ( -0.000 -3.771 0.000) 3.771 28.627 ( -0.000 -8.304 0.000) 8.304 28.678 ( -0.000 -2.161 0.000) 2.161 29.289 ( -0.000 -5.129 0.000) 5.129 30.344 ( 0.000 13.387 -0.000) 13.387 31.177 ( 0.000 4.152 -0.000) 4.152 ======================= Grid point 28 (18/186) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 7.289 0.000 4.387) 8.507 2.050 ( 11.795 0.000 3.498) 12.303 2.299 ( 4.953 0.000 -2.073) 5.370 2.321 ( 0.647 0.000 -4.627) 4.672 2.439 ( 0.272 0.000 2.783) 2.796 2.867 ( 11.701 0.000 5.302) 12.846 3.566 ( -9.182 -0.000 -0.281) 9.186 3.759 ( -8.003 -0.000 1.209) 8.094 3.883 ( 3.159 0.000 -3.607) 4.795 4.295 ( -4.728 -0.000 5.862) 7.532 4.783 ( -0.366 -0.000 -8.468) 8.475 5.032 ( 6.800 0.000 9.238) 11.471 5.300 ( 19.691 0.000 -12.604) 23.379 6.349 ( 2.752 0.000 1.702) 3.236 6.358 ( 5.496 0.000 8.832) 10.403 6.796 ( -9.580 -0.000 2.306) 9.854 6.947 ( -0.156 -0.000 -2.097) 2.103 7.316 ( -4.824 -0.000 -8.173) 9.490 7.450 ( 11.993 0.000 1.064) 12.040 7.526 ( -13.408 -0.000 1.517) 13.494 8.002 ( -2.363 -0.000 -7.796) 8.146 8.166 ( -2.511 -0.000 -5.480) 6.028 8.842 ( 5.046 0.000 0.942) 5.133 8.989 ( 13.187 0.000 -0.984) 13.224 9.479 ( 1.188 0.000 5.682) 5.805 9.642 ( 5.885 0.000 3.035) 6.621 10.374 ( -12.984 -0.000 0.398) 12.990 10.413 ( -9.821 -0.000 -1.764) 9.978 10.651 ( 7.420 0.000 -3.363) 8.147 11.074 ( 6.447 0.000 12.930) 14.449 11.190 ( 10.617 0.000 -2.631) 10.939 11.612 ( -2.901 -0.000 2.195) 3.638 11.619 ( -6.435 -0.000 -2.541) 6.919 12.114 ( -2.622 -0.000 5.653) 6.231 12.286 ( -12.469 -0.000 -17.749) 21.691 12.889 ( -5.530 -0.000 -0.899) 5.602 13.031 ( 5.663 0.000 31.069) 31.580 13.403 ( 5.593 0.000 -4.640) 7.267 13.948 ( -8.262 -0.000 -13.778) 16.065 14.329 ( -1.645 -0.000 4.881) 5.151 15.037 ( 2.675 0.000 -0.312) 2.693 15.150 ( -2.213 -0.000 -3.964) 4.540 15.981 ( 10.268 0.000 -2.401) 10.545 16.014 ( 5.145 0.000 1.482) 5.354 18.436 ( 0.191 0.000 0.407) 0.450 18.659 ( -4.612 -0.000 2.089) 5.063 20.119 ( 0.909 0.000 2.700) 2.849 20.482 ( 0.264 0.000 -3.247) 3.257 25.478 ( -3.334 -0.000 3.376) 4.745 26.168 ( 15.731 0.000 7.063) 17.243 26.646 ( -0.223 -0.000 -2.961) 2.969 26.707 ( 0.010 0.000 2.016) 2.016 27.433 ( -2.500 -0.000 0.921) 2.664 28.399 ( -3.245 -0.000 2.440) 4.060 28.504 ( 1.968 0.000 -9.329) 9.535 28.511 ( -11.828 -0.000 -7.827) 14.183 28.600 ( -4.699 -0.000 -1.841) 5.047 29.052 ( -0.426 -0.000 0.816) 0.920 30.420 ( 6.686 0.000 2.315) 7.075 31.625 ( -0.890 -0.000 2.991) 3.121 ======================= Grid point 29 (19/186) ======================= q-point: ( 0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 3.007 2.088 1.758) 4.061 2.135 ( 2.292 3.432 0.956) 4.236 2.200 ( 2.534 9.633 -2.665) 10.311 2.317 ( 1.000 3.411 1.549) 3.877 2.513 ( 0.081 -3.496 -1.158) 3.684 2.972 ( 5.234 3.577 1.294) 6.470 3.408 ( -5.803 9.900 2.844) 11.823 3.691 ( -3.754 -1.439 0.298) 4.031 3.900 ( 1.369 0.171 -3.795) 4.038 4.236 ( -2.569 2.063 0.317) 3.310 4.775 ( 1.584 -1.495 -0.415) 2.217 5.166 ( -1.096 -14.959 1.611) 15.086 5.581 ( 22.361 0.221 -4.273) 22.767 6.338 ( -5.730 0.824 4.304) 7.214 6.395 ( -2.844 -2.334 0.804) 3.766 6.688 ( 7.263 12.024 3.744) 14.537 7.015 ( -0.992 -6.690 -2.400) 7.176 7.193 ( -10.358 0.270 -4.320) 11.226 7.349 ( -3.088 5.824 1.265) 6.712 7.658 ( 10.445 -4.122 1.877) 11.385 7.929 ( -6.958 -1.959 -5.574) 9.128 8.156 ( -1.342 -4.062 -2.893) 5.164 8.810 ( 2.217 9.473 0.083) 9.729 9.187 ( 12.313 -4.441 -3.939) 13.669 9.418 ( -2.560 10.104 5.927) 11.991 9.728 ( 4.227 -0.547 3.247) 5.358 10.198 ( -5.301 9.285 -5.369) 11.965 10.240 ( -9.360 2.390 1.344) 9.754 10.720 ( 2.811 -1.482 1.421) 3.481 11.242 ( 8.332 -2.030 5.766) 10.334 11.297 ( 4.002 -1.567 1.811) 4.663 11.555 ( -2.953 -1.345 -1.239) 3.473 11.627 ( -2.116 -5.311 1.345) 5.874 12.081 ( -8.285 -5.342 0.054) 9.858 12.134 ( -2.086 0.690 -10.366) 10.596 12.834 ( -2.610 0.213 0.605) 2.688 13.224 ( 6.034 -2.857 20.953) 21.991 13.436 ( 1.706 1.772 -2.228) 3.319 13.835 ( -5.528 -4.742 -13.644) 15.466 14.334 ( -0.975 -1.511 2.566) 3.134 15.035 ( 1.469 3.623 -0.216) 3.915 15.109 ( -0.993 1.283 -1.776) 2.405 16.023 ( 3.712 3.586 -0.284) 5.169 16.120 ( 3.974 -3.582 -0.308) 5.359 18.453 ( 0.808 -1.687 0.663) 1.984 18.584 ( -2.623 4.443 0.725) 5.210 20.161 ( 0.357 -3.787 1.462) 4.075 20.467 ( 0.203 1.390 -1.789) 2.275 25.450 ( -2.064 0.464 1.623) 2.666 26.359 ( 11.120 0.046 5.021) 12.201 26.638 ( -0.200 -0.343 -1.754) 1.799 26.712 ( -0.013 0.052 1.128) 1.130 27.404 ( -2.441 1.114 0.675) 2.766 28.318 ( -8.454 -0.532 -3.659) 9.227 28.392 ( -4.741 -3.630 -0.812) 6.026 28.466 ( 1.132 4.741 -4.149) 6.401 28.604 ( 0.088 -1.825 -1.121) 2.144 29.074 ( -0.290 -3.296 0.354) 3.327 30.497 ( 3.743 -0.581 1.177) 3.967 31.570 ( -0.193 7.685 1.553) 7.843 ======================= Grid point 30 (20/186) ======================= q-point: (-0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.959 ( 0.000 10.353 -0.000) 10.353 2.006 ( 0.000 11.545 -0.000) 11.545 2.116 ( 0.000 7.052 -0.000) 7.052 2.313 ( 0.000 1.781 -0.000) 1.781 2.509 ( 0.000 0.236 -0.000) 0.236 2.898 ( 0.000 11.462 -0.000) 11.462 3.174 ( 0.000 18.266 -0.000) 18.266 3.715 ( -0.000 -4.523 0.000) 4.523 3.897 ( -0.000 -0.152 0.000) 0.152 4.218 ( -0.000 -2.025 0.000) 2.025 4.842 ( -0.000 -5.551 0.000) 5.551 5.399 ( -0.000 -17.163 0.000) 17.163 5.711 ( 0.000 2.585 -0.000) 2.585 6.299 ( -0.000 -2.667 0.000) 2.667 6.401 ( -0.000 -0.846 0.000) 0.846 6.583 ( 0.000 13.455 -0.000) 13.455 7.046 ( 0.000 1.693 -0.000) 1.693 7.084 ( -0.000 -0.052 0.000) 0.052 7.326 ( -0.000 -4.361 0.000) 4.361 7.761 ( 0.000 3.105 -0.000) 3.105 7.922 ( -0.000 -8.718 0.000) 8.718 8.219 ( -0.000 -6.607 0.000) 6.607 8.676 ( 0.000 11.244 -0.000) 11.244 9.191 ( 0.000 18.635 -0.000) 18.635 9.354 ( -0.000 -5.186 0.000) 5.186 9.752 ( 0.000 1.641 -0.000) 1.641 9.971 ( 0.000 16.956 -0.000) 16.956 10.167 ( -0.000 -0.507 0.000) 0.507 10.775 ( -0.000 -3.143 0.000) 3.143 11.301 ( 0.000 2.370 -0.000) 2.370 11.345 ( -0.000 -2.408 0.000) 2.408 11.584 ( -0.000 -5.517 0.000) 5.517 11.685 ( -0.000 -3.049 0.000) 3.049 12.090 ( 0.000 2.198 -0.000) 2.198 12.149 ( -0.000 -11.864 0.000) 11.864 12.837 ( -0.000 -3.778 0.000) 3.778 13.364 ( 0.000 5.659 -0.000) 5.659 13.375 ( -0.000 -4.894 0.000) 4.894 13.875 ( -0.000 -8.876 0.000) 8.876 14.365 ( -0.000 -2.898 0.000) 2.898 14.980 ( 0.000 5.351 -0.000) 5.351 15.079 ( 0.000 1.997 -0.000) 1.997 15.988 ( 0.000 4.527 -0.000) 4.527 16.190 ( -0.000 -3.180 0.000) 3.180 18.488 ( 0.000 6.817 -0.000) 6.817 18.506 ( -0.000 -4.182 0.000) 4.182 20.234 ( -0.000 -5.784 0.000) 5.784 20.437 ( 0.000 2.665 -0.000) 2.665 25.427 ( 0.000 1.264 -0.000) 1.264 26.458 ( -0.000 -1.397 0.000) 1.397 26.638 ( -0.000 -0.341 0.000) 0.341 26.713 ( 0.000 0.135 -0.000) 0.135 27.343 ( 0.000 4.131 -0.000) 4.131 28.284 ( -0.000 -3.272 0.000) 3.272 28.380 ( 0.000 7.595 -0.000) 7.595 28.425 ( -0.000 -5.517 0.000) 5.517 28.625 ( -0.000 -1.730 0.000) 1.730 29.133 ( -0.000 -5.341 0.000) 5.341 30.524 ( 0.000 0.900 -0.000) 0.900 31.434 ( 0.000 11.796 -0.000) 11.796 ======================= Grid point 38 (21/186) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 106 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( 0.000 0.000 0.000) 0.000 2.177 ( 0.000 0.000 0.000) 0.000 2.273 ( 0.000 0.000 0.000) 0.000 2.347 ( 0.000 0.000 -0.000) 0.000 2.503 ( 0.000 0.000 0.000) 0.000 3.039 ( 0.000 0.000 -0.000) 0.000 3.442 ( 0.000 0.000 0.000) 0.000 3.656 ( 0.000 0.000 -0.000) 0.000 3.908 ( 0.000 0.000 -0.000) 0.000 4.249 ( 0.000 0.000 -0.000) 0.000 4.767 ( 0.000 0.000 0.000) 0.000 5.032 ( 0.000 0.000 0.000) 0.000 5.754 ( 0.000 0.000 -0.000) 0.000 6.257 ( -0.000 -0.000 -0.000) 0.000 6.378 ( 0.000 0.000 0.000) 0.000 6.910 ( -0.000 -0.000 -0.000) 0.000 6.937 ( 0.000 0.000 -0.000) 0.000 7.079 ( 0.000 0.000 0.000) 0.000 7.370 ( 0.000 0.000 0.000) 0.000 7.746 ( 0.000 0.000 0.000) 0.000 7.817 ( -0.000 -0.000 -0.000) 0.000 8.111 ( 0.000 0.000 -0.000) 0.000 8.901 ( 0.000 0.000 0.000) 0.000 9.215 ( 0.000 0.000 0.000) 0.000 9.487 ( 0.000 0.000 0.000) 0.000 9.764 ( 0.000 0.000 -0.000) 0.000 10.169 ( 0.000 0.000 -0.000) 0.000 10.236 ( 0.000 0.000 0.000) 0.000 10.733 ( 0.000 0.000 -0.000) 0.000 11.301 ( 0.000 0.000 0.000) 0.000 11.330 ( 0.000 0.000 0.000) 0.000 11.524 ( 0.000 0.000 -0.000) 0.000 11.576 ( 0.000 0.000 -0.000) 0.000 11.930 ( 0.000 0.000 0.000) 0.000 12.140 ( 0.000 0.000 0.000) 0.000 12.823 ( 0.000 0.000 0.000) 0.000 13.292 ( 0.000 0.000 -0.000) 0.000 13.470 ( 0.000 0.000 -0.000) 0.000 13.721 ( 0.000 0.000 0.000) 0.000 14.321 ( 0.000 0.000 0.000) 0.000 15.068 ( 0.000 0.000 0.000) 0.000 15.106 ( 0.000 0.000 0.000) 0.000 16.089 ( 0.000 0.000 0.000) 0.000 16.106 ( 0.000 0.000 -0.000) 0.000 18.445 ( 0.000 0.000 -0.000) 0.000 18.600 ( 0.000 0.000 0.000) 0.000 20.139 ( 0.000 0.000 -0.000) 0.000 20.475 ( 0.000 0.000 0.000) 0.000 25.444 ( 0.000 0.000 0.000) 0.000 26.439 ( 0.000 0.000 -0.000) 0.000 26.631 ( 0.000 0.000 0.000) 0.000 26.715 ( 0.000 0.000 -0.000) 0.000 27.405 ( 0.000 0.000 -0.000) 0.000 28.229 ( 0.000 0.000 0.000) 0.000 28.351 ( 0.000 0.000 0.000) 0.000 28.502 ( 0.000 0.000 0.000) 0.000 28.589 ( 0.000 0.000 -0.000) 0.000 29.050 ( 0.000 0.000 -0.000) 0.000 30.518 ( 0.000 0.000 -0.000) 0.000 31.624 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 67 (22/186) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.560 ( -1.054 -0.000 27.532) 27.552 0.597 ( 7.982 0.000 28.550) 29.645 1.237 ( 2.991 0.000 55.034) 55.115 1.778 ( 1.730 0.000 0.841) 1.924 2.285 ( -14.628 -0.000 7.732) 16.546 2.429 ( 5.184 0.000 0.930) 5.267 2.571 ( 1.177 0.000 4.789) 4.931 3.929 ( 1.664 0.000 -10.432) 10.563 4.532 ( -14.937 -0.000 32.544) 35.808 4.618 ( -1.699 -0.000 11.144) 11.273 4.893 ( -10.321 -0.000 30.746) 32.432 5.692 ( -4.245 -0.000 -2.217) 4.789 5.711 ( -5.229 -0.000 -0.039) 5.229 5.753 ( -2.018 -0.000 -0.320) 2.043 6.045 ( 3.608 0.000 5.456) 6.541 6.991 ( 1.794 0.000 2.583) 3.145 7.021 ( 4.276 0.000 -8.274) 9.313 7.101 ( -1.236 -0.000 -1.462) 1.914 7.763 ( -0.723 -0.000 -2.525) 2.626 7.924 ( -5.196 -0.000 -10.983) 12.150 8.135 ( 3.924 0.000 -2.931) 4.898 8.251 ( 9.172 0.000 4.558) 10.242 8.338 ( 1.773 0.000 -1.922) 2.615 8.556 ( 9.604 0.000 1.968) 9.803 9.227 ( 3.708 0.000 4.732) 6.012 9.285 ( -7.930 -0.000 2.408) 8.288 9.369 ( 10.956 0.000 -4.154) 11.717 9.793 ( 6.852 0.000 0.033) 6.852 10.732 ( -0.642 -0.000 -0.440) 0.778 11.007 ( -1.082 -0.000 7.187) 7.268 11.285 ( 0.536 0.000 1.988) 2.059 11.638 ( -0.317 -0.000 5.957) 5.966 11.977 ( -1.913 -0.000 -10.889) 11.056 12.156 ( 2.540 0.000 -7.770) 8.175 12.622 ( 6.142 0.000 -23.770) 24.551 13.043 ( -1.441 -0.000 -7.770) 7.902 13.804 ( -0.649 -0.000 -13.414) 13.430 14.333 ( 9.118 0.000 -12.974) 15.857 14.539 ( 1.450 0.000 17.964) 18.022 14.899 ( -7.470 -0.000 3.730) 8.350 14.969 ( 0.985 0.000 4.617) 4.721 14.971 ( -3.953 -0.000 12.621) 13.226 15.517 ( 9.337 0.000 -5.809) 10.997 16.452 ( -22.234 -0.000 3.116) 22.451 18.182 ( 10.020 0.000 -1.735) 10.169 18.853 ( 0.733 0.000 -2.262) 2.378 19.921 ( 3.192 0.000 -6.522) 7.261 20.472 ( -0.075 -0.000 -7.148) 7.148 25.351 ( 0.729 0.000 4.865) 4.920 25.690 ( 0.932 0.000 8.215) 8.267 26.668 ( 0.060 0.000 -3.011) 3.012 27.006 ( 21.120 0.000 6.179) 22.006 27.533 ( -43.087 -0.000 -10.221) 44.283 28.065 ( -32.325 -0.000 13.650) 35.089 28.534 ( -1.192 -0.000 1.903) 2.245 28.769 ( -1.241 -0.000 -0.094) 1.245 29.134 ( -0.514 -0.000 3.094) 3.136 29.350 ( -0.780 -0.000 -5.755) 5.808 29.997 ( 1.495 0.000 -3.705) 3.995 30.829 ( 57.507 0.000 -3.417) 57.609 ======================= Grid point 68 (23/186) ======================= q-point: ( 0.12 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( 12.504 -11.063 19.406) 25.600 0.928 ( 16.511 -11.137 16.942) 26.147 1.647 ( 13.393 -14.391 39.891) 44.472 1.835 ( 5.515 -0.672 1.414) 5.733 2.310 ( 5.606 -0.081 9.388) 10.935 2.580 ( 5.053 1.533 4.618) 7.015 2.633 ( 16.476 -2.974 5.135) 17.512 3.949 ( -0.549 -5.780 -10.129) 11.675 4.406 ( -8.837 5.564 25.046) 27.136 4.595 ( -7.571 2.970 25.019) 26.308 4.900 ( -14.551 -6.874 19.182) 25.039 5.394 ( -16.855 10.423 -2.952) 20.036 5.747 ( -9.665 -13.182 1.026) 16.378 5.828 ( 7.022 -2.096 -0.984) 7.394 6.108 ( 0.556 -2.487 5.802) 6.337 6.961 ( -1.506 8.167 -5.772) 10.114 7.034 ( 1.221 -2.090 2.644) 3.584 7.133 ( 4.687 -2.358 -3.519) 6.317 7.701 ( -1.375 4.953 -6.814) 8.535 7.856 ( -5.451 -6.896 -8.320) 12.103 8.125 ( 4.106 3.286 -1.096) 5.372 8.349 ( 0.746 0.538 -0.650) 1.127 8.416 ( 9.622 0.227 -1.180) 9.697 8.746 ( 5.085 -3.409 -6.051) 8.608 8.962 ( -1.444 12.502 5.903) 13.901 9.366 ( -2.489 -3.856 3.414) 5.720 9.609 ( 16.752 -2.806 0.133) 16.986 10.027 ( 17.796 -5.045 -6.784) 19.702 10.755 ( -0.542 -4.763 -2.341) 5.335 11.016 ( -3.318 -2.225 7.220) 8.251 11.303 ( -2.208 -3.147 2.318) 4.489 11.655 ( 0.775 1.179 5.895) 6.061 11.897 ( -3.475 -0.426 -12.149) 12.644 12.111 ( 0.167 4.741 -7.863) 9.183 12.633 ( 5.345 -2.057 -22.750) 23.460 12.961 ( 1.951 6.952 -4.750) 8.643 13.683 ( -5.564 4.971 -9.819) 12.332 14.280 ( -20.987 18.633 14.325) 31.509 14.343 ( 0.318 15.927 -2.407) 16.111 14.671 ( -5.280 6.203 23.188) 24.577 14.902 ( -8.450 -3.034 11.382) 14.497 14.955 ( 2.039 4.043 3.237) 5.566 15.599 ( 1.404 -3.688 -1.111) 4.099 16.064 ( -32.148 -16.821 10.765) 37.846 18.285 ( 10.264 6.126 -5.160) 13.019 18.813 ( -2.173 2.582 -2.323) 4.097 20.005 ( 2.019 -7.272 -7.747) 10.816 20.436 ( -0.033 1.044 -8.140) 8.207 25.415 ( 4.675 -0.956 6.568) 8.118 25.822 ( -5.364 -12.379 3.894) 14.042 26.652 ( -1.083 -0.417 -2.772) 3.006 27.049 ( -21.653 3.986 12.817) 25.475 27.307 ( 22.800 0.622 -6.963) 23.847 27.989 ( -0.709 -1.671 13.218) 13.342 28.513 ( -1.037 2.087 0.979) 2.527 28.741 ( -2.452 0.306 0.942) 2.644 29.143 ( 0.673 -1.154 2.814) 3.115 29.320 ( -1.326 -0.200 -5.481) 5.643 29.981 ( 3.213 1.585 -1.422) 3.855 31.226 ( 24.328 11.682 -16.185) 31.469 ======================= Grid point 69 (24/186) ======================= q-point: ( 0.25 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.144 ( 9.079 -6.444 9.888) 14.891 1.397 ( 18.289 -15.225 8.596) 25.301 1.916 ( 4.261 -0.064 0.768) 4.330 2.100 ( 8.921 -13.377 17.491) 23.759 2.422 ( 3.656 1.239 13.430) 13.974 2.634 ( 7.190 -3.777 6.315) 10.288 2.993 ( 26.997 -1.928 5.111) 27.544 3.960 ( -5.064 -2.330 1.830) 5.867 4.390 ( -1.468 -3.098 15.489) 15.864 4.530 ( -12.092 3.520 28.658) 31.303 4.832 ( -11.951 -0.037 9.534) 15.288 5.004 ( -20.949 7.900 -0.981) 22.410 5.826 ( -7.280 -11.509 2.119) 13.782 5.956 ( 7.215 -3.217 -0.432) 7.912 6.168 ( -0.809 -3.428 7.134) 7.956 6.769 ( -3.629 11.013 -5.373) 12.780 7.101 ( 0.866 -4.570 2.963) 5.515 7.208 ( 6.272 -0.677 -5.231) 8.195 7.603 ( -1.489 2.432 -7.637) 8.152 7.868 ( -4.604 -6.077 -6.601) 10.084 8.157 ( 6.988 2.578 -2.860) 7.978 8.335 ( -3.324 0.593 1.055) 3.537 8.417 ( 1.787 6.115 3.492) 7.265 8.774 ( 0.000 -6.911 -2.840) 7.472 8.947 ( 6.799 5.450 3.365) 9.341 9.374 ( 0.960 3.340 3.246) 4.755 9.824 ( 12.081 -2.317 -1.109) 12.351 10.238 ( 13.089 -1.801 -5.326) 14.245 10.781 ( -1.622 -0.446 -1.890) 2.530 11.041 ( -4.836 -4.457 5.827) 8.787 11.352 ( -3.184 -9.030 1.578) 9.704 11.648 ( -0.155 2.917 2.358) 3.754 11.834 ( -1.455 1.210 -7.259) 7.502 12.017 ( 0.847 3.852 -6.946) 7.987 12.616 ( -0.098 -0.385 -21.695) 21.698 12.903 ( 5.282 6.200 -1.394) 8.263 13.504 ( -5.185 4.880 -9.998) 12.275 13.781 ( -13.598 20.194 29.564) 38.297 14.247 ( -3.901 0.790 -13.251) 13.836 14.637 ( -6.191 -0.678 13.794) 15.135 14.884 ( -5.122 -1.409 9.643) 11.009 14.949 ( 1.417 3.284 5.300) 6.394 15.681 ( 0.891 -6.701 -0.514) 6.779 16.059 ( -9.163 -11.574 2.860) 15.036 18.277 ( 5.874 6.096 -3.994) 9.361 18.716 ( -3.793 4.902 -1.805) 6.456 20.099 ( 2.276 -6.482 -6.920) 9.751 20.391 ( 0.524 1.595 -8.755) 8.915 25.528 ( 7.691 -0.120 8.094) 11.166 25.874 ( -9.461 -6.964 5.068) 12.794 26.641 ( -0.537 -1.006 -2.878) 3.096 26.878 ( -7.621 2.558 10.294) 13.061 27.494 ( 11.136 0.164 -2.703) 11.461 28.097 ( 4.186 -4.090 8.253) 10.117 28.461 ( -1.082 3.311 0.368) 3.503 28.724 ( -1.937 -1.153 2.762) 3.565 29.178 ( -0.964 -1.900 -0.155) 2.136 29.289 ( -1.841 -1.287 -3.266) 3.964 30.027 ( 3.804 -2.730 -3.269) 5.711 31.192 ( 10.700 14.632 -11.768) 21.612 ======================= Grid point 70 (25/186) ======================= q-point: ( 0.38 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 6.980 -2.869 4.675) 8.877 1.783 ( 9.764 -10.253 4.644) 14.900 1.925 ( 0.349 2.895 -0.514) 2.961 2.308 ( 1.604 2.111 7.034) 7.517 2.454 ( -0.187 -5.618 5.042) 7.551 2.898 ( 8.582 -8.187 6.164) 13.367 3.330 ( 23.150 2.052 2.536) 23.379 3.958 ( -3.782 -3.147 20.845) 21.418 4.266 ( -27.832 8.139 7.151) 29.866 4.513 ( 1.416 -5.269 12.586) 13.718 4.715 ( -2.583 4.654 7.290) 9.027 4.790 ( -11.038 -2.125 17.509) 20.807 5.883 ( -4.175 -6.251 1.940) 7.763 6.050 ( 3.676 -0.578 -3.192) 4.903 6.223 ( -2.291 -1.523 9.634) 10.019 6.583 ( -1.646 6.250 -4.095) 7.651 7.199 ( 1.824 -4.994 2.945) 6.078 7.280 ( 4.243 -3.081 -6.580) 8.413 7.541 ( -0.475 1.877 -3.026) 3.592 7.837 ( -5.713 -2.509 -6.706) 9.160 8.138 ( 5.617 7.086 -9.305) 12.975 8.343 ( -1.292 -5.103 6.256) 8.176 8.414 ( -0.802 -0.024 8.947) 8.983 8.857 ( -6.532 -8.052 -4.181) 11.180 8.972 ( 10.616 4.915 1.717) 11.824 9.308 ( 1.311 9.970 2.256) 10.306 9.969 ( 5.332 -3.924 -2.169) 6.966 10.402 ( 13.716 -0.192 -3.363) 14.124 10.720 ( -4.829 1.402 -1.825) 5.350 11.025 ( -6.841 -1.448 4.093) 8.102 11.464 ( -0.992 -7.522 0.399) 7.598 11.604 ( 0.497 1.762 -2.620) 3.196 11.752 ( -2.354 4.824 0.987) 5.458 12.011 ( 3.164 -1.454 -5.480) 6.493 12.494 ( -3.954 2.479 -20.584) 21.107 12.884 ( 4.640 6.970 0.309) 8.379 13.396 ( 1.568 0.279 -13.316) 13.410 13.583 ( -2.913 8.954 23.798) 25.593 14.126 ( -7.192 -0.306 -12.305) 14.256 14.622 ( -6.220 -1.594 12.159) 13.750 14.898 ( 0.081 -2.326 2.091) 3.129 14.919 ( -2.740 3.197 9.804) 10.670 15.783 ( 1.466 -5.236 -0.325) 5.447 16.114 ( -2.125 -5.138 0.399) 5.574 18.259 ( 5.064 4.085 -4.156) 7.720 18.587 ( -4.415 4.776 -1.547) 6.685 20.190 ( 3.042 -4.796 -6.257) 8.451 20.348 ( 0.861 1.325 -8.878) 9.017 25.655 ( 9.593 1.896 8.655) 13.059 25.825 ( -10.824 -2.246 5.626) 12.404 26.644 ( -0.269 -1.393 -2.509) 2.882 26.823 ( -3.313 1.169 8.970) 9.633 27.587 ( 5.456 0.027 0.851) 5.522 28.228 ( 2.128 -4.556 7.009) 8.626 28.417 ( -0.014 2.011 1.746) 2.663 28.736 ( -1.531 -1.725 2.685) 3.540 29.144 ( -6.457 -2.057 -4.293) 8.023 29.304 ( 0.242 -2.327 0.105) 2.342 30.108 ( 4.048 -3.126 -6.124) 7.979 31.064 ( 6.195 12.402 -10.975) 17.682 ======================= Grid point 71 (26/186) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 2.978 0.844 4.140) 5.170 1.852 ( -2.219 4.797 -3.637) 6.416 1.912 ( -3.075 0.992 4.032) 5.167 2.237 ( -2.542 3.262 -0.048) 4.135 2.541 ( -2.527 -1.561 5.210) 5.998 2.952 ( -6.186 4.169 -0.581) 7.483 3.503 ( 1.488 1.433 -1.829) 2.759 3.831 ( -13.918 5.889 1.766) 15.215 4.129 ( -2.392 -8.099 33.433) 34.483 4.593 ( -4.324 4.079 2.567) 6.476 4.694 ( 1.917 -6.923 24.692) 25.716 4.881 ( 7.194 -1.656 15.361) 17.043 5.900 ( -3.252 -2.088 0.868) 3.961 6.054 ( 4.011 4.349 -4.856) 7.654 6.172 ( -5.544 4.671 6.756) 9.910 6.588 ( 2.826 -5.428 1.754) 6.366 7.230 ( -2.965 1.821 -0.011) 3.479 7.356 ( 0.809 -5.851 -5.283) 7.925 7.541 ( -0.057 -2.156 1.890) 2.868 7.805 ( 2.585 -1.773 -6.333) 7.067 8.092 ( 1.941 2.355 -8.337) 8.878 8.402 ( -2.199 -2.895 5.218) 6.360 8.449 ( -3.507 -3.751 9.757) 11.026 8.796 ( -4.879 1.313 -5.774) 7.672 9.082 ( 2.148 -5.117 0.982) 5.636 9.163 ( 3.980 14.366 -0.498) 14.915 10.049 ( 0.858 -2.716 -1.900) 3.424 10.516 ( 1.903 2.154 -1.178) 3.107 10.673 ( 4.717 -1.414 -4.739) 6.834 10.952 ( -6.530 1.415 4.313) 7.952 11.452 ( 0.774 5.731 -4.849) 7.547 11.646 ( 0.962 -2.479 2.345) 3.545 11.684 ( -2.183 -0.616 1.452) 2.693 12.067 ( 2.635 -2.949 -2.167) 4.509 12.344 ( -2.023 2.662 -20.702) 20.970 12.827 ( 4.249 7.929 -3.013) 9.487 13.431 ( 5.063 -3.616 -11.026) 12.660 13.581 ( 3.287 3.435 16.364) 17.041 14.020 ( -6.072 -2.822 -7.445) 10.013 14.603 ( -5.962 -0.838 10.848) 12.406 14.865 ( -2.258 2.632 6.627) 7.479 14.971 ( 0.468 -4.991 3.880) 6.339 15.833 ( -0.925 -0.901 -0.068) 1.294 16.138 ( 0.984 0.719 -0.066) 1.221 18.269 ( 4.897 1.696 -4.550) 6.896 18.489 ( -2.252 1.407 -2.253) 3.482 20.228 ( 2.753 2.778 -6.441) 7.535 20.345 ( 1.596 -4.059 -7.934) 9.054 25.712 ( -10.845 0.514 5.287) 12.076 25.771 ( 10.807 5.041 7.738) 14.216 26.651 ( -0.527 -1.248 -1.529) 2.043 26.811 ( -2.176 0.437 8.901) 9.174 27.650 ( 4.144 0.262 2.848) 5.035 28.313 ( -3.309 -5.246 8.741) 10.718 28.428 ( 1.875 -0.340 4.338) 4.738 28.732 ( -3.216 -0.429 1.526) 3.586 29.077 ( -8.509 -5.313 -6.373) 11.885 29.338 ( 0.057 -1.989 0.660) 2.097 30.137 ( 2.574 2.436 -7.926) 8.682 30.962 ( 5.143 6.071 -12.899) 15.155 ======================= Grid point 72 (27/186) ======================= q-point: (-0.38 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.360 ( -8.026 8.761 6.056) 13.336 1.632 ( -13.542 14.134 -4.892) 20.176 1.808 ( -4.036 3.276 0.430) 5.216 2.202 ( -1.697 -1.787 -2.132) 3.259 2.408 ( -13.447 10.578 9.067) 19.363 2.723 ( -8.746 10.763 2.359) 14.067 3.276 ( -24.929 -2.589 -2.337) 25.171 3.830 ( 7.615 -0.082 -1.900) 7.849 4.320 ( -5.029 -5.557 39.468) 40.174 4.503 ( -2.790 1.438 5.644) 6.458 4.892 ( 3.510 -1.927 18.855) 19.275 5.125 ( 16.980 -4.581 15.762) 23.617 5.864 ( -4.732 0.216 -0.633) 4.779 5.985 ( -2.588 6.032 -1.722) 6.786 6.081 ( 2.999 7.024 3.858) 8.557 6.749 ( 4.414 -8.330 3.045) 9.907 7.134 ( -5.454 2.584 1.413) 6.198 7.347 ( -4.780 1.489 -6.639) 8.315 7.598 ( 1.317 -5.219 -1.066) 5.487 7.916 ( 5.996 -6.357 -4.663) 9.905 8.062 ( -1.450 -0.957 -3.463) 3.874 8.424 ( -2.821 -2.347 -1.209) 3.864 8.465 ( -3.662 -1.738 10.109) 10.891 8.704 ( -5.533 -1.963 -6.829) 9.006 8.972 ( 4.773 17.506 2.418) 18.306 9.204 ( 0.040 -7.122 -4.410) 8.377 10.032 ( -2.589 3.438 -1.190) 4.465 10.404 ( -12.582 -0.523 -4.725) 13.450 10.788 ( 11.055 2.796 -6.885) 13.320 10.889 ( -2.170 0.434 9.647) 9.898 11.354 ( 0.986 6.753 -4.433) 8.138 11.638 ( -2.473 0.578 6.369) 6.857 11.761 ( 4.434 -5.127 -3.121) 7.463 12.136 ( -0.213 -3.728 0.134) 3.737 12.249 ( 4.474 1.801 -15.526) 16.257 12.768 ( 5.805 6.609 -9.928) 13.264 13.505 ( 4.865 -1.792 -5.667) 7.680 13.639 ( 1.574 -2.243 0.892) 2.881 14.042 ( 2.464 -4.410 6.576) 8.292 14.572 ( -5.408 -0.457 8.339) 9.950 14.850 ( -1.274 0.091 9.118) 9.207 15.056 ( -1.096 -5.492 2.993) 6.350 15.779 ( -3.915 3.856 -0.806) 5.554 16.119 ( 3.981 6.617 1.347) 7.838 18.281 ( 0.708 -0.056 -4.034) 4.096 18.507 ( 4.692 -3.460 -4.002) 7.071 20.166 ( 2.569 6.434 -7.334) 10.089 20.412 ( 1.967 -4.843 -6.504) 8.344 25.574 ( -10.171 2.037 4.273) 11.218 25.851 ( 12.750 8.720 5.938) 16.549 26.655 ( -0.686 -1.032 -0.288) 1.273 26.810 ( -2.440 0.237 9.317) 9.634 27.706 ( 3.864 0.582 4.227) 5.756 28.364 ( -8.881 -8.324 13.924) 18.494 28.491 ( 1.750 -2.077 6.219) 6.786 28.684 ( -4.100 -0.015 0.162) 4.103 29.030 ( -10.198 -7.965 -8.583) 15.527 29.364 ( -0.318 -1.858 0.156) 1.892 30.049 ( 0.617 8.389 -7.511) 11.277 30.933 ( 4.641 0.621 -17.858) 18.462 ======================= Grid point 73 (28/186) ======================= q-point: (-0.25 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.033 ( -19.256 15.762 6.644) 25.757 1.173 ( -18.492 18.506 1.492) 26.203 1.677 ( -8.774 9.335 4.483) 13.573 2.025 ( -17.663 15.705 13.685) 27.312 2.230 ( 0.960 -2.999 0.240) 3.157 2.561 ( -1.810 4.574 3.076) 5.801 3.010 ( -28.685 -7.644 -2.440) 29.786 3.915 ( 6.719 -0.537 -3.998) 7.837 4.356 ( -6.351 1.378 23.043) 23.942 4.574 ( -5.135 -5.763 27.332) 28.401 4.985 ( 8.500 6.466 13.357) 17.102 5.460 ( 13.605 -6.502 13.109) 19.980 5.754 ( -8.625 3.915 3.789) 10.201 5.875 ( -2.637 3.132 -0.166) 4.098 6.057 ( 7.401 8.614 2.436) 11.615 6.903 ( 4.051 -4.447 -0.632) 6.049 7.069 ( -2.517 -0.066 2.450) 3.514 7.194 ( -6.844 4.495 -7.650) 11.206 7.691 ( -0.312 -7.550 -2.405) 7.930 8.010 ( -5.860 -9.883 -9.494) 14.905 8.081 ( 4.999 2.287 5.726) 7.938 8.332 ( -5.296 3.636 -6.486) 9.129 8.533 ( 0.885 -3.226 -0.147) 3.348 8.686 ( -5.602 -8.744 -2.717) 10.734 8.825 ( 8.357 15.914 2.288) 18.120 9.247 ( -2.015 -3.908 -8.440) 9.516 9.877 ( -4.257 12.096 -0.413) 12.829 10.199 ( -20.466 -2.792 -8.311) 22.264 10.787 ( 4.415 4.955 -4.163) 7.834 10.950 ( 3.330 0.509 7.961) 8.645 11.286 ( 2.667 4.692 -0.804) 5.456 11.626 ( -2.765 -0.719 5.252) 5.979 11.894 ( 6.899 -4.600 -3.498) 9.000 12.117 ( -0.407 0.043 -7.940) 7.951 12.406 ( 11.699 -10.992 10.390) 19.122 12.716 ( 5.347 4.690 -16.081) 17.584 13.566 ( 8.350 2.494 1.509) 8.844 13.704 ( 2.111 -6.866 -9.730) 12.094 14.211 ( 7.297 -3.534 17.449) 19.241 14.545 ( -5.657 -2.390 6.162) 8.700 14.888 ( 0.481 -0.754 11.000) 11.037 15.097 ( -5.719 -4.425 3.733) 8.137 15.646 ( -3.783 6.207 -3.845) 8.223 16.085 ( 10.353 12.231 6.745) 17.386 18.269 ( -3.087 -2.792 -4.867) 6.404 18.640 ( 8.464 -4.534 -4.090) 10.437 20.081 ( 3.888 7.779 -8.110) 11.891 20.467 ( 1.319 -3.163 -6.034) 6.939 25.445 ( -7.502 2.153 3.806) 8.683 25.883 ( 14.201 13.845 2.218) 19.956 26.660 ( -0.387 -0.621 0.468) 0.869 26.808 ( -2.633 0.102 10.404) 10.733 27.756 ( 2.395 0.285 3.660) 4.383 28.445 ( -17.055 -19.263 22.896) 34.441 28.533 ( -3.302 -2.189 3.867) 5.536 28.682 ( 3.061 -1.355 2.108) 3.956 28.964 ( -12.920 -7.924 -10.592) 18.491 29.380 ( -0.645 -1.528 -1.628) 2.324 29.907 ( -0.722 7.844 -5.202) 9.440 30.890 ( 3.062 3.841 -25.194) 25.668 ======================= Grid point 74 (29/186) ======================= q-point: (-0.12 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.612 ( -14.125 13.518 16.761) 25.753 0.752 ( -14.554 15.928 17.008) 27.473 1.325 ( -16.954 20.121 36.951) 45.362 1.801 ( -4.896 2.488 2.827) 6.177 2.305 ( 3.554 -3.176 -0.400) 4.783 2.539 ( 0.497 0.240 3.093) 3.142 2.705 ( -36.569 -7.424 -6.951) 37.957 3.962 ( 5.316 2.870 -9.622) 11.362 4.401 ( -4.581 -8.428 26.764) 28.431 4.634 ( -10.287 -1.889 31.493) 33.185 4.996 ( 6.483 14.219 11.286) 19.277 5.644 ( -5.113 -0.878 7.335) 8.984 5.684 ( 6.808 -1.903 4.040) 8.142 5.836 ( 0.703 2.476 5.097) 5.710 6.029 ( 4.883 7.718 2.025) 9.355 6.965 ( 2.315 -0.772 -2.134) 3.242 7.035 ( -0.058 4.368 -5.307) 6.874 7.099 ( -2.155 -3.489 -1.016) 4.225 7.760 ( -2.739 -5.898 -2.650) 7.022 7.994 ( -7.659 -4.177 -6.654) 10.972 8.127 ( 3.864 2.366 -0.746) 4.592 8.205 ( -6.064 -1.715 -2.758) 6.879 8.469 ( -6.393 4.352 -9.468) 12.225 8.614 ( 6.030 17.863 -6.231) 19.857 8.927 ( 1.885 -16.981 7.637) 18.715 9.243 ( 5.736 0.757 -6.629) 8.799 9.617 ( -4.105 17.980 1.314) 18.489 9.921 ( -19.822 0.287 -7.110) 21.060 10.758 ( 2.087 3.807 -1.608) 4.630 10.989 ( 1.145 1.056 6.984) 7.155 11.276 ( 2.514 2.433 1.723) 3.900 11.626 ( -1.865 -0.813 5.362) 5.735 11.991 ( 3.451 -1.787 -7.709) 8.633 12.122 ( 2.627 -1.992 -5.882) 6.743 12.648 ( 6.216 2.385 -24.158) 25.058 12.899 ( 6.134 -23.497 11.625) 26.924 13.777 ( 7.365 -6.516 -7.940) 12.639 13.868 ( 33.323 -9.621 17.647) 38.916 14.408 ( 6.430 -1.601 22.187) 23.155 14.568 ( -7.438 -13.248 12.183) 19.474 14.944 ( 1.455 0.570 11.413) 11.519 15.048 ( -10.035 -1.096 4.083) 10.889 15.521 ( 1.153 5.569 -7.756) 9.618 16.166 ( 28.057 11.935 19.201) 36.032 18.230 ( -7.826 -3.156 -6.701) 10.776 18.783 ( 7.620 -2.622 -2.752) 8.515 19.995 ( 5.126 9.092 -9.509) 14.120 20.486 ( 0.408 -1.209 -6.374) 6.501 25.364 ( -3.504 1.319 3.961) 5.450 25.815 ( 10.155 19.721 -1.601) 22.240 26.667 ( 1.100 0.136 -1.188) 1.625 26.832 ( 1.781 -0.014 13.085) 13.205 27.767 ( -3.612 -1.188 -1.332) 4.028 28.507 ( -26.324 -18.888 -2.212) 32.475 28.568 ( -24.598 -18.487 0.748) 30.780 28.783 ( -4.347 -4.194 1.016) 6.125 28.933 ( 8.399 -8.461 12.745) 17.452 29.376 ( -0.779 -0.532 -3.937) 4.048 29.827 ( 1.122 -0.852 3.974) 4.216 30.683 ( 8.699 23.483 -23.845) 34.579 ======================= Grid point 76 (30/186) ======================= q-point: ( 0.12 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 21.998 0.000 18.985) 29.057 1.155 ( 21.529 0.000 11.920) 24.609 1.839 ( 12.859 0.000 28.131) 30.930 1.931 ( 8.898 0.000 -0.614) 8.920 2.440 ( 7.887 0.000 11.615) 14.040 2.606 ( -1.510 -0.000 4.134) 4.401 2.979 ( 31.877 0.000 8.607) 33.019 3.847 ( -1.906 -0.000 -10.528) 10.699 4.407 ( -9.879 -0.000 27.067) 28.813 4.645 ( -1.931 -0.000 12.538) 12.686 4.723 ( -18.026 -0.000 33.762) 38.273 5.269 ( -21.038 -0.000 -5.448) 21.732 5.494 ( -7.638 -0.000 2.789) 8.131 5.921 ( 10.168 0.000 -0.997) 10.217 6.120 ( 0.721 0.000 6.149) 6.191 7.002 ( -2.227 -0.000 0.010) 2.227 7.068 ( 3.340 0.000 -7.246) 7.979 7.110 ( 2.267 0.000 -0.307) 2.288 7.603 ( -10.924 -0.000 -9.882) 14.731 7.804 ( 4.757 0.000 -4.767) 6.735 8.152 ( 0.995 0.000 -1.912) 2.156 8.363 ( -8.719 -0.000 2.277) 9.011 8.453 ( 7.634 0.000 0.092) 7.635 8.790 ( -1.186 -0.000 -7.061) 7.160 9.058 ( 7.812 0.000 -0.001) 7.812 9.398 ( 5.590 0.000 6.742) 8.758 9.830 ( 19.512 0.000 -3.178) 19.769 10.248 ( 23.750 0.000 -12.313) 26.752 10.682 ( -2.348 -0.000 -0.977) 2.544 10.963 ( -6.430 -0.000 6.691) 9.280 11.241 ( -5.461 -0.000 2.166) 5.875 11.701 ( 1.411 0.000 6.290) 6.447 11.799 ( -3.315 -0.000 -12.662) 13.089 12.114 ( -0.061 -0.000 -10.408) 10.408 12.597 ( 2.025 0.000 -20.056) 20.158 13.008 ( 2.735 0.000 -5.802) 6.414 13.573 ( -11.682 -0.000 -6.451) 13.345 14.132 ( -23.179 -0.000 11.595) 25.917 14.422 ( -30.874 -0.000 26.813) 40.892 14.486 ( -5.482 -0.000 1.066) 5.585 14.938 ( 1.552 0.000 15.056) 15.136 15.175 ( 13.178 0.000 -3.485) 13.631 15.362 ( -16.052 -0.000 7.761) 17.829 15.800 ( 2.817 0.000 6.614) 7.189 18.404 ( 3.936 0.000 -4.717) 6.143 18.811 ( -0.462 -0.000 -4.889) 4.911 19.974 ( 4.190 0.000 -5.604) 6.997 20.412 ( 0.046 0.000 -9.131) 9.132 25.523 ( 9.201 0.000 8.982) 12.858 25.738 ( -2.465 -0.000 10.159) 10.453 26.626 ( -0.773 -0.000 -3.432) 3.518 26.919 ( -10.785 -0.000 11.273) 15.601 27.496 ( 10.528 0.000 -5.141) 11.717 28.050 ( 6.322 0.000 6.494) 9.063 28.527 ( -0.168 -0.000 0.757) 0.776 28.694 ( -4.644 -0.000 -0.245) 4.651 29.109 ( -2.359 -0.000 0.520) 2.415 29.257 ( -5.757 -0.000 -3.764) 6.878 30.015 ( 4.029 0.000 -5.280) 6.641 31.496 ( 11.847 0.000 -17.804) 21.385 ======================= Grid point 77 (31/186) ======================= q-point: ( 0.25 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.372 ( 19.629 4.307 9.963) 22.430 1.523 ( 19.868 -7.260 9.113) 23.032 1.992 ( 5.869 2.494 4.587) 7.855 2.144 ( 10.760 -7.868 9.641) 16.451 2.518 ( -0.645 4.987 6.969) 8.594 2.668 ( 6.260 -6.745 8.879) 12.787 3.392 ( 29.155 2.297 6.997) 30.070 3.832 ( -3.610 -5.961 -3.540) 7.816 4.398 ( -6.040 0.246 24.061) 24.808 4.545 ( -11.059 7.267 26.229) 29.378 4.722 ( -7.634 -3.628 17.523) 19.455 4.892 ( -17.042 9.352 -4.097) 19.866 5.537 ( -8.452 -14.648 3.423) 17.254 6.050 ( 10.329 0.083 -2.521) 10.633 6.174 ( 2.903 -1.185 7.423) 8.058 6.875 ( -2.914 11.948 -3.996) 12.931 7.062 ( 1.333 -2.689 -0.198) 3.008 7.217 ( 3.906 -4.928 -5.490) 8.348 7.481 ( -8.421 -5.181 -7.381) 12.338 7.814 ( 1.255 3.550 -4.388) 5.782 8.164 ( -1.917 -2.561 -1.463) 3.517 8.243 ( -10.064 -2.415 3.054) 10.791 8.555 ( 7.299 2.123 0.424) 7.614 8.719 ( 0.146 1.861 -3.195) 3.700 9.160 ( 11.734 4.752 -1.825) 12.791 9.481 ( 5.342 1.269 4.680) 7.214 9.989 ( 13.245 6.195 -5.404) 15.589 10.451 ( 19.454 3.842 -6.233) 20.786 10.712 ( -2.166 -4.812 -3.680) 6.434 10.916 ( -8.033 -4.190 6.892) 11.384 11.212 ( -3.982 -5.460 3.316) 7.528 11.687 ( -0.820 2.952 -1.920) 3.615 11.781 ( -0.561 -3.329 -2.908) 4.456 12.052 ( 0.559 3.289 -10.208) 10.740 12.522 ( -3.936 0.048 -18.145) 18.567 13.024 ( 5.245 2.844 -1.582) 6.172 13.394 ( -11.615 -0.173 -6.326) 13.227 13.832 ( -24.160 6.296 36.922) 44.571 14.163 ( -9.949 3.291 -8.716) 13.630 14.485 ( -7.386 -6.099 5.395) 10.994 14.970 ( 1.156 4.661 12.540) 13.428 15.086 ( 3.809 10.469 -1.119) 11.197 15.525 ( 2.870 -14.673 -2.358) 15.136 15.914 ( 3.404 -5.758 5.224) 8.488 18.396 ( 2.422 3.811 -2.213) 5.028 18.743 ( -1.974 5.032 -4.723) 7.178 20.039 ( 3.818 -4.318 -6.056) 8.361 20.380 ( 0.625 0.568 -9.590) 9.627 25.692 ( 12.014 0.685 11.174) 16.421 25.750 ( -5.131 -2.399 9.407) 10.980 26.612 ( -0.205 -0.734 -3.817) 3.892 26.847 ( -5.789 0.524 8.801) 10.547 27.570 ( 2.448 -0.771 2.458) 3.554 28.166 ( 8.256 -0.495 1.493) 8.405 28.499 ( -0.675 3.348 0.578) 3.464 28.657 ( -4.323 -3.354 0.718) 5.519 29.073 ( -7.783 -2.311 -6.107) 10.159 29.187 ( -5.898 -3.520 2.015) 7.158 30.069 ( 7.599 -0.274 -6.359) 9.912 31.461 ( 6.541 11.429 -12.630) 18.246 ======================= Grid point 78 (32/186) ======================= q-point: ( 0.38 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( 16.274 6.800 5.213) 18.392 1.831 ( 10.480 -4.328 6.294) 12.968 2.001 ( 2.949 5.100 -0.164) 5.894 2.399 ( 6.396 -7.423 5.444) 11.209 2.410 ( -2.856 6.977 3.178) 8.182 2.875 ( 3.151 -6.788 4.395) 8.679 3.612 ( 10.122 4.022 -2.769) 11.238 3.927 ( 0.749 -6.863 20.049) 21.204 4.131 ( -21.909 14.596 8.849) 27.773 4.585 ( 7.883 -0.128 15.338) 17.246 4.634 ( -14.906 -1.140 22.783) 27.250 4.816 ( 5.567 -1.715 8.758) 10.518 5.660 ( -7.131 -15.014 3.576) 17.002 6.141 ( 8.321 2.061 -3.506) 9.261 6.260 ( 4.021 0.498 9.053) 9.918 6.650 ( -3.743 10.686 -4.174) 12.068 7.158 ( 3.753 -5.924 0.275) 7.018 7.265 ( 0.858 -0.409 -6.734) 6.800 7.475 ( -4.233 -7.804 -6.429) 10.961 7.706 ( -7.308 3.358 0.349) 8.050 8.143 ( -5.101 -4.412 -4.043) 7.863 8.260 ( -1.148 -5.538 3.837) 6.834 8.531 ( 2.785 9.229 0.773) 9.671 8.759 ( 4.610 -2.168 -3.493) 6.177 9.189 ( 8.069 8.432 -0.873) 11.703 9.522 ( 7.664 7.123 3.627) 11.074 9.991 ( 3.814 3.821 -5.372) 7.616 10.626 ( 13.829 0.229 -4.025) 14.405 10.640 ( -4.542 4.201 -1.311) 6.325 10.917 ( -6.154 -4.458 5.121) 9.163 11.339 ( 1.646 -10.476 4.616) 11.566 11.632 ( -0.366 2.149 -3.955) 4.516 11.781 ( -1.829 1.452 0.891) 2.499 12.004 ( 1.717 0.026 -8.645) 8.814 12.382 ( -6.841 0.571 -17.050) 18.380 13.020 ( 1.313 5.486 3.055) 6.415 13.300 ( -2.755 -4.712 -9.700) 11.130 13.681 ( -9.638 2.697 30.340) 31.948 13.974 ( -9.122 0.303 -16.017) 18.435 14.498 ( -6.509 -5.271 6.269) 10.462 14.960 ( 1.513 3.918 9.617) 10.494 15.011 ( 2.480 6.594 -0.645) 7.075 15.718 ( 4.702 -7.507 -3.013) 9.356 16.050 ( 2.923 -5.426 3.773) 7.227 18.370 ( 3.684 4.080 -1.365) 5.664 18.609 ( -3.445 6.623 -4.167) 8.549 20.135 ( 3.521 -5.904 -6.558) 9.501 20.346 ( 1.143 1.349 -9.307) 9.474 25.714 ( -7.851 -0.506 8.123) 11.309 25.878 ( 14.120 2.832 12.022) 18.759 26.613 ( 0.079 -1.297 -3.412) 3.651 26.816 ( -3.470 -0.046 7.945) 8.670 27.615 ( -0.285 -2.138 5.656) 6.054 28.253 ( 4.100 0.296 0.887) 4.205 28.455 ( -0.231 2.159 3.253) 3.912 28.670 ( -2.950 -4.144 0.219) 5.091 28.936 ( -14.938 -3.758 -7.898) 17.310 29.211 ( -3.172 -5.659 1.959) 6.777 30.160 ( 9.494 -0.259 -7.918) 12.365 31.307 ( 5.188 14.989 -10.036) 18.769 ======================= Grid point 79 (33/186) ======================= q-point: (-0.50 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 11.064 9.652 4.446) 15.341 1.913 ( 1.203 5.372 1.364) 5.672 1.942 ( -0.426 5.811 -1.940) 6.141 2.248 ( -4.957 5.878 -0.528) 7.708 2.552 ( 2.089 -0.219 5.892) 6.256 2.903 ( -5.550 0.774 0.298) 5.611 3.437 ( -19.817 12.875 -0.037) 23.632 3.855 ( 0.757 2.852 1.957) 3.541 4.129 ( -1.133 -6.489 33.809) 34.445 4.549 ( -11.372 -0.493 18.471) 21.697 4.756 ( 7.257 -3.257 11.779) 14.213 5.045 ( 17.473 -3.334 11.995) 21.454 5.771 ( -4.759 -9.638 2.057) 10.944 6.172 ( 5.228 5.368 -4.770) 8.883 6.272 ( 2.879 8.158 8.268) 11.967 6.546 ( -0.434 -2.887 0.052) 2.920 7.196 ( -7.128 1.774 -3.199) 8.012 7.284 ( 3.159 -4.080 -1.458) 5.362 7.518 ( 0.718 -4.184 -4.483) 6.174 7.622 ( -8.626 -7.174 -0.429) 11.228 8.135 ( -1.339 -2.547 -5.874) 6.541 8.348 ( -0.810 -6.189 4.244) 7.548 8.426 ( -0.026 7.710 1.979) 7.960 8.795 ( 3.003 3.500 -6.044) 7.603 9.151 ( 4.244 6.437 1.123) 7.791 9.482 ( 9.564 16.282 1.901) 18.978 9.989 ( -1.634 -3.650 -1.785) 4.379 10.466 ( -11.396 2.891 -3.496) 12.266 10.808 ( 13.700 0.333 2.393) 13.911 10.911 ( -1.140 0.004 0.672) 1.323 11.468 ( -0.717 -2.137 1.342) 2.624 11.621 ( 2.696 -2.807 -3.588) 5.293 11.720 ( -1.385 4.527 4.555) 6.570 12.031 ( 1.452 -3.766 -5.139) 6.535 12.255 ( -3.520 -1.076 -16.735) 17.135 12.946 ( -0.168 5.372 -1.119) 5.490 13.356 ( 1.637 -6.693 -7.053) 9.860 13.629 ( -8.181 1.647 4.243) 9.362 13.899 ( -0.330 -5.539 1.390) 5.720 14.505 ( -5.938 -4.106 5.597) 9.135 14.927 ( -1.473 5.062 9.194) 10.599 15.007 ( 5.160 1.487 0.042) 5.370 15.814 ( 2.229 -1.396 -2.927) 3.935 16.155 ( 3.066 -2.727 3.092) 5.138 18.369 ( 4.601 4.527 -1.676) 6.669 18.481 ( -1.854 2.576 -4.037) 5.135 20.238 ( 3.329 -6.046 -6.459) 9.452 20.304 ( 1.316 2.415 -8.858) 9.275 25.627 ( -8.586 1.554 6.624) 10.955 26.046 ( 15.336 5.490 10.849) 19.572 26.623 ( 0.111 -1.301 -2.362) 2.699 26.809 ( -2.919 -0.362 8.425) 8.924 27.660 ( -2.416 -3.380 7.111) 8.236 28.267 ( -1.307 0.654 2.670) 3.044 28.460 ( 0.011 -0.026 6.262) 6.262 28.673 ( -3.986 -1.260 -0.147) 4.183 28.787 ( -14.917 -8.188 -9.315) 19.399 29.257 ( -2.443 -5.328 0.782) 5.913 30.234 ( 8.741 2.963 -9.030) 12.912 31.136 ( 4.946 13.376 -10.086) 17.467 ======================= Grid point 80 (34/186) ======================= q-point: (-0.38 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 1.440 17.122 4.656) 17.802 1.688 ( -10.627 17.229 -1.736) 20.317 1.839 ( 0.569 6.580 -3.540) 7.493 2.200 ( 3.535 0.869 1.727) 4.029 2.472 ( -6.660 10.824 8.374) 15.219 2.769 ( -7.468 6.664 5.766) 11.551 2.997 ( -22.081 9.609 -0.059) 24.081 3.886 ( 2.510 -1.029 2.038) 3.393 4.309 ( -4.781 -6.151 37.133) 37.942 4.491 ( -6.699 0.406 16.484) 17.798 4.932 ( 4.636 -6.301 5.677) 9.665 5.362 ( 18.707 -2.112 11.009) 21.809 5.800 ( -4.332 -1.785 0.813) 4.755 6.064 ( -0.296 10.068 0.316) 10.078 6.258 ( 6.731 6.167 1.594) 9.268 6.671 ( 2.082 -10.408 3.711) 11.244 7.061 ( -9.203 0.311 -0.513) 9.222 7.281 ( -5.345 1.664 -1.417) 5.775 7.579 ( 3.731 -2.067 -2.828) 5.117 7.667 ( -6.556 -13.474 -6.776) 16.446 8.148 ( 2.190 -1.458 -3.720) 4.556 8.356 ( 0.394 2.176 2.738) 3.519 8.427 ( -1.413 -3.319 2.811) 4.573 8.689 ( -1.872 8.281 -4.312) 9.523 9.163 ( 5.185 0.875 -0.691) 5.304 9.341 ( 7.282 19.185 -0.381) 20.524 10.003 ( -5.758 -2.122 4.415) 7.560 10.259 ( -10.915 4.110 -4.273) 12.421 10.878 ( -1.915 0.379 0.754) 2.093 10.978 ( 12.640 2.263 0.086) 12.841 11.423 ( -0.618 3.724 -1.744) 4.158 11.654 ( -1.147 2.614 3.500) 4.516 11.746 ( 4.265 -5.019 1.814) 6.832 12.076 ( -0.765 -2.949 -4.685) 5.588 12.238 ( 4.710 -4.094 -11.008) 12.654 12.877 ( 3.424 5.312 -9.744) 11.614 13.434 ( -4.239 -8.188 -3.920) 10.019 13.521 ( -4.622 -4.210 -10.841) 12.515 14.074 ( 6.961 -6.667 14.783) 17.648 14.497 ( -5.012 -2.433 3.059) 6.356 14.892 ( -0.299 2.408 8.681) 9.014 15.054 ( 2.490 0.229 3.367) 4.194 15.793 ( -0.474 3.874 -3.895) 5.514 16.226 ( 4.012 -0.017 3.417) 5.270 18.300 ( -1.349 4.608 -3.965) 6.227 18.524 ( 6.863 -3.319 -2.288) 7.959 20.250 ( 2.324 4.452 -7.699) 9.192 20.335 ( 2.143 -6.056 -6.965) 9.476 25.515 ( -7.382 2.661 5.519) 9.593 26.184 ( 16.489 8.015 6.193) 19.351 26.637 ( 0.673 -1.046 -0.820) 1.490 26.807 ( -3.159 -0.325 9.660) 10.169 27.676 ( -9.886 -5.079 7.833) 13.597 28.220 ( -7.104 1.117 6.414) 9.636 28.469 ( -4.578 -2.214 3.635) 6.251 28.638 ( -0.858 -2.157 1.833) 2.958 28.739 ( -8.058 -7.671 -6.749) 13.012 29.300 ( -1.385 -4.317 -0.430) 4.554 30.211 ( 5.914 9.743 -7.816) 13.820 31.014 ( 5.284 7.789 -13.021) 16.066 ======================= Grid point 81 (35/186) ======================= q-point: (-0.25 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( -1.523 26.070 5.778) 26.746 1.315 ( -5.275 21.037 5.340) 22.336 1.716 ( -2.828 7.370 -2.199) 8.195 2.167 ( -9.727 19.421 17.134) 27.665 2.288 ( 7.175 2.396 6.085) 9.708 2.626 ( -3.887 8.842 6.538) 11.664 2.643 ( -19.755 0.505 -0.737) 19.775 3.951 ( 2.618 -2.439 2.357) 4.284 4.373 ( -5.569 1.310 21.010) 21.775 4.523 ( -7.313 -4.542 30.974) 32.149 5.063 ( 1.105 -5.322 0.060) 5.436 5.595 ( 6.881 -1.451 1.990) 7.308 5.717 ( -5.196 2.443 3.698) 6.830 5.970 ( 3.681 8.393 8.040) 12.191 6.246 ( 4.335 6.750 -0.720) 8.054 6.855 ( 0.875 -10.719 1.058) 10.806 6.984 ( -3.458 -1.561 -1.581) 4.110 7.150 ( -6.905 3.254 -0.009) 7.633 7.628 ( 1.713 -1.668 -3.815) 4.502 7.761 ( -2.192 -12.101 -7.138) 14.219 8.185 ( 1.993 0.046 -3.484) 4.014 8.346 ( 1.278 7.236 -4.994) 8.884 8.445 ( -0.959 -6.533 8.801) 11.003 8.566 ( -5.182 1.246 -2.003) 5.694 9.152 ( 2.870 15.755 -4.192) 16.554 9.239 ( 9.687 1.840 -1.379) 9.956 9.870 ( -16.507 3.003 5.156) 17.552 10.099 ( 0.007 7.832 -0.795) 7.872 10.847 ( -0.179 1.232 -3.904) 4.098 11.057 ( 5.287 3.570 3.009) 7.053 11.386 ( 2.794 4.124 2.985) 5.807 11.619 ( -1.560 1.699 4.807) 5.332 11.874 ( 2.785 -6.301 -2.448) 7.311 12.062 ( -1.645 -1.791 -7.232) 7.630 12.423 ( 11.334 -9.827 1.626) 15.089 12.797 ( 4.696 6.727 -18.960) 20.659 13.490 ( -5.605 -15.536 -4.388) 17.089 13.575 ( 1.636 -7.398 -4.919) 9.033 14.307 ( 7.091 -5.333 17.074) 19.242 14.466 ( -4.183 -0.707 0.135) 4.244 14.909 ( -0.645 -0.971 7.438) 7.529 15.071 ( -1.532 1.463 8.166) 8.437 15.695 ( 0.441 6.525 -6.290) 9.074 16.296 ( 5.602 0.068 4.517) 7.197 18.216 ( -2.309 2.063 -4.606) 5.550 18.671 ( 7.139 -4.865 -1.644) 8.794 20.190 ( 3.138 5.274 -8.078) 10.145 20.405 ( 1.110 -4.530 -6.787) 8.235 25.421 ( -4.263 2.625 5.116) 7.158 26.258 ( 13.324 10.674 -4.185) 17.578 26.668 ( 2.996 -0.226 -0.784) 3.105 26.822 ( -0.133 -0.950 12.843) 12.879 27.568 ( -27.322 -8.532 6.976) 29.461 28.113 ( -8.828 2.760 9.721) 13.418 28.469 ( -2.448 -3.390 2.550) 4.898 28.720 ( -0.439 -2.485 0.637) 2.602 28.751 ( 2.634 -7.059 4.174) 8.613 29.334 ( -0.541 -2.826 -2.053) 3.535 30.080 ( 3.249 13.388 -4.140) 14.385 30.953 ( 6.095 4.369 -17.040) 18.618 ======================= Grid point 82 (36/186) ======================= q-point: (-0.12 0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.948 ( 8.640 25.704 8.787) 28.506 1.004 ( -1.783 21.276 14.443) 25.777 1.609 ( 4.862 12.339 20.734) 24.614 1.882 ( -3.407 14.415 16.569) 22.224 2.321 ( -5.876 3.357 7.624) 10.194 2.455 ( 4.859 1.668 0.149) 5.139 2.585 ( 0.650 2.216 5.924) 6.359 4.011 ( 2.257 -0.144 -3.368) 4.057 4.356 ( -5.002 -0.342 19.666) 20.295 4.577 ( -10.547 -3.099 33.213) 34.985 5.070 ( -7.246 0.288 1.151) 7.343 5.502 ( -13.938 -2.630 -1.479) 14.261 5.775 ( 6.578 0.543 0.371) 6.611 5.939 ( 0.404 7.095 8.973) 11.446 6.164 ( -0.638 7.370 0.107) 7.398 6.930 ( -6.333 -7.390 -5.826) 11.343 7.013 ( 5.125 1.044 1.467) 5.431 7.092 ( 2.045 -0.179 0.078) 2.054 7.661 ( -0.201 -4.258 -4.524) 6.216 7.906 ( 6.083 -8.127 -3.837) 10.853 8.096 ( -5.433 5.107 -8.952) 11.651 8.297 ( 6.965 3.615 3.745) 8.695 8.428 ( -5.602 3.751 -4.242) 7.965 8.660 ( 2.947 -13.561 4.032) 14.451 8.948 ( -0.575 13.298 -1.402) 13.384 9.356 ( 10.917 -0.264 -3.754) 11.548 9.629 ( -11.344 6.322 5.029) 13.927 10.009 ( 7.169 11.250 0.189) 13.341 10.813 ( 0.232 2.178 -3.504) 4.132 11.053 ( 0.512 3.714 5.542) 6.691 11.363 ( 1.372 5.680 3.978) 7.069 11.616 ( -0.538 -0.995 5.107) 5.231 11.944 ( -0.675 -3.669 -8.249) 9.053 12.064 ( -0.637 -4.364 -5.551) 7.089 12.687 ( 6.907 2.413 -25.337) 26.372 12.762 ( 6.367 -11.893 5.753) 14.666 13.645 ( 0.029 -10.598 -12.686) 16.530 13.810 ( 0.278 -27.950 20.215) 34.495 14.395 ( -3.840 -0.152 -6.818) 7.827 14.517 ( 3.862 -3.470 21.146) 21.774 14.927 ( -2.724 -1.338 4.114) 5.112 15.027 ( -6.440 2.931 11.740) 13.707 15.616 ( 4.464 5.504 -6.200) 9.416 16.371 ( -3.751 -2.436 3.953) 5.969 18.168 ( 1.403 0.182 -3.494) 3.770 18.789 ( 1.509 -4.207 -1.578) 4.740 20.119 ( 2.267 6.448 -9.537) 11.733 20.438 ( 0.153 -2.654 -7.245) 7.717 25.383 ( 0.182 1.763 5.448) 5.730 26.130 ( -2.529 15.273 -10.830) 18.894 26.678 ( -0.074 0.644 -2.524) 2.606 26.989 ( 16.547 -3.497 6.689) 18.187 27.301 ( -33.865 -6.906 11.353) 36.379 28.019 ( -5.333 3.371 13.050) 14.495 28.495 ( -1.900 -2.749 1.541) 3.680 28.738 ( -1.238 -2.172 1.751) 3.052 28.988 ( 11.031 -7.726 10.332) 16.974 29.344 ( -0.588 -0.939 -4.224) 4.367 29.953 ( 3.561 7.927 1.460) 8.812 30.952 ( 13.487 1.882 -16.659) 21.517 ======================= Grid point 85 (37/186) ======================= q-point: ( 0.25 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( 16.853 0.000 1.695) 16.938 1.727 ( 18.943 0.000 11.156) 21.984 2.142 ( 7.921 0.000 -3.513) 8.666 2.203 ( 6.312 0.000 13.521) 14.922 2.538 ( -4.512 -0.000 0.580) 4.550 2.743 ( 8.555 0.000 11.194) 14.088 3.715 ( -3.801 -0.000 -5.914) 7.030 3.758 ( 17.929 0.000 12.791) 22.024 4.376 ( -16.125 -0.000 32.905) 36.644 4.653 ( -15.881 -0.000 10.283) 18.919 4.654 ( 8.499 0.000 20.682) 22.360 4.769 ( -3.159 -0.000 -1.991) 3.735 5.330 ( -8.175 -0.000 6.749) 10.601 6.172 ( 9.687 0.000 -4.381) 10.632 6.258 ( 7.316 0.000 7.632) 10.572 6.958 ( -0.889 -0.000 1.483) 1.729 7.020 ( -4.174 -0.000 -8.890) 9.821 7.189 ( 6.005 0.000 -1.689) 6.238 7.329 ( -6.306 -0.000 -3.333) 7.132 7.872 ( 3.271 0.000 -8.049) 8.688 7.981 ( -17.677 -0.000 3.735) 18.067 8.180 ( -1.002 -0.000 0.940) 1.374 8.675 ( 8.559 0.000 0.650) 8.584 8.744 ( 3.235 0.000 -3.873) 5.046 9.326 ( 10.472 0.000 -4.043) 11.225 9.553 ( 4.249 0.000 2.334) 4.848 10.211 ( 12.772 0.000 -9.479) 15.905 10.582 ( -5.871 -0.000 -4.061) 7.139 10.707 ( 10.948 0.000 -4.832) 11.967 10.831 ( 0.322 0.000 7.576) 7.583 11.152 ( -0.842 -0.000 9.212) 9.250 11.661 ( -2.546 -0.000 -10.137) 10.452 11.754 ( -1.517 -0.000 6.643) 6.814 12.040 ( 0.587 0.000 -13.206) 13.219 12.388 ( -8.352 -0.000 -14.659) 16.872 13.099 ( 0.388 0.000 3.803) 3.823 13.229 ( -5.884 -0.000 -7.370) 9.431 13.712 ( -19.378 -0.000 39.994) 44.441 14.002 ( -12.861 -0.000 -11.311) 17.127 14.403 ( -1.463 -0.000 -1.961) 2.447 15.049 ( 0.124 0.000 10.761) 10.761 15.170 ( -4.143 -0.000 -0.109) 4.144 15.525 ( 16.755 0.000 -7.936) 18.540 15.957 ( 4.835 0.000 7.007) 8.513 18.432 ( 0.715 0.000 -0.253) 0.758 18.733 ( -2.863 -0.000 -6.417) 7.027 20.035 ( 3.597 0.000 -6.791) 7.685 20.364 ( 1.624 0.000 -9.563) 9.699 25.700 ( -5.953 -0.000 9.979) 11.619 25.920 ( 15.328 0.000 13.956) 20.729 26.593 ( 0.294 0.000 -4.199) 4.209 26.814 ( -4.149 -0.000 6.518) 7.727 27.579 ( -2.132 -0.000 8.149) 8.423 28.270 ( 8.210 0.000 -3.242) 8.827 28.531 ( 0.089 0.000 -0.654) 0.660 28.556 ( -5.938 -0.000 2.206) 6.335 28.886 ( -14.880 -0.000 -7.002) 16.445 29.118 ( -2.954 -0.000 4.340) 5.250 30.152 ( 9.739 0.000 -8.163) 12.707 31.552 ( 3.229 0.000 -12.269) 12.687 ======================= Grid point 86 (38/186) ======================= q-point: ( 0.38 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( 13.630 5.006 0.997) 14.554 1.961 ( 11.108 0.454 6.544) 12.900 2.129 ( 3.320 7.428 -1.014) 8.199 2.361 ( -0.132 -3.023 3.181) 4.390 2.486 ( 1.313 -0.157 3.792) 4.016 2.880 ( 5.044 -0.957 4.557) 6.865 3.642 ( -5.283 1.090 -1.376) 5.567 3.972 ( 3.009 -2.655 21.635) 22.004 4.143 ( -15.679 13.973 15.256) 25.958 4.477 ( -14.551 -3.623 15.528) 21.586 4.776 ( 3.711 3.126 10.939) 11.966 4.947 ( 20.160 -3.485 10.212) 22.866 5.371 ( -7.316 -14.248 8.690) 18.222 6.248 ( 6.571 0.996 -5.644) 8.719 6.389 ( 9.461 0.963 8.184) 12.546 6.750 ( -5.430 13.693 -2.463) 14.935 7.099 ( -0.158 -9.964 -0.918) 10.007 7.237 ( -3.735 1.084 -5.038) 6.364 7.325 ( 5.322 -4.720 -0.595) 7.138 7.696 ( -10.103 7.399 1.454) 12.607 7.958 ( -4.735 -8.362 -4.804) 10.743 8.194 ( -1.483 -3.440 2.832) 4.696 8.693 ( 4.615 8.146 -2.634) 9.726 8.822 ( 8.576 -1.236 -4.860) 9.934 9.381 ( 6.846 6.300 -2.802) 9.717 9.637 ( 5.996 -2.558 2.077) 6.842 10.158 ( 2.989 13.741 -9.015) 16.704 10.493 ( -9.790 -1.222 -5.662) 11.375 10.763 ( -2.227 -5.468 5.324) 7.950 10.952 ( 15.321 4.557 2.318) 16.152 11.277 ( 4.433 -7.227 10.226) 13.283 11.601 ( -2.672 -1.207 -7.969) 8.491 11.754 ( -3.441 -1.293 5.805) 6.871 11.984 ( -0.340 0.354 -15.797) 15.804 12.233 ( -8.352 -0.207 -10.125) 13.127 13.017 ( -9.222 0.072 2.311) 9.507 13.260 ( 7.370 -0.161 -3.172) 8.025 13.659 ( -12.596 -0.551 32.257) 34.633 13.801 ( -7.801 -0.670 -17.300) 18.989 14.398 ( -2.318 -2.775 -1.091) 3.777 15.056 ( -0.088 3.416 9.158) 9.775 15.102 ( -0.265 3.605 -0.910) 3.727 15.728 ( 12.656 -3.497 -7.580) 15.161 16.060 ( 4.078 -2.637 6.981) 8.504 18.434 ( 1.429 0.969 0.710) 1.867 18.631 ( -3.669 5.002 -6.813) 9.214 20.077 ( 2.689 -4.042 -8.471) 9.764 20.354 ( 2.661 0.870 -8.502) 8.951 25.650 ( -7.130 0.260 8.818) 11.343 26.153 ( 15.601 2.165 14.963) 21.725 26.591 ( 0.766 -0.765 -3.703) 3.858 26.793 ( -3.113 -0.589 5.368) 6.233 27.583 ( -4.061 -1.573 10.213) 11.103 28.320 ( 3.666 1.952 -4.856) 6.390 28.484 ( -1.563 1.487 4.458) 4.953 28.560 ( -4.772 -4.825 -2.061) 7.092 28.683 ( -13.550 -0.801 -3.601) 14.043 29.125 ( -2.105 -3.173 3.224) 4.990 30.250 ( 9.993 -0.407 -9.842) 14.032 31.485 ( 2.680 8.460 -11.204) 14.293 ======================= Grid point 87 (39/186) ======================= q-point: (-0.50 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( 7.736 8.794 1.316) 11.786 2.027 ( -0.773 8.710 -3.111) 9.281 2.037 ( 5.033 5.728 2.283) 7.960 2.301 ( 0.116 5.666 4.198) 7.052 2.562 ( -1.374 -2.548 2.538) 3.850 2.899 ( 0.337 4.531 1.277) 4.720 3.419 ( -14.629 14.588 2.037) 20.759 3.895 ( -3.338 3.585 8.396) 9.720 4.142 ( -2.255 -5.042 30.363) 30.861 4.455 ( -10.182 -4.032 23.726) 26.132 4.811 ( 1.902 -0.696 3.354) 3.919 5.304 ( 22.948 -2.475 7.764) 24.352 5.541 ( -4.982 -16.108 7.298) 18.372 6.275 ( 4.394 2.553 -5.772) 7.690 6.500 ( 0.026 13.174 1.964) 13.320 6.513 ( 3.641 -0.343 5.606) 6.693 7.089 ( -10.780 1.208 -2.071) 11.044 7.260 ( 1.661 -9.247 -3.409) 9.994 7.394 ( -4.300 2.099 3.928) 6.191 7.572 ( 3.085 0.089 -0.805) 3.189 7.990 ( -4.665 -7.582 -4.317) 9.894 8.259 ( -1.038 -6.381 4.061) 7.635 8.597 ( 3.802 10.917 -3.451) 12.064 8.899 ( 8.518 3.580 -9.422) 13.196 9.322 ( 3.638 9.512 0.551) 10.199 9.772 ( 9.768 1.842 4.302) 10.831 9.945 ( -4.714 8.995 -5.906) 11.748 10.337 ( -11.066 1.543 -3.495) 11.707 10.825 ( -2.106 -3.576 5.593) 6.965 11.071 ( 13.245 4.410 -1.782) 14.073 11.427 ( -0.491 -3.728 5.412) 6.590 11.584 ( 0.105 -3.492 -5.244) 6.301 11.748 ( -2.612 -0.443 4.739) 5.429 11.964 ( 1.317 -5.413 -11.834) 13.080 12.143 ( -2.367 -1.303 -7.084) 7.582 12.933 ( -5.395 -0.662 0.369) 5.448 13.327 ( 3.847 0.721 -2.212) 4.496 13.487 ( -13.552 1.227 -10.272) 17.050 13.864 ( 3.790 -7.626 14.143) 16.509 14.405 ( -3.240 -3.598 -0.445) 4.862 15.019 ( -0.554 5.343 7.774) 9.449 15.079 ( 1.907 1.523 1.211) 2.725 15.850 ( 7.126 0.561 -6.457) 9.633 16.167 ( 2.866 -3.109 5.893) 7.253 18.463 ( 3.654 0.219 0.856) 3.760 18.479 ( -3.424 5.680 -7.406) 9.942 20.147 ( 1.808 -6.389 -9.863) 11.890 20.345 ( 3.319 2.108 -6.830) 7.881 25.575 ( -7.100 1.516 7.242) 10.254 26.343 ( 13.591 3.907 12.097) 18.610 26.606 ( 1.296 -1.088 -2.382) 2.922 26.786 ( -3.171 -1.097 6.203) 7.052 27.575 ( -7.926 -1.872 10.331) 13.155 28.300 ( 1.028 2.402 -2.752) 3.794 28.430 ( -9.297 -1.348 -1.067) 9.455 28.527 ( -4.966 -3.258 2.844) 6.585 28.625 ( -0.288 -1.604 0.683) 1.767 29.166 ( -1.663 -4.714 1.932) 5.359 30.333 ( 8.432 0.406 -11.199) 14.024 31.332 ( 2.694 12.514 -10.946) 16.842 ======================= Grid point 88 (40/186) ======================= q-point: (-0.38 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( 2.387 14.751 3.229) 15.288 1.841 ( -2.308 14.926 0.826) 15.126 1.957 ( 1.352 9.894 -3.922) 10.729 2.321 ( 6.983 2.331 6.928) 10.109 2.522 ( -5.111 2.354 2.170) 6.031 2.752 ( -7.542 10.928 0.091) 13.278 3.046 ( -8.329 17.366 7.718) 20.749 3.894 ( -1.422 -1.024 10.037) 10.188 4.289 ( -3.932 -6.025 30.962) 31.787 4.469 ( -7.596 -1.449 25.911) 27.040 4.875 ( 0.347 -6.110 -3.682) 7.142 5.581 ( 13.509 0.056 4.626) 14.279 5.684 ( -5.670 -8.182 3.978) 10.720 6.228 ( 4.473 7.931 -1.585) 9.243 6.377 ( -0.673 2.392 -2.010) 3.196 6.604 ( 1.545 -1.434 8.545) 8.801 6.950 ( -5.372 -0.173 -2.568) 5.957 7.253 ( -8.390 4.873 6.094) 11.457 7.402 ( -0.606 -12.132 -4.218) 12.859 7.649 ( 6.480 1.485 -2.583) 7.132 8.039 ( -2.164 -8.053 -1.266) 8.434 8.351 ( -0.782 -6.005 2.393) 6.511 8.494 ( 3.501 8.852 -1.292) 9.606 8.829 ( 3.068 12.742 -7.601) 15.150 9.282 ( 6.773 4.576 -2.290) 8.488 9.654 ( 0.070 17.102 -3.602) 17.478 9.909 ( -4.499 -0.817 8.043) 9.252 10.195 ( -4.422 0.996 -1.157) 4.678 10.827 ( -3.975 -1.986 -2.000) 4.873 11.156 ( 8.967 3.403 -1.616) 9.726 11.425 ( -2.210 -0.765 1.337) 2.694 11.656 ( 2.118 -4.423 -2.472) 5.492 11.742 ( -1.719 -0.791 4.885) 5.238 12.009 ( -0.456 -2.159 -8.394) 8.679 12.212 ( 7.854 -6.774 -2.211) 10.605 12.912 ( 1.080 -1.170 -4.848) 5.102 13.205 ( -12.736 -1.076 -14.882) 19.618 13.419 ( 0.599 -3.189 -3.622) 4.863 14.107 ( 6.862 -8.907 15.992) 19.549 14.410 ( -3.193 -3.362 -1.761) 4.960 14.968 ( -0.474 4.793 7.774) 9.145 15.095 ( 0.539 0.531 4.605) 4.667 15.851 ( 2.988 4.640 -6.192) 8.295 16.251 ( 1.236 -2.693 4.842) 5.676 18.331 ( -1.977 5.919 -8.095) 10.221 18.548 ( 4.301 -3.706 0.561) 5.704 20.217 ( 1.173 -5.708 -10.663) 12.152 20.335 ( 3.469 2.263 -5.173) 6.627 25.492 ( -5.202 2.266 6.076) 8.313 26.450 ( 6.956 4.324 3.073) 8.748 26.648 ( 4.001 -1.222 0.092) 4.184 26.782 ( -4.187 -1.604 8.354) 9.481 27.477 ( -14.596 0.634 9.568) 17.464 28.260 ( 0.597 4.879 0.815) 4.982 28.376 ( -2.845 -2.892 2.194) 4.612 28.551 ( -2.396 -5.476 2.551) 6.499 28.668 ( 2.220 -1.875 3.985) 4.932 29.222 ( -0.888 -4.986 0.569) 5.096 30.353 ( 5.448 4.419 -10.826) 12.899 31.154 ( 2.467 11.470 -12.398) 17.069 ======================= Grid point 89 (41/186) ======================= q-point: (-0.25 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( -2.360 19.692 3.801) 20.194 1.631 ( 5.886 19.798 3.176) 20.898 1.824 ( 3.746 9.182 -0.687) 9.940 2.372 ( -7.117 0.743 7.982) 10.720 2.399 ( 1.641 14.070 9.237) 16.911 2.531 ( -0.232 5.590 -0.590) 5.626 2.816 ( 1.852 14.490 10.943) 18.252 3.939 ( -1.753 -2.732 10.967) 11.437 4.399 ( -2.442 -1.561 22.009) 22.199 4.487 ( -8.349 -1.742 30.778) 31.938 4.935 ( -3.840 -7.498 -6.259) 10.495 5.528 ( -16.106 3.315 -4.327) 17.003 5.752 ( 5.360 -2.320 3.919) 7.033 6.202 ( 5.137 10.266 8.965) 14.566 6.322 ( -2.295 2.969 -2.998) 4.803 6.655 ( -6.449 -9.564 0.457) 11.544 6.986 ( 8.084 -2.126 -2.575) 8.747 7.140 ( -3.031 3.692 8.023) 9.338 7.572 ( 2.728 -12.985 -3.989) 13.855 7.648 ( 0.926 1.941 -4.138) 4.664 8.128 ( 0.265 -4.748 -2.815) 5.527 8.392 ( -1.759 -1.528 -0.902) 2.499 8.456 ( 2.393 1.932 4.196) 5.202 8.639 ( 1.414 13.973 -0.473) 14.052 9.289 ( 4.313 6.943 -11.875) 14.416 9.426 ( -2.866 8.742 1.536) 9.327 9.797 ( -5.445 7.136 7.514) 11.706 10.195 ( 3.248 1.789 2.194) 4.309 10.799 ( -2.605 -2.539 -5.410) 6.519 11.164 ( 1.823 4.236 -0.096) 4.613 11.454 ( 1.761 -1.929 3.879) 4.676 11.676 ( 0.664 4.934 3.050) 5.839 11.778 ( -2.095 -6.300 -0.477) 6.656 11.991 ( -0.682 -2.032 -9.095) 9.344 12.439 ( 10.360 -8.449 0.928) 13.401 12.872 ( 2.649 6.256 -20.965) 22.039 13.161 ( -5.671 -17.000 -2.379) 18.078 13.471 ( -0.408 -5.574 -2.093) 5.968 14.349 ( 4.737 -5.811 8.085) 11.026 14.406 ( -2.022 -3.360 2.660) 4.738 14.932 ( -1.542 2.506 7.520) 8.075 15.092 ( -3.213 1.630 8.783) 9.493 15.782 ( 2.677 6.152 -6.607) 9.416 16.303 ( -1.611 -2.705 3.884) 5.000 18.219 ( -0.519 3.776 -7.940) 8.807 18.653 ( 1.443 -5.166 0.121) 5.365 20.238 ( 1.794 0.680 -9.307) 9.503 20.347 ( 1.947 -1.938 -5.975) 6.577 25.438 ( -1.502 2.044 5.720) 6.257 26.391 ( -5.999 5.461 -4.324) 9.193 26.694 ( 0.574 0.398 -1.699) 1.837 26.822 ( -1.768 -5.998 9.127) 11.064 27.317 ( -6.770 4.513 10.765) 13.494 28.189 ( 0.179 7.290 5.439) 9.098 28.413 ( -0.763 -2.571 2.500) 3.667 28.638 ( 1.431 -5.542 3.070) 6.495 28.789 ( 7.329 -5.696 8.945) 12.891 29.277 ( -0.298 -3.961 -1.157) 4.138 30.265 ( 2.086 10.383 -7.597) 13.033 31.017 ( 2.661 5.520 -15.181) 16.371 ======================= Grid point 90 (42/186) ======================= q-point: (-0.12 0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( -3.920 18.106 4.680) 19.107 1.445 ( 12.049 22.251 3.672) 25.569 1.844 ( 8.804 3.096 3.776) 10.068 2.199 ( 1.093 17.708 17.900) 25.203 2.331 ( 0.270 1.576 11.799) 11.907 2.564 ( 6.496 1.746 3.470) 7.568 2.790 ( 14.388 8.670 6.571) 18.037 3.985 ( -3.459 -2.914 8.845) 9.934 4.414 ( -0.452 4.698 13.567) 14.365 4.520 ( -10.082 -3.101 32.592) 34.256 4.925 ( -9.610 -5.033 -1.474) 10.948 5.231 ( -22.725 -0.665 -3.922) 23.071 5.852 ( 5.204 -1.033 0.610) 5.340 6.088 ( -3.518 11.583 6.947) 13.957 6.230 ( -2.321 5.010 2.968) 6.269 6.706 ( -5.749 -10.063 -5.152) 12.683 7.119 ( 8.225 1.505 -0.391) 8.371 7.123 ( 3.033 0.635 3.209) 4.461 7.602 ( -1.362 -1.207 -4.615) 4.961 7.843 ( 9.240 -13.986 -4.808) 17.439 8.093 ( -1.577 4.305 -8.426) 9.593 8.363 ( -2.242 0.301 -0.446) 2.305 8.426 ( -3.946 5.352 7.761) 10.220 8.648 ( 11.323 -3.029 4.500) 12.556 9.071 ( -5.582 12.812 -5.563) 15.042 9.370 ( -4.204 -1.539 -0.941) 4.575 9.737 ( 8.602 6.330 4.177) 11.468 10.199 ( 5.613 5.306 -1.311) 7.835 10.793 ( -1.268 -1.796 -2.880) 3.623 11.116 ( -1.833 3.308 3.450) 5.119 11.484 ( 0.584 5.781 4.133) 7.130 11.616 ( -0.972 0.842 2.423) 2.743 11.825 ( -2.773 -6.061 -4.101) 7.826 11.993 ( 0.831 -1.967 -7.422) 7.723 12.654 ( 4.854 -6.558 -13.709) 15.953 12.771 ( 3.972 0.583 -9.212) 10.049 13.405 ( 1.470 -18.512 -3.932) 18.982 13.557 ( -3.946 -10.732 9.899) 15.124 14.332 ( -3.201 0.037 -10.204) 10.694 14.558 ( 2.146 -4.720 15.987) 16.807 14.914 ( -1.805 0.160 6.468) 6.717 15.014 ( -8.560 4.117 10.496) 14.156 15.726 ( 3.981 5.293 -4.284) 7.888 16.276 ( -8.765 1.047 2.460) 9.164 18.181 ( 3.170 -0.479 -5.898) 6.713 18.707 ( -3.422 -4.685 -0.506) 5.824 20.187 ( 1.390 4.991 -7.898) 9.446 20.379 ( 1.036 -2.896 -7.646) 8.241 25.446 ( 3.034 1.155 6.281) 7.070 26.138 ( -14.545 8.232 -2.597) 16.914 26.671 ( -0.908 0.875 -1.866) 2.252 26.887 ( -7.688 -6.125 8.881) 13.248 27.337 ( 12.674 2.597 4.154) 13.588 28.117 ( 0.794 7.118 9.011) 11.510 28.436 ( -1.616 -2.796 0.402) 3.254 28.716 ( 0.542 -1.688 4.462) 4.802 29.055 ( 10.860 -7.621 8.783) 15.910 29.304 ( -0.539 -1.773 -3.583) 4.034 30.105 ( 0.600 10.462 -3.419) 11.023 30.995 ( 6.224 -3.432 -14.782) 16.402 ======================= Grid point 94 (43/186) ======================= q-point: ( 0.38 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( 6.770 0.000 0.658) 6.802 2.114 ( 7.292 0.000 2.632) 7.752 2.217 ( 1.153 0.000 -5.252) 5.377 2.363 ( 0.940 0.000 7.556) 7.614 2.498 ( 1.389 0.000 3.070) 3.370 2.969 ( 5.662 0.000 2.240) 6.089 3.577 ( -6.373 -0.000 2.683) 6.915 4.034 ( -4.836 -0.000 27.516) 27.937 4.187 ( -11.966 -0.000 29.074) 31.440 4.267 ( -8.447 -0.000 -7.226) 11.116 4.864 ( 0.801 0.000 13.729) 13.752 5.151 ( 3.379 0.000 3.011) 4.526 5.307 ( 14.810 0.000 14.546) 20.759 6.289 ( 3.370 0.000 -7.461) 8.186 6.533 ( 5.021 0.000 7.112) 8.705 6.812 ( -4.119 -0.000 -1.240) 4.302 6.977 ( -0.029 -0.000 5.301) 5.301 7.151 ( -7.836 -0.000 -5.483) 9.563 7.459 ( 15.890 0.000 -0.105) 15.891 7.612 ( -13.123 -0.000 7.050) 14.896 7.829 ( -1.996 -0.000 -9.537) 9.744 8.159 ( -1.541 -0.000 3.877) 4.172 8.830 ( 3.686 0.000 -2.215) 4.300 8.876 ( 10.403 0.000 -10.665) 14.898 9.494 ( 4.634 0.000 -2.038) 5.062 9.692 ( 6.406 0.000 2.055) 6.727 10.228 ( -4.377 -0.000 -10.798) 11.651 10.340 ( -9.030 -0.000 -5.584) 10.617 10.737 ( 1.605 0.000 8.549) 8.699 11.176 ( 11.791 0.000 1.110) 11.843 11.329 ( 4.463 0.000 11.583) 12.413 11.513 ( -3.170 -0.000 -9.135) 9.669 11.714 ( -4.641 -0.000 7.380) 8.718 11.868 ( -5.764 -0.000 -20.132) 20.941 12.146 ( -2.048 -0.000 -2.736) 3.418 12.917 ( -6.356 -0.000 2.119) 6.700 13.368 ( 8.197 0.000 0.656) 8.223 13.518 ( -16.949 -0.000 -4.746) 17.601 13.737 ( 0.635 0.000 13.183) 13.199 14.345 ( -1.963 -0.000 -3.799) 4.276 15.106 ( -0.366 -0.000 7.353) 7.362 15.109 ( -0.978 -0.000 0.412) 1.062 15.851 ( 13.098 0.000 -9.303) 16.066 16.115 ( 2.865 0.000 8.301) 8.781 18.451 ( 0.208 0.000 1.447) 1.462 18.595 ( -3.355 -0.000 -8.109) 8.776 20.044 ( 2.034 0.000 -10.539) 10.734 20.373 ( 3.636 0.000 -7.378) 8.225 25.595 ( -6.806 -0.000 8.118) 10.594 26.398 ( 11.671 0.000 15.623) 19.501 26.589 ( 1.540 0.000 -3.102) 3.463 26.766 ( -2.594 -0.000 2.875) 3.872 27.555 ( -4.899 -0.000 11.774) 12.753 28.334 ( -0.060 -0.000 -5.803) 5.804 28.374 ( -12.239 -0.000 -5.207) 13.301 28.525 ( 1.112 0.000 8.156) 8.231 28.599 ( -1.402 -0.000 1.120) 1.794 29.092 ( -1.673 -0.000 3.202) 3.613 30.325 ( 8.363 0.000 -11.653) 14.343 31.528 ( 1.746 0.000 -12.037) 12.163 ======================= Grid point 95 (44/186) ======================= q-point: (-0.50 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( 1.835 3.105 0.551) 3.648 2.123 ( 0.605 5.731 -1.764) 6.027 2.192 ( 4.057 5.869 0.547) 7.156 2.384 ( -0.011 1.088 5.978) 6.077 2.522 ( -0.416 0.165 1.600) 1.662 2.999 ( 2.457 4.422 0.460) 5.079 3.451 ( -7.991 8.939 2.505) 12.249 3.951 ( -6.517 6.996 18.279) 20.628 4.146 ( -3.012 -2.665 23.334) 23.678 4.318 ( -7.688 -10.165 14.875) 19.588 4.856 ( -0.971 5.083 8.665) 10.092 5.285 ( -3.355 -15.542 10.524) 19.067 5.582 ( 18.724 -0.096 4.144) 19.177 6.303 ( 2.567 -0.944 -7.446) 7.932 6.467 ( -11.369 4.221 4.077) 12.794 6.783 ( 8.028 8.960 5.889) 13.394 6.982 ( -5.830 1.435 -1.858) 6.285 7.101 ( -2.925 -8.913 -0.411) 9.390 7.442 ( -5.969 7.233 7.298) 11.883 7.680 ( 14.072 0.172 -0.747) 14.093 7.811 ( -4.570 -7.413 -4.820) 9.953 8.192 ( -0.096 -4.023 4.836) 6.291 8.769 ( 2.860 9.402 -4.601) 10.851 8.999 ( 10.166 -1.184 -13.532) 16.966 9.470 ( 0.177 6.740 0.435) 6.756 9.803 ( 1.841 -3.274 4.026) 5.507 10.065 ( 0.169 9.333 -6.796) 11.547 10.224 ( -6.902 0.494 -3.334) 7.681 10.786 ( -1.436 -0.406 4.514) 4.754 11.251 ( 6.288 3.718 -1.138) 7.393 11.368 ( -5.989 -2.704 -0.618) 6.600 11.499 ( 0.364 -5.442 -5.961) 8.080 11.693 ( -4.115 -1.212 5.408) 6.903 11.847 ( 3.991 -7.578 -10.579) 13.612 12.139 ( 2.554 0.589 0.868) 2.761 12.873 ( -2.838 -0.078 3.760) 4.712 13.260 ( -15.241 1.354 -17.920) 23.563 13.434 ( 4.687 3.170 2.305) 6.109 13.874 ( 4.952 -6.490 16.666) 18.558 14.320 ( -2.456 -2.274 -4.341) 5.482 15.095 ( -0.224 2.801 4.854) 5.609 15.111 ( 0.090 0.798 3.864) 3.946 15.944 ( 7.867 2.004 -8.332) 11.634 16.179 ( 0.572 -1.956 7.414) 7.689 18.452 ( -1.483 0.035 -3.254) 3.577 18.515 ( 0.145 2.786 -4.524) 5.315 20.058 ( 1.784 -4.072 -11.583) 12.407 20.389 ( 3.769 1.107 -6.287) 7.413 25.536 ( -5.779 0.824 6.680) 8.871 26.527 ( 2.441 1.534 10.410) 10.802 26.612 ( 2.649 -1.066 -0.779) 2.960 26.748 ( -2.804 -0.729 2.496) 3.824 27.522 ( -6.060 1.494 11.306) 12.914 28.266 ( -3.702 -1.935 -0.425) 4.199 28.325 ( 0.335 -1.331 -3.254) 3.532 28.544 ( 0.290 3.186 7.236) 7.912 28.620 ( 1.185 -1.750 3.520) 4.106 29.102 ( -1.417 -2.819 2.489) 4.019 30.376 ( 5.612 -0.692 -13.117) 14.284 31.455 ( 1.583 7.224 -12.717) 14.711 ======================= Grid point 96 (45/186) ======================= q-point: (-0.38 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.959 ( -2.342 7.770 -2.166) 8.399 2.034 ( 3.192 9.811 0.918) 10.358 2.117 ( 2.253 10.711 2.478) 11.222 2.347 ( -8.068 0.254 4.667) 9.324 2.547 ( 5.432 0.445 2.924) 6.185 2.893 ( -0.479 12.485 -0.074) 12.495 3.203 ( -4.354 13.469 3.404) 14.559 3.917 ( -2.500 1.349 18.776) 18.990 4.263 ( -2.347 -6.089 25.188) 26.020 4.407 ( -8.123 -7.318 23.263) 25.705 4.805 ( -1.757 1.228 -0.656) 2.242 5.465 ( -8.230 -12.462 5.263) 15.835 5.717 ( 2.706 2.650 1.288) 4.001 6.314 ( -5.054 -0.616 -2.510) 5.676 6.345 ( 6.033 0.445 -1.566) 6.249 6.654 ( -11.072 7.343 6.979) 15.007 6.992 ( 11.522 2.860 -2.274) 12.087 7.195 ( -2.125 -7.129 6.292) 9.743 7.328 ( -1.423 3.625 2.705) 4.741 7.726 ( -0.539 1.319 -3.209) 3.511 7.939 ( 6.096 -6.622 2.339) 9.299 8.282 ( 0.829 -5.092 4.421) 6.794 8.647 ( 1.581 9.786 -3.164) 10.405 9.014 ( 6.838 8.898 -13.544) 17.589 9.372 ( -3.069 3.073 0.236) 4.349 9.703 ( -9.277 7.240 -3.379) 12.243 10.043 ( 6.993 9.060 5.178) 12.561 10.165 ( 1.340 -1.704 -0.422) 2.209 10.728 ( -5.635 -0.689 -4.917) 7.510 11.274 ( 3.091 3.161 -0.376) 4.437 11.322 ( -6.478 -6.663 -4.420) 10.290 11.611 ( 4.564 -6.606 -0.341) 8.037 11.693 ( -2.601 -2.720 3.760) 5.320 11.942 ( 1.377 -3.353 -12.283) 12.807 12.248 ( 9.059 -4.616 5.419) 11.522 12.876 ( -1.411 -2.137 4.936) 5.561 13.002 ( -9.970 1.509 -22.509) 24.665 13.433 ( 1.526 2.795 1.425) 3.489 14.119 ( 6.541 -9.418 15.498) 19.279 14.312 ( -2.723 -3.412 -5.337) 6.895 15.051 ( -1.546 4.952 7.201) 8.875 15.122 ( 0.453 0.725 4.571) 4.650 15.934 ( 2.753 4.645 -6.672) 8.583 16.225 ( -2.095 -2.836 5.182) 6.268 18.359 ( -0.611 5.279 -10.768) 12.008 18.535 ( 0.891 -2.714 1.455) 3.206 20.114 ( 1.840 -6.224 -11.301) 13.032 20.391 ( 3.300 2.260 -5.471) 6.777 25.483 ( -3.328 1.135 5.455) 6.490 26.486 ( -8.468 2.057 2.835) 9.164 26.675 ( 2.405 -2.403 1.528) 3.727 26.725 ( -3.361 -0.609 2.556) 4.266 27.448 ( -3.915 4.213 10.503) 11.975 28.291 ( 1.754 -0.264 0.256) 1.793 28.397 ( 6.812 -2.341 4.374) 8.427 28.517 ( -0.398 1.724 5.908) 6.167 28.686 ( 2.096 -2.480 6.681) 7.429 29.148 ( -0.772 -4.677 1.494) 4.970 30.388 ( 2.377 -0.115 -13.335) 13.545 31.292 ( 1.028 11.678 -13.902) 18.185 ======================= Grid point 97 (46/186) ======================= q-point: (-0.25 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -6.560 14.206 -3.026) 15.937 1.927 ( 3.014 10.956 -2.049) 11.547 2.020 ( 2.718 10.262 6.291) 12.340 2.262 ( -7.906 -2.163 5.244) 9.731 2.608 ( 3.428 4.999 4.496) 7.546 2.741 ( 9.350 12.890 4.101) 16.444 3.049 ( 2.921 9.017 5.203) 10.812 3.941 ( -2.899 0.590 20.048) 20.265 4.401 ( -2.971 -5.206 25.058) 25.765 4.470 ( -7.018 -3.269 26.549) 27.655 4.769 ( -4.207 -2.702 -7.297) 8.846 5.296 ( -24.239 2.968 -4.731) 24.874 5.768 ( 2.486 -4.967 4.099) 6.903 6.260 ( -5.300 -0.241 -5.133) 7.382 6.404 ( 0.694 8.442 7.843) 11.544 6.486 ( -5.239 -4.275 0.780) 6.806 7.120 ( 14.125 1.279 -2.554) 14.411 7.229 ( 2.235 5.336 9.609) 11.216 7.412 ( 2.548 -13.778 -1.351) 14.076 7.663 ( -2.940 2.784 -1.532) 4.329 8.089 ( 4.096 -4.009 0.264) 5.738 8.351 ( -0.329 -1.908 3.153) 3.700 8.540 ( 0.296 6.128 1.094) 6.232 8.870 ( 3.908 14.033 -5.104) 15.435 9.303 ( -7.147 -2.234 -4.258) 8.614 9.451 ( -7.043 12.052 -5.896) 15.153 9.968 ( 4.503 10.921 6.350) 13.411 10.250 ( 5.143 -1.339 -0.611) 5.350 10.702 ( -1.318 -4.234 -5.053) 6.722 11.203 ( -4.719 2.641 -0.556) 5.436 11.383 ( -0.698 -7.630 -3.055) 8.249 11.692 ( -3.235 -2.163 5.558) 6.784 11.754 ( 3.966 -0.052 1.293) 4.172 11.934 ( 1.786 -1.899 -10.699) 11.012 12.449 ( 7.452 -6.374 -1.873) 9.983 12.784 ( -8.777 -2.790 -19.258) 21.347 13.018 ( 8.621 -5.996 3.297) 11.006 13.425 ( 0.110 -0.308 0.701) 0.774 14.296 ( -3.028 -2.594 -7.844) 8.799 14.375 ( 4.836 -8.731 14.978) 17.999 14.977 ( -3.560 4.496 7.891) 9.755 15.113 ( -2.237 2.960 7.346) 8.230 15.868 ( 1.517 4.791 -5.454) 7.416 16.237 ( -4.571 -2.837 3.045) 6.182 18.251 ( 1.302 5.046 -10.662) 11.867 18.583 ( -1.995 -3.915 0.904) 4.486 20.184 ( 1.856 -5.473 -10.124) 11.658 20.373 ( 2.601 2.899 -5.358) 6.624 25.470 ( 0.480 0.511 5.126) 5.173 26.287 ( -17.003 3.333 0.259) 17.329 26.693 ( -0.569 0.649 -0.781) 1.164 26.752 ( -0.551 -3.686 5.613) 6.737 27.421 ( 3.327 3.150 7.843) 9.083 28.298 ( 2.012 3.353 2.236) 4.505 28.420 ( -0.560 3.812 4.990) 6.304 28.644 ( 6.774 -3.712 6.391) 10.025 28.825 ( 7.837 -7.474 9.920) 14.686 29.212 ( -0.103 -4.673 -0.090) 4.675 30.337 ( -0.669 3.253 -11.242) 11.722 31.089 ( 0.360 10.451 -15.639) 18.813 ======================= Grid point 98 (47/186) ======================= q-point: (-0.12 0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( -5.339 14.000 -0.147) 14.984 1.826 ( 7.353 12.109 -0.465) 14.175 1.935 ( -2.028 3.705 3.219) 5.311 2.258 ( -2.491 -3.045 5.588) 6.833 2.531 ( 0.844 9.388 7.683) 12.160 2.817 ( 16.689 7.790 8.075) 20.110 3.082 ( 13.777 3.452 3.791) 14.700 3.960 ( -4.131 0.631 20.732) 21.150 4.434 ( -16.020 -3.110 25.399) 30.190 4.534 ( 2.050 2.442 15.726) 16.046 4.699 ( -10.166 -4.557 -5.977) 12.643 4.954 ( -19.415 1.357 2.826) 19.667 5.876 ( 2.895 -3.373 1.660) 4.745 6.138 ( -6.405 3.982 -2.922) 8.088 6.284 ( -5.776 4.385 9.569) 12.006 6.537 ( 0.222 -4.073 -2.908) 5.009 7.218 ( 2.606 4.159 4.679) 6.781 7.252 ( 10.352 2.174 -3.780) 11.233 7.554 ( -3.278 0.248 1.136) 3.478 7.721 ( 7.542 -15.231 -6.035) 18.036 8.114 ( 0.859 3.089 -6.028) 6.828 8.358 ( -0.183 0.883 3.199) 3.324 8.481 ( -3.532 4.741 9.404) 11.108 8.796 ( 8.086 2.858 0.266) 8.580 9.150 ( -7.138 14.730 -7.262) 17.907 9.245 ( -7.515 -5.402 -0.617) 9.276 9.947 ( 7.578 5.961 2.597) 9.985 10.311 ( 7.234 1.818 -4.040) 8.482 10.733 ( -1.296 -2.937 -1.537) 3.559 11.109 ( -6.164 1.218 2.368) 6.715 11.468 ( 0.032 -6.592 -4.096) 7.761 11.662 ( -2.743 4.389 2.203) 5.625 11.736 ( -2.189 0.041 1.932) 2.920 11.986 ( 4.816 -0.956 -5.650) 7.485 12.547 ( -0.293 -5.077 -19.131) 19.795 12.746 ( 1.875 -5.727 -4.813) 7.712 13.269 ( 10.035 -9.753 -0.392) 13.999 13.457 ( -1.223 -3.737 6.273) 7.403 14.239 ( -5.024 -0.746 -9.634) 10.891 14.565 ( 1.923 -5.191 13.124) 14.244 14.911 ( -4.075 1.138 7.188) 8.340 15.020 ( -6.488 6.317 8.488) 12.411 15.821 ( 2.313 3.793 -2.479) 5.087 16.203 ( -5.571 -0.124 0.728) 5.620 18.201 ( 3.470 1.181 -7.840) 8.654 18.593 ( -4.631 -3.732 -0.032) 5.947 20.220 ( 1.810 -0.361 -8.039) 8.248 20.351 ( 1.971 0.861 -6.870) 7.199 25.523 ( 4.893 -0.614 6.111) 7.853 26.023 ( -16.016 3.813 2.111) 16.599 26.672 ( -0.343 1.102 -1.461) 1.862 26.803 ( -2.263 -2.655 7.881) 8.619 27.492 ( 7.537 0.074 2.422) 7.917 28.264 ( 1.656 6.940 7.624) 10.441 28.397 ( -0.798 -0.526 1.479) 1.761 28.733 ( 1.304 -0.451 4.891) 5.082 29.107 ( 8.969 -7.141 7.991) 13.975 29.262 ( 0.895 -2.880 -2.495) 3.914 30.207 ( -1.992 7.351 -7.609) 10.765 30.964 ( 2.428 0.251 -15.145) 15.340 ======================= Grid point 103 (48/186) ======================= q-point: (-0.50 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( -2.669 -0.000 1.062) 2.873 2.156 ( -0.731 -0.000 -1.899) 2.035 2.279 ( 3.705 0.000 0.312) 3.718 2.409 ( -0.098 -0.000 5.884) 5.885 2.518 ( -2.902 -0.000 1.370) 3.209 3.038 ( -1.801 -0.000 -0.570) 1.889 3.466 ( -2.444 -0.000 2.032) 3.178 4.004 ( -9.793 -0.000 30.083) 31.637 4.161 ( 1.777 0.000 -3.914) 4.299 4.174 ( -6.129 -0.000 24.933) 25.675 4.956 ( -0.967 -0.000 14.773) 14.804 5.137 ( -5.041 -0.000 10.747) 11.870 5.765 ( 6.141 0.000 0.915) 6.209 6.289 ( 1.553 0.000 -8.519) 8.659 6.374 ( -8.948 -0.000 9.482) 13.038 6.816 ( -12.021 -0.000 -5.419) 13.186 7.015 ( -0.597 -0.000 7.479) 7.503 7.057 ( 13.392 0.000 -0.475) 13.401 7.481 ( -1.681 -0.000 9.883) 10.025 7.649 ( -7.251 -0.000 -7.399) 10.360 7.882 ( 14.289 0.000 4.062) 14.855 8.191 ( 1.618 0.000 5.795) 6.016 8.851 ( 0.827 0.000 -5.218) 5.283 9.049 ( 8.491 0.000 -14.628) 16.913 9.472 ( -7.147 -0.000 -0.681) 7.179 9.793 ( -4.860 -0.000 2.601) 5.512 10.112 ( 3.362 0.000 -4.443) 5.572 10.197 ( 4.840 0.000 -3.480) 5.961 10.798 ( -2.057 -0.000 3.561) 4.113 11.158 ( -13.557 -0.000 -13.404) 19.065 11.329 ( 0.928 0.000 0.896) 1.290 11.467 ( 4.237 0.000 -2.930) 5.151 11.675 ( -3.215 -0.000 8.696) 9.272 11.834 ( 7.562 0.000 -11.730) 13.956 12.207 ( 6.381 0.000 4.153) 7.614 12.886 ( 1.073 0.000 8.364) 8.433 13.009 ( -15.319 -0.000 -19.505) 24.802 13.518 ( 1.938 0.000 3.055) 3.618 13.946 ( 5.949 0.000 15.007) 16.143 14.258 ( -1.835 -0.000 -6.416) 6.674 15.131 ( 1.984 0.000 2.763) 3.401 15.132 ( -1.492 -0.000 6.542) 6.710 16.010 ( 4.081 0.000 -8.858) 9.753 16.174 ( -3.252 -0.000 7.775) 8.428 18.421 ( -1.085 -0.000 -5.631) 5.734 18.527 ( 1.302 0.000 -3.552) 3.783 20.010 ( 1.835 0.000 -12.358) 12.493 20.423 ( 3.679 0.000 -5.786) 6.857 25.499 ( -4.189 -0.000 5.252) 6.719 26.516 ( -10.507 -0.000 7.359) 12.828 26.632 ( 2.797 0.000 -0.284) 2.811 26.723 ( -1.602 -0.000 0.716) 1.754 27.512 ( -4.415 -0.000 10.721) 11.595 28.289 ( 8.364 0.000 5.796) 10.176 28.316 ( 1.552 0.000 -1.472) 2.139 28.608 ( 0.120 0.000 1.982) 1.985 28.633 ( 1.616 0.000 10.694) 10.816 29.073 ( -1.364 -0.000 2.266) 2.645 30.370 ( 2.124 0.000 -14.519) 14.673 31.477 ( 1.475 0.000 -14.491) 14.566 ======================= Grid point 104 (49/186) ======================= q-point: (-0.38 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( -5.356 3.230 -0.543) 6.278 2.101 ( -4.760 2.043 -1.526) 5.400 2.297 ( 1.200 7.984 4.712) 9.348 2.303 ( -4.371 6.452 0.925) 7.848 2.563 ( 0.182 -6.794 3.294) 7.553 2.961 ( -6.689 1.683 -0.527) 6.917 3.369 ( 2.518 12.589 -0.549) 12.850 3.991 ( -2.852 1.985 25.455) 25.691 4.232 ( -5.855 -6.251 25.682) 27.072 4.253 ( -0.715 -8.242 4.862) 9.596 4.885 ( -1.727 9.343 10.525) 14.179 5.202 ( -10.993 -10.140 5.295) 15.865 5.710 ( -9.681 1.333 6.168) 11.556 6.262 ( -1.336 1.009 -6.541) 6.752 6.384 ( -0.075 -2.877 5.208) 5.951 6.626 ( -5.204 6.212 -2.147) 8.383 7.093 ( -0.058 -7.987 5.432) 9.659 7.204 ( 13.849 3.542 -1.179) 14.343 7.420 ( -0.902 7.409 5.228) 9.113 7.629 ( -3.844 -6.328 1.437) 7.542 8.032 ( 8.163 1.091 4.587) 9.427 8.268 ( 2.993 -3.277 5.925) 7.403 8.767 ( -0.822 8.136 -4.407) 9.289 9.093 ( 2.542 -1.986 -13.466) 13.847 9.314 ( -10.412 5.580 -1.273) 11.882 9.672 ( -8.044 3.495 -2.736) 9.187 10.191 ( 8.060 -1.693 -3.570) 8.977 10.261 ( 8.535 5.971 1.294) 10.496 10.675 ( -4.806 5.941 -4.877) 9.065 11.070 ( -8.372 -10.930 -9.961) 16.993 11.316 ( -2.079 1.298 3.488) 4.263 11.587 ( 7.727 -6.945 -1.339) 10.475 11.663 ( -3.002 -0.160 7.519) 8.098 11.891 ( 4.834 -2.035 -14.644) 15.555 12.328 ( 8.208 -2.001 2.043) 8.692 12.751 ( -12.818 0.738 -18.203) 22.275 12.965 ( 5.174 -0.334 11.615) 12.720 13.500 ( -0.917 3.803 2.877) 4.856 14.126 ( 5.722 -7.165 13.634) 16.431 14.227 ( -1.101 -1.752 -8.001) 8.264 15.106 ( -2.854 3.363 6.950) 8.231 15.169 ( 2.674 1.083 4.480) 5.329 15.977 ( -1.070 2.824 -6.940) 7.568 16.155 ( -6.090 -2.511 5.225) 8.408 18.381 ( 1.114 2.400 -9.694) 10.049 18.530 ( 1.046 0.460 -1.180) 1.643 20.022 ( 1.877 -4.434 -11.845) 12.786 20.439 ( 3.263 1.372 -5.295) 6.370 25.475 ( -1.826 -0.050 3.911) 4.317 26.344 ( -17.642 1.021 3.234) 17.965 26.678 ( 2.179 -1.302 1.404) 2.900 26.709 ( -0.593 0.133 1.266) 1.404 27.489 ( -2.284 1.458 9.132) 9.525 28.333 ( 3.134 1.044 0.324) 3.319 28.503 ( 14.060 -3.172 8.924) 16.952 28.589 ( 0.761 3.371 5.041) 6.112 28.700 ( 0.931 -1.860 9.920) 10.135 29.089 ( -0.774 -3.278 1.812) 3.825 30.333 ( -1.087 -1.204 -14.807) 14.895 31.389 ( 1.142 7.514 -16.423) 18.096 ======================= Grid point 105 (50/186) ======================= q-point: (-0.25 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( -8.307 9.879 -2.845) 13.217 1.987 ( -6.221 3.303 -0.443) 7.058 2.077 ( -12.162 4.150 5.263) 13.887 2.274 ( 3.351 6.029 0.048) 6.898 2.646 ( -2.727 -2.904 4.144) 5.749 2.891 ( -3.901 -3.607 0.607) 5.348 3.274 ( 12.428 12.322 0.205) 17.502 4.013 ( -3.511 2.572 23.901) 24.294 4.317 ( -11.921 -7.128 24.811) 28.434 4.391 ( 1.075 -7.703 8.059) 11.200 4.785 ( -0.505 6.621 5.804) 8.819 5.027 ( -21.524 3.861 4.370) 22.300 5.715 ( -0.480 -6.904 8.194) 10.726 6.183 ( -5.255 1.452 -5.884) 8.021 6.332 ( -12.341 -0.875 3.944) 12.986 6.588 ( 8.366 5.342 0.708) 9.951 7.236 ( -2.686 -8.172 -1.134) 8.677 7.295 ( 10.252 0.629 -2.752) 10.633 7.401 ( 8.300 2.048 7.015) 11.059 7.656 ( -1.068 1.324 5.937) 6.176 8.115 ( 4.306 -1.105 2.171) 4.947 8.356 ( 1.550 -1.206 5.779) 6.104 8.620 ( -2.762 7.099 -1.502) 7.764 9.049 ( 2.160 8.436 -12.794) 15.476 9.098 ( -15.365 -2.292 1.315) 15.591 9.504 ( -4.896 7.940 -6.827) 11.560 10.168 ( -0.653 10.450 0.223) 10.473 10.316 ( 10.694 -0.109 -3.964) 11.405 10.645 ( 2.717 -2.677 -3.293) 5.039 11.069 ( -8.511 -6.234 -4.763) 11.575 11.300 ( -1.484 -2.656 1.251) 3.290 11.654 ( -2.739 -0.780 5.027) 5.778 11.774 ( 3.981 -4.387 -0.047) 5.924 11.924 ( 6.825 -1.750 -10.152) 12.358 12.431 ( 2.106 -2.474 -11.059) 11.527 12.587 ( -4.371 -4.233 -12.445) 13.853 13.122 ( 10.857 -1.622 13.316) 17.257 13.449 ( -0.637 2.274 1.941) 3.057 14.193 ( -2.865 -2.018 -7.841) 8.588 14.364 ( 4.982 -8.659 12.097) 15.689 15.017 ( -5.253 5.513 7.627) 10.778 15.176 ( 0.436 4.493 6.259) 7.717 15.893 ( -2.563 1.811 -4.481) 5.471 16.130 ( -6.748 -4.002 2.088) 8.118 18.313 ( 2.950 5.351 -11.515) 13.036 18.529 ( -1.078 -0.472 -0.105) 1.181 20.087 ( 1.883 -6.669 -10.270) 12.390 20.430 ( 2.839 2.818 -5.197) 6.558 25.493 ( 1.567 -1.380 3.621) 4.180 26.098 ( -18.771 1.851 2.045) 18.973 26.692 ( -0.511 0.211 -0.104) 0.563 26.744 ( 1.189 -1.491 5.483) 5.805 27.497 ( 1.648 0.268 6.272) 6.490 28.359 ( 2.979 1.410 1.667) 3.693 28.515 ( -1.057 6.629 7.186) 9.834 28.713 ( 3.189 -0.565 6.025) 6.840 28.876 ( 13.159 -8.003 11.734) 19.362 29.149 ( 0.297 -4.841 0.851) 4.924 30.273 ( -3.604 -1.308 -13.381) 13.920 31.195 ( 0.161 12.311 -18.325) 22.077 ======================= Grid point 106 (51/186) ======================= q-point: (-0.12 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -8.045 10.589 0.091) 13.299 1.876 ( -4.623 0.397 -3.736) 5.957 1.955 ( -8.498 -0.778 6.608) 10.793 2.238 ( 0.732 2.223 -0.203) 2.349 2.604 ( -5.441 1.578 4.720) 7.374 2.937 ( -3.647 -7.013 -0.485) 7.919 3.362 ( 19.711 6.052 1.114) 20.649 3.978 ( -13.257 -1.415 14.463) 19.671 4.229 ( -16.246 4.018 23.675) 28.993 4.529 ( 0.168 -7.888 1.822) 8.098 4.724 ( 2.045 10.908 15.498) 19.062 4.819 ( -8.278 -1.388 15.574) 17.692 5.852 ( 2.694 -6.030 3.816) 7.627 6.070 ( -6.016 0.569 -5.112) 7.915 6.216 ( -9.935 -1.279 4.549) 11.002 6.605 ( 5.562 5.666 1.910) 8.166 7.240 ( -3.399 -2.286 -0.012) 4.096 7.388 ( 6.362 1.823 -5.078) 8.342 7.598 ( -1.774 4.345 2.514) 5.324 7.619 ( 11.853 -7.751 2.610) 14.400 8.153 ( 1.188 2.915 -4.129) 5.192 8.393 ( 1.561 0.071 7.536) 7.696 8.515 ( -4.210 3.124 4.429) 6.863 8.885 ( -2.338 5.892 -4.474) 7.758 9.036 ( -8.361 -9.060 -3.129) 12.720 9.264 ( -3.810 14.422 -5.630) 15.944 10.071 ( 0.996 3.374 -0.957) 3.645 10.428 ( 10.337 1.084 -4.032) 11.148 10.685 ( -0.099 -1.039 -3.174) 3.341 11.007 ( -8.975 -2.654 2.727) 9.749 11.362 ( 0.879 -6.803 -4.329) 8.111 11.647 ( -2.506 -0.640 4.966) 5.599 11.760 ( -1.147 4.012 -3.087) 5.191 12.038 ( 6.631 -0.609 -1.325) 6.789 12.389 ( -2.435 -4.416 -22.030) 22.600 12.672 ( 4.746 -7.608 -5.063) 10.298 13.346 ( 13.069 -2.826 3.614) 13.851 13.453 ( 0.945 -0.691 6.957) 7.054 14.135 ( -4.651 -0.181 -8.517) 9.706 14.552 ( 1.250 -5.904 12.177) 13.590 14.901 ( -6.028 3.442 7.263) 10.047 15.086 ( -3.424 8.362 6.260) 10.992 15.851 ( -1.217 -0.027 -0.983) 1.564 16.120 ( -3.711 -4.005 -0.484) 5.482 18.252 ( 3.863 3.654 -9.112) 10.550 18.512 ( -2.484 -0.637 -0.717) 2.662 20.166 ( 1.854 -5.743 -8.378) 10.325 20.398 ( 2.519 3.912 -5.975) 7.573 25.585 ( 5.942 -3.266 5.031) 8.443 25.867 ( -15.452 1.095 3.192) 15.816 26.676 ( -0.619 0.835 -0.559) 1.180 26.789 ( -0.686 -1.166 7.816) 7.932 27.564 ( 4.768 -1.342 3.111) 5.850 28.378 ( 1.743 3.004 5.937) 6.878 28.428 ( -1.559 5.495 6.131) 8.379 28.748 ( -0.972 -0.588 3.841) 4.005 29.143 ( 4.067 -2.599 4.560) 6.640 29.242 ( 6.109 -5.731 1.286) 8.474 30.185 ( -4.628 0.339 -10.415) 11.401 30.985 ( 1.258 7.507 -17.896) 19.447 ======================= Grid point 112 (52/186) ======================= q-point: (-0.38 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( -9.467 -0.000 2.519) 9.797 1.995 ( -12.271 -0.000 -1.608) 12.376 2.377 ( -7.925 -0.000 0.091) 7.926 2.392 ( 4.316 0.000 -1.042) 4.440 2.397 ( -6.359 -0.000 5.510) 8.414 2.808 ( -15.299 -0.000 -1.750) 15.399 3.532 ( 7.980 0.000 -3.970) 8.913 4.049 ( -2.574 -0.000 25.271) 25.402 4.172 ( -9.230 -0.000 22.574) 24.388 4.240 ( 3.965 0.000 3.836) 5.517 4.929 ( -15.372 -0.000 2.585) 15.588 5.064 ( 2.062 0.000 17.119) 17.243 5.612 ( -9.332 -0.000 13.569) 16.468 6.230 ( -2.176 -0.000 -9.748) 9.988 6.287 ( -13.178 -0.000 6.960) 14.903 6.702 ( 10.111 0.000 -7.453) 12.561 7.040 ( -1.548 -0.000 6.696) 6.872 7.404 ( 12.793 0.000 0.759) 12.815 7.410 ( -7.791 -0.000 -3.152) 8.405 7.634 ( 7.990 0.000 12.910) 15.182 8.134 ( 2.665 0.000 5.273) 5.909 8.308 ( 4.182 0.000 5.675) 7.049 8.782 ( -4.666 -0.000 -5.565) 7.263 8.959 ( -11.939 -0.000 -3.172) 12.353 9.277 ( -1.773 -0.000 -11.553) 11.688 9.567 ( -8.585 -0.000 -4.575) 9.728 10.274 ( 8.555 0.000 -8.179) 11.836 10.419 ( 8.614 0.000 -0.921) 8.663 10.681 ( -4.865 -0.000 -5.359) 7.238 10.853 ( -0.345 -0.000 -8.627) 8.634 11.287 ( -6.775 -0.000 7.181) 9.872 11.630 ( 8.047 0.000 -1.512) 8.188 11.652 ( -2.197 -0.000 6.920) 7.260 11.909 ( 7.551 0.000 -14.092) 15.987 12.406 ( 7.074 0.000 -4.925) 8.619 12.534 ( -11.831 -0.000 -15.860) 19.787 13.115 ( 9.326 0.000 20.129) 22.184 13.504 ( -4.498 -0.000 4.096) 6.084 14.175 ( -0.349 -0.000 -9.893) 9.899 14.196 ( 6.409 0.000 11.666) 13.310 15.114 ( -3.867 -0.000 7.231) 8.200 15.241 ( 4.261 0.000 5.279) 6.784 15.927 ( -5.921 -0.000 -7.204) 9.325 16.052 ( -9.500 -0.000 4.762) 10.627 18.388 ( 2.280 0.000 -7.790) 8.117 18.553 ( 2.817 0.000 -4.681) 5.464 19.970 ( 1.595 0.000 -11.669) 11.778 20.470 ( 3.004 0.000 -4.954) 5.794 25.469 ( -0.338 -0.000 2.403) 2.427 26.124 ( -19.427 -0.000 2.392) 19.574 26.690 ( 0.144 0.000 0.659) 0.675 26.726 ( 1.567 0.000 4.206) 4.488 27.502 ( -1.054 -0.000 7.675) 7.747 28.389 ( 3.806 0.000 1.576) 4.119 28.611 ( -0.750 -0.000 3.664) 3.740 28.735 ( -0.422 -0.000 13.214) 13.221 28.735 ( 17.715 0.000 9.909) 20.298 29.061 ( -0.471 -0.000 1.781) 1.842 30.242 ( -3.528 -0.000 -15.056) 15.464 31.397 ( 1.369 0.000 -19.707) 19.754 ======================= Grid point 113 (53/186) ======================= q-point: (-0.25 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.745 ( -15.620 3.169 0.563) 15.948 1.844 ( -15.140 -4.449 5.008) 16.556 2.060 ( -12.648 14.204 -1.923) 19.116 2.370 ( -0.978 3.635 -2.281) 4.402 2.488 ( -8.743 -10.142 3.016) 13.726 2.664 ( -12.815 -8.136 -1.677) 15.272 3.577 ( 12.661 7.061 -5.382) 15.463 3.994 ( -16.557 2.196 11.639) 20.357 4.212 ( -3.733 -4.774 27.863) 28.514 4.352 ( 3.779 -4.833 5.889) 8.505 4.766 ( -10.799 0.510 11.901) 16.079 5.090 ( 2.603 10.956 19.458) 22.482 5.645 ( -0.181 -7.031 12.113) 14.006 6.106 ( -10.020 1.841 -1.741) 10.335 6.169 ( -10.139 -2.068 -1.953) 10.531 6.769 ( 9.416 5.044 -5.049) 11.815 7.094 ( -2.429 -6.634 1.660) 7.257 7.327 ( -2.559 -1.891 -2.569) 4.090 7.547 ( 10.019 1.050 3.924) 10.811 7.785 ( 9.702 4.112 11.589) 15.664 8.153 ( 0.380 -0.541 3.252) 3.318 8.392 ( 3.336 -0.843 6.099) 7.003 8.633 ( -7.233 5.114 -4.535) 9.951 8.825 ( -14.202 -5.606 -3.046) 15.570 9.141 ( -3.155 9.121 -11.615) 15.101 9.469 ( -5.341 -0.778 -6.258) 8.264 10.237 ( -3.240 7.225 -13.160) 15.358 10.469 ( 9.467 2.665 -2.652) 10.186 10.653 ( 3.183 -1.729 -5.602) 6.671 10.911 ( 0.267 -2.766 0.030) 2.779 11.228 ( -6.185 -2.994 3.060) 7.522 11.647 ( -0.883 0.681 5.252) 5.369 11.758 ( 5.049 -4.296 -2.816) 7.202 11.976 ( 8.973 -1.509 -8.422) 12.398 12.343 ( -6.933 1.564 -11.017) 13.110 12.505 ( 6.002 -4.535 -8.926) 11.673 13.316 ( 11.788 0.215 16.478) 20.261 13.452 ( -3.953 0.081 5.990) 7.177 14.133 ( -0.381 0.531 -9.529) 9.551 14.359 ( 5.092 -6.135 10.986) 13.574 15.048 ( -5.771 4.783 7.974) 10.944 15.283 ( 2.664 4.829 6.270) 8.350 15.816 ( -7.682 -1.492 -4.501) 9.027 15.972 ( -9.430 -4.782 1.592) 10.693 18.375 ( 2.877 2.950 -8.557) 9.497 18.552 ( 2.875 2.888 -4.937) 6.401 19.988 ( 1.573 -5.226 -10.374) 11.722 20.478 ( 2.643 1.570 -4.858) 5.749 25.497 ( 1.884 -2.300 2.007) 3.587 25.892 ( -17.778 0.571 2.417) 17.951 26.689 ( -0.511 0.161 0.976) 1.114 26.765 ( 0.718 -0.516 6.557) 6.617 27.533 ( 1.940 -0.698 5.901) 6.251 28.433 ( 3.673 1.731 3.555) 5.397 28.590 ( -1.783 2.892 5.751) 6.680 28.746 ( -1.675 1.858 9.821) 10.134 29.018 ( 15.350 -4.936 9.116) 18.522 29.098 ( 0.988 -3.412 2.438) 4.308 30.149 ( -4.768 -1.387 -13.835) 14.699 31.276 ( 0.369 8.488 -23.402) 24.896 ======================= Grid point 114 (54/186) ======================= q-point: (-0.12 -0.38 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.486 ( -17.399 3.170 3.261) 17.983 1.710 ( -19.395 -5.599 -0.306) 20.190 1.826 ( -5.667 -0.692 0.939) 5.786 2.280 ( -2.277 4.038 -2.988) 5.515 2.454 ( -15.188 -7.250 5.316) 17.649 2.679 ( -9.139 -12.004 -1.837) 15.198 3.593 ( -3.162 6.457 -5.567) 9.093 3.774 ( -7.701 0.737 3.462) 8.476 4.301 ( -5.274 0.627 36.351) 36.737 4.467 ( 4.135 -1.920 -0.224) 4.564 4.772 ( -3.591 -5.642 23.288) 24.229 5.034 ( 8.381 14.061 19.585) 25.525 5.821 ( 4.390 -7.363 6.756) 10.915 5.972 ( -7.588 -0.819 -3.432) 8.368 6.070 ( -9.523 -2.824 0.306) 9.938 6.777 ( 6.361 6.579 -0.106) 9.152 7.132 ( -3.971 -4.917 1.016) 6.401 7.360 ( -1.405 -5.710 -6.868) 9.041 7.648 ( 6.376 3.603 -0.295) 7.330 7.817 ( 7.650 6.361 9.541) 13.785 8.185 ( 0.133 2.166 -2.461) 3.281 8.439 ( -0.998 -0.596 10.572) 10.635 8.498 ( -2.232 2.362 -3.854) 5.041 8.777 ( -7.179 -11.045 -2.451) 13.400 8.906 ( -6.916 9.165 -9.413) 14.847 9.363 ( -2.945 7.173 -5.491) 9.501 10.062 ( -4.985 1.149 -8.338) 9.782 10.532 ( 3.254 2.839 -4.359) 6.136 10.684 ( 4.202 -1.121 -8.897) 9.903 10.893 ( -6.000 -0.550 10.220) 11.863 11.265 ( 0.267 -6.602 -3.995) 7.721 11.643 ( -1.396 0.701 5.997) 6.197 11.793 ( 2.592 2.541 -6.287) 7.260 12.122 ( 8.792 -1.578 1.285) 9.025 12.234 ( -3.458 -2.094 -14.167) 14.733 12.632 ( 7.528 -5.712 -9.744) 13.574 13.443 ( 4.230 -2.984 -5.406) 7.485 13.538 ( 8.522 0.197 18.031) 19.944 14.082 ( -0.774 1.796 -5.805) 6.125 14.529 ( 1.432 -5.406 11.345) 12.649 14.913 ( -6.583 5.887 8.240) 12.078 15.191 ( -3.048 9.624 4.892) 11.218 15.779 ( -4.887 -4.399 -0.068) 6.576 15.986 ( -3.079 -9.326 -0.550) 9.836 18.320 ( 2.150 4.585 -8.055) 9.514 18.525 ( 2.727 3.539 -3.884) 5.920 20.068 ( 1.983 -7.396 -8.599) 11.514 20.460 ( 2.333 3.145 -5.397) 6.668 25.609 ( 5.325 -6.174 3.019) 8.694 25.700 ( -13.225 -0.273 3.713) 13.739 26.677 ( -0.871 0.698 0.658) 1.295 26.796 ( -1.063 -0.538 8.338) 8.423 27.611 ( 4.662 -1.840 4.237) 6.563 28.461 ( 2.466 2.605 7.206) 8.049 28.517 ( -3.178 7.018 9.212) 12.009 28.724 ( -3.252 0.125 3.830) 5.026 29.151 ( -0.446 -0.985 -0.549) 1.213 29.280 ( 9.451 -4.785 5.758) 12.057 30.062 ( -5.506 -1.875 -11.386) 12.786 31.048 ( -0.131 9.843 -24.246) 26.168 ======================= Grid point 121 (55/186) ======================= q-point: (-0.25 -0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( -23.855 -0.000 2.664) 24.003 1.568 ( -23.072 -0.000 6.205) 23.891 2.009 ( -24.590 -0.000 -2.682) 24.736 2.136 ( -10.742 -0.000 -1.668) 10.871 2.442 ( -11.214 -0.000 1.484) 11.311 2.458 ( 2.329 0.000 -2.075) 3.119 3.737 ( 10.556 0.000 -9.146) 13.967 3.797 ( -19.894 -0.000 4.082) 20.308 4.255 ( -1.712 -0.000 29.941) 29.990 4.395 ( 3.932 0.000 10.380) 11.100 4.716 ( -8.284 -0.000 24.035) 25.422 5.332 ( 9.039 0.000 18.386) 20.487 5.635 ( 1.334 0.000 15.106) 15.165 5.959 ( -13.678 -0.000 3.432) 14.102 6.030 ( -7.552 -0.000 -9.476) 12.118 6.891 ( 8.170 0.000 -11.507) 14.112 7.030 ( -1.696 -0.000 3.151) 3.579 7.246 ( -4.764 -0.000 -0.258) 4.771 7.703 ( 10.587 0.000 6.680) 12.519 8.025 ( 14.151 0.000 8.799) 16.664 8.104 ( -6.774 -0.000 3.054) 7.430 8.453 ( 2.612 0.000 6.147) 6.679 8.559 ( -7.688 -0.000 -6.384) 9.993 8.593 ( -10.660 -0.000 -7.840) 13.233 9.141 ( -3.712 -0.000 -9.662) 10.351 9.339 ( -6.784 -0.000 -5.880) 8.978 10.145 ( -10.047 -0.000 -23.300) 25.374 10.564 ( 6.190 0.000 -2.317) 6.609 10.672 ( 5.596 0.000 -7.296) 9.195 11.010 ( 9.961 0.000 0.482) 9.973 11.079 ( -11.471 -0.000 -1.795) 11.611 11.667 ( -1.825 -0.000 8.471) 8.665 11.792 ( 7.525 0.000 -4.561) 8.800 12.027 ( 6.159 0.000 -7.924) 10.036 12.291 ( -2.569 -0.000 11.987) 12.260 12.530 ( 9.586 0.000 -14.785) 17.621 13.362 ( -5.658 -0.000 -1.581) 5.875 13.550 ( 10.119 0.000 20.217) 22.608 14.119 ( 1.922 0.000 -7.553) 7.793 14.418 ( 4.940 0.000 10.859) 11.930 15.040 ( -6.237 -0.000 8.901) 10.868 15.405 ( 5.110 0.000 8.236) 9.693 15.643 ( -12.790 -0.000 -4.842) 13.676 15.805 ( -10.811 -0.000 0.663) 10.831 18.404 ( 2.320 0.000 -6.594) 6.991 18.610 ( 5.525 0.000 -8.497) 10.135 19.931 ( 1.322 0.000 -9.845) 9.934 20.503 ( 2.138 0.000 -4.710) 5.173 25.505 ( 1.759 0.000 1.204) 2.132 25.697 ( -14.934 -0.000 3.040) 15.240 26.687 ( -0.847 -0.000 1.725) 1.921 26.788 ( -0.595 -0.000 7.931) 7.953 27.582 ( 3.800 0.000 5.583) 6.754 28.511 ( 3.708 0.000 6.729) 7.683 28.594 ( -2.249 -0.000 3.779) 4.398 28.792 ( -2.012 -0.000 13.690) 13.837 29.056 ( 1.536 0.000 0.607) 1.652 29.218 ( 11.631 0.000 7.941) 14.084 30.040 ( -3.511 -0.000 -12.513) 12.997 31.245 ( -0.852 -0.000 -31.199) 31.211 ======================= Grid point 122 (56/186) ======================= q-point: (-0.12 -0.25 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.228 ( -26.019 -1.014 6.160) 26.758 1.295 ( -30.085 -7.751 -0.437) 31.070 1.702 ( -17.537 -3.671 6.422) 19.033 2.066 ( -16.765 -9.625 0.911) 19.353 2.308 ( -4.967 3.741 0.096) 6.219 2.509 ( -0.179 -4.074 -0.087) 4.079 3.481 ( -21.268 10.163 -1.022) 23.593 3.835 ( 8.832 -0.386 -7.205) 11.405 4.325 ( -4.151 -0.464 26.941) 27.262 4.552 ( 5.379 -3.772 15.520) 16.854 4.726 ( -5.578 -5.426 28.893) 29.923 5.401 ( 9.417 12.104 18.011) 23.656 5.786 ( -5.155 -7.209 18.160) 20.208 5.849 ( 0.229 -3.432 -5.924) 6.850 5.923 ( -6.359 -2.356 -5.842) 8.951 6.913 ( 5.474 3.570 -7.019) 9.590 7.044 ( -1.576 -3.441 1.996) 4.279 7.224 ( -4.134 -4.411 -4.012) 7.256 7.808 ( 5.418 7.448 2.285) 9.489 7.976 ( 0.645 2.834 5.646) 6.350 8.211 ( 1.230 2.349 -0.282) 2.666 8.382 ( -7.227 -0.180 -0.052) 7.230 8.508 ( -1.304 -4.367 -3.391) 5.681 8.580 ( 3.778 -6.235 -6.973) 10.088 8.943 ( -6.029 12.633 -4.704) 14.768 9.321 ( -3.167 -4.583 -5.563) 7.872 9.907 ( -12.155 -1.318 -18.878) 22.491 10.557 ( -8.583 8.855 -14.947) 19.377 10.675 ( 4.880 -3.497 -6.708) 9.002 10.912 ( -2.344 2.383 9.480) 10.052 11.182 ( 4.303 -5.961 -3.035) 7.954 11.655 ( -2.705 1.016 6.451) 7.069 11.865 ( 7.368 1.856 -5.555) 9.412 12.102 ( 3.694 -4.485 -10.790) 12.255 12.343 ( 8.720 8.858 27.139) 29.850 12.630 ( 8.579 -3.573 -14.103) 16.889 13.365 ( -0.042 -10.339 -0.954) 10.383 13.706 ( 8.055 1.892 5.141) 9.741 14.134 ( 4.638 2.274 4.204) 6.660 14.532 ( 2.199 -2.729 11.209) 11.744 14.945 ( -6.502 5.711 9.462) 12.823 15.293 ( -7.372 11.744 3.375) 14.271 15.632 ( -4.548 -6.871 0.069) 8.240 15.788 ( -2.441 -14.505 3.018) 15.015 18.370 ( 0.251 4.249 -7.203) 8.366 18.625 ( 6.556 3.993 -7.029) 10.408 19.965 ( 2.157 -6.498 -8.716) 11.084 20.499 ( 1.658 1.504 -5.119) 5.588 25.522 ( -9.010 -1.901 1.652) 9.356 25.615 ( 2.529 -6.048 4.257) 7.816 26.677 ( -1.199 0.466 1.444) 1.934 26.803 ( -1.960 -0.192 9.105) 9.316 27.667 ( 5.196 -1.272 4.892) 7.249 28.556 ( 1.042 2.271 5.755) 6.274 28.587 ( 0.232 2.346 11.651) 11.887 28.747 ( -2.947 7.302 9.641) 12.449 29.113 ( -0.354 -2.900 -0.218) 2.930 29.358 ( 5.505 -0.909 3.470) 6.571 29.959 ( -3.221 1.601 -10.252) 10.864 31.035 ( -4.595 5.574 -36.852) 37.553 ======================= Grid point 130 (57/186) ======================= q-point: (-0.12 -0.12 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.824 ( -32.497 -0.000 1.406) 32.528 0.906 ( -28.084 -0.000 10.975) 30.152 1.358 ( -30.483 -0.000 28.902) 42.006 1.868 ( -8.343 -0.000 -0.856) 8.387 2.306 ( 0.908 0.000 -2.395) 2.562 2.507 ( 1.982 0.000 1.339) 2.392 3.300 ( -23.592 -0.000 -17.288) 29.248 3.893 ( 6.870 0.000 -10.177) 12.278 4.459 ( 1.936 0.000 42.527) 42.571 4.546 ( 1.309 0.000 12.240) 12.310 4.705 ( -9.099 -0.000 35.334) 36.487 5.658 ( -10.546 -0.000 18.363) 21.175 5.659 ( 5.161 0.000 9.325) 10.658 5.827 ( -2.715 -0.000 -1.831) 3.275 5.870 ( 8.114 0.000 -0.599) 8.136 6.971 ( 5.072 0.000 -10.630) 11.778 6.994 ( -2.172 -0.000 0.154) 2.177 7.149 ( -2.542 -0.000 -0.367) 2.568 7.897 ( -8.391 -0.000 -0.705) 8.421 8.006 ( 7.711 0.000 6.025) 9.786 8.221 ( -9.662 -0.000 -6.700) 11.758 8.342 ( 5.009 0.000 -2.783) 5.730 8.382 ( -3.329 -0.000 -4.153) 5.323 8.546 ( -0.991 -0.000 -18.126) 18.153 9.049 ( 2.148 0.000 1.438) 2.585 9.191 ( -2.099 -0.000 -1.429) 2.540 9.632 ( -15.056 -0.000 -19.794) 24.870 10.332 ( -24.902 -0.000 -30.935) 39.712 10.694 ( 3.926 0.000 -0.228) 3.933 10.941 ( 1.018 0.000 7.695) 7.762 11.209 ( 4.913 0.000 1.077) 5.030 11.645 ( -3.011 -0.000 5.432) 6.211 11.959 ( 7.316 0.000 -5.990) 9.455 12.101 ( 4.634 0.000 -6.520) 7.999 12.632 ( 7.251 0.000 -21.926) 23.094 12.954 ( 43.994 0.000 71.723) 84.140 13.183 ( -5.838 -0.000 -4.659) 7.469 13.806 ( 6.441 0.000 -9.141) 11.182 14.266 ( 7.006 0.000 16.759) 18.164 14.593 ( 3.137 0.000 15.262) 15.581 14.947 ( -5.630 -0.000 9.980) 11.458 15.258 ( -15.244 -0.000 -2.344) 15.424 15.532 ( -4.691 -0.000 -5.549) 7.266 15.679 ( 7.641 0.000 22.245) 23.521 18.372 ( -1.893 -0.000 -9.996) 10.174 18.720 ( 7.578 0.000 -6.255) 9.826 19.908 ( 1.918 0.000 -8.018) 8.244 20.506 ( 0.870 0.000 -5.431) 5.500 25.411 ( -7.234 -0.000 2.520) 7.661 25.600 ( 2.038 0.000 5.051) 5.447 26.669 ( -1.077 -0.000 0.945) 1.433 26.806 ( -2.393 -0.000 10.393) 10.665 27.735 ( 4.196 0.000 4.008) 5.803 28.560 ( -2.163 -0.000 3.058) 3.745 28.699 ( 6.286 0.000 5.800) 8.553 28.885 ( 3.978 0.000 18.654) 19.074 29.099 ( 1.376 0.000 1.881) 2.331 29.397 ( 0.662 0.000 -0.905) 1.121 29.965 ( 2.553 0.000 -6.008) 6.528 30.745 ( -22.323 -0.000 -54.764) 59.138 ======================= Grid point 131 (58/186) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.052 ( 3.059 0.000 20.269) 20.499 1.098 ( -1.368 -0.000 21.397) 21.440 1.814 ( -0.589 -0.000 4.192) 4.233 2.068 ( 1.639 0.000 27.288) 27.337 2.473 ( 3.767 0.000 5.144) 6.376 2.560 ( 6.449 0.000 18.632) 19.716 2.697 ( 0.032 0.000 7.276) 7.277 3.741 ( 0.210 0.000 -7.913) 7.916 4.799 ( -2.650 -0.000 5.575) 6.173 5.257 ( -16.753 -0.000 32.437) 36.508 5.518 ( -4.037 -0.000 17.417) 17.878 5.702 ( 4.040 0.000 -0.587) 4.083 5.756 ( -15.540 -0.000 0.994) 15.572 5.819 ( -10.269 -0.000 24.726) 26.774 6.249 ( -4.090 -0.000 18.864) 19.303 6.819 ( 5.315 0.000 -9.972) 11.300 7.072 ( 0.299 0.000 5.339) 5.347 7.095 ( -0.887 -0.000 1.746) 1.959 7.686 ( -0.890 -0.000 -5.236) 5.311 7.765 ( -10.605 -0.000 -3.212) 11.080 7.994 ( 7.527 0.000 -9.852) 12.398 8.295 ( 3.714 0.000 -2.229) 4.332 8.364 ( 4.754 0.000 5.450) 7.232 8.546 ( 6.284 0.000 0.845) 6.340 9.176 ( -6.298 -0.000 -9.251) 11.191 9.337 ( 5.791 0.000 5.316) 7.861 9.538 ( 6.200 0.000 16.347) 17.483 9.804 ( 4.595 0.000 1.307) 4.777 10.708 ( -0.998 -0.000 -2.330) 2.535 11.165 ( -2.612 -0.000 7.875) 8.297 11.318 ( 1.770 0.000 0.392) 1.813 11.624 ( -1.962 -0.000 -24.063) 24.143 11.790 ( -0.989 -0.000 8.799) 8.854 11.921 ( 1.673 0.000 -14.901) 14.995 12.254 ( 8.412 0.000 -11.142) 13.960 12.749 ( 1.935 0.000 -21.505) 21.592 13.421 ( 5.535 0.000 -24.864) 25.473 14.017 ( 5.164 0.000 -18.869) 19.563 14.704 ( -9.911 -0.000 1.220) 9.986 15.146 ( -5.542 -0.000 11.775) 13.014 15.190 ( 0.379 0.000 23.476) 23.479 15.242 ( -13.740 -0.000 11.995) 18.239 15.389 ( 18.668 0.000 -4.396) 19.178 16.525 ( -15.496 -0.000 3.863) 15.971 18.148 ( 4.423 0.000 -1.198) 4.582 18.800 ( 1.433 0.000 -2.676) 3.036 19.722 ( 5.749 0.000 -13.510) 14.682 20.268 ( 0.487 0.000 -13.265) 13.274 25.497 ( 2.034 0.000 9.536) 9.751 25.890 ( 1.567 0.000 11.178) 11.287 26.590 ( 0.688 0.000 -4.740) 4.790 27.044 ( -1.252 -0.000 -5.347) 5.492 27.494 ( -12.778 -0.000 8.738) 15.480 28.315 ( -9.174 -0.000 11.358) 14.601 28.583 ( -2.748 -0.000 2.710) 3.859 28.774 ( -1.183 -0.000 0.717) 1.383 29.173 ( -3.691 -0.000 -5.863) 6.929 29.240 ( 3.174 0.000 1.370) 3.457 29.898 ( 0.742 0.000 -5.714) 5.762 30.729 ( 25.372 0.000 -6.651) 26.229 ======================= Grid point 132 (59/186) ======================= q-point: ( 0.12 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( 3.715 -5.515 12.811) 14.434 1.245 ( 12.658 -3.425 18.148) 22.390 1.845 ( 3.800 -0.381 2.308) 4.462 2.220 ( 1.210 -7.061 17.817) 19.204 2.568 ( 6.550 -2.343 10.383) 12.497 2.692 ( -3.047 1.788 5.378) 6.434 2.843 ( 22.834 0.743 17.265) 28.637 3.770 ( 0.801 -8.546 -6.425) 10.722 4.760 ( -1.065 4.104 5.035) 6.582 5.158 ( -14.547 0.965 33.473) 36.510 5.321 ( -17.647 13.204 5.025) 22.606 5.642 ( -14.718 -3.536 28.531) 32.298 5.776 ( -0.687 -5.695 1.232) 5.867 5.846 ( -3.521 -6.778 11.616) 13.902 6.281 ( -2.863 -2.986 14.625) 15.199 6.803 ( 1.640 5.501 -9.680) 11.254 7.076 ( -1.264 -2.201 0.918) 2.699 7.114 ( 1.400 0.197 3.911) 4.159 7.578 ( -4.531 4.013 -2.564) 6.574 7.733 ( -3.124 -5.817 -4.375) 7.921 8.029 ( 7.958 3.812 -8.220) 12.059 8.345 ( 5.129 0.180 0.243) 5.138 8.486 ( 2.666 -4.307 6.776) 8.460 8.624 ( 3.822 -0.996 -4.077) 5.676 8.989 ( -3.459 5.721 -3.417) 7.508 9.440 ( 2.812 -1.001 3.776) 4.813 9.720 ( 8.814 -1.832 10.190) 13.597 9.957 ( 12.044 -4.304 -1.092) 12.836 10.707 ( -1.207 -3.981 -3.294) 5.306 11.158 ( -4.262 -1.975 6.395) 7.934 11.342 ( -1.888 -2.694 1.427) 3.586 11.521 ( -0.221 0.421 -22.265) 22.270 11.806 ( 1.291 1.125 3.870) 4.232 11.882 ( 0.088 0.654 -10.608) 10.628 12.309 ( 4.876 -0.256 -10.070) 11.191 12.716 ( 7.617 2.373 -18.222) 19.892 13.362 ( 2.863 4.397 -22.644) 23.244 13.976 ( -0.267 -0.638 -21.213) 21.225 14.479 ( -10.590 13.574 2.086) 17.342 15.008 ( -6.624 11.640 12.318) 18.196 15.144 ( -11.506 -1.643 11.292) 16.205 15.259 ( -0.969 1.147 22.839) 22.888 15.572 ( 9.693 -1.362 0.114) 9.789 16.267 ( -25.938 -5.418 9.099) 28.016 18.194 ( 7.512 4.240 -3.362) 9.258 18.763 ( -3.210 1.627 -2.187) 4.211 19.790 ( 5.457 -5.287 -14.098) 16.015 20.217 ( 0.498 1.135 -13.920) 13.975 25.595 ( 6.587 -0.606 11.221) 13.026 25.979 ( -1.879 -5.581 10.094) 11.687 26.581 ( -0.601 -0.785 -4.667) 4.771 26.991 ( -1.041 1.053 -9.524) 9.638 27.488 ( 1.567 -1.603 16.504) 16.655 28.274 ( -4.710 -0.387 13.781) 14.569 28.541 ( -2.185 2.569 1.656) 3.758 28.771 ( -2.095 -2.014 2.303) 3.708 29.126 ( -3.551 -2.694 -6.425) 7.820 29.272 ( 2.520 1.150 2.792) 3.933 29.888 ( -0.583 -1.952 -6.917) 7.211 30.915 ( 18.540 8.221 -14.869) 25.148 ======================= Grid point 133 (60/186) ======================= q-point: ( 0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( 4.852 -2.070 10.300) 11.572 1.568 ( 15.502 -7.656 8.143) 19.111 1.908 ( 3.085 -0.563 1.096) 3.322 2.398 ( 3.398 -6.352 12.912) 14.786 2.594 ( -7.324 3.874 2.904) 8.779 2.752 ( 8.777 -5.400 2.846) 10.691 3.164 ( 21.682 1.655 11.423) 24.563 3.967 ( 5.597 -15.136 2.457) 16.324 4.696 ( -3.754 5.835 1.943) 7.205 4.879 ( -21.681 13.547 7.726) 26.707 5.128 ( -7.232 0.377 32.602) 33.397 5.577 ( -17.747 0.212 39.497) 43.301 5.853 ( -3.835 -8.112 1.707) 9.134 5.938 ( 0.702 -4.047 1.643) 4.424 6.376 ( -1.071 -7.025 15.040) 16.634 6.655 ( -2.506 9.545 -6.069) 11.586 7.113 ( 2.706 -1.803 -3.109) 4.499 7.154 ( -0.246 -3.693 2.750) 4.611 7.502 ( -2.171 0.182 0.138) 2.183 7.757 ( -2.535 -4.148 -4.405) 6.560 8.023 ( 6.780 7.384 -8.834) 13.362 8.387 ( 1.139 -0.127 2.416) 2.674 8.552 ( -1.946 -3.464 8.651) 9.520 8.691 ( 0.944 -6.558 -4.274) 7.885 8.947 ( 6.522 4.439 -1.289) 7.994 9.452 ( 1.091 4.556 3.142) 5.641 9.843 ( 3.594 -1.995 1.672) 4.437 10.161 ( 14.959 -1.330 -1.510) 15.094 10.731 ( -3.030 -2.717 -3.965) 5.682 11.155 ( -5.492 -3.270 5.476) 8.417 11.381 ( -1.384 -6.622 1.706) 6.977 11.453 ( 2.666 2.583 -16.959) 17.361 11.801 ( 2.299 0.936 -13.907) 14.127 11.865 ( -0.022 -0.278 6.500) 6.505 12.287 ( -1.026 1.689 -12.656) 12.810 12.768 ( 12.385 1.596 -9.904) 15.938 13.223 ( -0.945 6.832 -18.321) 19.576 13.897 ( -2.284 -0.899 -21.579) 21.718 14.148 ( -7.180 17.127 7.621) 20.074 14.843 ( -5.915 5.673 11.214) 13.890 15.055 ( -11.648 -1.684 9.403) 15.064 15.281 ( -3.926 2.371 20.714) 21.216 15.702 ( 5.054 -4.009 3.201) 7.201 16.151 ( -13.067 -7.565 6.436) 16.413 18.195 ( 7.076 6.706 -3.507) 10.361 18.668 ( -5.297 3.187 -2.181) 6.555 19.886 ( 5.103 -6.143 -14.522) 16.573 20.161 ( 1.421 1.453 -14.481) 14.623 25.737 ( 9.520 1.200 12.481) 15.743 26.025 ( -6.905 -3.726 9.195) 12.087 26.573 ( -0.658 -1.934 -4.168) 4.642 26.949 ( -0.080 0.477 -2.845) 2.886 27.614 ( 4.724 -1.097 13.701) 14.533 28.308 ( -1.546 -3.929 11.539) 12.287 28.487 ( -0.707 2.772 2.032) 3.509 28.786 ( -2.957 -2.960 3.510) 5.462 29.094 ( -5.634 -3.561 -6.711) 9.458 29.298 ( 1.657 0.207 3.032) 3.461 29.894 ( 0.049 -3.624 -9.541) 10.206 30.894 ( 12.372 13.592 -16.723) 24.849 ======================= Grid point 134 (61/186) ======================= q-point: ( 0.38 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( 5.296 -0.525 8.917) 10.384 1.793 ( 6.350 0.183 -4.441) 7.751 1.964 ( 1.983 -3.799 6.517) 7.800 2.412 ( -7.912 7.236 1.399) 10.813 2.577 ( 2.762 -5.900 8.379) 10.613 2.915 ( 4.228 -4.561 -3.050) 6.927 3.397 ( 14.945 2.055 4.635) 15.781 4.301 ( -25.583 7.472 2.216) 26.744 4.330 ( 9.563 -11.238 14.647) 20.791 4.702 ( 0.883 6.634 6.736) 9.495 5.189 ( -1.936 -1.084 30.886) 30.965 5.479 ( -18.823 0.012 39.313) 43.587 5.908 ( -2.847 -4.702 3.760) 6.660 5.967 ( 1.183 1.233 -3.152) 3.585 6.482 ( -5.218 5.213 8.511) 11.262 6.531 ( 0.943 -6.189 7.556) 9.812 7.167 ( 2.758 -2.975 -4.061) 5.740 7.222 ( 0.351 -4.651 0.376) 4.679 7.509 ( -0.475 -2.254 0.163) 2.309 7.728 ( -3.238 1.131 -4.555) 5.702 7.968 ( 3.717 3.266 -6.588) 8.240 8.424 ( -0.801 -3.040 1.914) 3.681 8.612 ( -3.263 -4.307 10.110) 11.463 8.738 ( -3.999 -4.630 -6.259) 8.752 8.991 ( 9.934 4.472 1.455) 10.991 9.365 ( 0.264 10.359 2.360) 10.628 9.907 ( 1.944 -4.109 -4.551) 6.432 10.363 ( 16.752 0.378 -0.183) 16.757 10.650 ( -8.061 1.563 -4.904) 9.564 11.145 ( -5.807 -2.376 8.058) 10.213 11.386 ( 3.560 5.375 -12.105) 13.715 11.493 ( 1.786 -7.336 -1.280) 7.658 11.767 ( 0.973 0.691 -9.105) 9.183 11.918 ( 2.178 -2.936 2.049) 4.191 12.165 ( -4.359 3.644 -12.453) 13.688 12.846 ( 7.751 7.507 -3.477) 11.337 13.085 ( 2.254 0.264 -17.143) 17.293 13.752 ( -5.202 6.250 -14.121) 16.295 14.003 ( 0.907 0.471 4.744) 4.853 14.778 ( -2.939 1.246 7.155) 7.835 14.971 ( -9.406 -1.613 6.580) 11.592 15.250 ( -6.904 1.504 19.465) 20.708 15.827 ( 2.634 -4.549 5.042) 7.284 16.141 ( -3.956 -2.966 2.766) 5.666 18.177 ( 7.103 6.693 -3.391) 10.331 18.542 ( -6.070 3.105 -2.180) 7.158 19.983 ( 5.825 -5.186 -14.568) 16.525 20.113 ( 1.877 1.208 -14.785) 14.952 25.870 ( 10.685 4.488 12.194) 16.823 25.973 ( -10.324 -0.368 8.544) 13.406 26.588 ( -0.318 -2.624 -3.289) 4.219 26.961 ( 1.092 -0.846 3.770) 4.015 27.705 ( 2.738 0.656 11.428) 11.770 28.408 ( -1.636 -7.101 9.953) 12.336 28.478 ( 2.554 1.085 3.887) 4.776 28.796 ( -3.932 -2.772 3.505) 5.952 29.027 ( -9.730 -4.073 -6.584) 12.434 29.327 ( 0.348 -1.118 1.968) 2.290 29.917 ( 2.063 -3.028 -12.510) 13.036 30.771 ( 9.204 14.520 -17.357) 24.430 ======================= Grid point 135 (62/186) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( 2.982 0.681 8.520) 9.052 1.729 ( -3.010 5.712 -6.499) 9.161 2.039 ( -5.719 -0.324 7.276) 9.260 2.206 ( -5.482 5.835 -2.189) 8.300 2.676 ( -0.649 -0.412 7.258) 7.298 2.933 ( -1.957 2.454 -1.139) 3.339 3.481 ( -0.924 3.514 0.839) 3.729 3.879 ( -16.050 6.576 5.424) 18.173 4.617 ( 2.698 3.506 8.743) 9.799 4.799 ( 11.978 -12.204 18.152) 24.938 5.310 ( 2.195 -2.093 23.856) 24.048 5.392 ( -16.288 -1.127 36.900) 40.351 5.907 ( -3.001 3.027 0.509) 4.293 5.949 ( 3.546 1.630 -0.100) 3.904 6.403 ( -6.488 1.101 14.787) 16.185 6.662 ( 2.026 -5.548 7.836) 9.812 7.219 ( -1.404 -2.958 -0.097) 3.276 7.266 ( 0.150 -0.673 -3.834) 3.896 7.505 ( -0.694 0.018 -4.628) 4.680 7.684 ( -0.768 -3.340 -6.648) 7.479 8.007 ( 2.195 -4.273 1.092) 4.926 8.423 ( -3.916 -0.144 -1.737) 4.286 8.652 ( -7.400 -6.970 7.550) 12.663 8.683 ( -3.630 2.450 -2.020) 4.823 9.047 ( 6.967 4.865 -2.871) 8.969 9.223 ( 1.176 11.319 4.585) 12.269 9.977 ( 4.116 -2.328 -5.021) 6.897 10.479 ( -10.090 3.185 -5.368) 11.864 10.554 ( 15.111 1.304 -2.479) 15.368 11.135 ( -6.853 -2.460 11.911) 13.960 11.315 ( 4.236 6.190 -8.897) 11.637 11.584 ( 2.975 -3.004 -5.118) 6.638 11.748 ( 0.695 0.639 -3.154) 3.292 11.990 ( 0.056 -2.071 -8.671) 8.915 12.059 ( 0.547 -2.079 -1.978) 2.921 12.713 ( 0.379 11.470 -7.869) 13.915 13.169 ( 8.586 -5.175 -12.770) 16.235 13.563 ( -6.116 3.095 -12.511) 14.266 14.124 ( 6.538 -6.420 7.792) 12.028 14.747 ( -4.896 0.395 4.409) 6.600 14.933 ( -2.270 -1.768 4.319) 5.189 15.220 ( -7.990 -1.563 18.055) 19.805 15.903 ( -2.953 -2.490 7.634) 8.555 16.139 ( 2.784 2.549 0.383) 3.794 18.175 ( 7.522 5.086 -4.122) 9.972 18.441 ( -4.085 0.363 -1.889) 4.515 20.023 ( 5.399 4.618 -14.353) 16.015 20.115 ( 2.968 -6.519 -15.008) 16.629 25.849 ( -11.250 2.155 7.910) 13.921 25.959 ( 10.368 7.741 10.487) 16.655 26.608 ( -0.406 -2.436 -2.807) 3.739 27.011 ( 0.550 -0.957 9.815) 9.877 27.759 ( 2.734 1.093 8.824) 9.302 28.501 ( -2.505 -6.181 8.857) 11.087 28.561 ( 3.579 -3.615 7.830) 9.337 28.777 ( -6.013 -1.340 3.520) 7.095 28.929 ( -13.158 -6.792 -7.862) 16.765 29.345 ( -1.262 -1.667 0.144) 2.096 29.926 ( 3.785 1.301 -12.618) 13.237 30.631 ( 7.871 11.696 -19.150) 23.780 ======================= Grid point 136 (63/186) ======================= q-point: (-0.38 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -8.428 7.611 2.516) 11.631 1.596 ( -6.878 8.579 7.612) 13.373 1.823 ( -11.617 5.386 0.231) 12.807 2.197 ( 1.708 -1.828 2.093) 3.262 2.594 ( -7.769 7.360 7.951) 13.332 2.829 ( -2.090 9.509 6.631) 11.780 3.270 ( -23.840 0.432 3.964) 24.172 3.783 ( 4.709 3.967 -1.403) 6.315 4.630 ( 2.125 1.436 8.210) 8.602 5.147 ( 3.243 -9.010 30.251) 31.730 5.337 ( -8.699 -2.936 17.251) 19.542 5.504 ( 5.842 -3.270 26.787) 27.611 5.814 ( -1.395 5.084 -1.660) 5.527 5.978 ( 4.436 2.317 3.379) 6.039 6.358 ( -10.271 0.737 23.899) 26.023 6.791 ( 4.896 -3.892 2.119) 6.604 7.146 ( -7.893 2.819 -5.197) 9.862 7.231 ( -0.476 3.685 0.582) 3.761 7.536 ( 0.734 -6.002 -3.663) 7.070 7.725 ( -2.165 -9.183 -11.330) 14.744 8.115 ( 1.397 -4.662 4.679) 6.752 8.326 ( -4.616 3.807 -3.740) 7.056 8.583 ( -2.826 3.944 -2.223) 5.337 8.681 ( -9.225 -8.036 6.056) 13.651 8.975 ( 7.034 13.890 -1.955) 15.692 9.156 ( 0.491 3.720 1.846) 4.182 10.002 ( 4.651 6.730 -1.285) 8.281 10.285 ( -12.649 1.026 -6.926) 14.458 10.670 ( 10.035 3.297 -4.336) 11.418 11.107 ( -5.956 -1.106 6.048) 8.560 11.299 ( 6.550 4.150 2.100) 8.034 11.634 ( 4.664 -1.646 -8.922) 10.201 11.740 ( -0.127 -0.098 -0.329) 0.366 11.953 ( 0.853 -0.269 -9.126) 9.170 12.198 ( 4.623 -8.156 -2.480) 9.698 12.564 ( 1.066 4.804 -7.062) 8.607 13.298 ( 8.220 -4.152 -11.937) 15.077 13.451 ( -2.111 -1.708 -12.033) 12.336 14.358 ( 8.282 -8.365 10.587) 15.832 14.680 ( -6.738 -0.460 3.584) 7.646 14.988 ( 3.733 -1.748 4.937) 6.431 15.217 ( -8.410 -4.176 15.377) 18.017 15.849 ( -10.053 2.441 8.183) 13.190 16.165 ( 8.938 4.734 3.637) 10.748 18.182 ( 3.693 2.512 -4.963) 6.677 18.444 ( 3.529 -2.829 -1.833) 4.880 19.947 ( 4.573 7.298 -14.867) 17.181 20.201 ( 3.893 -6.126 -14.379) 16.107 25.700 ( -10.510 3.274 7.846) 13.519 25.991 ( 9.708 10.591 7.855) 16.374 26.623 ( -0.523 -1.853 -2.899) 3.480 27.055 ( -1.494 -0.183 13.485) 13.569 27.805 ( 2.288 1.023 6.269) 6.751 28.589 ( -1.887 -5.645 8.603) 10.462 28.685 ( 0.309 -0.802 1.884) 2.071 28.709 ( -12.340 -9.852 7.542) 17.499 28.850 ( -9.188 -6.722 -5.335) 12.572 29.339 ( -2.201 -1.227 -2.441) 3.508 29.890 ( 4.743 6.047 -7.593) 10.804 30.521 ( 7.241 8.163 -21.744) 24.329 ======================= Grid point 137 (64/186) ======================= q-point: (-0.25 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( -16.480 10.300 12.082) 22.883 1.310 ( -7.502 13.651 13.731) 20.765 1.738 ( -4.499 -2.196 3.022) 5.848 2.249 ( 0.460 -0.436 1.641) 1.759 2.381 ( -7.040 13.379 16.360) 22.276 2.698 ( -1.441 8.790 10.808) 14.005 2.973 ( -26.673 -2.090 1.762) 26.813 3.791 ( 6.302 4.073 -5.784) 9.474 4.687 ( -0.551 -3.055 11.919) 12.316 5.299 ( -8.474 -2.738 33.901) 35.051 5.386 ( -1.558 -5.036 14.696) 15.613 5.682 ( 3.387 1.542 17.699) 18.086 5.751 ( 1.085 0.124 -1.182) 1.609 6.013 ( 3.223 2.780 4.675) 6.322 6.294 ( -11.057 1.528 28.225) 30.352 6.859 ( 5.225 5.378 -3.403) 8.235 7.016 ( -6.184 -3.390 -6.506) 9.595 7.160 ( -2.615 4.069 5.046) 6.989 7.624 ( -1.253 -8.378 -3.435) 9.141 7.796 ( -1.661 -9.909 -11.199) 15.045 8.114 ( -5.462 1.553 -4.971) 7.547 8.244 ( 0.415 3.697 3.203) 4.909 8.505 ( -1.821 2.698 1.056) 3.422 8.636 ( -2.377 5.775 -4.870) 7.919 8.935 ( 1.448 -1.574 4.184) 4.699 9.132 ( 4.334 3.325 2.673) 6.081 9.889 ( 3.270 16.152 1.670) 16.564 10.069 ( -16.556 1.309 -5.415) 17.468 10.706 ( 5.232 2.060 -4.440) 7.165 11.101 ( 0.034 -1.041 4.920) 5.029 11.331 ( 5.103 4.986 4.663) 8.523 11.683 ( 2.829 -2.883 -9.841) 10.638 11.752 ( 1.049 -1.012 -1.659) 2.208 11.955 ( 1.597 -1.005 -6.968) 7.219 12.237 ( 3.874 3.234 -19.304) 19.952 12.660 ( 2.324 -13.431 -3.455) 14.062 13.372 ( 3.033 -4.277 -17.994) 18.743 13.565 ( 16.736 -6.795 -0.588) 18.073 14.581 ( -1.738 -11.233 0.158) 11.368 14.677 ( 2.996 -3.025 16.303) 16.850 15.091 ( 6.668 -0.294 7.064) 9.719 15.215 ( -9.357 -4.170 12.968) 16.526 15.666 ( -12.607 6.250 6.963) 15.700 16.270 ( 12.478 2.701 10.947) 16.818 18.164 ( -0.993 -0.140 -4.761) 4.865 18.573 ( 9.813 -3.368 -2.342) 10.636 19.847 ( 5.263 8.296 -15.280) 18.166 20.267 ( 2.941 -4.131 -13.717) 14.624 25.566 ( -7.645 3.201 7.865) 11.425 25.966 ( 7.625 12.339 6.320) 15.822 26.622 ( -0.730 -0.780 -3.541) 3.699 27.071 ( -3.153 0.244 13.205) 13.579 27.807 ( -3.912 0.424 1.989) 4.409 28.566 ( -17.364 -6.675 -3.613) 18.950 28.638 ( -7.251 -4.815 3.521) 9.389 28.762 ( -2.016 -3.769 -2.242) 4.827 28.946 ( 3.483 -9.219 12.650) 16.036 29.307 ( -2.001 0.028 -5.249) 5.618 29.855 ( 5.123 4.945 -0.291) 7.126 30.434 ( 8.373 7.943 -18.926) 22.167 ======================= Grid point 138 (65/186) ======================= q-point: (-0.12 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.027 ( -8.980 3.873 19.625) 21.926 1.146 ( -4.450 9.988 21.486) 24.108 1.767 ( -1.724 -5.015 7.825) 9.452 2.094 ( -5.259 13.612 20.995) 25.568 2.364 ( 6.903 1.729 7.955) 10.674 2.632 ( -11.027 -0.934 7.313) 13.264 2.706 ( -10.622 2.763 6.573) 12.793 3.777 ( 3.516 3.712 -7.301) 8.914 4.769 ( -2.704 -5.126 10.241) 11.767 5.316 ( -11.487 -2.058 29.305) 31.544 5.466 ( -3.057 -2.308 20.153) 20.514 5.685 ( 3.375 3.559 -0.202) 4.909 5.802 ( -6.109 -3.544 15.918) 17.415 5.967 ( -5.064 5.437 3.600) 8.257 6.252 ( -7.394 1.360 26.226) 27.283 6.805 ( 4.161 3.441 -9.864) 11.245 7.029 ( 0.845 -1.757 3.122) 3.681 7.113 ( -2.268 0.507 2.808) 3.645 7.686 ( -3.689 -6.354 -4.215) 8.470 7.862 ( 0.536 -3.888 -6.726) 7.788 7.986 ( -6.665 0.705 -7.293) 9.905 8.230 ( 4.337 1.567 0.551) 4.644 8.424 ( -2.436 7.913 1.251) 8.374 8.518 ( 4.117 6.220 -1.154) 7.548 9.062 ( 0.305 -12.829 -0.206) 12.834 9.226 ( 10.209 -0.043 8.106) 13.036 9.663 ( -3.372 18.041 5.241) 19.087 9.851 ( -8.694 2.433 -1.917) 9.229 10.721 ( 2.249 1.249 -2.569) 3.635 11.147 ( 0.203 -1.122 7.651) 7.736 11.319 ( 2.873 4.582 1.330) 5.569 11.698 ( 1.142 -1.538 -17.637) 17.740 11.771 ( -0.927 -1.135 4.033) 4.291 11.949 ( 0.481 -0.574 -11.164) 11.189 12.203 ( 8.183 1.912 -16.690) 18.686 12.776 ( -0.972 -6.976 -18.110) 19.432 13.408 ( 5.083 -3.518 -22.641) 23.470 13.911 ( 17.658 -5.153 -8.986) 20.472 14.693 ( -6.438 -13.514 3.803) 15.444 14.933 ( 8.879 -12.130 17.490) 23.062 15.182 ( -8.498 -1.405 13.239) 15.795 15.203 ( 8.913 2.397 9.275) 13.085 15.442 ( -11.383 6.361 4.790) 13.892 16.475 ( 11.216 -2.846 11.124) 16.051 18.135 ( -2.013 -0.839 -2.758) 3.516 18.727 ( 8.809 -2.115 -2.680) 9.447 19.755 ( 5.511 6.978 -14.815) 17.279 20.290 ( 1.478 -1.870 -13.185) 13.399 25.488 ( -3.130 2.017 8.225) 9.028 25.900 ( 3.557 10.000 8.208) 13.417 26.604 ( -0.230 0.209 -4.292) 4.303 27.065 ( -3.071 0.067 7.587) 8.185 27.685 ( -15.393 -0.684 -2.902) 15.679 28.423 ( -16.860 -5.341 0.628) 17.697 28.606 ( -4.477 -1.075 3.167) 5.588 28.780 ( 0.048 -0.355 0.373) 0.517 29.148 ( 3.682 -5.981 6.199) 9.368 29.251 ( -2.156 1.085 -7.958) 8.316 29.886 ( 4.027 0.321 -0.983) 4.157 30.454 ( 18.323 3.680 -4.633) 19.254 ======================= Grid point 140 (66/186) ======================= q-point: ( 0.12 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 11.995 0.000 6.969) 13.873 1.475 ( 16.351 0.000 17.109) 23.666 1.907 ( 5.867 0.000 0.216) 5.871 2.278 ( 5.090 0.000 17.307) 18.040 2.661 ( 6.322 0.000 6.537) 9.094 2.666 ( -4.909 -0.000 1.212) 5.057 3.265 ( 29.112 0.000 18.069) 34.264 3.671 ( -0.732 -0.000 -5.827) 5.873 4.805 ( 0.723 0.000 2.098) 2.219 5.109 ( -12.608 -0.000 36.788) 38.889 5.259 ( -21.862 -0.000 4.560) 22.333 5.413 ( -13.703 -0.000 20.693) 24.818 5.721 ( -12.313 -0.000 30.755) 33.128 5.859 ( 7.872 0.000 -4.442) 9.039 6.279 ( -0.898 -0.000 12.191) 12.224 6.849 ( 2.629 0.000 -12.850) 13.116 7.030 ( -2.456 -0.000 3.321) 4.130 7.136 ( -0.046 -0.000 3.078) 3.078 7.509 ( -8.252 -0.000 2.577) 8.645 7.684 ( 2.980 0.000 -7.512) 8.082 8.095 ( 4.304 0.000 -5.347) 6.864 8.444 ( -7.561 -0.000 5.374) 9.277 8.450 ( 8.865 0.000 -0.384) 8.873 8.650 ( 1.365 0.000 -4.192) 4.408 9.011 ( 5.785 0.000 -2.963) 6.500 9.483 ( 3.232 0.000 0.413) 3.258 9.877 ( 9.893 0.000 6.891) 12.056 10.147 ( 20.333 0.000 -0.175) 20.334 10.619 ( -3.638 -0.000 -6.698) 7.622 11.088 ( -6.830 -0.000 5.320) 8.657 11.307 ( -2.597 -0.000 5.206) 5.818 11.469 ( 2.687 0.000 -18.414) 18.609 11.839 ( 0.204 0.000 -15.846) 15.848 11.850 ( 0.657 0.000 8.111) 8.138 12.304 ( 0.167 0.000 -11.346) 11.347 12.794 ( 11.626 0.000 -14.072) 18.253 13.334 ( -0.943 -0.000 -19.337) 19.360 13.859 ( -4.405 -0.000 -22.341) 22.771 14.431 ( -8.988 -0.000 -3.410) 9.613 14.922 ( -20.577 -0.000 15.677) 25.868 15.186 ( 3.257 0.000 5.471) 6.367 15.330 ( -1.855 -0.000 21.592) 21.671 15.562 ( -13.749 -0.000 9.684) 16.817 15.977 ( -8.543 -0.000 11.330) 14.190 18.311 ( 7.276 0.000 -4.111) 8.357 18.721 ( -3.817 -0.000 -3.210) 4.987 19.779 ( 5.885 0.000 -13.797) 15.000 20.180 ( 0.614 0.000 -14.398) 14.411 25.754 ( 11.938 0.000 13.718) 18.185 25.960 ( -2.611 -0.000 11.676) 11.964 26.545 ( -1.185 -0.000 -5.113) 5.249 26.952 ( -1.693 -0.000 -6.143) 6.372 27.597 ( 7.735 0.000 13.193) 15.293 28.258 ( -4.051 -0.000 12.052) 12.715 28.543 ( -1.366 -0.000 0.675) 1.523 28.725 ( -3.777 -0.000 3.796) 5.355 29.030 ( -5.022 -0.000 -6.875) 8.514 29.295 ( -1.817 -0.000 5.884) 6.158 29.848 ( 1.733 0.000 -10.912) 11.048 31.120 ( 13.401 0.000 -19.128) 23.355 ======================= Grid point 141 (67/186) ======================= q-point: ( 0.25 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 13.316 1.212 4.129) 13.994 1.743 ( 15.620 -1.630 10.933) 19.136 1.970 ( 5.085 1.831 -1.044) 5.504 2.430 ( 4.642 -3.750 14.812) 15.969 2.571 ( -5.486 3.604 -0.085) 6.564 2.776 ( 5.423 -3.814 -0.027) 6.629 3.524 ( 14.905 8.438 5.319) 17.935 3.870 ( 14.085 -15.608 9.359) 23.013 4.698 ( -14.926 11.637 -1.324) 18.973 4.927 ( -5.973 10.222 13.682) 18.094 5.133 ( -8.226 -3.622 30.145) 31.456 5.393 ( -19.225 -6.738 32.690) 38.518 5.721 ( -7.524 -5.687 21.637) 23.603 5.951 ( 7.271 -1.381 -6.028) 9.545 6.351 ( 1.866 -3.376 11.361) 11.998 6.747 ( -0.839 9.201 -8.850) 12.794 7.059 ( -0.129 -4.696 1.608) 4.965 7.152 ( 1.078 -0.362 0.784) 1.381 7.450 ( -5.224 -1.946 5.247) 7.656 7.695 ( 1.313 -0.554 -7.437) 7.572 8.111 ( 1.165 1.745 -5.240) 5.644 8.332 ( -9.407 -1.744 4.498) 10.572 8.573 ( 6.845 -0.737 1.318) 7.010 8.639 ( -0.084 0.106 -2.329) 2.333 9.103 ( 10.753 2.405 -1.192) 11.083 9.517 ( 3.003 -0.100 -2.237) 3.746 9.944 ( 6.011 6.866 0.011) 9.125 10.392 ( 18.971 1.754 -0.083) 19.052 10.599 ( -3.440 -6.096 -8.228) 10.802 11.041 ( -6.423 -2.947 5.517) 8.965 11.338 ( 1.063 -2.874 9.072) 9.575 11.449 ( 2.566 -0.376 -15.105) 15.326 11.776 ( 0.297 0.817 -16.105) 16.128 11.885 ( -0.097 -0.312 7.386) 7.393 12.232 ( -3.667 1.148 -12.525) 13.101 12.912 ( 13.530 0.186 -8.974) 16.236 13.208 ( -4.870 4.501 -13.484) 15.026 13.734 ( -5.823 -2.838 -22.347) 23.267 14.251 ( -6.805 9.860 -2.093) 12.162 14.727 ( -21.125 -3.993 17.728) 27.865 15.104 ( 0.565 12.703 6.586) 14.320 15.328 ( -5.869 2.561 18.762) 19.824 15.578 ( -5.700 -14.194 7.839) 17.187 16.035 ( 3.618 -2.774 7.160) 8.488 18.348 ( 5.793 4.237 -2.722) 7.676 18.637 ( -4.702 2.752 -4.176) 6.865 19.827 ( 4.848 -4.097 -14.882) 16.180 20.143 ( 2.033 0.440 -14.642) 14.789 25.951 ( -0.018 -0.200 10.950) 10.951 25.971 ( 9.155 1.714 15.654) 18.216 26.526 ( -0.355 -1.472 -5.090) 5.310 26.922 ( -1.768 -1.285 -1.446) 2.621 27.729 ( 5.737 0.702 12.682) 13.937 28.269 ( -2.226 -2.627 7.830) 8.554 28.519 ( -0.315 1.357 0.874) 1.645 28.710 ( -4.401 -2.482 5.129) 7.200 28.939 ( -8.855 -1.995 -6.386) 11.098 29.284 ( -4.220 -1.205 6.901) 8.178 29.859 ( 5.637 -1.033 -14.328) 15.432 31.130 ( 9.269 8.523 -19.317) 23.059 ======================= Grid point 142 (68/186) ======================= q-point: ( 0.38 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 11.924 3.898 4.264) 13.250 1.901 ( 6.364 5.594 -4.954) 9.815 1.998 ( 3.875 -0.362 7.445) 8.401 2.409 ( -5.871 6.277 -0.143) 8.596 2.610 ( 4.701 -3.458 11.557) 12.947 2.875 ( 1.855 -3.828 -2.923) 5.162 3.593 ( 6.873 3.338 2.095) 7.922 4.185 ( -15.764 11.803 5.027) 20.325 4.378 ( 11.880 -9.059 17.211) 22.791 4.856 ( 2.014 7.847 10.039) 12.900 5.201 ( -8.049 -7.053 18.608) 21.466 5.344 ( -14.862 -1.670 41.304) 43.928 5.809 ( -4.505 -7.128 16.440) 18.477 6.023 ( 6.645 0.692 -7.053) 9.715 6.476 ( 1.943 -5.552 7.575) 9.591 6.573 ( -2.106 9.965 2.391) 10.462 7.152 ( 2.733 -5.343 -0.645) 6.036 7.168 ( 0.535 -0.251 -0.238) 0.638 7.458 ( -2.912 -3.615 4.251) 6.295 7.663 ( -3.194 0.877 -3.994) 5.189 8.039 ( -0.828 2.704 -6.428) 7.022 8.336 ( -2.466 -5.381 2.785) 6.541 8.563 ( -4.955 1.644 3.032) 6.037 8.686 ( 3.728 -0.920 -3.135) 4.957 9.174 ( 8.355 5.116 1.032) 9.852 9.546 ( 7.253 5.222 -1.488) 9.060 9.899 ( 2.094 2.820 -4.029) 5.345 10.495 ( -4.328 -1.617 -7.267) 8.611 10.654 ( 14.684 3.559 1.602) 15.194 11.040 ( -5.770 -3.987 6.404) 9.498 11.415 ( 2.834 -0.595 -12.566) 12.896 11.474 ( 3.280 -3.284 6.171) 7.722 11.730 ( 0.833 -1.720 -15.624) 15.741 11.909 ( -0.991 -1.278 5.837) 6.057 12.110 ( -4.296 2.657 -10.299) 11.471 13.012 ( -3.028 9.069 -8.411) 12.734 13.055 ( 10.163 -2.361 -10.416) 14.743 13.615 ( -9.382 -1.756 -17.956) 20.335 14.068 ( -1.424 5.129 4.071) 6.701 14.642 ( -14.266 -7.278 10.226) 19.002 15.000 ( 2.266 7.293 4.671) 8.952 15.272 ( -6.149 3.448 17.379) 18.754 15.733 ( -1.471 -10.020 5.108) 11.342 16.142 ( 5.158 -1.274 5.333) 7.528 18.339 ( 5.499 5.757 -2.537) 8.355 18.508 ( -5.421 3.881 -3.505) 7.532 19.904 ( 3.889 -6.865 -15.999) 17.839 20.117 ( 3.677 1.415 -14.343) 14.875 25.897 ( -8.487 1.279 9.711) 12.960 26.153 ( 14.895 6.016 14.618) 21.720 26.538 ( 0.294 -2.408 -4.162) 4.818 26.944 ( -0.919 -3.611 4.161) 5.585 27.801 ( 2.262 1.848 12.717) 13.048 28.317 ( -2.897 -5.018 5.290) 7.846 28.528 ( 1.772 -0.777 2.114) 2.866 28.707 ( -4.996 -2.964 5.053) 7.699 28.810 ( -13.040 -2.058 -4.542) 13.961 29.279 ( -4.004 -2.584 4.884) 6.823 29.911 ( 8.300 -1.258 -16.533) 18.542 31.014 ( 7.225 13.155 -18.411) 23.754 ======================= Grid point 143 (69/186) ======================= q-point: (-0.50 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 7.551 7.012 3.843) 10.997 1.798 ( 0.741 8.729 -6.552) 10.939 2.026 ( -3.978 4.507 5.256) 7.985 2.264 ( 0.595 7.369 2.780) 7.899 2.701 ( -1.144 0.160 8.379) 8.458 2.901 ( -2.199 -1.286 -0.230) 2.558 3.487 ( -13.662 11.623 5.854) 18.868 3.903 ( -0.088 5.737 4.772) 7.463 4.728 ( 4.830 0.247 12.051) 12.985 4.865 ( 6.631 -5.161 18.836) 20.625 5.199 ( -16.223 -6.787 21.233) 27.570 5.437 ( 4.378 -2.642 27.970) 28.434 5.886 ( -4.341 -3.310 14.152) 15.168 6.046 ( 6.484 3.697 -7.215) 10.381 6.442 ( -2.741 5.320 6.726) 9.003 6.615 ( 1.169 -5.762 10.603) 12.124 7.150 ( -4.495 -0.286 0.952) 4.604 7.253 ( 3.454 -3.195 -2.347) 5.258 7.479 ( -0.403 -1.181 -0.391) 1.308 7.579 ( -6.368 -0.177 -2.895) 6.997 8.030 ( 3.309 -1.680 -3.623) 5.187 8.375 ( -0.702 -1.049 0.158) 1.272 8.498 ( -7.317 -3.130 4.453) 9.119 8.682 ( 0.142 2.784 -5.147) 5.854 9.178 ( 4.182 6.285 1.674) 7.733 9.504 ( 8.089 14.832 1.403) 16.952 9.952 ( 3.609 -6.411 -2.635) 7.815 10.364 ( -9.828 2.229 -5.307) 11.390 10.794 ( 14.034 5.760 -1.211) 15.218 11.033 ( -6.512 -3.824 6.899) 10.228 11.395 ( 3.491 2.164 -9.582) 10.425 11.565 ( 1.574 -3.262 -0.780) 3.704 11.740 ( 2.163 -2.370 -10.227) 10.718 11.936 ( -1.435 -2.151 -3.393) 4.266 12.038 ( 2.073 -0.497 0.012) 2.132 12.806 ( -2.672 9.360 -12.832) 16.106 13.184 ( 8.700 -3.126 -8.536) 12.583 13.424 ( -11.897 0.520 -11.081) 16.266 14.135 ( 5.717 -6.233 4.633) 9.644 14.602 ( -11.351 -5.734 5.463) 13.841 14.996 ( 5.609 2.746 3.553) 7.185 15.212 ( -5.185 3.103 16.835) 17.887 15.822 ( -3.639 -4.426 4.436) 7.246 16.233 ( 5.990 0.496 4.185) 7.324 18.288 ( -0.468 4.985 -6.570) 8.260 18.431 ( 2.337 1.700 0.778) 2.993 19.993 ( 2.380 -7.833 -16.784) 18.674 20.095 ( 5.621 2.865 -13.659) 15.046 25.786 ( -9.277 2.908 8.913) 13.190 26.266 ( 12.813 9.135 10.357) 18.839 26.564 ( 0.585 -2.334 -3.585) 4.318 27.010 ( -1.348 -3.504 10.572) 11.219 27.836 ( 0.094 1.267 10.556) 10.633 28.361 ( -6.295 -6.633 5.860) 10.861 28.565 ( -5.573 -4.048 -0.442) 6.903 28.677 ( -5.449 -0.479 0.156) 5.472 28.704 ( -4.376 -3.097 6.318) 8.286 29.284 ( -3.046 -2.684 2.021) 4.535 29.973 ( 8.802 0.072 -16.401) 18.614 30.843 ( 6.119 14.043 -18.352) 23.905 ======================= Grid point 144 (70/186) ======================= q-point: (-0.38 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( -1.207 13.179 -0.282) 13.237 1.723 ( -0.238 9.976 4.977) 11.151 1.819 ( -5.999 10.845 2.576) 12.659 2.271 ( 7.053 3.097 4.394) 8.868 2.632 ( -5.803 6.260 7.933) 11.653 2.851 ( -8.758 -0.579 3.485) 9.444 3.139 ( -15.121 13.960 12.511) 24.084 3.912 ( 6.171 4.304 1.988) 7.782 4.710 ( 0.677 4.066 4.219) 5.898 5.130 ( -5.323 -8.909 37.235) 38.654 5.182 ( -8.319 -7.819 11.750) 16.383 5.647 ( 7.686 -2.350 17.943) 19.661 5.867 ( -3.970 3.511 8.589) 10.093 6.073 ( 6.329 1.650 -0.798) 6.589 6.378 ( -3.912 4.041 14.560) 15.609 6.749 ( 1.181 -7.380 5.105) 9.051 7.052 ( -9.788 1.330 0.567) 9.894 7.281 ( 0.677 3.159 -0.690) 3.303 7.497 ( 2.624 -0.876 -3.280) 4.291 7.529 ( -4.150 -6.376 -5.884) 9.617 8.101 ( 1.351 -2.892 -1.302) 3.447 8.356 ( 1.633 3.546 0.928) 4.013 8.500 ( -5.679 -6.501 3.452) 9.297 8.607 ( -0.288 4.419 -3.843) 5.863 9.117 ( 1.037 7.228 -2.487) 7.714 9.393 ( 6.286 14.644 5.078) 16.725 10.058 ( -2.272 -2.770 -0.737) 3.658 10.193 ( -4.044 5.282 -0.688) 6.687 10.783 ( -0.163 3.941 -6.589) 7.679 11.073 ( 2.714 -1.502 4.022) 5.079 11.412 ( 5.235 0.432 -0.380) 5.266 11.607 ( 1.142 -2.686 -7.723) 8.256 11.753 ( 2.102 0.097 -6.563) 6.892 11.918 ( -1.129 -1.693 -5.470) 5.836 12.160 ( 7.550 -4.943 -1.436) 9.138 12.618 ( -0.460 7.381 -13.048) 14.998 13.282 ( -5.529 -2.320 -9.627) 11.341 13.316 ( 5.162 -8.054 -5.703) 11.137 14.329 ( 3.422 -8.467 0.352) 9.140 14.567 ( -6.470 -4.867 6.887) 10.629 15.077 ( 6.481 -0.186 5.940) 8.794 15.181 ( -2.914 1.772 15.127) 15.506 15.783 ( -7.770 1.708 4.220) 9.005 16.315 ( 6.457 0.727 4.729) 8.036 18.182 ( -4.070 1.776 -6.770) 8.097 18.506 ( 8.550 -1.020 0.775) 8.645 20.013 ( 2.571 1.192 -15.914) 16.164 20.124 ( 5.486 -3.817 -14.309) 15.793 25.661 ( -7.956 3.549 8.675) 12.294 26.297 ( 9.734 10.853 5.630) 15.627 26.590 ( 1.328 -1.539 -3.630) 4.160 27.058 ( -3.693 -1.731 12.783) 13.418 27.815 ( -8.233 0.288 6.926) 10.763 28.351 ( -11.370 -5.322 3.923) 13.153 28.526 ( -5.397 -4.037 4.155) 7.918 28.681 ( -1.318 -3.436 0.783) 3.763 28.772 ( 3.411 -3.365 10.478) 11.522 29.286 ( -1.865 -1.749 -0.823) 2.686 30.004 ( 7.428 3.244 -12.082) 14.550 30.673 ( 5.671 11.248 -19.903) 23.554 ======================= Grid point 145 (71/186) ======================= q-point: (-0.25 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( -3.204 16.942 5.605) 18.131 1.505 ( -3.862 15.340 12.427) 20.116 1.740 ( 2.591 3.267 3.695) 5.572 2.332 ( 6.487 4.367 3.455) 8.549 2.504 ( -2.426 6.146 9.659) 11.703 2.714 ( -17.136 1.159 10.105) 19.928 2.856 ( -4.350 13.654 14.036) 20.059 3.923 ( 6.342 5.929 -2.246) 8.968 4.690 ( -1.443 0.546 6.069) 6.262 5.176 ( -13.176 -6.874 26.486) 30.371 5.322 ( -4.595 -7.572 19.200) 21.144 5.720 ( -7.442 -0.501 7.514) 10.587 5.829 ( 0.969 3.103 16.605) 16.920 6.113 ( 4.430 4.613 -0.573) 6.421 6.335 ( -2.746 4.157 18.724) 19.376 6.840 ( -7.157 -6.038 -2.674) 9.738 6.944 ( 1.554 1.037 0.209) 1.880 7.208 ( -2.131 4.868 4.006) 6.654 7.532 ( 1.086 -2.418 -4.046) 4.837 7.623 ( 2.501 -10.658 -6.266) 12.614 8.070 ( -4.021 3.223 -5.001) 7.181 8.342 ( 2.969 4.125 2.787) 5.796 8.542 ( -0.232 4.210 1.824) 4.594 8.561 ( -0.893 -6.785 0.993) 6.915 9.002 ( 0.238 7.491 -5.479) 9.284 9.332 ( 6.928 8.535 7.397) 13.250 9.909 ( -12.153 4.099 -0.468) 12.834 10.122 ( 2.159 10.129 1.751) 10.504 10.736 ( 0.909 -0.730 -6.110) 6.220 11.134 ( 3.389 0.173 3.698) 5.019 11.473 ( 4.816 3.162 3.420) 6.700 11.609 ( -0.862 -2.519 -11.162) 11.475 11.755 ( 2.057 -0.328 -7.419) 7.706 11.913 ( -1.780 -2.075 -4.052) 4.888 12.260 ( 6.767 0.446 -15.736) 17.135 12.565 ( 3.408 -3.112 -8.437) 9.617 13.268 ( -0.086 -5.853 -13.873) 15.058 13.562 ( 9.873 -16.251 2.293) 19.153 14.360 ( -8.525 -5.452 -6.106) 11.818 14.693 ( 2.941 -8.646 12.438) 15.430 15.143 ( -3.356 -0.383 14.895) 15.273 15.235 ( 7.300 0.378 9.186) 11.739 15.627 ( -9.204 6.154 2.653) 11.385 16.412 ( 4.754 -1.500 6.113) 7.888 18.105 ( -3.601 -0.824 -5.558) 6.674 18.647 ( 7.934 -3.119 -0.486) 8.539 19.954 ( 4.493 5.442 -15.569) 17.093 20.192 ( 3.126 -4.712 -14.413) 15.482 25.564 ( -4.487 3.202 8.828) 10.408 26.246 ( 4.504 12.168 2.841) 13.282 26.609 ( 1.978 -0.001 -4.299) 4.732 27.053 ( -5.650 -1.338 7.487) 9.475 27.666 ( -16.543 0.137 6.382) 17.732 28.304 ( -6.350 -1.707 8.114) 10.444 28.534 ( -4.636 -3.234 3.134) 6.463 28.747 ( 1.616 -3.143 4.008) 5.343 28.941 ( 6.730 -6.795 10.323) 14.073 29.274 ( -1.074 -0.087 -3.732) 3.885 29.989 ( 4.819 5.564 -4.369) 8.559 30.565 ( 7.715 5.310 -20.382) 22.431 ======================= Grid point 146 (72/186) ======================= q-point: (-0.12 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( 4.514 12.510 13.514) 18.961 1.309 ( -4.485 11.649 14.288) 18.972 1.788 ( 4.987 0.734 5.152) 7.208 2.297 ( -0.052 9.990 13.365) 16.686 2.499 ( 2.077 1.638 7.818) 8.254 2.589 ( 3.014 3.094 16.731) 17.280 2.744 ( -1.156 5.405 9.530) 11.017 3.881 ( 4.215 8.222 -5.577) 10.792 4.707 ( -2.456 -3.240 7.206) 8.274 5.189 ( -13.550 -5.026 28.070) 31.572 5.360 ( -13.123 -7.309 9.990) 18.040 5.667 ( -8.804 -2.764 17.053) 19.390 5.841 ( -1.224 4.586 16.735) 17.395 6.018 ( -3.478 9.088 -0.838) 9.767 6.313 ( -2.316 4.542 18.217) 18.917 6.781 ( -3.830 -3.325 -8.394) 9.807 7.027 ( 4.280 -2.748 1.294) 5.248 7.143 ( -0.938 4.214 4.264) 6.068 7.563 ( -1.628 -4.315 -3.383) 5.720 7.806 ( 5.918 -7.851 -5.714) 11.371 7.932 ( -3.009 3.960 -5.768) 7.616 8.325 ( 2.518 3.394 -0.128) 4.228 8.496 ( 0.292 4.959 9.149) 10.410 8.625 ( 4.053 0.930 -6.231) 7.491 8.941 ( -0.785 -2.526 -0.753) 2.750 9.382 ( 6.173 1.052 6.257) 8.852 9.725 ( -4.811 6.383 5.096) 9.479 9.988 ( 3.314 11.506 -1.634) 12.085 10.748 ( 1.605 0.828 -2.780) 3.315 11.175 ( 0.728 0.551 6.043) 6.112 11.427 ( 0.213 7.596 0.762) 7.637 11.590 ( -2.226 -3.537 -18.446) 18.913 11.767 ( 1.938 -0.708 -2.211) 3.024 11.900 ( -1.095 -1.498 -6.348) 6.614 12.276 ( 7.556 1.361 -13.203) 15.273 12.648 ( 4.510 -5.660 -15.853) 17.426 13.318 ( 3.217 -6.398 -20.156) 21.391 13.932 ( 10.078 -11.932 -8.821) 17.937 14.344 ( -11.722 -16.160 3.071) 20.199 14.876 ( -1.807 -9.374 12.873) 16.026 15.162 ( -2.228 -0.531 18.280) 18.423 15.305 ( -6.838 2.126 15.424) 17.005 15.485 ( 6.117 5.040 -3.976) 8.867 16.471 ( -6.443 -2.426 5.295) 8.685 18.092 ( 1.002 -2.948 -3.281) 4.523 18.752 ( 1.887 -3.017 -1.750) 3.966 19.871 ( 4.723 7.233 -15.461) 17.710 20.225 ( 1.483 -3.048 -13.940) 14.346 25.534 ( 0.658 2.079 9.459) 9.707 26.103 ( -1.650 11.736 4.926) 12.835 26.607 ( 1.161 1.026 -4.651) 4.902 27.020 ( -3.686 -1.991 -3.705) 5.593 27.510 ( -9.892 1.696 13.604) 16.905 28.287 ( -4.641 -0.310 12.385) 13.230 28.531 ( -3.700 -3.087 1.990) 5.213 28.793 ( 0.354 0.384 3.122) 3.165 29.150 ( 5.754 -5.152 5.973) 9.763 29.229 ( -1.074 1.723 -7.017) 7.304 29.948 ( 1.124 4.324 -2.499) 5.119 30.634 ( 15.514 -4.271 -14.278) 21.513 ======================= Grid point 149 (73/186) ======================= q-point: ( 0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( 14.546 0.000 0.151) 14.547 1.948 ( 12.190 0.000 8.873) 15.077 2.051 ( 5.341 0.000 -3.540) 6.408 2.503 ( 1.713 0.000 15.085) 15.182 2.537 ( -3.059 -0.000 -0.581) 3.114 2.814 ( 5.963 0.000 -2.392) 6.425 3.662 ( 1.263 0.000 1.659) 2.085 4.098 ( 26.097 0.000 18.839) 32.187 4.586 ( -19.012 -0.000 -3.695) 19.368 4.961 ( -16.551 -0.000 16.530) 23.392 5.035 ( -0.234 -0.000 14.608) 14.610 5.310 ( -10.144 -0.000 40.604) 41.852 5.673 ( -7.394 -0.000 30.631) 31.511 6.013 ( 8.013 0.000 -10.753) 13.411 6.411 ( 5.595 0.000 7.184) 9.106 6.775 ( -0.536 -0.000 -10.801) 10.815 7.040 ( 1.424 0.000 6.069) 6.234 7.181 ( 3.744 0.000 1.688) 4.107 7.386 ( -6.284 -0.000 9.259) 11.190 7.690 ( 2.040 0.000 -10.303) 10.503 8.058 ( -10.389 -0.000 2.245) 10.629 8.243 ( -2.479 -0.000 3.893) 4.615 8.630 ( -0.570 -0.000 -4.666) 4.700 8.669 ( 7.452 0.000 -1.415) 7.585 9.256 ( 10.760 0.000 -0.636) 10.779 9.539 ( 4.288 0.000 -3.909) 5.803 10.078 ( 4.438 0.000 -4.464) 6.295 10.435 ( -5.737 -0.000 -10.054) 11.576 10.659 ( 16.876 0.000 0.676) 16.889 11.000 ( -0.071 -0.000 7.959) 7.959 11.376 ( 2.364 0.000 8.361) 8.689 11.407 ( 0.318 0.000 -12.150) 12.154 11.719 ( -1.553 -0.000 -16.671) 16.743 11.899 ( -1.733 -0.000 7.328) 7.530 12.149 ( -4.089 -0.000 -10.209) 10.997 13.022 ( 6.678 0.000 -11.851) 13.604 13.164 ( 0.005 0.000 -0.615) 0.615 13.546 ( -7.379 -0.000 -24.394) 25.485 14.256 ( -1.337 -0.000 -11.222) 11.301 14.454 ( -24.723 -0.000 25.609) 35.596 15.263 ( -9.651 -0.000 9.325) 13.420 15.299 ( -0.696 -0.000 10.887) 10.909 15.462 ( 6.590 0.000 5.592) 8.643 16.120 ( 6.153 0.000 9.023) 10.921 18.428 ( 3.846 0.000 -1.716) 4.212 18.581 ( -5.105 -0.000 -5.698) 7.650 19.794 ( 3.270 0.000 -16.641) 16.959 20.133 ( 4.004 0.000 -14.380) 14.927 25.914 ( -7.028 -0.000 11.123) 13.157 26.252 ( 17.371 0.000 18.712) 25.532 26.498 ( 0.723 0.000 -5.646) 5.692 26.876 ( -2.821 -0.000 -0.432) 2.854 27.834 ( 1.619 0.000 15.678) 15.762 28.248 ( -0.672 -0.000 1.892) 2.008 28.509 ( -2.316 -0.000 -1.547) 2.785 28.670 ( -3.053 -0.000 8.635) 9.159 28.782 ( -11.062 -0.000 -3.566) 11.623 29.238 ( -5.071 -0.000 7.651) 9.179 29.890 ( 8.844 0.000 -17.710) 19.795 31.214 ( 6.305 0.000 -20.538) 21.484 ======================= Grid point 150 (74/186) ======================= q-point: ( 0.38 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( 11.829 2.754 -0.134) 12.146 2.039 ( 3.638 6.664 -5.639) 9.458 2.088 ( 5.502 1.006 5.950) 8.166 2.463 ( -0.203 5.715 4.285) 7.146 2.608 ( -1.105 -5.333 8.609) 10.187 2.886 ( 5.539 0.006 -1.632) 5.775 3.677 ( -0.121 2.134 5.845) 6.223 4.209 ( -14.659 14.478 1.319) 20.645 4.515 ( 16.254 -6.774 23.814) 29.618 4.889 ( -13.729 -8.355 9.982) 18.919 5.061 ( -2.001 3.250 16.337) 16.777 5.348 ( -4.391 -2.707 31.453) 31.873 5.736 ( -5.651 -4.712 28.101) 29.048 6.073 ( 6.306 -1.210 -10.900) 12.651 6.496 ( 4.203 0.507 -1.624) 4.534 6.697 ( 1.217 6.857 3.326) 7.718 7.126 ( 2.734 -4.272 5.300) 7.336 7.219 ( 2.636 4.427 2.172) 5.591 7.381 ( -2.197 -4.996 7.260) 9.083 7.647 ( -1.576 3.135 -6.790) 7.644 7.952 ( -9.119 -3.413 3.959) 10.511 8.268 ( -0.876 -3.610 3.118) 4.850 8.575 ( 0.362 4.576 -6.760) 8.171 8.729 ( 3.925 0.630 -4.562) 6.051 9.346 ( 7.996 4.435 0.733) 9.173 9.638 ( 9.218 -4.028 -1.974) 10.251 10.002 ( 0.202 9.663 -6.025) 11.389 10.354 ( -7.219 -2.633 -7.328) 10.618 10.851 ( 8.975 -3.556 4.135) 10.502 11.034 ( 4.464 5.653 3.970) 8.224 11.366 ( 0.061 -3.354 -13.732) 14.136 11.482 ( 2.458 -3.449 6.407) 7.680 11.627 ( -3.858 -2.188 -18.309) 18.839 11.894 ( -3.125 -0.444 6.741) 7.443 12.081 ( -0.277 1.345 -4.143) 4.364 12.975 ( -3.415 2.277 -7.075) 8.179 13.205 ( 8.297 4.650 -6.012) 11.252 13.398 ( -8.467 -3.608 -16.058) 18.509 14.124 ( -2.881 5.871 1.048) 6.624 14.379 ( -12.647 -9.705 9.636) 18.627 15.144 ( -0.795 6.638 5.620) 8.734 15.302 ( -3.932 2.134 14.747) 15.410 15.635 ( 5.811 -7.375 -0.052) 9.389 16.227 ( 5.146 -0.353 9.033) 10.402 18.426 ( -0.351 3.638 -9.301) 9.994 18.490 ( -2.194 1.754 1.885) 3.383 19.801 ( 2.485 -4.684 -18.263) 19.017 20.140 ( 5.447 0.623 -13.910) 14.951 25.846 ( -8.542 1.211 10.409) 13.520 26.478 ( 13.129 5.149 12.673) 18.960 26.511 ( 3.135 -0.603 -0.909) 3.319 26.877 ( -2.080 -4.851 3.449) 6.305 27.873 ( -3.083 1.092 17.566) 17.868 28.258 ( -0.208 -1.486 -0.890) 1.744 28.457 ( -8.205 -2.759 -3.129) 9.205 28.665 ( -5.764 -0.303 0.650) 5.808 28.678 ( -0.927 0.166 10.376) 10.418 29.216 ( -3.937 -1.637 5.950) 7.320 29.948 ( 9.514 -0.936 -19.810) 21.996 31.161 ( 4.712 7.009 -20.397) 22.077 ======================= Grid point 151 (75/186) ======================= q-point: (-0.50 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.909 ( 4.004 6.362 -3.126) 8.141 1.937 ( 5.048 10.349 -1.342) 11.593 2.097 ( 0.549 6.222 3.083) 6.965 2.419 ( 4.883 6.496 5.697) 9.925 2.654 ( -6.172 -3.780 7.144) 10.169 2.913 ( 1.312 3.749 0.832) 4.058 3.516 ( -12.882 12.695 8.029) 19.788 4.011 ( 2.771 4.029 5.941) 7.694 4.814 ( 0.135 -2.308 17.581) 17.733 4.882 ( -4.132 -8.448 13.089) 16.117 5.023 ( -8.865 0.971 25.547) 27.059 5.526 ( 7.235 -6.846 15.361) 18.308 5.818 ( -5.956 -4.823 20.612) 21.991 6.125 ( 5.337 -0.277 -8.366) 9.927 6.455 ( -3.458 2.603 -1.427) 4.558 6.701 ( 6.158 4.555 11.025) 13.425 7.122 ( -8.032 4.812 6.245) 11.255 7.236 ( 2.095 -4.518 2.108) 5.408 7.493 ( 7.027 -1.879 -3.076) 7.898 7.527 ( -5.670 4.780 3.541) 8.218 7.965 ( -2.747 -6.826 2.639) 7.817 8.322 ( -1.680 -5.153 1.476) 5.618 8.495 ( 2.856 5.936 -5.077) 8.316 8.720 ( 2.456 2.886 -8.047) 8.895 9.340 ( 4.324 8.164 1.934) 9.439 9.782 ( 7.491 10.864 -1.878) 13.329 9.893 ( 2.042 -5.682 -0.387) 6.050 10.258 ( -7.648 -0.176 -3.222) 8.300 10.900 ( -9.723 2.488 -0.574) 10.053 11.053 ( 13.115 2.346 0.586) 13.336 11.378 ( -0.430 -3.380 -10.818) 11.342 11.506 ( -2.566 -3.704 -3.150) 5.498 11.657 ( 3.575 -7.180 -14.128) 16.245 11.879 ( -3.408 -0.701 2.729) 4.422 12.106 ( 6.190 -0.107 4.081) 7.415 12.847 ( -1.318 7.828 -10.821) 13.420 13.144 ( -8.442 -2.062 -9.086) 12.573 13.337 ( 2.472 3.094 -2.444) 4.654 14.130 ( 4.036 -4.333 -0.157) 5.924 14.394 ( -8.718 -7.971 5.017) 12.834 15.115 ( 3.394 2.941 4.863) 6.620 15.268 ( -2.982 3.525 15.223) 15.908 15.757 ( 1.651 -3.155 -1.118) 3.732 16.316 ( 3.578 -0.399 7.871) 8.655 18.278 ( -4.816 4.818 -11.525) 13.388 18.505 ( 3.377 0.437 3.639) 4.984 19.854 ( 2.551 -7.504 -18.724) 20.332 20.150 ( 5.958 1.568 -13.515) 14.853 25.746 ( -8.511 2.397 9.483) 12.966 26.539 ( 1.856 -0.555 -2.406) 3.089 26.559 ( 8.425 7.147 6.474) 12.806 26.958 ( -2.845 -5.427 10.715) 12.343 27.844 ( -8.441 1.825 15.713) 17.930 28.273 ( -0.095 -1.363 -0.241) 1.388 28.396 ( -6.167 -4.930 1.008) 7.959 28.629 ( -2.858 -0.016 3.178) 4.274 28.726 ( 2.620 -0.538 10.387) 10.726 29.221 ( -2.710 -2.549 3.621) 5.192 30.011 ( 8.652 -1.524 -20.238) 22.062 31.014 ( 3.533 11.331 -20.172) 23.405 ======================= Grid point 152 (76/186) ======================= q-point: (-0.38 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( 0.389 11.924 -4.318) 12.688 1.879 ( 2.318 10.443 3.118) 11.142 1.973 ( 1.175 12.135 3.719) 12.746 2.452 ( 8.961 4.630 3.649) 10.726 2.623 ( -8.505 -1.804 9.239) 12.686 2.794 ( -6.034 9.459 4.853) 12.224 3.230 ( -8.310 11.862 9.619) 17.386 4.061 ( 6.080 3.406 8.037) 10.637 4.756 ( -3.584 2.407 -2.550) 5.014 5.016 ( -10.580 -3.185 30.966) 32.878 5.075 ( -3.769 -9.990 24.346) 26.584 5.697 ( -2.872 -2.884 7.319) 8.374 5.852 ( -4.451 -1.840 14.246) 15.038 6.176 ( 7.821 0.180 -4.705) 9.129 6.395 ( -4.821 -0.471 8.073) 9.415 6.761 ( 4.525 2.895 7.689) 9.380 6.966 ( -9.095 2.484 5.567) 10.949 7.315 ( 1.599 -0.789 -1.377) 2.253 7.406 ( -4.791 -1.217 2.092) 5.368 7.577 ( 6.820 3.682 -1.017) 7.817 8.053 ( 0.059 -5.153 2.785) 5.858 8.370 ( -0.977 -4.023 -0.414) 4.160 8.461 ( 3.530 3.312 -1.023) 4.947 8.676 ( 3.658 4.688 -6.695) 8.955 9.250 ( 1.153 10.232 -0.341) 10.302 9.626 ( -1.320 11.133 1.207) 11.275 9.998 ( -1.224 1.408 -0.162) 1.873 10.214 ( 0.739 -2.136 3.392) 4.076 10.719 ( -8.404 0.701 -8.000) 11.624 11.163 ( 7.269 2.283 1.238) 7.720 11.388 ( -2.657 -6.061 -6.784) 9.477 11.565 ( 4.806 -4.777 -7.536) 10.135 11.724 ( 2.218 -3.256 -12.338) 12.952 11.854 ( -2.998 -1.028 1.497) 3.505 12.231 ( 7.942 -1.544 -0.045) 8.090 12.672 ( -0.544 7.802 -14.217) 16.226 13.074 ( -7.985 -5.994 2.689) 10.340 13.346 ( 5.680 0.652 -4.157) 7.068 14.236 ( -0.325 -5.325 -8.703) 10.208 14.452 ( -1.041 -8.517 8.772) 12.271 15.158 ( 2.216 1.039 8.425) 8.774 15.256 ( 0.271 1.760 14.276) 14.387 15.749 ( -2.473 2.533 -1.588) 3.880 16.381 ( 1.292 -0.946 6.868) 7.052 18.127 ( -3.996 2.889 -10.998) 12.053 18.576 ( 4.109 -1.985 2.406) 5.158 19.929 ( 3.117 -6.999 -18.117) 19.671 20.151 ( 5.593 2.006 -13.395) 14.654 25.647 ( -6.400 2.601 9.057) 11.391 26.509 ( 0.587 6.643 3.314) 7.447 26.605 ( 5.116 0.333 -3.626) 6.280 26.982 ( -8.962 -3.695 8.982) 13.215 27.722 ( -11.551 3.714 14.771) 19.115 28.294 ( 0.835 -0.371 2.377) 2.547 28.458 ( 1.575 -3.185 5.951) 6.931 28.624 ( -0.792 -2.920 5.093) 5.924 28.824 ( 4.210 -2.360 10.327) 11.400 29.238 ( -1.532 -2.356 1.051) 3.000 30.060 ( 6.762 -0.827 -17.591) 18.864 30.815 ( 2.358 12.094 -20.692) 24.083 ======================= Grid point 153 (77/186) ======================= q-point: (-0.25 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( -1.407 13.187 -1.218) 13.318 1.704 ( -0.910 15.836 6.035) 16.971 1.906 ( 6.432 8.014 4.253) 11.122 2.494 ( 3.495 4.831 1.731) 6.209 2.588 ( -3.206 -1.175 9.929) 10.500 2.629 ( -1.438 8.212 11.044) 13.837 3.040 ( -2.078 11.484 10.388) 15.624 4.096 ( 6.211 6.609 6.257) 11.019 4.685 ( -2.588 0.542 -3.452) 4.348 5.048 ( -9.696 -3.764 32.398) 34.027 5.173 ( -12.786 -6.876 14.019) 20.181 5.602 ( -14.663 -1.591 14.855) 20.934 5.888 ( -1.304 -0.805 12.671) 12.763 6.207 ( 0.109 3.455 -3.679) 5.048 6.420 ( 1.540 -0.254 10.713) 10.827 6.702 ( -9.013 2.098 5.343) 10.686 6.972 ( 5.851 -1.636 2.839) 6.706 7.260 ( -1.301 4.045 1.426) 4.482 7.508 ( 3.819 -9.589 -3.720) 10.972 7.571 ( 2.968 4.038 0.097) 5.012 8.068 ( -1.441 3.015 -1.258) 3.571 8.391 ( -0.680 0.413 0.532) 0.957 8.511 ( 5.035 -4.058 0.496) 6.486 8.648 ( 4.437 5.516 1.663) 7.272 9.096 ( -1.558 9.880 -5.478) 11.404 9.486 ( -3.747 5.935 4.225) 8.193 9.899 ( -1.198 7.043 2.846) 7.690 10.213 ( -2.533 3.338 -1.958) 4.625 10.693 ( 1.777 -4.478 -3.747) 6.103 11.195 ( 2.197 1.478 2.451) 3.608 11.415 ( -3.601 -7.458 -10.667) 13.504 11.645 ( 5.170 4.047 -5.078) 8.301 11.733 ( 2.957 -2.855 -11.940) 12.628 11.847 ( -2.590 -1.688 2.755) 4.140 12.295 ( 3.978 -0.354 -12.037) 12.682 12.581 ( 4.087 1.852 -9.237) 10.269 13.117 ( -1.888 -7.702 -4.096) 8.925 13.478 ( 6.713 -10.233 4.110) 12.910 14.200 ( -5.219 -1.524 -11.629) 12.837 14.630 ( 2.217 -9.257 8.260) 12.603 15.170 ( -2.673 1.425 14.191) 14.511 15.322 ( -0.161 -0.697 14.065) 14.083 15.647 ( -0.165 6.019 -3.696) 7.065 16.415 ( -3.145 -1.757 6.236) 7.202 18.038 ( -1.249 -0.269 -8.918) 9.009 18.658 ( 1.154 -3.537 0.565) 3.763 19.981 ( 4.127 -1.874 -16.739) 17.342 20.148 ( 4.004 -0.024 -13.763) 14.334 25.591 ( -2.252 1.854 9.246) 9.695 26.386 ( -6.131 8.242 3.175) 10.752 26.635 ( 2.702 0.899 -4.263) 5.126 26.935 ( -7.608 -3.864 2.420) 8.870 27.602 ( -6.309 4.682 17.091) 18.810 28.316 ( 0.811 0.954 6.367) 6.489 28.478 ( -1.956 0.810 4.523) 4.994 28.744 ( 3.878 -4.260 6.725) 8.855 28.983 ( 7.526 -5.694 9.192) 13.174 29.245 ( -1.072 -0.904 -1.901) 2.362 30.073 ( 3.660 1.978 -10.702) 11.483 30.635 ( 3.316 6.335 -21.792) 22.935 ======================= Grid point 154 (78/186) ======================= q-point: (-0.12 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.399 ( -2.503 9.033 7.643) 12.094 1.545 ( 8.081 14.674 5.924) 17.769 1.898 ( 3.303 4.187 2.573) 5.921 2.434 ( -1.233 5.878 8.631) 10.515 2.607 ( -3.457 -2.169 8.181) 9.142 2.665 ( 11.617 4.212 7.241) 14.323 2.967 ( 9.293 8.766 11.073) 16.906 4.070 ( 5.760 10.793 2.880) 12.568 4.661 ( -1.948 -2.179 0.983) 3.084 5.030 ( -25.258 -7.282 3.320) 26.496 5.092 ( -8.334 -2.789 31.350) 32.558 5.581 ( -11.169 -4.433 32.344) 34.505 5.913 ( -1.243 1.080 10.356) 10.486 6.080 ( -5.347 7.259 -2.984) 9.497 6.436 ( -0.026 6.526 14.498) 15.899 6.621 ( -6.791 -5.279 -2.240) 8.888 7.071 ( 5.995 0.013 -0.275) 6.002 7.208 ( 0.038 3.796 1.481) 4.074 7.522 ( -0.339 1.438 -1.476) 2.088 7.737 ( 6.343 -11.216 -5.223) 13.903 7.959 ( -1.447 5.846 -3.574) 7.003 8.371 ( 0.831 1.642 1.175) 2.183 8.600 ( -0.191 3.331 7.378) 8.097 8.690 ( 10.000 0.269 0.974) 10.051 8.929 ( -3.746 4.615 -6.376) 8.717 9.411 ( -3.999 -0.799 4.665) 6.196 9.843 ( 4.426 6.416 5.380) 9.471 10.116 ( 2.166 5.116 -6.417) 8.488 10.760 ( 1.063 -1.492 -0.662) 1.948 11.202 ( -1.417 0.589 4.939) 5.172 11.431 ( -1.444 -6.105 -14.820) 16.093 11.537 ( -1.505 9.304 -4.716) 10.539 11.786 ( 5.289 -0.867 -11.524) 12.710 11.851 ( -1.580 -0.986 4.436) 4.811 12.299 ( 2.056 -1.649 -13.155) 13.416 12.639 ( 9.061 -1.921 -9.833) 13.509 13.180 ( 0.605 -7.458 -15.119) 16.869 13.786 ( 4.467 -18.403 3.907) 19.336 14.100 ( -6.450 -1.194 -9.238) 11.330 14.775 ( -1.788 -6.620 8.692) 11.071 15.166 ( -6.299 -0.471 14.180) 15.524 15.286 ( -8.597 3.083 16.176) 18.577 15.637 ( 9.427 3.154 -1.946) 10.130 16.361 ( -11.224 0.841 5.559) 12.554 18.058 ( 3.798 -4.216 -5.482) 7.890 18.689 ( -3.573 -3.383 -0.959) 5.014 19.957 ( 4.462 4.613 -15.329) 16.618 20.160 ( 2.393 -2.393 -14.238) 14.635 25.613 ( 3.325 0.469 10.250) 10.786 26.181 ( -9.602 7.434 5.763) 13.442 26.618 ( 0.069 1.723 -3.759) 4.135 26.935 ( -0.813 -2.944 -2.352) 3.855 27.563 ( -0.142 3.564 16.667) 17.044 28.327 ( 0.243 3.127 10.806) 11.252 28.465 ( -2.145 -1.509 2.737) 3.791 28.816 ( 0.137 0.339 4.986) 4.999 29.186 ( 5.135 -2.970 4.039) 7.177 29.213 ( 0.164 0.118 -5.044) 5.048 30.004 ( -1.081 5.722 -6.509) 8.734 30.647 ( 9.827 -7.299 -18.547) 22.223 ======================= Grid point 158 (79/186) ======================= q-point: ( 0.38 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.002 ( 8.326 0.000 -0.433) 8.338 2.107 ( 2.015 0.000 -3.402) 3.954 2.179 ( 4.559 0.000 1.911) 4.943 2.549 ( -3.123 -0.000 10.310) 10.773 2.552 ( 1.701 0.000 2.098) 2.701 2.959 ( 5.555 0.000 -1.539) 5.765 3.699 ( -4.898 -0.000 9.802) 10.958 4.160 ( -8.388 -0.000 -1.674) 8.554 4.656 ( -14.107 -0.000 12.804) 19.051 4.722 ( 5.906 0.000 33.096) 33.619 5.152 ( 0.591 0.000 13.476) 13.489 5.377 ( 0.072 0.000 20.715) 20.715 5.737 ( -4.604 -0.000 27.111) 27.499 6.083 ( 4.085 0.000 -12.525) 13.175 6.526 ( 0.120 0.000 -6.951) 6.952 6.809 ( 6.724 0.000 5.374) 8.608 7.145 ( 0.610 0.000 10.867) 10.884 7.241 ( -12.365 -0.000 13.648) 18.417 7.431 ( 15.990 0.000 -3.604) 16.391 7.646 ( 0.733 0.000 -7.794) 7.829 7.812 ( -10.944 -0.000 12.540) 16.644 8.235 ( -1.431 -0.000 2.059) 2.507 8.621 ( 6.158 0.000 -12.419) 13.862 8.745 ( 1.050 0.000 -6.531) 6.615 9.480 ( 6.305 0.000 1.554) 6.493 9.724 ( 11.277 0.000 1.179) 11.338 10.048 ( -1.847 -0.000 -6.248) 6.515 10.210 ( -7.917 -0.000 -6.858) 10.474 10.900 ( 1.457 0.000 7.807) 7.942 11.210 ( 8.723 0.000 1.485) 8.848 11.237 ( -5.170 -0.000 -17.777) 18.514 11.452 ( -8.332 -0.000 -6.324) 10.460 11.513 ( 4.124 0.000 -11.589) 12.301 11.876 ( -3.103 -0.000 8.361) 8.918 12.106 ( 3.523 0.000 0.724) 3.596 12.967 ( 0.423 0.000 2.471) 2.507 13.142 ( -12.466 -0.000 -20.881) 24.319 13.378 ( 9.208 0.000 -0.486) 9.221 14.164 ( 0.300 0.000 -14.157) 14.160 14.175 ( -9.485 -0.000 19.848) 21.998 15.180 ( -2.177 -0.000 7.033) 7.362 15.323 ( -3.506 -0.000 14.206) 14.633 15.687 ( 9.753 0.000 -5.577) 11.235 16.309 ( 2.750 0.000 10.188) 10.553 18.367 ( -4.967 -0.000 -13.083) 13.994 18.513 ( 0.815 0.000 4.453) 4.527 19.732 ( 2.662 0.000 -19.893) 20.070 20.170 ( 6.144 0.000 -13.774) 15.082 25.781 ( -8.923 -0.000 10.143) 13.510 26.512 ( 3.412 0.000 -4.857) 5.935 26.750 ( 7.620 0.000 18.706) 20.198 26.800 ( -3.157 -0.000 0.723) 3.239 27.880 ( -6.987 -0.000 19.698) 20.900 28.255 ( 1.612 0.000 -2.180) 2.711 28.315 ( -7.392 -0.000 -0.651) 7.420 28.636 ( -0.598 -0.000 2.553) 2.622 28.726 ( 1.711 0.000 11.535) 11.661 29.179 ( -3.360 -0.000 5.547) 6.485 29.981 ( 8.381 0.000 -22.141) 23.674 31.184 ( 3.197 0.000 -21.680) 21.914 ======================= Grid point 159 (80/186) ======================= q-point: (-0.50 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( 1.586 6.649 -1.803) 7.069 2.099 ( 3.593 3.798 -0.144) 5.230 2.205 ( 3.440 4.023 0.687) 5.338 2.554 ( -0.947 -0.109 9.804) 9.850 2.556 ( -2.086 0.941 1.956) 3.010 2.989 ( 1.933 2.770 -1.092) 3.550 3.551 ( -11.451 10.001 7.512) 16.958 4.114 ( 3.912 1.646 6.679) 7.913 4.622 ( -11.270 -9.775 9.792) 17.845 4.864 ( -5.793 -3.846 36.293) 36.953 5.127 ( -1.596 8.429 16.535) 18.628 5.516 ( 0.114 -8.329 10.023) 13.033 5.793 ( -0.791 -1.032 17.609) 17.657 6.111 ( 3.280 -3.712 -10.557) 11.661 6.447 ( -4.407 3.552 -2.201) 6.073 6.899 ( 9.361 4.407 5.653) 11.790 7.087 ( -13.804 4.235 14.388) 20.384 7.208 ( -0.582 -3.221 9.288) 9.848 7.504 ( -1.707 3.905 -7.759) 8.852 7.668 ( 10.385 3.511 5.987) 12.491 7.841 ( -0.161 -8.563 7.751) 11.551 8.255 ( 0.429 -3.293 0.125) 3.324 8.616 ( 5.829 6.208 -9.323) 12.627 8.740 ( 3.222 -0.640 -11.162) 11.635 9.493 ( 1.417 5.880 2.608) 6.586 9.865 ( -3.148 3.366 1.561) 4.866 9.974 ( 10.804 1.139 -1.680) 10.993 10.130 ( -6.225 -3.729 -4.931) 8.773 10.824 ( -10.268 6.937 -2.780) 12.700 11.153 ( -4.757 -8.988 -11.582) 15.413 11.272 ( 4.925 3.730 -1.537) 6.366 11.411 ( 0.646 -4.617 -5.302) 7.060 11.567 ( 4.136 -5.803 -14.076) 15.777 11.865 ( -2.655 0.946 8.311) 8.776 12.178 ( 5.492 -1.620 1.896) 6.032 12.871 ( -10.020 5.138 -15.479) 19.141 13.020 ( 0.378 0.067 8.056) 8.065 13.444 ( 5.529 3.938 -1.689) 6.995 14.115 ( 1.739 -1.516 -8.220) 8.538 14.228 ( -3.319 -7.305 8.376) 11.599 15.187 ( 1.303 0.884 7.288) 7.456 15.315 ( -3.542 1.612 14.099) 14.626 15.774 ( 5.933 -0.096 -6.738) 8.978 16.360 ( -0.532 -0.440 9.500) 9.525 18.235 ( -3.987 3.453 -14.276) 15.219 18.540 ( 0.741 -0.627 4.117) 4.230 19.736 ( 3.552 -5.008 -20.124) 21.040 20.195 ( 6.125 0.812 -13.638) 14.972 25.698 ( -8.151 1.015 9.268) 12.384 26.552 ( 4.184 -0.564 -3.772) 5.661 26.714 ( -1.105 5.263 4.426) 6.965 26.865 ( -7.429 -4.534 10.728) 13.814 27.827 ( -8.616 2.887 18.303) 20.434 28.275 ( 1.743 -0.349 0.110) 1.780 28.330 ( 4.764 -4.168 4.760) 7.920 28.639 ( 0.159 1.431 3.967) 4.220 28.794 ( 2.767 0.046 11.827) 12.146 29.171 ( -2.648 -1.824 4.395) 5.446 30.007 ( 6.433 -1.714 -22.963) 23.909 31.097 ( 2.036 6.304 -22.496) 23.451 ======================= Grid point 160 (81/186) ======================= q-point: (-0.38 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( -1.535 10.296 -2.695) 10.753 2.048 ( 0.276 8.298 1.188) 8.388 2.168 ( 4.672 8.847 1.165) 10.073 2.491 ( -9.973 -1.917 7.949) 12.897 2.609 ( 5.549 0.985 3.642) 6.711 2.918 ( -0.286 8.172 1.897) 8.394 3.302 ( -7.422 9.942 6.579) 14.043 4.201 ( 5.670 1.047 11.656) 13.004 4.645 ( -7.378 -5.852 3.079) 9.908 4.952 ( -11.219 -7.408 29.543) 32.458 5.064 ( -2.192 5.608 23.015) 23.789 5.552 ( -13.233 -3.650 4.975) 14.601 5.846 ( -1.152 -1.056 10.975) 11.085 6.179 ( 0.108 -4.872 -6.023) 7.747 6.381 ( 1.235 0.907 4.405) 4.664 6.876 ( -11.852 7.083 14.305) 19.882 6.989 ( 8.974 3.398 3.642) 10.264 7.282 ( -0.115 -4.662 4.909) 6.772 7.394 ( -2.084 4.065 -1.425) 4.785 7.727 ( 4.444 4.564 4.702) 7.918 8.012 ( 4.912 -5.612 5.796) 9.446 8.327 ( 2.932 -3.718 -0.559) 4.768 8.557 ( 2.788 5.714 -4.961) 8.064 8.756 ( 6.277 1.833 -10.708) 12.547 9.380 ( -3.933 8.885 0.905) 9.759 9.664 ( -10.138 7.262 0.073) 12.471 10.082 ( 4.797 3.878 -2.665) 6.719 10.174 ( 1.607 -4.568 1.567) 5.090 10.601 ( -6.236 1.047 -6.375) 8.979 11.154 ( -8.844 -9.573 -11.065) 17.096 11.304 ( 5.711 3.760 0.338) 6.846 11.521 ( 7.321 -7.757 -8.539) 13.663 11.652 ( 3.006 -5.471 -11.398) 12.995 11.845 ( -2.223 1.056 7.769) 8.149 12.270 ( 3.454 -1.955 -3.644) 5.388 12.639 ( -9.058 1.947 -11.357) 14.657 13.061 ( 4.448 3.874 11.178) 12.639 13.430 ( 3.976 3.758 -1.663) 5.718 14.127 ( -1.264 -3.511 -11.708) 12.289 14.373 ( 3.071 -9.221 7.767) 12.441 15.227 ( 1.062 1.708 9.276) 9.491 15.303 ( -2.672 0.245 14.465) 14.711 15.777 ( 1.940 3.124 -6.450) 7.425 16.373 ( -4.247 -1.275 8.218) 9.338 18.095 ( -1.442 3.956 -14.562) 15.158 18.576 ( -0.174 -2.115 2.986) 3.663 19.810 ( 4.574 -7.674 -19.058) 21.048 20.203 ( 5.534 2.019 -13.472) 14.704 25.627 ( -5.490 0.802 8.658) 10.283 26.552 ( -5.058 3.905 2.400) 6.826 26.659 ( 0.770 1.147 -0.984) 1.696 26.827 ( -8.818 -3.789 6.098) 11.371 27.735 ( -6.953 4.437 17.464) 19.313 28.309 ( 2.324 -0.348 1.807) 2.965 28.527 ( 10.304 -2.504 7.773) 13.148 28.635 ( 1.566 0.605 6.406) 6.622 28.878 ( 3.046 -1.683 11.527) 12.041 29.190 ( -1.585 -2.691 2.621) 4.077 30.031 ( 4.254 -3.207 -21.349) 22.004 30.915 ( 0.558 10.646 -23.178) 25.512 ======================= Grid point 161 (82/186) ======================= q-point: (-0.25 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -4.126 11.898 -0.146) 12.594 1.905 ( -0.992 10.601 0.269) 10.650 2.095 ( 3.061 9.490 1.577) 10.096 2.428 ( -10.641 -3.616 9.753) 14.880 2.667 ( 4.537 2.799 1.192) 5.463 2.841 ( 6.515 7.512 4.081) 10.748 3.165 ( -0.498 5.801 6.912) 9.037 4.281 ( 4.881 3.624 13.525) 14.828 4.621 ( -3.329 -1.589 -3.220) 4.896 4.908 ( -22.078 -2.765 10.376) 24.551 5.078 ( -3.694 1.797 30.205) 30.483 5.438 ( -13.453 -4.425 22.041) 26.198 5.881 ( -1.506 -2.215 6.971) 7.467 6.164 ( -6.790 -1.359 -1.214) 7.030 6.456 ( 5.000 -0.909 2.045) 5.478 6.683 ( -11.417 5.825 14.892) 19.648 7.097 ( 10.913 1.465 1.701) 11.142 7.293 ( -1.330 2.814 -0.762) 3.204 7.420 ( 3.170 -7.272 -0.776) 7.970 7.691 ( 1.354 7.365 3.549) 8.287 8.104 ( 1.320 1.667 3.245) 3.880 8.399 ( 2.440 -0.637 1.114) 2.757 8.541 ( 4.423 -0.839 -0.876) 4.586 8.770 ( 5.132 2.880 -4.145) 7.198 9.174 ( -6.368 10.064 -4.630) 12.777 9.452 ( -11.606 3.950 2.883) 12.594 10.056 ( 3.421 8.939 2.644) 9.930 10.159 ( -1.418 -2.161 -8.825) 9.196 10.647 ( 3.115 -5.676 -0.075) 6.475 11.149 ( -5.544 -7.980 -7.788) 12.452 11.300 ( 1.485 1.487 -3.028) 3.686 11.677 ( 3.057 -3.222 -12.262) 13.042 11.697 ( 3.744 -3.131 -6.161) 7.860 11.856 ( 2.209 0.522 7.818) 8.141 12.253 ( -2.407 -0.016 -11.663) 11.909 12.569 ( -0.949 -4.623 -4.613) 6.600 13.089 ( 4.685 3.347 -0.322) 5.767 13.484 ( 5.512 -3.035 4.559) 7.771 14.097 ( -2.186 -1.117 -11.028) 11.298 14.568 ( 3.820 -8.577 5.087) 10.678 15.196 ( -5.402 2.979 12.045) 13.533 15.337 ( -3.137 0.256 14.838) 15.168 15.734 ( 4.131 3.533 -5.034) 7.408 16.343 ( -8.017 -1.585 6.733) 10.589 18.012 ( 1.897 1.240 -12.209) 12.418 18.601 ( -2.846 -2.718 1.200) 4.114 19.912 ( 5.096 -6.909 -17.400) 19.403 20.183 ( 4.532 3.203 -13.424) 14.526 25.612 ( -0.976 -0.557 8.812) 8.884 26.352 ( -15.598 5.072 5.533) 17.310 26.661 ( 1.087 1.105 -2.717) 3.128 26.843 ( 0.245 -3.446 3.428) 4.867 27.667 ( -3.951 3.751 16.159) 17.052 28.354 ( 2.732 -0.251 3.335) 4.318 28.550 ( 0.616 6.178 7.937) 10.077 28.781 ( 5.467 -2.573 6.814) 9.107 29.032 ( 8.095 -5.992 9.859) 14.094 29.210 ( -1.290 -1.512 -0.187) 1.996 30.052 ( 1.847 -3.160 -16.212) 16.620 30.687 ( 0.167 9.540 -23.684) 25.534 ======================= Grid point 162 (83/186) ======================= q-point: (-0.12 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( -3.126 8.826 6.340) 11.308 1.787 ( 2.827 6.382 -2.607) 7.451 2.008 ( 1.072 7.591 3.951) 8.625 2.402 ( -7.901 -5.363 7.282) 12.009 2.634 ( -0.021 5.867 3.253) 6.708 2.893 ( 9.361 3.649 -0.894) 10.087 3.197 ( 10.833 2.190 7.956) 13.618 4.316 ( 4.374 6.222 13.233) 15.263 4.585 ( -16.507 3.289 -1.757) 16.923 4.630 ( -11.948 -6.356 2.521) 13.766 5.124 ( -3.450 0.966 33.064) 33.258 5.486 ( -11.288 -5.978 36.127) 38.319 5.914 ( -0.847 -2.077 3.220) 3.925 6.054 ( -7.675 2.461 -1.370) 8.176 6.489 ( -3.071 -0.909 1.166) 3.408 6.568 ( -3.118 4.680 15.871) 16.837 7.185 ( 6.715 4.450 -0.662) 8.083 7.246 ( 0.543 1.252 -1.664) 2.152 7.542 ( 0.809 -1.601 -4.654) 4.988 7.655 ( 2.976 -3.398 0.258) 4.524 8.025 ( -1.693 7.676 -0.747) 7.896 8.424 ( 2.557 1.509 2.493) 3.877 8.650 ( 1.919 -0.841 6.609) 6.933 8.797 ( 4.054 -2.626 0.105) 4.831 8.942 ( -3.467 10.033 -7.938) 13.255 9.316 ( -8.877 -2.626 4.166) 10.152 9.971 ( -0.052 5.062 -2.181) 5.512 10.205 ( 10.683 1.355 -4.212) 11.563 10.709 ( -3.511 -3.191 -1.767) 5.063 11.172 ( -2.893 -3.125 2.787) 5.089 11.313 ( 1.846 -4.130 -8.956) 10.033 11.609 ( -1.541 5.929 -5.724) 8.384 11.758 ( 1.317 -2.624 -7.154) 7.733 11.909 ( 5.123 2.821 2.083) 6.208 12.199 ( -3.244 -3.891 -12.597) 13.578 12.670 ( 5.255 -7.168 -3.536) 9.565 13.095 ( 4.186 0.552 -12.149) 12.861 13.652 ( 2.959 -9.607 2.682) 10.404 14.034 ( -0.981 2.097 -7.660) 8.003 14.716 ( 1.248 -5.291 5.257) 7.562 15.106 ( -9.968 1.820 9.465) 13.866 15.289 ( -7.131 3.185 17.125) 18.822 15.776 ( 7.882 1.448 0.011) 8.014 16.257 ( -10.125 0.449 4.784) 11.207 18.039 ( 5.479 -3.510 -7.420) 9.869 18.584 ( -5.513 -2.508 -0.479) 6.076 19.987 ( 5.292 -2.180 -15.686) 16.697 20.142 ( 3.162 2.515 -13.891) 14.466 25.688 ( 4.749 -2.465 10.016) 11.356 26.122 ( -14.154 3.188 6.992) 16.105 26.634 ( -0.052 2.141 -2.606) 3.373 26.916 ( 2.635 -1.896 2.925) 4.369 27.653 ( -0.358 1.726 13.595) 13.709 28.408 ( 3.330 0.028 4.966) 5.980 28.491 ( -0.942 6.168 8.999) 10.950 28.837 ( -0.841 0.547 5.099) 5.197 29.172 ( -3.961 1.647 -3.175) 5.337 29.247 ( 8.055 -3.884 2.840) 9.383 30.016 ( -2.025 2.477 -10.836) 11.298 30.589 ( 5.797 -4.294 -21.264) 22.455 ======================= Grid point 167 (84/186) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -0.705 -0.000 3.255) 3.331 2.117 ( -0.872 -0.000 -1.639) 1.857 2.275 ( 3.651 0.000 -0.771) 3.731 2.549 ( -3.602 -0.000 1.640) 3.957 2.555 ( -1.859 -0.000 7.941) 8.156 2.999 ( -2.501 -0.000 -3.532) 4.328 3.525 ( -8.190 -0.000 4.637) 9.411 4.207 ( 5.577 0.000 8.990) 10.579 4.467 ( -7.738 -0.000 14.042) 16.033 4.849 ( -12.054 -0.000 34.238) 36.298 5.254 ( 0.471 0.000 14.275) 14.283 5.412 ( -9.930 -0.000 12.881) 16.264 5.850 ( -0.363 -0.000 11.509) 11.514 6.071 ( 2.121 0.000 -12.653) 12.829 6.421 ( -1.158 -0.000 -2.237) 2.519 6.990 ( -16.303 -0.000 21.857) 27.267 7.075 ( 11.451 0.000 2.853) 11.801 7.206 ( -1.748 -0.000 10.845) 10.985 7.478 ( -3.404 -0.000 -9.208) 9.817 7.744 ( -1.530 -0.000 15.995) 16.068 7.945 ( 16.305 0.000 1.555) 16.379 8.249 ( 2.478 0.000 -0.539) 2.536 8.691 ( 0.540 0.000 -10.744) 10.757 8.747 ( 9.404 0.000 -12.843) 15.918 9.506 ( -7.807 -0.000 4.351) 8.938 9.835 ( -13.470 -0.000 -0.151) 13.471 10.011 ( 3.252 0.000 -5.866) 6.707 10.136 ( 13.081 0.000 -1.053) 13.123 10.796 ( -9.872 -0.000 -2.795) 10.260 10.855 ( -10.632 -0.000 -15.795) 19.040 11.393 ( 7.254 0.000 -7.021) 10.095 11.415 ( 5.306 0.000 8.678) 10.171 11.513 ( 3.824 0.000 -17.622) 18.032 11.867 ( -3.643 -0.000 9.557) 10.227 12.225 ( 4.205 0.000 -1.959) 4.639 12.683 ( -13.600 -0.000 -11.838) 18.031 13.141 ( 7.593 0.000 14.428) 16.304 13.529 ( 3.458 0.000 -2.494) 4.263 14.068 ( -0.313 -0.000 -12.217) 12.221 14.206 ( 2.280 0.000 9.850) 10.110 15.241 ( 2.424 0.000 9.273) 9.584 15.325 ( -3.907 -0.000 12.342) 12.945 15.818 ( 4.024 0.000 -8.533) 9.434 16.353 ( -5.237 -0.000 9.254) 10.633 18.172 ( -1.403 -0.000 -16.183) 16.244 18.549 ( -0.465 -0.000 3.862) 3.890 19.680 ( 4.482 0.000 -20.373) 20.860 20.231 ( 6.133 0.000 -13.637) 14.953 25.638 ( -7.087 -0.000 8.367) 10.965 26.600 ( 5.472 0.000 -3.274) 6.377 26.702 ( -17.626 -0.000 10.525) 20.530 26.750 ( -1.006 -0.000 2.257) 2.471 27.805 ( -8.555 -0.000 17.686) 19.647 28.315 ( 3.578 0.000 1.269) 3.797 28.441 ( 13.974 0.000 8.884) 16.559 28.673 ( 0.707 0.000 4.642) 4.695 28.874 ( 2.630 0.000 12.852) 13.118 29.139 ( -2.550 -0.000 4.432) 5.113 29.976 ( 3.883 0.000 -24.049) 24.360 31.078 ( 1.052 0.000 -24.803) 24.825 ======================= Grid point 168 (85/186) ======================= q-point: (-0.38 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( -3.810 8.489 1.017) 9.360 2.103 ( -3.640 2.099 1.710) 4.537 2.300 ( 2.560 2.440 -0.281) 3.547 2.410 ( -9.341 6.003 5.870) 12.560 2.619 ( -0.783 -5.917 1.786) 6.230 2.923 ( -7.081 -0.975 -3.618) 8.011 3.397 ( -1.968 8.969 3.747) 9.917 4.314 ( 5.083 0.414 11.971) 13.012 4.498 ( -5.247 -6.571 11.390) 14.158 4.790 ( -16.592 -3.867 22.343) 28.098 5.220 ( -1.792 7.841 22.038) 23.460 5.384 ( -9.025 -2.490 12.774) 15.838 5.838 ( -5.430 -0.430 10.329) 11.677 6.071 ( -1.574 -3.391 -9.499) 10.208 6.446 ( 6.690 -0.242 -2.875) 7.286 6.833 ( -16.493 4.173 24.369) 29.720 7.192 ( 10.899 5.172 0.491) 12.074 7.236 ( -2.581 -3.082 8.799) 9.674 7.404 ( -1.093 0.230 -4.427) 4.566 7.816 ( 2.451 0.114 12.843) 13.075 8.092 ( 7.853 1.773 1.937) 8.281 8.323 ( 4.371 -4.233 -0.015) 6.085 8.632 ( 1.246 4.008 -9.094) 10.016 8.810 ( 6.337 0.355 -11.694) 13.305 9.359 ( -13.467 3.219 4.900) 14.688 9.604 ( -12.855 4.877 -4.526) 14.474 10.056 ( 1.497 -3.509 -10.915) 11.562 10.271 ( 7.314 3.984 -0.226) 8.332 10.574 ( -1.705 4.111 -2.437) 5.074 10.857 ( -6.100 -11.890 -9.842) 16.597 11.415 ( 1.245 5.272 -0.074) 5.418 11.522 ( 11.442 -4.262 -8.003) 14.599 11.575 ( 2.028 -5.801 -7.144) 9.423 11.857 ( -2.023 -0.057 10.918) 11.104 12.260 ( 1.476 -0.727 -6.505) 6.710 12.495 ( -9.240 0.133 -6.609) 11.361 13.255 ( 7.072 4.862 10.660) 13.685 13.519 ( 2.220 3.476 -1.129) 4.276 14.044 ( 0.045 -1.667 -8.131) 8.300 14.333 ( 5.069 -6.942 5.850) 10.397 15.290 ( -2.936 2.700 10.277) 11.024 15.324 ( 1.438 -0.621 12.473) 12.571 15.805 ( 0.393 1.389 -7.541) 7.678 16.299 ( -9.260 -1.190 8.095) 12.357 18.094 ( 1.890 3.091 -17.029) 17.410 18.554 ( -1.419 -0.629 2.924) 3.310 19.711 ( 5.170 -5.531 -19.255) 20.690 20.250 ( 5.768 1.323 -13.466) 14.709 25.592 ( -4.534 -0.591 7.607) 8.876 26.462 ( -20.019 2.728 7.797) 21.656 26.661 ( 2.791 -0.944 -2.509) 3.870 26.774 ( 1.957 -1.186 4.460) 5.013 27.748 ( -7.237 1.747 16.096) 17.734 28.366 ( 4.365 0.867 2.791) 5.253 28.675 ( 5.865 1.211 7.610) 9.684 28.703 ( 10.057 -1.821 7.260) 12.536 28.941 ( 2.074 0.059 12.929) 13.094 29.146 ( -1.436 -2.399 3.960) 4.848 29.947 ( 1.721 -2.710 -22.931) 23.155 30.949 ( -0.378 6.375 -26.820) 27.570 ======================= Grid point 169 (86/186) ======================= q-point: (-0.25 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( -5.724 10.743 2.246) 12.378 1.965 ( -7.107 7.757 -0.727) 10.545 2.236 ( -7.822 5.120 6.501) 11.386 2.268 ( -5.227 -0.591 1.815) 5.564 2.694 ( -0.702 -4.157 0.155) 4.219 2.861 ( -6.401 -5.164 -2.902) 8.721 3.321 ( 7.008 7.432 4.238) 11.059 4.365 ( -8.236 2.020 12.643) 15.224 4.467 ( -10.768 -5.272 -0.242) 11.992 4.763 ( -2.487 0.279 16.640) 16.827 5.202 ( -1.996 4.880 30.250) 30.706 5.347 ( -6.295 -0.291 22.725) 23.582 5.838 ( -3.118 -3.015 5.439) 6.957 6.038 ( -6.370 -2.461 -3.858) 7.843 6.541 ( 7.260 0.409 -0.950) 7.333 6.653 ( -14.208 4.052 21.497) 26.084 7.224 ( 4.532 1.851 -3.510) 6.024 7.267 ( -2.938 -3.108 4.470) 6.187 7.438 ( 6.914 0.781 -0.144) 6.960 7.822 ( 1.612 7.536 4.026) 8.695 8.160 ( 2.713 0.216 5.342) 5.996 8.425 ( 3.179 -2.336 1.278) 4.147 8.575 ( 0.589 1.074 -3.120) 3.351 8.811 ( 1.039 0.620 -9.171) 9.251 9.142 ( -13.637 4.457 3.063) 14.670 9.381 ( -8.656 5.337 -5.562) 11.591 10.022 ( -4.822 -1.677 -12.897) 13.871 10.271 ( 9.382 4.631 -0.856) 10.498 10.606 ( -0.152 -3.444 -1.202) 3.651 10.955 ( 1.886 -9.978 -4.732) 11.203 11.342 ( -2.138 4.013 0.039) 4.547 11.619 ( -1.280 -3.937 -7.764) 8.799 11.676 ( 7.768 -2.777 -8.253) 11.670 11.928 ( 4.123 -2.463 11.176) 12.165 12.196 ( -3.010 3.733 -9.494) 10.636 12.457 ( -0.850 -5.665 -3.058) 6.494 13.238 ( 4.197 7.601 -3.244) 9.269 13.539 ( 3.889 -0.081 0.970) 4.009 14.055 ( 1.863 -0.443 -0.921) 2.125 14.524 ( 5.260 -8.115 2.891) 10.093 15.205 ( -7.176 4.784 9.182) 12.597 15.381 ( -0.896 2.601 14.815) 15.069 15.781 ( 2.031 -0.751 -3.601) 4.201 16.219 ( -11.142 -2.406 6.372) 13.059 18.035 ( 4.745 2.783 -15.000) 15.977 18.543 ( -3.020 -0.458 1.411) 3.365 19.813 ( 5.393 -8.116 -17.435) 19.973 20.242 ( 5.069 3.109 -13.367) 14.630 25.609 ( -0.294 -2.882 7.652) 8.182 26.200 ( -19.360 2.449 7.494) 20.904 26.675 ( 0.694 0.713 -1.953) 2.192 26.859 ( 4.545 -1.860 5.863) 7.648 27.701 ( -4.341 1.592 13.862) 14.613 28.419 ( 4.551 1.215 3.933) 6.136 28.668 ( 0.313 4.616 8.436) 9.621 28.846 ( 2.527 1.403 6.317) 6.947 29.100 ( 10.225 -5.738 10.124) 15.491 29.176 ( -0.957 -1.479 1.902) 2.593 29.939 ( 0.007 -5.077 -18.960) 19.628 30.725 ( -1.542 9.481 -27.718) 29.335 ======================= Grid point 170 (87/186) ======================= q-point: (-0.12 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( -4.448 8.711 7.036) 12.049 1.783 ( -7.512 1.549 -4.452) 8.868 2.116 ( -6.138 3.518 7.637) 10.411 2.227 ( -6.433 -3.732 -1.098) 7.518 2.691 ( -2.705 0.859 3.887) 4.813 2.893 ( -2.944 -7.769 -2.915) 8.805 3.389 ( 11.048 2.397 2.081) 11.495 4.102 ( -28.203 -2.237 3.550) 28.514 4.514 ( 1.542 -3.452 6.674) 7.671 4.776 ( 8.762 11.526 15.971) 21.557 5.236 ( -1.052 2.824 31.063) 31.209 5.402 ( -8.675 -4.346 33.163) 34.554 5.870 ( 0.370 -3.559 -3.200) 4.801 5.965 ( -7.260 -0.952 1.772) 7.533 6.478 ( -10.066 4.347 18.501) 21.506 6.643 ( 4.347 0.935 3.640) 5.746 7.244 ( -0.203 -1.196 -1.847) 2.210 7.279 ( 0.256 -0.373 -1.906) 1.959 7.506 ( 4.418 0.167 -3.746) 5.795 7.733 ( 2.257 6.921 -1.078) 7.359 8.116 ( -2.255 8.280 3.078) 9.117 8.460 ( -0.618 -0.075 -0.975) 1.156 8.647 ( 0.911 -6.304 7.697) 9.990 8.768 ( -2.030 1.241 -5.053) 5.586 8.966 ( -6.409 -0.178 -2.191) 6.775 9.213 ( -5.565 3.269 -1.079) 6.543 9.971 ( -0.100 -1.454 -8.282) 8.409 10.371 ( 12.461 1.000 -1.383) 12.578 10.588 ( -6.498 -2.267 -6.025) 9.147 11.112 ( 3.240 -6.010 4.857) 8.379 11.271 ( -3.185 -0.029 -2.293) 3.925 11.611 ( 0.080 -0.185 -8.135) 8.137 11.735 ( 2.060 -0.710 -3.023) 3.727 12.042 ( 4.994 0.261 3.892) 6.337 12.072 ( -2.441 3.011 -10.608) 11.294 12.564 ( 1.988 -9.783 -4.250) 10.850 13.188 ( 6.570 5.542 -10.800) 13.803 13.583 ( 0.225 -3.266 -7.041) 7.765 14.092 ( 5.116 3.242 6.095) 8.592 14.684 ( 3.155 -5.700 2.538) 6.992 15.056 ( -9.269 4.974 6.759) 12.503 15.316 ( -7.232 5.535 16.336) 18.703 15.862 ( 5.268 -2.055 3.509) 6.655 16.140 ( -8.801 -2.671 3.244) 9.752 18.054 ( 7.116 -1.359 -9.489) 11.938 18.500 ( -4.385 0.078 -0.292) 4.395 19.929 ( 5.187 -7.110 -15.704) 18.002 20.198 ( 4.157 4.962 -13.777) 15.222 25.726 ( 5.111 -5.861 8.564) 11.568 25.985 ( -15.384 0.701 7.966) 17.338 26.652 ( -0.253 1.875 -2.108) 2.832 26.955 ( 3.226 -1.025 7.879) 8.575 27.701 ( -0.287 0.281 10.911) 10.918 28.476 ( 4.487 0.950 4.804) 6.642 28.619 ( -0.543 7.251 10.846) 13.058 28.838 ( -3.265 0.965 4.931) 5.993 29.137 ( -4.863 3.030 -3.315) 6.620 29.306 ( 6.844 -2.776 2.962) 7.957 29.938 ( -1.948 -3.594 -13.107) 13.730 30.544 ( 3.066 0.942 -24.898) 25.104 ======================= Grid point 176 (88/186) ======================= q-point: (-0.38 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( -9.995 -0.000 0.268) 9.998 2.045 ( -7.399 -0.000 9.168) 11.781 2.353 ( 1.561 0.000 -0.284) 1.587 2.404 ( -7.064 -0.000 1.535) 7.229 2.450 ( -12.553 -0.000 -0.942) 12.588 2.761 ( -11.794 -0.000 -3.056) 12.184 3.467 ( 2.417 0.000 -0.921) 2.586 4.369 ( -17.058 -0.000 4.533) 17.650 4.440 ( 5.725 0.000 14.920) 15.981 4.662 ( -6.005 -0.000 23.999) 24.739 5.295 ( -6.621 -0.000 25.102) 25.960 5.413 ( 4.242 0.000 17.368) 17.878 5.774 ( -8.598 -0.000 12.518) 15.186 5.996 ( -1.594 -0.000 -13.012) 13.109 6.516 ( 8.299 0.000 -8.977) 12.225 6.742 ( -18.627 -0.000 32.467) 37.430 7.193 ( -4.947 -0.000 8.453) 9.794 7.327 ( -3.692 -0.000 -4.982) 6.201 7.414 ( 13.762 0.000 1.166) 13.811 7.923 ( 6.518 0.000 12.472) 14.073 8.192 ( 2.503 0.000 0.047) 2.503 8.325 ( 3.367 0.000 -1.464) 3.671 8.614 ( -2.759 -0.000 -10.959) 11.301 8.836 ( 1.305 0.000 -7.134) 7.253 9.213 ( -14.525 -0.000 5.371) 15.486 9.454 ( -10.980 -0.000 -7.332) 13.203 9.981 ( -2.647 -0.000 -20.122) 20.295 10.375 ( 4.701 0.000 -3.752) 6.015 10.571 ( -3.346 -0.000 -1.588) 3.704 10.757 ( 9.134 0.000 -0.727) 9.163 11.450 ( -10.040 -0.000 8.792) 13.346 11.503 ( 5.695 0.000 -15.179) 16.213 11.634 ( 14.125 0.000 -9.408) 16.972 11.880 ( -1.324 -0.000 15.079) 15.137 12.247 ( 0.989 0.000 -9.319) 9.371 12.403 ( -2.204 -0.000 0.416) 2.243 13.370 ( 1.198 0.000 -0.725) 1.400 13.562 ( 2.130 0.000 -1.367) 2.531 14.048 ( 3.830 0.000 3.833) 5.419 14.370 ( 6.418 0.000 3.643) 7.380 15.288 ( -4.820 -0.000 8.452) 9.729 15.416 ( 4.944 0.000 14.217) 15.052 15.766 ( -3.850 -0.000 -5.977) 7.109 16.174 ( -12.878 -0.000 7.177) 14.742 18.099 ( 4.917 0.000 -18.167) 18.821 18.544 ( -1.269 -0.000 2.057) 2.417 19.670 ( 5.177 0.000 -18.470) 19.182 20.286 ( 5.660 0.000 -13.265) 14.422 25.563 ( -2.852 -0.000 6.694) 7.277 26.239 ( -21.547 -0.000 8.338) 23.104 26.681 ( 1.849 0.000 -1.933) 2.675 26.832 ( 4.972 0.000 6.316) 8.038 27.726 ( -5.971 -0.000 14.266) 15.465 28.447 ( 5.300 0.000 3.768) 6.503 28.710 ( -1.107 -0.000 6.552) 6.645 28.908 ( 14.473 0.000 6.403) 15.826 29.002 ( 0.086 0.000 13.013) 13.013 29.134 ( 0.963 0.000 5.933) 6.011 29.860 ( 0.258 0.000 -22.321) 22.323 30.882 ( -1.847 -0.000 -30.728) 30.784 ======================= Grid point 177 (89/186) ======================= q-point: (-0.25 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( -14.439 4.295 2.184) 15.222 1.987 ( -11.595 -4.079 7.080) 14.185 2.042 ( -18.014 13.635 1.077) 22.618 2.332 ( -3.149 4.047 -0.446) 5.147 2.512 ( -5.220 -13.805 1.194) 14.807 2.655 ( -10.440 -5.295 0.103) 11.706 3.490 ( 6.931 3.223 -2.095) 7.925 4.093 ( -26.198 -0.065 -0.194) 26.199 4.517 ( 4.227 4.081 14.791) 15.916 4.824 ( 5.324 -6.636 26.298) 27.640 5.302 ( -4.334 2.002 26.704) 27.128 5.475 ( 3.529 7.863 20.379) 22.127 5.766 ( -3.490 -4.578 9.210) 10.861 5.923 ( -4.752 -1.021 -9.441) 10.618 6.583 ( -8.661 0.080 12.790) 15.446 6.616 ( -1.705 0.522 10.934) 11.078 7.176 ( -5.075 -3.277 5.240) 7.997 7.257 ( -1.910 1.523 -3.183) 4.013 7.577 ( 11.649 1.824 1.024) 11.835 7.973 ( 3.328 8.688 0.323) 9.309 8.201 ( 1.421 -1.290 3.801) 4.258 8.399 ( 0.422 -5.110 -2.033) 5.516 8.530 ( -4.423 -2.066 -6.703) 8.292 8.756 ( -8.701 2.003 -2.553) 9.287 9.057 ( -8.788 4.215 4.410) 10.697 9.317 ( -5.254 1.189 -9.311) 10.757 9.863 ( -6.471 -3.851 -19.188) 20.613 10.414 ( 7.693 1.448 -3.450) 8.555 10.547 ( -2.112 -0.411 -3.950) 4.498 10.935 ( 10.412 -4.854 2.054) 11.670 11.310 ( -11.754 1.359 6.114) 13.318 11.551 ( 5.739 -2.146 -13.686) 14.995 11.755 ( 8.688 1.889 -5.608) 10.512 11.929 ( -1.704 -4.182 8.967) 10.040 12.217 ( 2.021 1.160 -9.822) 10.095 12.453 ( 7.440 2.041 8.427) 11.425 13.311 ( -1.668 2.433 -8.511) 9.008 13.561 ( 1.209 0.721 -9.758) 9.859 14.150 ( 7.647 1.523 15.873) 17.684 14.507 ( 6.422 -5.652 1.399) 8.669 15.216 ( -6.148 4.783 6.288) 10.010 15.487 ( 0.142 5.958 15.136) 16.267 15.734 ( -1.136 -5.922 0.914) 6.099 16.046 ( -13.557 -2.886 5.730) 14.998 18.093 ( 6.845 2.481 -16.729) 18.245 18.526 ( -1.331 1.189 0.708) 1.920 19.717 ( 5.071 -6.115 -16.995) 18.760 20.296 ( 5.097 1.881 -13.108) 14.190 25.586 ( 0.038 -3.324 6.510) 7.310 26.006 ( -18.760 0.608 8.467) 20.591 26.686 ( 0.492 0.603 -1.688) 1.859 26.926 ( 4.307 -0.767 9.035) 10.038 27.711 ( -2.698 0.303 11.895) 12.201 28.518 ( 5.437 1.507 4.375) 7.140 28.714 ( -1.954 -0.043 7.014) 7.282 28.943 ( 0.187 6.798 8.003) 10.502 29.124 ( 1.054 -5.026 3.913) 6.456 29.228 ( 8.902 -1.128 7.912) 11.964 29.810 ( 0.019 -3.169 -18.983) 19.245 30.694 ( -3.859 5.332 -32.851) 33.504 ======================= Grid point 178 (90/186) ======================= q-point: (-0.12 -0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( -14.195 -0.777 1.420) 14.287 1.689 ( -17.176 4.117 5.876) 18.614 1.912 ( -12.336 -4.058 2.856) 13.297 2.240 ( -1.487 4.381 0.451) 4.648 2.580 ( -10.209 -7.786 6.126) 14.225 2.688 ( -3.660 -12.111 3.124) 13.032 3.508 ( -1.019 4.063 -2.004) 4.644 3.784 ( -17.728 -1.349 -0.672) 17.792 4.566 ( 3.134 1.829 11.802) 12.347 5.055 ( 7.549 0.793 27.267) 28.304 5.326 ( -3.043 -0.325 22.961) 23.164 5.467 ( -0.249 7.569 28.247) 29.244 5.807 ( -1.059 -2.321 -8.138) 8.528 5.889 ( -1.169 -3.329 6.274) 7.198 6.445 ( -15.735 2.375 29.579) 33.588 6.718 ( 7.604 -2.247 -4.368) 9.053 7.189 ( -2.143 -3.803 -1.895) 4.759 7.212 ( -4.416 -1.278 -0.461) 4.621 7.624 ( 4.741 7.393 -1.206) 8.865 7.857 ( 2.571 8.074 -7.357) 11.221 8.198 ( -2.608 5.210 4.326) 7.257 8.382 ( -6.683 -2.048 -5.545) 8.922 8.580 ( -2.830 -3.510 1.444) 4.734 8.691 ( 0.529 -12.792 -2.710) 13.087 8.888 ( -8.092 8.308 7.302) 13.705 9.204 ( -2.957 2.795 -9.185) 10.046 9.863 ( -0.713 -9.797 -8.475) 12.974 10.447 ( -6.844 1.331 -5.469) 8.861 10.526 ( 9.125 -1.211 -5.502) 10.723 11.131 ( 7.900 -4.876 4.851) 10.475 11.189 ( -9.199 -0.231 4.824) 10.389 11.603 ( 6.473 -0.573 -11.933) 13.588 11.763 ( 0.376 2.445 1.163) 2.734 11.971 ( -0.629 -2.144 -6.109) 6.505 12.222 ( 5.687 2.748 -4.482) 7.745 12.522 ( 5.683 3.452 3.826) 7.672 13.277 ( 5.398 0.919 -10.209) 11.585 13.515 ( -0.579 -0.270 -14.841) 14.855 14.280 ( 9.358 4.229 16.864) 19.744 14.656 ( 3.502 -4.937 1.204) 6.171 15.062 ( -6.544 7.007 5.148) 10.882 15.367 ( -8.395 7.926 13.779) 17.976 15.873 ( -1.471 -4.778 12.071) 13.065 15.991 ( -3.130 -7.334 1.274) 8.075 18.110 ( 7.712 0.566 -11.037) 13.476 18.483 ( -0.979 2.717 -0.888) 3.021 19.828 ( 4.933 -8.493 -15.662) 18.487 20.269 ( 4.330 4.059 -13.440) 14.692 25.705 ( 1.459 -7.620 6.211) 9.938 25.837 ( -11.226 -1.089 9.432) 14.703 26.664 ( -0.549 1.525 -2.172) 2.710 27.009 ( 1.367 -0.642 11.808) 11.904 27.740 ( 1.338 -0.408 8.898) 9.007 28.574 ( 4.797 1.933 5.111) 7.272 28.705 ( -2.261 1.289 6.736) 7.221 28.861 ( -2.804 7.046 9.665) 12.285 29.106 ( -6.170 4.061 -4.577) 8.690 29.355 ( 3.285 -0.759 0.883) 3.485 29.813 ( 0.064 -5.004 -11.562) 12.598 30.493 ( 0.300 0.856 -28.568) 28.582 ======================= Grid point 185 (91/186) ======================= q-point: (-0.25 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -19.679 -0.000 4.761) 20.247 1.632 ( -29.902 -0.000 -0.207) 29.903 2.115 ( -9.322 -0.000 12.900) 15.915 2.144 ( -11.723 -0.000 3.190) 12.149 2.462 ( 3.836 0.000 3.355) 5.096 2.467 ( -12.158 -0.000 0.084) 12.158 3.587 ( 7.510 0.000 -4.601) 8.808 3.766 ( -25.596 -0.000 -3.762) 25.871 4.673 ( 3.566 0.000 16.421) 16.804 4.925 ( 5.031 0.000 32.273) 32.663 5.360 ( -3.066 -0.000 24.535) 24.726 5.696 ( 6.505 0.000 16.963) 18.167 5.708 ( -2.442 -0.000 12.021) 12.267 5.824 ( -3.498 -0.000 -10.024) 10.616 6.488 ( -18.753 -0.000 34.033) 38.857 6.644 ( 5.799 0.000 -8.452) 10.250 7.102 ( -4.874 -0.000 3.873) 6.225 7.222 ( -3.574 -0.000 -1.467) 3.863 7.762 ( 13.171 0.000 1.197) 13.226 8.112 ( -7.985 -0.000 -2.765) 8.450 8.134 ( 5.911 0.000 -7.123) 9.256 8.334 ( -3.299 -0.000 -2.028) 3.873 8.399 ( -5.429 -0.000 -8.968) 10.483 8.642 ( -12.350 -0.000 6.579) 13.993 9.061 ( -0.640 -0.000 2.428) 2.511 9.236 ( -3.743 -0.000 -4.792) 6.080 9.652 ( -8.810 -0.000 -18.674) 20.648 10.487 ( -6.785 -0.000 -7.932) 10.437 10.503 ( 8.414 0.000 -3.995) 9.314 11.043 ( 9.846 0.000 2.142) 10.077 11.187 ( -11.004 -0.000 10.051) 14.903 11.594 ( 9.599 0.000 -14.919) 17.740 11.863 ( -6.259 -0.000 10.421) 12.156 11.879 ( 8.706 0.000 -7.506) 11.495 12.193 ( 3.011 0.000 -17.762) 18.016 12.741 ( 21.791 0.000 23.585) 32.111 13.220 ( -6.220 -0.000 -13.478) 14.844 13.530 ( 0.493 0.000 -16.167) 16.174 14.351 ( 9.545 0.000 24.204) 26.018 14.555 ( 7.701 0.000 -0.587) 7.723 15.203 ( -5.301 -0.000 4.060) 6.677 15.569 ( -10.223 -0.000 1.920) 10.401 15.693 ( 6.668 0.000 23.510) 24.437 15.865 ( -13.329 -0.000 4.633) 14.111 18.144 ( 7.290 0.000 -16.013) 17.594 18.534 ( 0.774 0.000 -0.879) 1.172 19.675 ( 4.688 0.000 -15.990) 16.663 20.325 ( 4.469 0.000 -12.808) 13.565 25.580 ( -0.180 -0.000 5.969) 5.972 25.825 ( -14.869 -0.000 9.287) 17.531 26.686 ( -0.398 -0.000 -2.038) 2.076 26.997 ( 1.820 0.000 12.011) 12.148 27.734 ( 0.267 0.000 9.750) 9.753 28.612 ( 5.318 0.000 3.330) 6.274 28.697 ( -3.440 -0.000 6.501) 7.355 29.053 ( -2.426 -0.000 9.329) 9.639 29.079 ( 2.001 0.000 1.372) 2.426 29.339 ( 5.353 0.000 3.242) 6.259 29.750 ( 3.638 0.000 -14.929) 15.366 30.536 ( -7.775 -0.000 -35.022) 35.875 ======================= Grid point 186 (92/186) ======================= q-point: (-0.12 -0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -22.463 -5.824 6.061) 23.984 1.397 ( -22.880 -2.432 9.277) 24.809 1.876 ( -8.505 8.452 7.125) 13.948 2.225 ( -6.280 -10.373 13.001) 17.778 2.324 ( -11.299 -2.274 2.055) 11.708 2.567 ( 1.816 -5.695 6.360) 8.728 3.378 ( -26.425 4.955 -4.586) 27.274 3.686 ( 6.015 -2.909 -5.828) 8.866 4.702 ( 1.185 5.980 15.716) 16.857 5.167 ( 3.743 -7.219 32.041) 33.056 5.388 ( -3.363 2.399 25.322) 25.656 5.665 ( -0.582 6.367 13.495) 14.933 5.738 ( 0.324 -0.555 -6.249) 6.282 5.899 ( 4.895 -3.221 9.868) 11.477 6.367 ( -17.569 0.912 35.079) 39.243 6.725 ( 6.486 -4.995 -8.892) 12.086 7.087 ( -4.078 -3.806 0.326) 5.588 7.164 ( -3.511 1.223 0.459) 3.746 7.796 ( 1.331 11.937 -2.081) 12.190 7.945 ( 0.910 5.214 -9.890) 11.217 8.200 ( -8.509 0.537 -1.623) 8.679 8.218 ( -1.767 -5.017 -8.191) 9.767 8.475 ( -0.134 -14.849 -4.780) 15.600 8.525 ( -6.070 1.427 6.011) 8.661 9.007 ( 0.282 9.322 9.419) 13.255 9.150 ( -3.760 2.384 -9.357) 10.362 9.645 ( -1.565 -15.009 -4.315) 15.695 10.302 ( -15.256 1.011 -9.185) 17.836 10.606 ( 8.224 -1.369 -3.432) 9.016 11.118 ( -3.535 0.678 6.554) 7.478 11.186 ( 5.783 -3.493 5.376) 8.634 11.662 ( 9.144 0.370 -14.658) 17.280 11.797 ( -3.869 2.982 6.761) 8.341 11.949 ( 3.646 -0.705 -6.416) 7.414 12.200 ( 4.238 -3.826 -20.222) 21.012 12.857 ( 7.273 20.352 5.383) 22.273 13.302 ( 15.171 -7.678 -0.216) 17.005 13.472 ( 1.907 1.041 -18.322) 18.450 14.527 ( 9.888 3.447 21.427) 23.849 14.670 ( 5.960 -0.873 0.686) 6.062 15.102 ( -4.524 5.652 4.389) 8.466 15.389 ( -11.441 6.414 9.777) 16.359 15.724 ( -13.839 -4.894 8.845) 17.138 15.979 ( 11.868 -7.418 17.660) 22.533 18.167 ( 5.059 0.893 -10.706) 11.875 18.538 ( 4.235 2.665 -2.492) 5.590 19.728 ( 4.823 -6.552 -15.223) 17.260 20.317 ( 3.559 2.132 -12.934) 13.583 25.601 ( -7.061 -3.653 5.983) 9.950 25.759 ( -1.087 -4.372 9.764) 10.753 26.660 ( -1.328 0.780 -2.791) 3.188 27.048 ( -1.235 -0.315 13.749) 13.808 27.783 ( 1.847 -0.491 6.762) 7.026 28.660 ( -0.100 1.309 5.436) 5.592 28.684 ( -0.411 -0.362 1.438) 1.539 28.986 ( -2.418 5.257 4.044) 7.059 29.067 ( -5.182 6.664 -2.847) 8.909 29.359 ( -1.553 0.432 -4.189) 4.489 29.771 ( 4.404 0.043 -5.991) 7.435 30.356 ( -2.790 -4.651 -25.147) 25.726 ======================= Grid point 194 (93/186) ======================= q-point: (-0.12 -0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( -13.568 -0.000 21.836) 25.708 1.161 ( -18.693 -0.000 12.347) 22.403 1.902 ( -8.769 -0.000 5.017) 10.103 1.975 ( -12.770 -0.000 25.864) 28.845 2.291 ( 0.880 0.000 2.322) 2.483 2.595 ( 3.301 0.000 7.559) 8.249 3.028 ( -30.169 -0.000 -5.638) 30.692 3.722 ( 5.328 0.000 -6.182) 8.161 4.806 ( -1.468 -0.000 12.652) 12.736 5.259 ( 2.752 0.000 30.155) 30.280 5.440 ( -6.682 -0.000 31.319) 32.024 5.658 ( -0.806 -0.000 -4.951) 5.016 5.810 ( 3.072 0.000 7.244) 7.869 5.951 ( -0.315 -0.000 9.569) 9.574 6.285 ( -15.360 -0.000 35.180) 38.387 6.732 ( 6.802 0.000 -10.754) 12.725 7.024 ( -2.025 -0.000 3.032) 3.646 7.142 ( -2.347 -0.000 0.639) 2.433 7.842 ( -8.635 -0.000 -4.874) 9.915 7.950 ( -2.302 -0.000 -12.365) 12.577 8.059 ( -2.979 -0.000 -1.057) 3.161 8.232 ( 2.657 0.000 -5.702) 6.290 8.286 ( -0.571 -0.000 -5.139) 5.170 8.495 ( -4.700 -0.000 7.683) 9.006 9.103 ( 4.270 0.000 0.746) 4.335 9.200 ( 1.914 0.000 1.904) 2.700 9.472 ( -1.300 -0.000 4.782) 4.955 10.052 ( -18.957 -0.000 -7.161) 20.264 10.672 ( 5.391 0.000 -2.261) 5.845 11.136 ( -1.277 -0.000 10.736) 10.811 11.232 ( 4.989 0.000 0.105) 4.990 11.715 ( 7.047 0.000 -17.459) 18.827 11.792 ( -4.163 -0.000 9.035) 9.948 11.971 ( 2.741 0.000 -8.067) 8.520 12.157 ( 6.543 0.000 -23.030) 23.942 12.947 ( -5.402 -0.000 -19.257) 20.000 13.448 ( 4.165 0.000 -21.700) 22.096 13.642 ( 31.910 0.000 7.512) 32.782 14.718 ( 4.869 0.000 19.761) 20.352 14.835 ( 17.993 0.000 1.929) 18.096 15.105 ( -4.033 -0.000 6.364) 7.535 15.312 ( -12.961 -0.000 11.165) 17.107 15.533 ( -13.940 -0.000 7.135) 15.660 16.202 ( 18.560 0.000 25.682) 31.686 18.175 ( 0.251 0.000 -7.493) 7.497 18.632 ( 9.150 0.000 -3.311) 9.731 19.687 ( 4.761 0.000 -14.306) 15.077 20.324 ( 2.353 0.000 -12.699) 12.915 25.508 ( -6.706 -0.000 7.025) 9.712 25.760 ( 1.787 0.000 10.284) 10.438 26.633 ( -1.802 -0.000 -3.619) 4.042 27.065 ( -2.983 -0.000 13.043) 13.380 27.799 ( -2.502 -0.000 2.006) 3.207 28.641 ( -3.874 -0.000 4.858) 6.213 28.687 ( -4.269 -0.000 -6.359) 7.659 28.866 ( -13.055 -0.000 -10.771) 16.925 29.148 ( 2.689 0.000 2.194) 3.470 29.312 ( -3.280 -0.000 -6.911) 7.650 29.846 ( 6.238 0.000 -5.250) 8.153 30.235 ( 5.108 0.000 -2.425) 5.654 ======================= Grid point 195 (94/186) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 6.932 0.000 6.624) 9.588 1.439 ( -8.955 -0.000 13.180) 15.935 2.000 ( -4.593 -0.000 13.578) 14.334 2.350 ( 4.416 0.000 5.871) 7.346 2.598 ( 5.017 0.000 3.420) 6.072 2.820 ( -4.917 -0.000 3.564) 6.073 3.001 ( 9.749 0.000 25.536) 27.334 3.651 ( -0.667 -0.000 0.798) 1.040 4.792 ( -3.479 -0.000 -6.652) 7.507 5.530 ( 1.022 0.000 0.911) 1.369 5.669 ( -4.266 -0.000 -3.900) 5.780 5.715 ( -0.078 -0.000 1.933) 1.934 5.806 ( -13.355 -0.000 4.677) 14.150 6.274 ( 2.653 0.000 10.331) 10.666 6.618 ( -5.567 -0.000 10.102) 11.534 6.973 ( -9.748 -0.000 29.108) 30.697 7.162 ( -3.199 -0.000 5.233) 6.134 7.216 ( 0.148 0.000 8.417) 8.419 7.553 ( -0.892 -0.000 -8.129) 8.177 7.789 ( 2.632 0.000 -4.080) 4.855 7.942 ( -10.584 -0.000 16.227) 19.374 8.259 ( 5.276 0.000 -1.199) 5.411 8.444 ( 8.656 0.000 5.417) 10.211 8.722 ( -3.362 -0.000 17.219) 17.544 9.055 ( -7.453 -0.000 1.305) 7.566 9.384 ( 3.809 0.000 -2.031) 4.317 9.822 ( 6.193 0.000 5.934) 8.577 9.921 ( 1.641 0.000 15.855) 15.940 10.612 ( -2.910 -0.000 -8.583) 9.063 11.091 ( 5.813 0.000 -21.927) 22.684 11.296 ( -4.934 -0.000 5.088) 7.087 11.329 ( 3.349 0.000 -4.012) 5.227 11.610 ( 2.016 0.000 -16.686) 16.807 11.964 ( -1.582 -0.000 8.315) 8.464 12.092 ( 4.253 0.000 -16.210) 16.759 12.253 ( 12.158 0.000 -18.095) 21.800 12.883 ( 2.773 0.000 -26.842) 26.985 13.592 ( 0.869 0.000 -23.714) 23.730 14.737 ( -10.405 -0.000 2.876) 10.795 15.200 ( 10.186 0.000 -7.326) 12.547 15.395 ( -8.840 -0.000 12.753) 15.517 15.571 ( -1.706 -0.000 13.040) 13.151 15.670 ( 0.142 0.000 23.595) 23.595 16.587 ( -11.449 -0.000 1.825) 11.594 18.164 ( 0.697 0.000 3.628) 3.694 18.773 ( 1.833 0.000 0.792) 1.997 19.398 ( 7.513 0.000 -18.679) 20.133 19.951 ( 1.145 0.000 -18.573) 18.608 25.711 ( 3.837 0.000 11.633) 12.249 26.109 ( 1.841 0.000 10.561) 10.720 26.481 ( -0.176 -0.000 -6.231) 6.233 26.866 ( -7.162 -0.000 -10.467) 12.683 27.780 ( -3.782 -0.000 17.334) 17.742 28.512 ( -2.212 -0.000 8.639) 8.917 28.624 ( -3.954 -0.000 0.712) 4.017 28.804 ( 1.270 0.000 2.380) 2.698 29.000 ( -1.104 -0.000 -8.495) 8.566 29.284 ( 2.610 0.000 -0.947) 2.777 29.819 ( -2.116 -0.000 -0.305) 2.137 30.569 ( 13.435 0.000 -9.406) 16.400 ======================= Grid point 196 (95/186) ======================= q-point: ( 0.12 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( -2.383 -4.017 8.649) 9.829 1.469 ( 12.321 -1.721 5.399) 13.561 1.998 ( -0.865 0.947 12.237) 12.304 2.449 ( 5.406 -2.763 6.630) 8.990 2.663 ( 2.709 -0.414 0.236) 2.750 2.742 ( -7.754 -0.232 -1.237) 7.856 3.249 ( 16.933 4.278 22.496) 28.480 3.755 ( 3.558 -12.934 6.460) 14.889 4.725 ( 0.894 3.722 -7.293) 8.237 5.414 ( -15.805 11.392 1.146) 19.516 5.495 ( -3.878 2.728 -1.066) 4.859 5.757 ( -1.492 -6.687 0.187) 6.854 5.846 ( -0.389 -8.747 6.424) 10.860 6.314 ( 0.022 1.682 8.408) 8.575 6.569 ( -5.787 1.166 10.389) 11.949 6.930 ( -10.086 1.952 28.409) 30.210 7.145 ( -2.568 0.048 6.308) 6.810 7.245 ( -2.394 -2.377 8.983) 9.596 7.536 ( -0.069 -1.078 -4.865) 4.983 7.766 ( -4.223 -0.517 2.958) 5.182 7.922 ( 1.073 1.964 6.186) 6.579 8.343 ( 6.452 -0.803 -0.446) 6.517 8.578 ( 5.817 -2.233 4.639) 7.768 8.721 ( -7.952 -2.331 12.999) 15.416 8.974 ( 0.004 2.832 7.855) 8.350 9.426 ( -0.131 -3.053 -6.594) 7.267 9.946 ( -0.880 4.175 7.901) 8.979 9.986 ( 14.279 -0.229 7.135) 15.964 10.581 ( -4.360 -7.896 -9.960) 13.437 11.101 ( 6.595 0.861 -16.300) 17.605 11.264 ( -5.174 -3.320 3.038) 6.857 11.371 ( 3.706 0.204 0.185) 3.716 11.554 ( 0.957 2.170 -16.672) 16.840 11.972 ( -0.116 1.138 3.941) 4.104 12.057 ( 2.817 -0.337 -19.242) 19.450 12.410 ( 15.451 -1.526 -5.864) 16.597 12.836 ( 5.067 0.188 -27.643) 28.104 13.503 ( -1.998 -1.010 -25.773) 25.870 14.530 ( -13.306 8.956 3.562) 16.430 15.164 ( -2.566 6.075 0.465) 6.611 15.334 ( -8.331 1.296 10.535) 13.493 15.650 ( 5.460 1.518 11.890) 13.171 15.741 ( -0.860 -0.838 20.175) 20.210 16.413 ( -17.454 -2.158 5.334) 18.378 18.175 ( 3.630 3.729 2.096) 5.610 18.752 ( -3.507 1.726 1.785) 4.298 19.458 ( 7.116 -4.084 -18.779) 20.493 19.885 ( 0.918 1.362 -19.488) 19.557 25.838 ( 8.845 -0.029 12.775) 15.539 26.183 ( -0.973 -3.294 9.997) 10.571 26.463 ( -0.186 -1.250 -7.157) 7.268 26.801 ( 0.540 -1.405 -9.335) 9.455 27.833 ( -0.139 -2.182 17.599) 17.734 28.507 ( -3.398 -0.067 9.755) 10.330 28.567 ( -2.740 1.689 0.770) 3.310 28.838 ( 0.206 -1.581 4.389) 4.670 28.976 ( -2.366 -3.054 -7.418) 8.364 29.307 ( 4.045 1.528 -2.552) 5.021 29.780 ( -5.657 -1.649 -1.211) 6.016 30.629 ( 10.936 7.298 -14.144) 19.311 ======================= Grid point 197 (96/186) ======================= q-point: ( 0.25 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( 2.203 -4.518 6.188) 7.972 1.647 ( 9.723 -0.431 0.896) 9.774 2.042 ( 1.892 -0.510 10.674) 10.852 2.552 ( -3.721 1.110 -4.525) 5.963 2.626 ( 2.389 -1.093 7.571) 8.014 2.746 ( 2.839 -3.651 -1.170) 4.771 3.433 ( 11.551 3.788 15.864) 19.986 4.120 ( 11.981 -18.656 12.328) 25.369 4.644 ( -1.640 6.570 -4.011) 7.870 5.052 ( -14.824 12.662 7.519) 20.896 5.397 ( -5.044 0.029 -8.575) 9.948 5.803 ( -1.001 -1.894 -0.914) 2.329 6.006 ( 0.937 -8.382 9.622) 12.795 6.270 ( -3.982 4.772 4.735) 7.814 6.534 ( -5.159 -1.062 11.156) 12.337 6.905 ( -5.544 -0.242 24.883) 25.494 7.143 ( -1.381 -0.048 8.665) 8.774 7.295 ( -4.047 -5.875 10.407) 12.618 7.525 ( -1.641 0.740 0.429) 1.851 7.733 ( -1.495 1.791 -0.685) 2.432 7.919 ( -0.920 0.392 4.687) 4.792 8.419 ( 3.883 -0.761 1.824) 4.357 8.651 ( -1.782 -3.377 1.914) 4.271 8.745 ( -3.538 -5.869 12.425) 14.190 9.019 ( 6.422 3.649 10.735) 13.030 9.411 ( -1.008 -0.034 -8.013) 8.076 9.864 ( -2.614 4.541 0.623) 5.276 10.199 ( 16.311 1.047 4.993) 17.090 10.608 ( -5.350 -7.006 -7.851) 11.804 11.109 ( 4.615 0.886 -12.919) 13.747 11.275 ( -4.674 -5.333 1.974) 7.361 11.417 ( 5.009 0.417 -2.610) 5.664 11.480 ( 1.898 1.983 -16.686) 16.911 11.942 ( 1.115 2.923 -6.866) 7.545 12.064 ( 0.960 -1.655 -1.507) 2.435 12.610 ( 13.560 -3.423 -5.991) 15.215 12.806 ( 4.434 1.826 -20.525) 21.078 13.416 ( -0.878 -3.237 -25.800) 26.017 14.228 ( -11.766 11.867 2.923) 16.965 15.038 ( -4.597 5.883 3.683) 8.325 15.226 ( -9.501 2.419 10.942) 14.692 15.688 ( -2.853 2.895 19.032) 19.462 15.838 ( 4.357 -2.141 10.560) 11.623 16.285 ( -13.560 -4.413 5.972) 15.460 18.169 ( 5.288 6.190 1.593) 8.296 18.660 ( -6.373 3.227 2.162) 7.464 19.544 ( 6.652 -5.271 -19.296) 21.080 19.815 ( 2.026 1.282 -20.392) 20.533 25.993 ( 10.772 2.762 12.544) 16.764 26.205 ( -5.906 -1.237 8.011) 10.030 26.479 ( 0.633 -3.676 -4.611) 5.931 26.845 ( 5.303 -3.507 -6.245) 8.912 27.935 ( 0.819 -2.166 16.944) 17.101 28.498 ( -1.841 -0.322 4.095) 4.501 28.547 ( -1.949 -1.709 6.998) 7.463 28.872 ( -1.404 -1.758 5.050) 5.528 28.957 ( -5.067 -3.900 -6.719) 9.275 29.332 ( 5.106 1.704 -2.594) 5.976 29.718 ( -7.215 -2.978 -4.772) 9.149 30.561 ( 8.901 12.410 -16.593) 22.551 ======================= Grid point 198 (97/186) ======================= q-point: ( 0.38 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( 3.096 -2.852 6.109) 7.419 1.697 ( 1.807 2.457 -3.646) 4.753 2.126 ( 2.915 -1.831 8.461) 9.135 2.387 ( -9.051 5.252 -3.017) 10.891 2.748 ( 5.262 -1.070 7.738) 9.419 2.855 ( 4.381 -4.678 -1.096) 6.502 3.546 ( 6.909 3.880 10.760) 13.363 4.384 ( -18.102 5.802 5.814) 19.879 4.620 ( 14.609 -15.158 14.523) 25.576 4.836 ( 0.587 9.786 6.787) 11.923 5.333 ( -2.313 -3.217 -11.803) 12.450 5.785 ( -0.225 1.382 -3.225) 3.516 6.120 ( -0.561 2.461 4.103) 4.818 6.155 ( -6.507 -0.716 13.590) 15.084 6.545 ( -3.422 -2.997 10.042) 11.024 6.952 ( 0.619 1.078 15.465) 15.515 7.181 ( -3.014 -4.610 10.942) 12.250 7.370 ( -4.352 -6.847 12.239) 14.684 7.462 ( -3.519 3.933 -0.120) 5.279 7.660 ( -0.656 5.340 -0.670) 5.422 7.967 ( -1.672 -7.088 6.666) 9.873 8.473 ( -0.708 -1.564 4.955) 5.244 8.657 ( -2.818 -1.206 0.403) 3.092 8.824 ( -6.793 -7.387 11.299) 15.112 9.066 ( 6.487 6.511 7.235) 11.697 9.363 ( 2.661 5.422 -2.500) 6.537 9.806 ( 0.552 -0.085 -4.488) 4.523 10.382 ( 13.060 1.857 1.577) 13.286 10.556 ( -5.578 0.787 -4.495) 7.207 11.104 ( 5.317 2.595 -13.707) 14.929 11.299 ( -6.341 -7.178 4.745) 10.689 11.441 ( 3.803 0.643 -16.980) 17.413 11.464 ( 4.900 -1.156 -11.021) 12.116 11.888 ( 0.680 3.214 -4.924) 5.919 12.100 ( -0.660 -2.132 5.932) 6.337 12.713 ( -2.599 3.136 -15.200) 15.736 12.801 ( 11.951 -2.432 -4.884) 13.137 13.398 ( 1.710 -2.122 -18.700) 18.897 14.004 ( -3.737 3.476 -3.036) 5.938 14.921 ( -5.396 3.801 1.848) 6.855 15.135 ( -6.644 1.294 13.423) 15.033 15.653 ( -7.638 1.835 20.294) 21.761 15.968 ( 5.681 -2.789 7.946) 10.158 16.216 ( -8.417 -2.173 4.019) 9.577 18.152 ( 5.857 7.149 1.551) 9.371 18.537 ( -6.864 3.081 2.532) 7.939 19.634 ( 7.742 -4.365 -19.940) 21.831 19.761 ( 2.347 0.293 -20.627) 20.762 26.084 ( 3.737 5.063 7.760) 9.991 26.153 ( -2.660 2.222 9.506) 10.118 26.524 ( -0.148 -3.502 -2.421) 4.260 26.982 ( 8.196 -5.181 -0.533) 9.711 28.000 ( -1.497 0.837 16.729) 16.816 28.524 ( 2.408 -2.054 0.053) 3.166 28.605 ( -2.907 -6.444 9.997) 12.244 28.883 ( -2.673 -1.023 3.637) 4.628 28.901 ( -8.977 -4.001 -4.939) 11.000 29.363 ( 3.376 1.570 0.055) 3.724 29.663 ( -4.158 -4.120 -10.386) 11.922 30.417 ( 7.842 14.577 -17.657) 24.202 ======================= Grid point 199 (98/186) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( -2.334 4.131 -1.550) 4.991 1.724 ( 0.900 -3.136 4.670) 5.697 2.157 ( -12.406 6.153 3.076) 14.186 2.212 ( 2.966 1.019 4.163) 5.212 2.808 ( 0.833 2.327 5.856) 6.356 2.930 ( 1.891 0.051 1.848) 2.644 3.560 ( 0.071 5.048 7.297) 8.874 4.070 ( -18.550 7.643 13.094) 23.958 4.790 ( 1.390 3.304 9.695) 10.336 5.052 ( 13.847 -12.201 5.973) 19.398 5.353 ( 1.619 -5.705 -7.790) 9.791 5.775 ( 5.566 2.006 -4.152) 7.228 6.014 ( -5.634 3.940 10.007) 12.141 6.178 ( -3.924 0.321 10.988) 11.672 6.611 ( -0.243 -6.265 6.126) 8.765 6.950 ( 3.680 8.405 3.027) 9.662 7.245 ( -8.033 -6.180 14.322) 17.545 7.362 ( -5.215 1.735 6.787) 8.733 7.459 ( -3.530 -7.461 10.436) 13.306 7.589 ( -1.459 2.926 0.409) 3.295 8.088 ( -0.645 -8.160 4.924) 9.552 8.458 ( -3.901 2.154 6.424) 7.818 8.624 ( -3.659 0.200 1.630) 4.010 8.831 ( -13.613 -7.462 6.876) 16.979 9.050 ( 5.513 9.224 5.464) 12.055 9.316 ( 4.938 9.402 5.464) 11.943 9.861 ( 7.665 -2.475 -6.369) 10.269 10.359 ( -8.413 4.007 -4.281) 10.255 10.551 ( 11.265 4.433 -0.560) 12.119 11.073 ( 3.728 3.185 -12.251) 13.196 11.348 ( -6.218 -7.959 1.781) 10.256 11.418 ( 5.231 2.475 -11.856) 13.193 11.504 ( 4.080 -3.901 -17.999) 18.863 11.854 ( 1.859 2.274 -0.326) 2.956 12.136 ( -2.484 -2.818 2.670) 4.609 12.559 ( -5.061 4.452 -7.248) 9.897 12.969 ( 10.669 -3.592 -6.061) 12.786 13.331 ( -2.244 2.851 -8.595) 9.329 14.051 ( 7.271 -8.407 -12.518) 16.740 14.811 ( -5.942 1.711 -0.187) 6.186 15.135 ( -1.136 -0.897 16.650) 16.713 15.601 ( -9.311 -0.126 19.259) 21.392 16.104 ( -1.425 -5.696 10.772) 12.268 16.149 ( 0.899 3.741 0.171) 3.851 18.135 ( 5.526 6.245 0.875) 8.385 18.447 ( -3.715 1.001 3.315) 5.079 19.666 ( 7.697 5.433 -21.173) 23.175 19.767 ( 3.260 -7.892 -19.626) 21.403 25.996 ( -8.517 3.249 6.345) 11.107 26.163 ( 6.672 7.895 9.514) 14.048 26.550 ( -0.830 -2.578 -2.522) 3.701 27.155 ( 6.877 -3.905 4.495) 9.097 28.003 ( -2.486 2.443 15.071) 15.469 28.599 ( 3.002 -3.648 -2.021) 5.138 28.694 ( -5.528 -7.798 7.506) 12.153 28.787 ( -11.830 -2.684 -3.849) 12.727 28.895 ( -1.526 -2.413 5.391) 6.100 29.351 ( -1.709 2.009 0.459) 2.677 29.681 ( 3.491 -4.577 -10.478) 11.955 30.253 ( 7.403 13.697 -18.098) 23.874 ======================= Grid point 200 (99/186) ======================= q-point: (-0.38 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -3.864 3.999 2.948) 6.294 1.779 ( -2.342 -4.353 3.609) 6.120 1.885 ( -12.078 11.505 10.056) 19.478 2.258 ( 1.131 -0.894 3.074) 3.395 2.735 ( -4.675 6.548 6.316) 10.229 2.931 ( 1.711 4.376 4.863) 6.762 3.442 ( -15.956 3.869 11.259) 19.908 3.839 ( -3.938 9.467 7.901) 12.945 4.826 ( -2.219 -3.089 10.046) 10.742 5.281 ( 3.405 -7.480 -4.859) 9.548 5.499 ( 10.037 -4.747 -0.526) 11.115 5.820 ( 5.527 4.418 2.398) 7.471 5.980 ( -0.450 -1.433 7.686) 7.832 6.133 ( -4.588 2.155 10.074) 11.278 6.719 ( -2.272 -6.428 -0.523) 6.838 6.874 ( 5.987 7.774 -0.760) 9.841 7.203 ( -13.253 0.168 24.297) 27.677 7.352 ( -2.810 -0.310 8.219) 8.691 7.525 ( -3.045 -3.160 0.253) 4.395 7.586 ( -2.861 -7.419 6.588) 10.326 8.155 ( -3.856 -2.811 1.618) 5.039 8.382 ( -2.100 5.796 3.451) 7.065 8.607 ( -2.220 -1.908 9.946) 10.368 8.735 ( -12.150 -0.048 1.799) 12.283 9.009 ( -0.018 5.086 7.335) 8.926 9.275 ( 5.526 8.378 8.766) 13.326 9.974 ( 9.894 2.422 -2.395) 10.464 10.161 ( -9.862 4.824 -3.926) 11.659 10.592 ( 5.759 4.150 -4.495) 8.402 11.055 ( 3.478 -0.017 -7.029) 7.843 11.326 ( 2.261 1.857 -15.222) 15.500 11.460 ( 0.733 -2.955 0.529) 3.090 11.546 ( 3.015 -4.722 -17.552) 18.424 11.869 ( 4.067 1.637 1.868) 4.765 12.106 ( -5.221 -0.621 -5.462) 7.582 12.442 ( -4.350 0.458 -9.271) 10.251 13.076 ( 3.236 0.014 -9.768) 10.290 13.326 ( 7.599 -3.990 0.646) 8.607 14.241 ( 8.843 -10.193 -15.711) 20.710 14.753 ( -3.159 -2.494 1.023) 4.153 15.235 ( 2.689 -2.623 18.823) 19.194 15.560 ( -9.342 -1.542 17.663) 20.041 16.014 ( -10.142 3.171 5.583) 12.003 16.281 ( 8.702 -3.174 7.877) 12.159 18.124 ( 2.637 3.082 0.271) 4.065 18.455 ( 3.502 -0.729 3.430) 4.956 19.585 ( 6.246 7.455 -21.121) 23.253 19.862 ( 4.902 -7.256 -19.348) 21.238 25.860 ( -8.896 3.833 7.788) 12.429 26.154 ( 5.986 9.393 8.297) 13.889 26.557 ( -1.179 -1.686 -3.238) 3.836 27.257 ( 0.099 -1.217 5.177) 5.320 27.980 ( -3.853 2.470 11.763) 12.622 28.602 ( -15.585 -6.572 -7.242) 18.399 28.677 ( 1.168 -0.700 -2.033) 2.446 28.757 ( -2.448 -2.001 7.286) 7.943 28.977 ( 1.161 -6.131 7.000) 9.377 29.284 ( -2.853 2.477 -2.756) 4.677 29.782 ( 6.803 -2.686 -2.821) 7.840 30.126 ( 7.737 8.295 -17.343) 20.723 ======================= Grid point 201 (100/186) ======================= q-point: (-0.25 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -8.301 5.512 4.378) 10.884 1.675 ( -7.180 8.470 18.729) 21.774 1.841 ( -1.878 -7.239 7.143) 10.341 2.285 ( 1.481 0.714 1.925) 2.532 2.605 ( -3.159 7.152 7.094) 10.557 2.894 ( 0.641 5.923 7.951) 9.936 3.164 ( -22.214 5.252 15.895) 27.815 3.750 ( 2.658 7.035 2.358) 7.882 4.859 ( -6.225 -5.648 3.350) 9.048 5.397 ( 2.629 -5.774 0.162) 6.347 5.642 ( 5.772 -1.208 -2.396) 6.365 5.790 ( 1.191 6.242 5.276) 8.259 6.019 ( -0.855 -1.602 -2.325) 2.950 6.136 ( 0.335 -0.201 13.983) 13.989 6.670 ( -2.961 2.122 -4.175) 5.541 6.945 ( 0.594 -4.303 10.100) 10.995 7.129 ( -9.495 0.705 23.967) 25.789 7.305 ( -3.837 5.068 10.645) 12.398 7.558 ( 0.635 -5.434 -5.724) 7.918 7.678 ( -4.359 -7.904 4.814) 10.230 8.109 ( -6.995 -0.458 5.261) 8.764 8.281 ( 1.271 7.883 0.603) 8.007 8.549 ( -6.438 8.558 -0.020) 10.709 8.682 ( -2.811 -3.364 17.039) 17.594 8.975 ( -2.025 -0.714 4.896) 5.346 9.310 ( 7.276 3.653 10.044) 12.929 9.957 ( 2.622 11.894 4.912) 13.133 9.979 ( -10.306 1.366 -2.731) 10.749 10.602 ( 5.505 0.429 -6.173) 8.283 11.107 ( 5.647 -0.964 -6.322) 8.532 11.274 ( 2.430 1.285 -17.816) 18.027 11.467 ( 0.095 3.097 -0.122) 3.101 11.590 ( 1.618 -5.796 -16.488) 17.552 11.921 ( 6.100 1.242 2.640) 6.762 12.023 ( -3.512 1.213 -2.546) 4.504 12.349 ( -3.244 -1.985 -23.472) 23.778 13.026 ( -1.100 0.352 -15.949) 15.991 13.539 ( 11.921 -4.058 -5.057) 13.570 14.466 ( 8.284 -14.732 -7.041) 18.309 14.811 ( 3.196 -4.931 -0.039) 5.876 15.381 ( 2.234 -3.544 19.160) 19.613 15.532 ( -7.532 -1.147 17.428) 19.021 15.838 ( -11.752 5.445 8.029) 15.239 16.472 ( 7.294 -5.298 8.183) 12.175 18.121 ( -0.661 -0.590 1.612) 1.839 18.563 ( 9.173 -1.138 1.855) 9.428 19.487 ( 6.674 7.733 -20.632) 23.022 19.941 ( 4.200 -5.257 -18.827) 19.993 25.737 ( -6.560 3.614 9.066) 11.760 26.119 ( 4.495 9.207 8.556) 13.348 26.543 ( -1.554 -0.613 -4.066) 4.396 27.213 ( -9.035 0.481 -1.028) 9.106 27.904 ( -8.602 2.372 9.937) 13.356 28.506 ( -6.989 -3.344 -0.162) 7.749 28.674 ( -4.321 -2.865 -0.845) 5.253 28.782 ( 1.911 1.002 2.963) 3.665 29.093 ( 2.151 -3.074 0.997) 3.883 29.211 ( -2.094 0.730 -2.515) 3.353 29.850 ( 4.995 3.530 -1.107) 6.215 30.159 ( 11.055 -3.486 -9.006) 14.679 ======================= Grid point 202 (101/186) ======================= q-point: (-0.12 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -2.863 3.373 6.641) 7.980 1.546 ( -10.412 4.186 16.986) 20.358 1.965 ( -2.485 -6.829 12.490) 14.450 2.295 ( 5.052 4.054 4.304) 7.777 2.548 ( 3.063 3.627 5.399) 7.190 2.855 ( -1.473 2.928 8.365) 8.984 2.942 ( -11.697 2.541 20.978) 24.153 3.695 ( 1.017 5.210 -0.023) 5.308 4.846 ( -6.632 -4.240 -3.244) 8.514 5.489 ( 1.196 -2.957 2.291) 3.927 5.672 ( -0.512 -1.198 -0.612) 1.439 5.738 ( 0.786 4.169 0.205) 4.247 5.982 ( -8.124 0.914 -0.038) 8.175 6.194 ( 3.344 0.276 10.422) 10.949 6.631 ( -3.403 -1.582 4.852) 6.134 6.986 ( -9.167 -1.155 26.253) 27.832 7.144 ( -0.186 -2.004 9.233) 9.450 7.227 ( -2.796 4.327 9.363) 10.687 7.596 ( -1.795 -1.960 -6.016) 6.576 7.733 ( 1.751 -3.840 -3.048) 5.206 8.041 ( -12.244 -1.506 13.400) 18.214 8.234 ( 3.212 3.577 0.870) 4.886 8.393 ( 3.536 8.381 1.385) 9.201 8.713 ( -4.557 0.255 18.452) 19.008 9.037 ( -0.757 -7.025 2.504) 7.496 9.375 ( 6.234 4.992 4.018) 8.940 9.821 ( -7.607 1.433 2.862) 8.253 9.879 ( 1.343 5.946 11.947) 13.412 10.646 ( 3.668 0.768 -5.241) 6.443 11.119 ( 4.310 1.530 -20.959) 21.453 11.269 ( 1.431 -3.099 -4.753) 5.852 11.391 ( -1.799 5.177 -0.724) 5.528 11.619 ( 2.178 -3.068 -16.607) 17.028 11.965 ( -2.689 0.154 7.631) 8.092 12.023 ( 9.422 1.008 -3.202) 10.002 12.263 ( 1.436 -1.522 -31.553) 31.622 12.950 ( 0.077 0.037 -21.818) 21.818 13.630 ( 5.562 -0.086 -18.494) 19.312 14.735 ( -2.600 -13.121 2.272) 13.568 14.978 ( 16.535 -4.630 -5.472) 18.022 15.455 ( -8.172 -2.654 13.754) 16.217 15.565 ( 1.053 -0.299 21.777) 21.804 15.653 ( -10.570 4.591 12.371) 16.907 16.621 ( 0.808 -3.858 3.773) 5.456 18.138 ( -1.442 -2.241 3.803) 4.644 18.697 ( 8.190 -1.027 0.377) 8.262 19.411 ( 7.162 5.399 -19.531) 21.492 19.974 ( 2.629 -2.604 -18.372) 18.741 25.675 ( -1.976 2.027 10.308) 10.690 26.087 ( 2.739 6.032 9.927) 11.935 26.511 ( -1.209 0.178 -4.955) 5.103 27.038 ( -12.790 0.735 -8.703) 15.488 27.809 ( -7.508 1.643 14.146) 16.099 28.501 ( -1.877 -1.353 5.757) 6.205 28.655 ( -4.554 -2.456 0.941) 5.259 28.792 ( 1.704 1.457 0.858) 2.401 29.065 ( -0.367 3.189 -8.667) 9.242 29.240 ( 1.274 -2.747 1.467) 3.364 29.840 ( 1.729 2.460 -1.361) 3.301 30.374 ( 13.967 -5.599 -4.750) 15.780 ======================= Grid point 204 (102/186) ======================= q-point: ( 0.12 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( 5.322 0.000 5.208) 7.446 1.652 ( 14.702 0.000 2.905) 14.986 2.042 ( 0.564 0.000 11.633) 11.647 2.543 ( 8.106 0.000 8.328) 11.621 2.631 ( -7.333 -0.000 -4.814) 8.772 2.692 ( 1.731 0.000 -0.409) 1.779 3.665 ( 25.150 0.000 22.188) 33.539 3.672 ( 0.536 0.000 6.616) 6.638 4.758 ( 2.424 0.000 -5.547) 6.054 5.336 ( -10.288 -0.000 -13.268) 16.789 5.370 ( -15.989 -0.000 4.498) 16.609 5.755 ( 5.617 0.000 15.730) 16.703 5.799 ( 0.486 0.000 -0.138) 0.505 6.341 ( -2.766 -0.000 7.932) 8.400 6.527 ( -9.246 -0.000 17.206) 19.532 6.927 ( -8.530 -0.000 28.456) 29.707 7.120 ( -2.645 -0.000 4.924) 5.590 7.241 ( -1.223 -0.000 7.343) 7.444 7.508 ( 1.242 0.000 -9.878) 9.956 7.701 ( -6.727 -0.000 11.028) 12.917 7.997 ( 4.338 0.000 -0.857) 4.422 8.442 ( 8.916 0.000 -0.369) 8.924 8.544 ( -11.488 -0.000 7.305) 13.614 8.693 ( 0.776 0.000 9.562) 9.593 9.071 ( 6.396 0.000 11.925) 13.532 9.380 ( 0.912 0.000 -10.677) 10.716 10.028 ( 0.709 0.000 6.969) 7.005 10.218 ( 18.080 0.000 7.575) 19.603 10.398 ( -5.229 -0.000 -14.429) 15.347 11.138 ( 5.348 0.000 -15.093) 16.013 11.166 ( -6.078 -0.000 2.575) 6.601 11.431 ( 2.539 0.000 0.966) 2.717 11.523 ( 1.546 0.000 -13.580) 13.667 12.004 ( -0.025 -0.000 7.052) 7.052 12.021 ( 2.948 0.000 -17.175) 17.426 12.563 ( 13.593 0.000 -8.594) 16.082 12.837 ( 10.198 0.000 -26.541) 28.433 13.362 ( -4.416 -0.000 -26.489) 26.854 14.412 ( -15.310 -0.000 1.300) 15.365 15.098 ( -11.176 -0.000 2.899) 11.546 15.346 ( -1.456 -0.000 9.988) 10.093 15.755 ( -0.983 -0.000 10.283) 10.330 15.765 ( -4.787 -0.000 21.640) 22.163 16.196 ( -13.189 -0.000 9.232) 16.100 18.260 ( 4.943 0.000 -0.500) 4.968 18.716 ( -5.518 -0.000 3.488) 6.528 19.453 ( 6.398 0.000 -18.252) 19.341 19.833 ( 1.027 0.000 -20.775) 20.800 26.035 ( 13.542 0.000 13.567) 19.169 26.191 ( -0.643 -0.000 11.886) 11.904 26.417 ( -0.900 -0.000 -7.768) 7.820 26.789 ( 3.727 0.000 -9.134) 9.865 27.895 ( 3.091 0.000 15.357) 15.665 28.484 ( -5.486 -0.000 10.919) 12.219 28.546 ( -2.276 -0.000 -0.561) 2.345 28.843 ( -1.076 -0.000 7.436) 7.513 28.897 ( -3.574 -0.000 -6.117) 7.085 29.357 ( 4.641 0.000 -5.176) 6.952 29.678 ( -8.129 -0.000 -0.840) 8.172 30.747 ( 8.774 0.000 -18.532) 20.505 ======================= Grid point 205 (103/186) ======================= q-point: ( 0.25 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( 9.201 -1.192 2.369) 9.576 1.805 ( 10.453 3.194 -0.412) 10.938 2.098 ( 2.134 -0.328 9.958) 10.189 2.514 ( -3.960 3.602 -3.969) 6.664 2.695 ( 7.995 -2.679 3.271) 9.044 2.729 ( 1.342 -2.772 4.445) 5.408 3.670 ( 5.885 5.156 10.772) 13.313 4.156 ( 22.021 -11.583 17.305) 30.308 4.675 ( -9.045 7.651 -0.020) 11.847 5.108 ( -4.483 7.082 0.202) 8.384 5.250 ( -8.645 -2.185 -8.119) 12.059 5.786 ( 1.200 0.265 -1.997) 2.345 5.952 ( 2.695 -7.837 13.423) 15.775 6.283 ( -7.388 3.566 8.666) 11.933 6.483 ( -6.925 -1.308 14.623) 16.233 6.927 ( -5.002 0.648 27.464) 27.923 7.139 ( -1.203 -3.510 5.710) 6.810 7.254 ( -0.256 0.752 8.557) 8.594 7.497 ( 0.037 -0.966 -7.705) 7.765 7.682 ( -4.710 -2.236 9.676) 10.991 7.993 ( 1.885 4.893 -3.991) 6.589 8.432 ( -6.131 -0.526 9.674) 11.465 8.574 ( 3.730 -3.591 0.046) 5.178 8.718 ( -4.043 -0.740 9.707) 10.541 9.190 ( 7.867 2.473 10.850) 13.629 9.382 ( 4.088 -1.934 -10.500) 11.432 9.956 ( -0.533 9.458 0.861) 9.512 10.375 ( -2.976 -7.058 -7.136) 10.469 10.478 ( 17.352 -0.818 2.754) 17.588 11.116 ( 0.397 -0.038 -2.394) 2.427 11.158 ( -1.225 -3.678 -9.549) 10.306 11.399 ( -1.521 0.069 -14.553) 14.633 11.527 ( 3.437 1.607 -5.279) 6.502 11.983 ( 1.519 3.089 -1.824) 3.896 12.050 ( 0.472 -1.913 2.932) 3.533 12.673 ( 9.718 -1.513 -18.230) 20.714 12.891 ( 10.993 4.173 -12.828) 17.402 13.252 ( -1.857 -5.430 -24.565) 25.227 14.189 ( -12.977 5.493 -1.600) 14.182 14.954 ( -13.612 -0.257 4.692) 14.400 15.296 ( -1.788 9.166 11.886) 15.116 15.705 ( -10.432 -0.447 17.884) 20.709 15.809 ( -6.327 -6.861 14.801) 17.498 16.180 ( 2.279 -0.165 6.366) 6.764 18.290 ( 3.666 2.830 -2.356) 5.195 18.639 ( -5.780 2.865 5.089) 8.216 19.483 ( 4.185 -3.958 -18.928) 19.785 19.783 ( 3.519 0.349 -21.775) 22.060 26.145 ( -3.066 0.995 8.407) 9.003 26.287 ( 13.073 5.138 12.958) 19.111 26.421 ( 1.720 -3.667 -2.960) 5.017 26.837 ( 4.634 -4.081 -6.001) 8.610 27.999 ( 3.920 -0.671 13.282) 13.865 28.450 ( -6.204 -0.905 9.174) 11.112 28.529 ( -1.411 -1.408 1.596) 2.554 28.828 ( -6.279 -1.209 -4.320) 7.717 28.858 ( -1.958 -0.612 8.247) 8.499 29.392 ( 3.803 0.414 -3.690) 5.315 29.580 ( -6.690 -1.563 -5.635) 8.885 30.730 ( 7.086 6.627 -20.585) 22.757 ======================= Grid point 206 (104/186) ======================= q-point: ( 0.38 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 8.473 0.413 0.994) 8.541 1.806 ( 3.988 7.986 -2.285) 9.214 2.158 ( 0.557 -0.447 6.773) 6.811 2.405 ( -0.707 6.816 -0.435) 6.866 2.817 ( 2.312 -6.265 -0.445) 6.693 2.835 ( 4.743 -0.418 9.249) 10.402 3.724 ( 5.332 4.762 10.874) 13.013 4.309 ( -16.139 10.603 7.966) 20.889 4.682 ( 17.156 -10.777 13.278) 24.224 5.021 ( 1.801 7.789 4.751) 9.300 5.183 ( -2.777 -5.352 -11.684) 13.149 5.799 ( 3.354 -0.341 -5.004) 6.034 6.100 ( -2.408 -5.915 14.129) 15.505 6.141 ( -8.398 5.210 6.848) 12.024 6.499 ( -2.272 -2.997 10.492) 11.146 6.980 ( -3.428 -1.759 25.678) 25.965 7.199 ( 1.697 -0.711 5.022) 5.348 7.284 ( -0.934 -2.406 9.326) 9.677 7.449 ( -3.808 2.329 -4.423) 6.284 7.686 ( -2.908 0.276 5.683) 6.390 7.949 ( 2.156 1.047 0.804) 2.528 8.442 ( -3.659 -2.960 11.578) 12.498 8.626 ( 0.167 -0.771 -1.941) 2.095 8.672 ( -10.876 -2.277 7.067) 13.168 9.254 ( 5.868 5.599 7.344) 10.941 9.475 ( 10.644 -0.873 -5.094) 11.832 9.844 ( 0.983 5.578 -0.584) 5.694 10.381 ( -5.573 -3.735 -3.886) 7.753 10.673 ( 15.203 3.694 -0.824) 15.667 11.138 ( -4.045 -4.352 3.137) 6.719 11.150 ( 2.427 0.365 -11.445) 11.705 11.354 ( 1.508 -4.553 -20.702) 21.250 11.495 ( 0.233 1.707 -11.869) 11.993 11.954 ( 1.089 3.887 2.910) 4.976 12.092 ( 0.367 -1.132 6.085) 6.200 12.679 ( 1.548 3.908 -18.772) 19.236 12.916 ( 9.152 0.886 -6.875) 11.481 13.307 ( 3.002 -6.448 -13.509) 15.267 13.976 ( -5.466 3.563 -7.387) 9.856 14.811 ( -13.184 -1.491 3.915) 13.833 15.201 ( -1.534 6.463 14.670) 16.104 15.641 ( -9.113 1.369 19.133) 21.236 15.896 ( -5.595 -9.362 10.121) 14.879 16.238 ( 6.501 2.773 3.462) 7.870 18.257 ( -0.560 3.264 -3.934) 5.142 18.548 ( -2.624 4.773 7.271) 9.085 19.537 ( 2.614 -7.590 -20.349) 21.875 19.760 ( 6.298 1.394 -21.613) 22.555 26.073 ( -7.264 2.772 7.271) 10.645 26.377 ( 8.553 4.312 3.041) 10.049 26.491 ( 3.848 1.258 3.624) 5.434 26.993 ( 7.452 -7.648 1.917) 10.849 28.075 ( 1.561 1.976 13.716) 13.945 28.429 ( -6.612 -4.524 3.553) 8.764 28.563 ( -1.652 -4.148 5.534) 7.111 28.740 ( -7.326 -0.672 -2.760) 7.858 28.866 ( -1.950 -0.166 8.454) 8.678 29.394 ( -3.198 0.986 5.205) 6.188 29.549 ( 3.162 -4.087 -17.285) 18.041 30.616 ( 6.022 10.931 -20.970) 24.403 ======================= Grid point 207 (105/186) ======================= q-point: (-0.50 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 1.444 8.333 -1.397) 8.572 1.774 ( 5.434 3.083 1.250) 6.371 2.124 ( -5.836 4.590 4.525) 8.695 2.333 ( 4.239 6.523 3.109) 8.378 2.872 ( -1.231 2.958 7.938) 8.560 2.914 ( 0.248 -4.253 2.085) 4.743 3.656 ( -7.349 10.509 10.776) 16.750 4.072 ( -4.646 6.711 11.904) 14.433 4.875 ( -1.859 5.674 7.126) 9.297 5.050 ( 4.518 -8.037 -4.238) 10.148 5.308 ( 10.916 -8.076 1.485) 13.659 5.862 ( 7.429 -1.690 -4.215) 8.707 6.005 ( -6.495 3.982 7.687) 10.822 6.151 ( -5.460 -2.554 10.124) 11.783 6.571 ( 1.018 -3.674 6.759) 7.760 7.040 ( -4.708 -1.592 23.699) 24.215 7.199 ( 0.509 5.582 -3.481) 6.598 7.338 ( -6.368 1.412 9.319) 11.376 7.361 ( -0.644 -5.654 3.993) 6.952 7.634 ( -2.508 4.594 7.018) 8.755 8.031 ( 3.221 -4.458 3.536) 6.538 8.467 ( -2.206 0.022 9.479) 9.733 8.581 ( -12.750 -5.834 1.440) 14.095 8.613 ( -1.929 0.905 3.874) 4.421 9.234 ( 2.871 8.350 5.442) 10.372 9.551 ( 8.388 8.804 2.538) 12.422 9.874 ( 6.196 -4.667 -4.200) 8.821 10.313 ( -5.559 1.962 0.542) 5.920 10.731 ( 5.711 5.784 -7.102) 10.794 11.076 ( -3.435 -0.136 -5.009) 6.075 11.216 ( 3.841 -5.275 -5.838) 8.755 11.413 ( 1.689 -2.353 -14.244) 14.536 11.431 ( 3.017 -3.120 -17.966) 18.483 11.928 ( 0.457 2.659 3.918) 4.758 12.121 ( 1.368 1.346 2.288) 2.987 12.535 ( -2.311 5.842 -12.327) 13.836 13.053 ( 10.981 -3.167 -2.470) 11.692 13.292 ( -5.002 2.067 -3.273) 6.325 13.974 ( 5.891 -7.648 -16.004) 18.690 14.696 ( -10.446 -2.270 1.900) 10.858 15.200 ( 1.218 1.114 15.742) 15.828 15.578 ( -7.191 2.152 19.252) 20.663 15.961 ( -7.537 -6.380 8.112) 12.779 16.295 ( 8.486 3.142 1.519) 9.176 18.171 ( -5.370 1.236 -3.731) 6.654 18.516 ( 3.416 4.161 7.805) 9.482 19.606 ( 1.436 -8.663 -22.001) 23.689 19.751 ( 8.512 2.453 -20.380) 22.222 25.957 ( -8.105 3.484 7.763) 11.752 26.415 ( 7.949 6.781 2.392) 10.719 26.509 ( 0.771 0.446 0.523) 1.033 27.178 ( 3.708 -4.811 5.703) 8.332 28.079 ( -1.611 4.374 13.648) 14.422 28.408 ( -9.714 -6.187 -1.170) 11.576 28.617 ( -6.092 -6.106 6.893) 11.041 28.689 ( 0.790 -0.362 2.103) 2.276 28.884 ( 0.149 -0.634 7.494) 7.523 29.339 ( -4.579 1.297 3.473) 5.891 29.636 ( 7.626 -6.041 -15.749) 18.511 30.450 ( 5.082 12.569 -20.467) 24.550 ======================= Grid point 208 (106/186) ======================= q-point: (-0.38 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( -0.742 8.420 1.975) 8.681 1.782 ( 2.869 3.031 1.897) 4.585 1.953 ( -6.466 10.015 8.461) 14.618 2.338 ( 5.728 3.966 2.285) 7.332 2.783 ( -5.050 6.477 6.770) 10.644 2.950 ( -3.530 -1.885 5.460) 6.769 3.404 ( -13.799 10.764 13.892) 22.344 4.011 ( 4.619 10.002 8.388) 13.847 4.777 ( -6.663 0.947 1.968) 7.012 5.202 ( 4.403 -8.261 -1.736) 9.521 5.540 ( 5.911 -5.482 3.372) 8.739 5.919 ( -5.333 1.703 6.739) 8.761 5.979 ( 7.751 -0.960 -6.822) 10.370 6.135 ( -3.116 -0.599 11.816) 12.235 6.646 ( 0.378 -2.564 1.773) 3.140 7.020 ( -0.158 8.016 -5.929) 9.972 7.103 ( -10.991 -3.000 27.408) 29.682 7.336 ( -0.438 -1.238 7.055) 7.176 7.445 ( -2.630 -5.441 8.994) 10.835 7.570 ( -1.414 3.916 7.895) 8.926 8.107 ( -0.005 -0.829 1.956) 2.125 8.441 ( -1.053 3.499 3.026) 4.745 8.536 ( -9.845 -6.939 1.204) 12.104 8.623 ( 0.914 -0.326 11.703) 11.743 9.141 ( -0.685 9.827 6.298) 11.692 9.505 ( 5.124 9.935 5.617) 12.511 9.973 ( -0.906 -2.151 -5.813) 6.263 10.234 ( 1.766 5.917 3.122) 6.919 10.633 ( -3.445 2.425 -8.557) 9.538 11.080 ( 4.793 -1.080 -4.996) 7.007 11.333 ( 2.997 -8.190 -9.345) 12.782 11.339 ( 0.703 1.816 -19.083) 19.182 11.513 ( 4.805 -2.939 -10.284) 11.726 11.924 ( -0.445 -0.305 2.209) 2.274 12.098 ( 2.796 4.770 -2.723) 6.163 12.400 ( -1.677 4.984 -10.275) 11.543 13.106 ( -1.025 5.782 -7.786) 9.752 13.326 ( 7.229 -9.811 5.086) 13.205 14.123 ( 3.971 -10.397 -15.627) 19.185 14.655 ( -3.611 -5.353 0.463) 6.474 15.291 ( 2.237 -2.265 15.052) 15.385 15.544 ( -4.195 1.819 19.679) 20.203 15.920 ( -10.570 -0.399 7.516) 12.976 16.387 ( 8.258 -0.252 2.082) 8.520 18.084 ( -6.729 -1.594 -1.815) 7.150 18.569 ( 7.001 1.586 5.928) 9.310 19.627 ( 3.001 -1.335 -22.849) 23.084 19.785 ( 7.558 -2.664 -19.195) 20.801 25.839 ( -7.061 3.666 8.848) 11.899 26.404 ( 6.882 10.079 4.197) 12.906 26.514 ( -0.216 -1.287 -3.002) 3.273 27.214 ( -6.703 -0.767 1.979) 7.031 28.003 ( -7.119 4.785 12.650) 15.284 28.388 ( -3.890 -4.551 1.658) 6.212 28.615 ( -4.572 -1.850 3.097) 5.824 28.767 ( 2.055 -3.329 7.331) 8.309 28.952 ( 3.029 -3.311 5.554) 7.140 29.275 ( -2.911 2.111 -0.169) 3.600 29.783 ( 7.736 -7.261 -8.783) 13.773 30.275 ( 4.340 10.646 -19.319) 22.481 ======================= Grid point 209 (107/186) ======================= q-point: (-0.25 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -1.808 9.379 4.534) 10.573 1.729 ( -7.024 7.841 9.074) 13.897 1.860 ( 3.952 1.511 8.345) 9.357 2.374 ( 6.376 3.002 1.289) 7.164 2.668 ( -2.571 5.132 6.962) 9.023 2.915 ( -7.250 -0.053 6.928) 10.028 3.149 ( -9.427 11.193 16.175) 21.812 3.952 ( 6.224 12.415 6.392) 15.288 4.713 ( -6.148 -3.873 -3.892) 8.243 5.355 ( 1.492 -6.257 5.799) 8.661 5.597 ( -6.889 -3.189 0.553) 7.611 5.861 ( -3.084 1.638 5.008) 6.105 6.003 ( 2.818 0.799 -6.702) 7.315 6.202 ( 2.818 -0.247 10.368) 10.747 6.631 ( -2.436 1.436 -4.070) 4.956 6.934 ( -4.079 -0.599 6.649) 7.823 7.115 ( -5.935 0.253 25.700) 26.378 7.358 ( -2.546 2.076 11.348) 11.814 7.505 ( 0.317 -4.137 2.551) 4.871 7.580 ( 0.071 -3.199 5.995) 6.795 8.071 ( -4.047 3.188 5.157) 7.289 8.378 ( -0.638 4.682 0.437) 4.745 8.518 ( -2.392 -1.866 -1.811) 3.533 8.706 ( 1.461 -1.175 15.883) 15.993 9.015 ( -3.179 7.262 7.259) 10.749 9.485 ( 4.593 4.980 7.035) 9.767 9.886 ( -5.535 2.886 -1.323) 6.381 10.130 ( -3.493 9.300 -1.203) 10.007 10.632 ( 5.685 -2.269 -4.150) 7.395 11.150 ( 5.290 -0.838 -7.534) 9.244 11.242 ( -0.852 0.502 -18.209) 18.236 11.446 ( 3.889 -4.697 -9.027) 10.894 11.536 ( 1.758 0.707 -8.519) 8.728 11.934 ( -1.280 -2.134 -0.420) 2.523 12.080 ( 4.936 3.200 -2.928) 6.571 12.288 ( 2.931 4.941 -14.234) 15.350 12.983 ( -1.732 3.055 -13.866) 14.303 13.562 ( 7.443 -6.695 -6.923) 12.172 14.259 ( -3.122 -15.510 -0.775) 15.840 14.770 ( 5.692 -9.327 -2.624) 11.238 15.383 ( -1.199 -2.245 12.301) 12.562 15.571 ( 0.250 0.737 20.211) 20.226 15.779 ( -12.000 3.592 9.860) 15.941 16.505 ( 4.311 -3.144 2.791) 6.021 18.044 ( -5.089 -3.988 0.720) 6.505 18.667 ( 5.941 -0.837 2.969) 6.695 19.581 ( 5.780 4.269 -21.783) 22.938 19.854 ( 4.787 -4.968 -19.114) 20.321 25.754 ( -3.686 3.191 9.965) 11.094 26.342 ( 3.272 10.744 6.026) 12.746 26.513 ( 0.495 -0.232 -5.112) 5.141 27.070 ( -12.703 1.305 -4.618) 13.579 27.895 ( -6.512 4.522 15.631) 17.527 28.437 ( 0.224 -3.170 5.401) 6.266 28.589 ( -4.091 -1.119 2.940) 5.161 28.837 ( 2.282 0.439 3.978) 4.607 29.076 ( 3.970 -4.857 2.282) 6.675 29.205 ( -1.792 2.808 -2.549) 4.194 29.919 ( 3.622 -0.887 -2.814) 4.672 30.197 ( 7.671 -1.635 -15.705) 17.555 ======================= Grid point 210 (108/186) ======================= q-point: (-0.12 0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( 4.889 6.116 6.599) 10.240 1.552 ( -7.750 7.667 10.387) 15.058 1.941 ( 1.142 -1.830 10.348) 10.570 2.415 ( 5.239 3.014 2.563) 6.565 2.641 ( 2.306 2.309 3.833) 5.034 2.839 ( -7.574 0.131 3.927) 8.533 3.038 ( 3.225 5.735 21.892) 22.860 3.866 ( 5.034 13.430 5.497) 15.360 4.700 ( -3.064 -5.189 -6.889) 9.153 5.426 ( -8.663 -7.235 7.937) 13.798 5.526 ( -7.918 -2.952 -1.491) 8.581 5.825 ( 0.112 3.170 0.863) 3.287 5.972 ( -0.550 5.751 -1.529) 5.976 6.256 ( 1.313 -0.550 8.167) 8.290 6.581 ( -2.766 -0.496 1.667) 3.267 6.934 ( -8.579 -2.338 21.832) 23.573 7.130 ( -2.832 -1.004 12.786) 13.134 7.303 ( -3.168 5.464 12.948) 14.406 7.554 ( -1.335 -1.544 1.255) 2.395 7.694 ( 5.192 -6.647 -3.149) 9.003 7.972 ( -7.885 3.911 11.232) 14.270 8.322 ( 1.921 3.554 -0.586) 4.083 8.525 ( 5.454 2.590 -0.425) 6.053 8.765 ( -1.034 2.935 18.725) 18.982 8.945 ( -4.511 -1.923 4.193) 6.452 9.490 ( 0.040 2.967 1.668) 3.404 9.839 ( 4.080 1.445 6.012) 7.408 9.967 ( -3.336 5.048 0.494) 6.071 10.697 ( 3.135 2.614 -2.910) 5.013 11.107 ( 2.644 1.361 -22.680) 22.874 11.264 ( 3.392 -1.749 0.222) 3.823 11.424 ( -2.854 5.018 -1.086) 5.874 11.545 ( 2.763 -3.914 -16.391) 17.077 11.949 ( -0.715 -1.729 1.409) 2.342 12.083 ( 2.832 0.132 -13.483) 13.778 12.286 ( 12.640 3.347 -9.773) 16.324 12.889 ( 0.932 0.958 -21.196) 21.238 13.602 ( 1.552 -0.023 -21.789) 21.844 14.456 ( -8.221 -18.266 7.076) 21.244 14.997 ( 7.217 -11.073 -1.472) 13.299 15.402 ( -5.008 -0.350 8.813) 10.142 15.600 ( -5.231 1.855 13.243) 14.359 15.683 ( -0.849 1.290 20.582) 20.640 16.554 ( -5.629 -1.953 2.426) 6.433 18.079 ( -0.644 -5.304 2.924) 6.091 18.739 ( 1.083 -1.903 1.005) 2.409 19.513 ( 6.658 6.043 -20.232) 22.140 19.896 ( 2.627 -3.655 -18.983) 19.509 25.742 ( 1.972 1.816 11.205) 11.521 26.245 ( -0.528 8.539 8.290) 11.913 26.497 ( 0.894 0.997 -6.370) 6.509 26.892 ( -7.272 1.630 -8.028) 10.954 27.835 ( -3.381 3.709 17.865) 18.556 28.494 ( -0.720 -1.465 8.117) 8.280 28.572 ( -3.453 -1.972 2.378) 4.633 28.847 ( 1.366 2.375 2.273) 3.560 29.081 ( -1.242 4.224 -7.466) 8.668 29.227 ( 3.283 -3.623 1.091) 5.010 29.873 ( -2.040 3.755 -3.379) 5.449 30.394 ( 11.695 -10.886 -10.332) 19.027 ======================= Grid point 213 (109/186) ======================= q-point: ( 0.25 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 12.104 0.000 -0.149) 12.105 1.947 ( 7.486 0.000 -1.275) 7.593 2.154 ( 2.232 0.000 6.966) 7.314 2.516 ( 0.916 0.000 -1.545) 1.796 2.703 ( 0.959 0.000 -1.619) 1.882 2.811 ( 6.210 0.000 9.951) 11.730 3.793 ( 4.687 0.000 11.111) 12.059 4.466 ( 26.436 0.000 18.094) 32.035 4.581 ( -17.121 -0.000 3.327) 17.441 4.973 ( -10.311 -0.000 -12.303) 16.052 5.248 ( 2.724 0.000 6.055) 6.639 5.794 ( 2.842 0.000 -9.705) 10.112 5.964 ( -0.914 -0.000 15.090) 15.118 6.224 ( -12.432 -0.000 14.407) 19.029 6.462 ( -1.319 -0.000 10.679) 10.760 6.978 ( -3.446 -0.000 28.088) 28.298 7.127 ( 2.619 0.000 2.201) 3.421 7.308 ( 1.046 0.000 10.651) 10.702 7.470 ( 2.425 0.000 -11.496) 11.749 7.645 ( -5.132 -0.000 12.544) 13.553 8.022 ( -0.142 -0.000 -4.851) 4.853 8.379 ( -5.955 -0.000 15.141) 16.270 8.612 ( 4.116 0.000 -4.520) 6.113 8.658 ( -9.567 -0.000 6.892) 11.792 9.345 ( 7.618 0.000 9.959) 12.539 9.411 ( 9.089 0.000 -8.028) 12.127 10.041 ( -1.125 -0.000 1.695) 2.034 10.221 ( -2.029 -0.000 -10.980) 11.165 10.738 ( 17.777 0.000 7.553) 19.316 11.071 ( -1.065 -0.000 -18.548) 18.579 11.123 ( 0.843 0.000 4.281) 4.364 11.315 ( -3.328 -0.000 -16.641) 16.971 11.519 ( -1.476 -0.000 -11.167) 11.264 12.025 ( -1.878 -0.000 4.949) 5.293 12.063 ( 3.151 0.000 5.284) 6.152 12.730 ( 11.315 0.000 -17.306) 20.676 13.061 ( -5.135 -0.000 -22.438) 23.018 13.071 ( 14.178 0.000 -7.791) 16.177 14.066 ( -9.961 -0.000 -6.115) 11.688 14.777 ( -16.693 -0.000 7.897) 18.467 15.445 ( 4.076 0.000 7.615) 8.637 15.525 ( -14.835 -0.000 15.799) 21.672 15.751 ( -6.972 -0.000 18.600) 19.864 16.282 ( 7.325 0.000 6.223) 9.612 18.312 ( -0.928 -0.000 -6.616) 6.681 18.624 ( -3.493 -0.000 8.301) 9.005 19.416 ( 1.160 0.000 -20.698) 20.730 19.774 ( 6.565 0.000 -21.870) 22.834 26.124 ( -6.572 -0.000 9.793) 11.794 26.366 ( 1.473 0.000 -7.476) 7.620 26.631 ( 19.082 0.000 18.894) 26.853 26.815 ( 1.605 0.000 -5.235) 5.475 28.093 ( 4.933 0.000 9.189) 10.430 28.398 ( -7.850 -0.000 13.442) 15.566 28.480 ( -4.067 -0.000 -0.971) 4.182 28.733 ( -5.730 -0.000 -1.751) 5.991 28.868 ( -1.197 -0.000 10.599) 10.667 29.406 ( -3.416 -0.000 5.609) 6.568 29.490 ( 2.066 0.000 -18.382) 18.498 30.776 ( 5.416 0.000 -23.011) 23.640 ======================= Grid point 214 (110/186) ======================= q-point: ( 0.38 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 10.479 2.118 -1.169) 10.755 1.964 ( 4.446 6.867 -1.405) 8.300 2.190 ( 0.896 1.045 4.172) 4.393 2.509 ( 3.085 4.538 0.793) 5.545 2.749 ( -0.184 -5.134 2.645) 5.778 2.910 ( 3.826 -0.450 6.001) 7.131 3.878 ( 3.128 3.801 13.901) 14.747 4.288 ( -15.122 9.183 7.263) 19.125 4.857 ( 13.070 -2.884 4.984) 14.283 4.894 ( -1.458 -8.608 -1.846) 8.924 5.267 ( 4.882 5.421 6.917) 10.053 5.811 ( 4.196 -1.088 -9.807) 10.722 6.001 ( -8.249 -5.400 15.749) 18.580 6.103 ( -9.485 1.353 7.234) 12.005 6.509 ( 1.822 -0.579 9.785) 9.970 7.033 ( -2.041 0.799 26.176) 26.268 7.207 ( 5.617 -2.201 0.336) 6.042 7.346 ( 0.732 1.361 11.341) 11.446 7.435 ( -0.363 4.934 -7.149) 8.694 7.653 ( -3.377 -3.521 10.864) 11.909 8.001 ( 1.799 1.469 0.635) 2.408 8.371 ( -8.445 -3.364 10.856) 14.159 8.547 ( -7.085 1.060 3.488) 7.968 8.622 ( -0.325 -0.403 -4.506) 4.536 9.423 ( 5.901 4.918 6.852) 10.294 9.574 ( 14.170 -3.895 -3.585) 15.127 9.954 ( -0.418 8.118 1.671) 8.298 10.231 ( -3.852 -6.617 -4.549) 8.906 10.895 ( 8.536 5.963 -8.573) 13.487 11.021 ( -3.081 -2.506 0.929) 4.079 11.170 ( 2.193 -1.258 -3.773) 4.542 11.229 ( 0.447 -4.848 -18.430) 19.062 11.440 ( -2.977 0.235 -13.448) 13.776 12.001 ( -1.681 2.022 4.506) 5.218 12.123 ( 2.298 -0.800 5.184) 5.727 12.759 ( 5.303 8.995 -12.973) 16.653 12.965 ( 4.368 -3.136 -9.412) 10.840 13.252 ( 8.173 -4.704 -6.514) 11.461 13.920 ( -4.384 2.117 -11.657) 12.633 14.618 ( -15.116 -2.611 7.483) 17.068 15.335 ( -2.617 8.253 12.853) 15.497 15.596 ( -3.039 -3.746 13.509) 14.344 15.754 ( -5.622 -5.365 12.258) 14.514 16.376 ( 6.512 1.910 4.922) 8.383 18.226 ( -5.897 2.093 -8.069) 10.211 18.613 ( -0.561 2.152 9.440) 9.699 19.389 ( 0.969 -5.352 -22.870) 23.508 19.790 ( 8.078 0.451 -21.105) 22.603 26.045 ( -8.221 2.393 9.243) 12.600 26.388 ( 2.690 -2.436 -6.310) 7.279 26.721 ( 5.534 9.150 4.237) 11.502 26.997 ( 9.033 -7.832 10.631) 15.998 28.171 ( 3.198 1.243 8.961) 9.595 28.324 ( -8.686 0.941 7.779) 11.698 28.451 ( -6.719 -5.226 4.919) 9.831 28.686 ( -1.362 -0.022 1.336) 1.908 28.895 ( 0.433 0.729 10.652) 10.686 29.356 ( -6.548 0.142 7.923) 10.280 29.506 ( 7.723 -2.797 -23.501) 24.895 30.715 ( 4.086 5.529 -23.814) 24.786 ======================= Grid point 215 (111/186) ======================= q-point: (-0.50 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( 2.820 8.710 -0.942) 9.204 1.937 ( 7.856 6.732 -0.088) 10.347 2.160 ( -1.573 4.797 3.127) 5.938 2.485 ( 4.304 5.685 1.502) 7.287 2.819 ( -4.062 -5.193 7.049) 9.651 2.940 ( 0.488 2.297 1.939) 3.046 3.727 ( -13.257 12.632 13.072) 22.499 4.187 ( 4.323 2.963 11.790) 12.902 4.860 ( -8.595 -3.360 -3.943) 10.035 5.030 ( 7.129 2.112 1.846) 7.661 5.396 ( 9.997 -3.726 8.787) 13.821 5.844 ( -1.078 -3.197 -2.482) 4.188 6.000 ( -8.393 -3.358 12.405) 15.350 6.053 ( -0.497 -2.405 -2.358) 3.405 6.585 ( 1.736 -1.938 10.293) 10.616 7.072 ( -3.149 1.747 24.759) 25.020 7.264 ( -6.671 8.853 -4.371) 11.916 7.304 ( 4.495 -2.193 -0.681) 5.047 7.375 ( 0.629 1.893 12.316) 12.477 7.689 ( -0.403 1.692 9.583) 9.739 8.060 ( 4.514 -2.006 6.146) 7.885 8.322 ( -10.328 -6.578 -0.992) 12.285 8.505 ( -0.900 1.638 3.587) 4.044 8.618 ( -0.243 -1.045 3.831) 3.979 9.405 ( 2.594 8.701 5.151) 10.439 9.753 ( 8.828 4.846 -2.974) 10.501 9.890 ( 3.110 -0.470 2.383) 3.946 10.245 ( -4.111 -4.314 1.897) 6.253 10.743 ( -9.237 5.166 -14.142) 17.663 11.042 ( 4.126 -0.730 -8.347) 9.340 11.165 ( -1.607 -4.706 -9.249) 10.501 11.353 ( 0.983 -1.755 -8.662) 8.892 11.384 ( 7.140 -4.306 -9.577) 12.698 11.964 ( -1.294 2.686 4.164) 5.121 12.172 ( 2.191 -0.114 0.130) 2.198 12.606 ( 0.842 9.675 -9.284) 13.435 13.110 ( 7.655 -5.153 3.676) 9.933 13.290 ( -0.207 4.866 -2.738) 5.587 13.884 ( 3.979 -5.525 -17.880) 19.133 14.527 ( -10.011 -4.374 3.524) 11.479 15.296 ( 1.307 3.045 12.991) 13.407 15.606 ( -3.716 2.079 18.103) 18.597 15.816 ( -5.187 -6.430 6.177) 10.315 16.432 ( 5.488 2.407 2.869) 6.644 18.079 ( -8.111 1.565 -6.934) 10.785 18.622 ( 1.515 1.791 8.534) 8.851 19.427 ( 2.369 -8.690 -24.168) 25.792 19.811 ( 8.302 1.254 -20.097) 21.781 25.933 ( -8.112 3.057 9.051) 12.532 26.442 ( 3.166 -2.610 -5.605) 6.946 26.670 ( 3.271 7.884 3.500) 9.225 27.160 ( -2.046 -3.058 8.357) 9.131 28.149 ( -6.179 5.524 14.041) 16.305 28.285 ( -0.115 -2.674 1.636) 3.137 28.501 ( -2.100 -6.595 9.173) 11.491 28.696 ( 0.363 -0.336 4.011) 4.041 28.936 ( 2.762 0.907 8.791) 9.259 29.306 ( -4.475 0.317 4.909) 6.650 29.587 ( 7.603 -6.065 -20.648) 22.824 30.572 ( 2.634 9.184 -23.485) 25.354 ======================= Grid point 216 (112/186) ======================= q-point: (-0.38 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( 0.239 10.175 1.505) 10.289 1.924 ( 5.266 7.810 1.102) 9.484 2.051 ( -1.853 8.561 4.278) 9.748 2.484 ( 6.123 4.502 0.640) 7.627 2.803 ( -7.489 0.740 6.540) 9.970 2.900 ( -2.502 1.935 3.836) 4.972 3.445 ( -11.572 10.690 13.226) 20.570 4.251 ( 8.277 6.544 10.812) 15.107 4.712 ( -8.179 4.274 -2.169) 9.479 5.165 ( 5.653 -6.628 2.041) 8.947 5.513 ( -4.167 -2.487 7.002) 8.519 5.833 ( -6.036 -2.728 -0.395) 6.636 5.996 ( -3.244 -2.817 2.248) 4.849 6.128 ( 4.970 -4.216 -0.030) 6.518 6.656 ( 0.283 -0.847 8.702) 8.748 7.012 ( -9.997 5.551 2.434) 11.691 7.128 ( 0.427 2.323 18.467) 18.617 7.366 ( 2.186 0.111 2.813) 3.564 7.400 ( -2.454 -1.046 13.656) 13.914 7.664 ( 0.713 5.766 7.879) 9.789 8.151 ( 3.645 1.450 5.655) 6.883 8.331 ( -4.162 -8.459 -1.792) 9.596 8.478 ( -0.167 1.524 0.248) 1.554 8.678 ( 2.182 -1.309 11.883) 12.152 9.287 ( -2.314 10.758 4.486) 11.883 9.678 ( -0.663 7.971 2.444) 8.363 9.950 ( 1.467 1.321 -2.722) 3.362 10.265 ( -4.624 -0.797 -0.431) 4.712 10.558 ( -2.500 -1.202 -6.515) 7.080 11.089 ( 5.701 -2.549 -13.601) 14.966 11.167 ( -5.305 -5.752 -12.534) 14.776 11.345 ( 5.556 -2.039 -14.968) 16.096 11.532 ( 7.438 -1.529 -0.127) 7.595 11.929 ( -0.738 2.044 2.861) 3.593 12.164 ( 0.412 2.245 -5.077) 5.567 12.488 ( 3.117 7.665 -4.219) 9.288 13.128 ( -5.814 6.619 -2.466) 9.148 13.327 ( 9.180 -6.084 3.595) 11.585 13.975 ( 1.737 -7.598 -13.894) 15.931 14.532 ( -1.484 -7.363 -1.193) 7.605 15.348 ( 2.199 0.135 11.792) 11.996 15.605 ( -2.083 1.542 18.812) 18.990 15.811 ( -7.738 -1.474 6.516) 10.223 16.476 ( 3.750 0.734 1.822) 4.234 17.959 ( -7.221 -1.486 -4.308) 8.538 18.657 ( 1.606 0.050 6.176) 6.381 19.506 ( 4.375 -8.371 -24.434) 26.196 19.822 ( 7.573 1.756 -19.024) 20.551 25.835 ( -6.114 2.578 9.600) 11.670 26.491 ( 2.941 -1.395 -5.523) 6.411 26.608 ( 2.005 8.179 4.263) 9.439 27.093 ( -12.555 0.173 2.258) 12.758 28.039 ( -6.165 5.690 16.287) 18.321 28.348 ( 1.674 -2.885 3.026) 4.504 28.594 ( 1.677 -0.218 7.586) 7.772 28.753 ( 1.804 -4.622 7.318) 8.841 29.002 ( 4.656 -0.159 5.396) 7.128 29.265 ( -2.757 1.092 1.752) 3.444 29.720 ( 6.786 -9.178 -14.605) 18.536 30.380 ( 1.007 10.068 -22.142) 24.345 ======================= Grid point 217 (113/186) ======================= q-point: (-0.25 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( 0.086 9.346 3.768) 10.078 1.822 ( -3.191 10.730 5.097) 12.300 1.981 ( 3.985 5.108 4.383) 7.822 2.513 ( 7.268 4.055 0.177) 8.325 2.710 ( -5.462 1.665 2.794) 6.357 2.843 ( -5.266 1.866 6.780) 8.785 3.260 ( -3.833 8.239 13.979) 16.674 4.269 ( 9.351 13.237 12.130) 20.243 4.590 ( -4.025 -0.963 -6.573) 7.768 5.253 ( -11.672 -5.072 4.751) 13.584 5.463 ( -6.331 -1.906 6.158) 9.035 5.812 ( -2.667 -3.115 -0.237) 4.108 6.020 ( 0.559 -2.364 0.526) 2.485 6.226 ( 1.474 -2.687 -0.547) 3.113 6.649 ( -1.847 3.858 4.860) 6.474 6.875 ( -6.165 -0.150 5.385) 8.188 7.184 ( 0.075 3.018 22.046) 22.251 7.382 ( -1.908 0.401 11.562) 11.725 7.450 ( -1.345 -4.503 6.227) 7.802 7.623 ( 0.672 3.838 4.680) 6.090 8.133 ( -0.870 6.579 6.878) 9.558 8.377 ( -0.099 -1.541 -2.510) 2.947 8.506 ( 4.505 -2.223 1.818) 5.343 8.770 ( 2.491 -1.252 12.913) 13.211 9.103 ( -6.358 9.926 5.713) 13.099 9.568 ( -5.058 4.217 3.071) 7.266 9.924 ( 4.300 4.176 -0.092) 5.995 10.104 ( -10.311 3.167 -7.638) 13.217 10.667 ( 7.065 -4.383 0.212) 8.316 11.094 ( -2.705 -2.969 -18.231) 18.668 11.180 ( 3.790 -4.556 -7.336) 9.431 11.422 ( 7.602 -3.469 -17.321) 19.231 11.579 ( 1.840 4.192 0.865) 4.659 11.913 ( 0.189 0.610 0.276) 0.695 12.110 ( -0.261 1.555 -7.313) 7.481 12.447 ( 8.418 6.899 -1.698) 11.016 12.963 ( -3.478 4.861 -10.046) 11.689 13.513 ( 4.347 -6.837 -7.801) 11.247 14.034 ( -3.886 -8.525 0.191) 9.371 14.685 ( 5.346 -11.220 -2.905) 12.763 15.390 ( -2.246 0.067 9.383) 9.649 15.634 ( -2.789 0.401 15.125) 15.386 15.741 ( -4.454 2.161 12.452) 13.400 16.507 ( -1.113 -1.004 2.241) 2.696 17.926 ( -3.208 -4.989 -0.814) 5.988 18.690 ( -1.027 -1.488 3.080) 3.572 19.579 ( 6.258 -3.802 -23.474) 24.590 19.824 ( 5.721 0.520 -18.314) 19.194 25.789 ( -1.895 1.359 10.456) 10.712 26.473 ( -4.547 5.118 2.462) 7.275 26.543 ( 3.570 4.163 -2.468) 6.014 26.935 ( -8.638 1.073 -2.008) 8.933 27.960 ( -4.308 4.981 18.103) 19.264 28.416 ( 0.681 -3.136 3.751) 4.936 28.602 ( 0.647 3.611 7.768) 8.590 28.867 ( 2.416 -2.275 4.853) 5.879 29.095 ( 5.620 -2.015 1.062) 6.064 29.213 ( -1.848 2.351 -1.109) 3.190 29.887 ( 3.813 -7.995 -7.078) 11.339 30.209 ( 2.089 3.601 -19.976) 20.405 ======================= Grid point 218 (114/186) ======================= q-point: (-0.12 0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( 2.641 4.666 5.717) 7.838 1.652 ( -1.181 10.132 4.857) 11.298 1.998 ( 2.486 1.870 7.647) 8.256 2.549 ( 6.873 4.134 1.372) 8.136 2.647 ( -6.415 -1.937 0.257) 6.706 2.780 ( -1.627 2.964 2.452) 4.176 3.246 ( 6.826 3.656 17.300) 18.954 4.208 ( 9.147 17.876 11.661) 23.220 4.589 ( 0.184 -4.700 -7.036) 8.463 5.115 ( -22.249 -8.759 6.771) 24.851 5.452 ( -3.409 -0.864 1.483) 3.816 5.827 ( -0.595 -1.268 -1.843) 2.315 6.053 ( 1.520 2.295 3.462) 4.423 6.243 ( -2.656 -2.618 1.705) 4.100 6.580 ( -3.253 3.243 7.086) 8.445 6.877 ( -3.899 -2.766 13.539) 14.358 7.168 ( -3.078 5.011 16.907) 17.900 7.375 ( -3.435 3.888 14.744) 15.630 7.511 ( -1.557 -3.576 2.988) 4.914 7.651 ( 2.473 -5.117 -1.710) 5.935 8.014 ( -5.117 8.031 8.917) 13.046 8.385 ( 3.626 1.926 -0.068) 4.107 8.615 ( 6.842 -0.579 0.778) 6.911 8.870 ( 3.444 -1.420 13.496) 14.001 8.909 ( -8.566 7.358 7.424) 13.514 9.468 ( -6.148 -0.104 -1.217) 6.268 9.909 ( -4.763 2.734 -0.781) 5.547 10.013 ( 10.106 1.044 -0.514) 10.173 10.734 ( -1.464 0.790 -2.808) 3.264 11.073 ( 4.025 -2.419 -16.651) 17.300 11.276 ( 4.233 -3.448 -1.077) 5.565 11.468 ( -0.146 4.887 -6.074) 7.797 11.487 ( 1.628 0.759 -13.071) 13.194 11.919 ( 0.721 -1.611 -4.391) 4.733 12.079 ( 1.364 0.933 -6.031) 6.254 12.501 ( 13.162 4.682 -1.428) 14.043 12.848 ( -0.174 1.594 -17.025) 17.101 13.530 ( 0.205 -0.353 -22.631) 22.635 14.142 ( -7.492 -14.203 7.625) 17.777 14.904 ( 3.541 -11.043 1.693) 11.720 15.335 ( -10.125 0.657 6.611) 12.110 15.625 ( -2.026 0.381 15.803) 15.937 15.771 ( 2.476 1.174 14.386) 14.645 16.460 ( -9.342 0.668 3.501) 9.999 18.011 ( 2.516 -7.276 2.039) 7.964 18.688 ( -4.569 -2.366 1.317) 5.311 19.589 ( 6.871 2.850 -21.263) 22.527 19.827 ( 3.450 -1.722 -18.913) 19.302 25.834 ( 4.244 -0.548 11.533) 12.301 26.317 ( -8.092 5.488 6.517) 11.751 26.525 ( 2.200 3.041 -4.867) 6.146 26.858 ( 1.085 2.181 -4.663) 5.261 27.923 ( -2.134 3.650 18.433) 18.912 28.473 ( -0.041 -2.620 3.315) 4.225 28.580 ( -0.679 3.808 8.934) 9.736 28.894 ( 0.140 1.605 2.741) 3.180 29.091 ( -2.743 4.167 -6.442) 8.148 29.238 ( 5.242 -2.723 0.156) 5.909 29.865 ( -4.808 3.703 -6.510) 8.900 30.312 ( 9.109 -13.075 -14.525) 21.562 ======================= Grid point 222 (115/186) ======================= q-point: ( 0.38 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( 9.534 0.000 -1.023) 9.589 2.059 ( 3.373 0.000 -1.088) 3.545 2.223 ( 0.935 0.000 2.258) 2.443 2.579 ( 2.172 0.000 0.736) 2.294 2.719 ( -0.888 -0.000 4.984) 5.062 2.956 ( 1.583 0.000 1.964) 2.523 3.957 ( -8.601 -0.000 15.642) 17.850 4.234 ( -2.895 -0.000 9.313) 9.753 4.700 ( -5.748 -0.000 -6.698) 8.826 5.125 ( 14.823 0.000 9.425) 17.566 5.369 ( 2.079 0.000 8.238) 8.497 5.821 ( 4.801 0.000 -13.393) 14.227 5.892 ( -12.270 -0.000 19.992) 23.457 6.009 ( -7.229 -0.000 3.121) 7.874 6.563 ( 1.389 0.000 9.102) 9.207 7.109 ( -1.449 -0.000 25.045) 25.087 7.261 ( 5.086 0.000 -6.076) 7.923 7.408 ( 2.780 0.000 7.574) 8.068 7.549 ( 9.627 0.000 -1.879) 9.808 7.564 ( -9.603 -0.000 15.388) 18.139 8.037 ( -0.048 -0.000 8.371) 8.371 8.231 ( -9.197 -0.000 -1.640) 9.342 8.547 ( 0.182 0.000 10.256) 10.257 8.576 ( -1.620 -0.000 -10.058) 10.188 9.552 ( 4.092 0.000 5.336) 6.724 9.733 ( 17.091 0.000 -0.895) 17.115 10.027 ( -2.397 -0.000 4.972) 5.519 10.089 ( -5.818 -0.000 -4.778) 7.528 10.849 ( -6.898 -0.000 -20.894) 22.003 11.036 ( -5.557 -0.000 4.724) 7.293 11.084 ( -1.058 -0.000 -21.432) 21.458 11.267 ( 13.197 0.000 7.364) 15.112 11.358 ( -2.471 -0.000 -13.033) 13.266 12.016 ( -0.901 -0.000 4.913) 4.995 12.149 ( 1.426 0.000 1.144) 1.828 12.808 ( -6.397 -0.000 -11.319) 13.001 13.014 ( 14.289 0.000 3.172) 14.637 13.322 ( 9.084 0.000 -6.473) 11.155 13.847 ( -1.633 -0.000 -15.224) 15.311 14.447 ( -12.389 -0.000 7.394) 14.428 15.394 ( -3.845 -0.000 13.885) 14.407 15.619 ( 3.842 0.000 9.791) 10.518 15.687 ( -5.975 -0.000 10.682) 12.240 16.471 ( 3.735 0.000 5.039) 6.272 18.122 ( -7.899 -0.000 -9.960) 12.712 18.649 ( -0.986 -0.000 9.435) 9.486 19.285 ( 2.192 0.000 -24.905) 25.001 19.826 ( 8.508 0.000 -20.465) 22.164 25.983 ( -9.557 -0.000 9.996) 13.829 26.395 ( 4.792 0.000 -6.808) 8.326 26.801 ( -0.602 -0.000 -0.624) 0.867 27.094 ( 2.852 0.000 14.992) 15.260 28.242 ( 3.681 0.000 3.113) 4.821 28.288 ( -9.489 -0.000 18.219) 20.542 28.344 ( -1.182 -0.000 3.381) 3.582 28.699 ( 1.537 0.000 3.715) 4.020 28.959 ( 2.391 0.000 11.445) 11.692 29.307 ( -5.348 -0.000 7.139) 8.921 29.494 ( 7.267 0.000 -25.639) 26.649 30.707 ( 2.433 0.000 -25.597) 25.713 ======================= Grid point 223 (116/186) ======================= q-point: (-0.50 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( 2.856 8.280 0.374) 8.766 2.100 ( 6.023 2.543 -0.229) 6.541 2.219 ( 0.793 3.112 0.951) 3.349 2.579 ( 0.885 2.148 0.992) 2.525 2.736 ( -3.924 -2.480 6.593) 8.063 2.956 ( -1.201 0.271 -2.437) 2.730 3.751 ( -15.369 9.541 12.672) 22.087 4.324 ( 6.945 0.852 13.915) 15.575 4.686 ( -3.597 -6.809 -1.812) 7.912 5.180 ( 1.470 6.796 2.416) 7.361 5.457 ( 1.297 -2.790 9.246) 9.745 5.784 ( -5.856 0.971 4.402) 7.390 5.859 ( -4.843 -4.260 3.132) 7.170 6.013 ( 1.892 -4.924 -2.509) 5.842 6.605 ( -1.800 -1.371 12.381) 12.586 7.144 ( -3.510 3.526 17.611) 18.301 7.265 ( 0.659 2.657 -4.154) 4.975 7.416 ( -1.283 6.280 9.307) 11.301 7.446 ( -1.444 2.294 11.723) 12.033 7.748 ( 8.798 -2.121 3.895) 9.853 8.051 ( -4.833 -4.839 8.143) 10.634 8.209 ( 4.913 -0.959 -1.788) 5.315 8.509 ( -1.507 0.832 -7.243) 7.445 8.620 ( 1.984 -2.127 9.672) 10.099 9.547 ( -0.144 6.651 1.891) 6.916 9.861 ( -3.259 4.662 -5.719) 8.066 9.963 ( 6.282 1.034 3.991) 7.514 10.113 ( -2.242 -7.865 3.852) 9.040 10.635 ( -8.776 5.138 -15.060) 18.172 10.982 ( -9.516 -6.509 -3.496) 12.048 11.044 ( 5.512 -0.869 -20.227) 20.983 11.303 ( 0.764 -0.856 -12.491) 12.543 11.484 ( 12.421 -1.260 11.112) 16.714 12.002 ( -1.222 2.317 4.386) 5.109 12.172 ( 0.781 -1.188 -2.833) 3.170 12.657 ( -6.219 4.135 -4.644) 8.795 13.198 ( 9.146 0.184 7.306) 11.707 13.367 ( 4.002 3.692 -6.072) 8.155 13.817 ( 4.739 -2.690 -15.956) 16.861 14.373 ( -6.434 -3.920 2.560) 7.957 15.399 ( 1.442 2.856 13.220) 13.602 15.633 ( -6.999 -0.120 16.653) 18.064 15.728 ( 1.773 -2.949 2.847) 4.466 16.507 ( 0.796 0.877 4.300) 4.460 17.973 ( -7.558 1.589 -10.250) 12.835 18.662 ( -1.449 0.179 8.380) 8.506 19.280 ( 4.524 -5.869 -25.648) 26.697 19.858 ( 8.294 0.627 -19.676) 21.362 25.888 ( -8.955 1.171 9.709) 13.260 26.450 ( 5.736 -1.120 -6.286) 8.583 26.773 ( 0.164 3.438 2.445) 4.222 27.081 ( -12.225 -0.693 9.177) 15.302 28.189 ( -7.906 4.456 16.239) 18.602 28.300 ( 3.592 -0.217 3.252) 4.851 28.472 ( 7.621 -6.020 8.962) 13.215 28.734 ( 2.059 0.987 5.674) 6.117 29.024 ( 3.374 1.278 10.219) 10.837 29.273 ( -3.948 -0.171 5.761) 6.986 29.521 ( 6.311 -4.426 -24.295) 25.488 30.603 ( 0.670 4.816 -26.345) 26.790 ======================= Grid point 224 (117/186) ======================= q-point: (-0.38 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( 0.000 10.820 2.355) 11.074 2.077 ( 0.163 7.152 1.285) 7.268 2.174 ( 3.358 7.122 0.599) 7.897 2.583 ( 1.950 0.030 1.669) 2.567 2.699 ( -8.494 -0.698 3.638) 9.266 2.917 ( -1.911 0.756 -2.512) 3.246 3.494 ( -9.973 9.570 13.285) 19.171 4.426 ( 5.830 1.504 8.956) 10.792 4.699 ( -2.618 2.224 5.267) 6.288 5.134 ( -5.116 -2.354 0.441) 5.649 5.460 ( -4.565 2.169 10.463) 11.620 5.730 ( -5.413 -1.914 2.781) 6.380 5.880 ( -3.793 -5.623 0.601) 6.810 6.121 ( 4.647 -5.218 -5.051) 8.622 6.642 ( -5.106 -3.194 15.075) 16.234 7.010 ( -4.674 8.456 -1.808) 9.830 7.262 ( 2.779 4.064 17.940) 18.603 7.393 ( -0.863 0.218 6.203) 6.266 7.438 ( -2.594 2.406 13.520) 13.975 7.785 ( 1.899 6.309 2.301) 6.979 8.171 ( 2.866 -8.592 3.926) 9.871 8.295 ( 7.569 1.804 1.902) 8.011 8.477 ( -0.011 -0.992 -2.900) 3.066 8.718 ( 2.360 -2.443 11.328) 11.826 9.380 ( -7.043 9.826 -1.482) 12.180 9.696 ( -10.551 3.742 1.027) 11.242 9.988 ( -0.699 -1.074 -4.204) 4.395 10.164 ( -3.454 2.203 -3.107) 5.141 10.533 ( 4.475 -2.487 -0.431) 5.138 10.953 ( -7.960 -7.628 -7.182) 13.158 11.075 ( 6.936 -2.014 -20.424) 21.664 11.332 ( 6.567 -2.848 -12.823) 14.686 11.647 ( 6.339 1.268 9.874) 11.802 11.976 ( 1.131 2.734 5.099) 5.896 12.155 ( -1.526 1.028 -6.645) 6.895 12.549 ( -3.722 0.810 1.426) 4.067 13.178 ( -2.302 9.614 -1.847) 10.057 13.381 ( 5.723 -1.205 -5.195) 7.822 13.907 ( 6.513 -3.029 -6.366) 9.598 14.417 ( 1.267 -7.848 -3.283) 8.601 15.426 ( 0.389 2.646 10.389) 10.728 15.620 ( -4.974 -1.618 15.155) 16.032 15.770 ( -0.417 0.086 7.128) 7.140 16.503 ( -2.392 0.310 3.836) 4.531 17.849 ( -4.629 -0.302 -8.247) 9.461 18.664 ( -2.684 -0.386 6.013) 6.596 19.370 ( 6.840 -8.920 -25.025) 27.434 19.875 ( 7.491 1.768 -18.823) 20.336 25.812 ( -6.228 0.401 9.743) 11.570 26.507 ( 4.404 -0.041 -5.683) 7.190 26.715 ( -3.258 5.796 5.422) 8.579 26.936 ( -12.295 -1.076 4.382) 13.096 28.091 ( -7.325 4.256 17.194) 19.167 28.361 ( 3.410 -0.604 3.403) 4.855 28.687 ( 9.167 -1.367 8.167) 12.353 28.767 ( 2.689 -0.598 6.477) 7.038 29.084 ( 4.068 0.788 7.107) 8.227 29.249 ( -2.535 0.311 3.368) 4.227 29.610 ( 5.125 -8.984 -18.647) 21.323 30.419 ( -1.355 7.850 -25.748) 26.952 ======================= Grid point 225 (118/186) ======================= q-point: (-0.25 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( -1.177 10.020 3.936) 10.829 1.933 ( -4.740 9.602 2.311) 10.955 2.122 ( 3.435 6.897 2.179) 8.007 2.578 ( -12.057 -2.735 3.348) 12.808 2.644 ( 5.890 1.695 -2.226) 6.521 2.875 ( -0.840 1.949 -0.119) 2.125 3.363 ( -1.834 5.117 13.506) 14.559 4.501 ( 4.622 0.541 4.282) 6.324 4.633 ( 1.614 7.862 8.474) 11.671 4.990 ( -21.197 0.390 4.768) 21.730 5.449 ( -0.044 1.190 7.016) 7.117 5.735 ( -0.876 -4.043 -0.159) 4.140 5.929 ( -3.483 -7.848 2.987) 9.091 6.204 ( 1.664 -2.511 -3.660) 4.740 6.660 ( -5.215 -0.981 13.395) 14.408 6.857 ( -2.055 4.930 -2.147) 5.757 7.331 ( 2.820 2.372 21.471) 21.785 7.398 ( -6.046 1.990 18.093) 19.180 7.415 ( 0.739 -0.604 0.667) 1.165 7.700 ( -1.247 6.114 0.385) 6.251 8.236 ( -1.314 5.344 6.310) 8.373 8.390 ( 7.833 -1.865 -1.780) 8.246 8.541 ( 5.305 -3.534 3.653) 7.347 8.803 ( -0.570 -1.934 10.803) 10.989 9.151 ( -7.828 7.988 1.165) 11.245 9.500 ( -13.559 2.669 1.097) 13.863 9.952 ( -7.480 -2.368 -9.294) 12.162 10.084 ( 7.706 5.590 -0.329) 9.526 10.661 ( 1.207 -4.579 0.261) 4.743 10.950 ( -0.658 -5.927 -10.539) 12.110 11.149 ( 7.301 -4.563 -13.083) 15.661 11.424 ( 8.756 -2.331 -15.979) 18.370 11.659 ( -2.267 3.822 4.644) 6.427 11.969 ( 2.040 5.745 0.701) 6.137 12.098 ( -0.513 0.472 -1.227) 1.411 12.553 ( 0.732 -2.550 3.310) 4.242 12.991 ( -1.567 9.635 -8.507) 12.948 13.437 ( 1.259 -4.372 -12.427) 13.234 13.976 ( 3.561 0.664 0.797) 3.709 14.592 ( 6.303 -11.155 -2.952) 13.148 15.373 ( -7.800 2.431 6.893) 10.690 15.647 ( -2.116 0.394 14.872) 15.027 15.798 ( 1.930 0.617 11.104) 11.287 16.462 ( -6.654 -0.222 4.144) 7.842 17.833 ( 0.492 -4.707 -3.845) 6.098 18.642 ( -4.807 -0.847 3.170) 5.820 19.500 ( 7.962 -8.033 -23.691) 26.252 19.864 ( 6.058 3.064 -18.138) 19.366 25.803 ( -1.486 -1.594 10.111) 10.343 26.454 ( -9.599 4.436 2.172) 10.795 26.608 ( -0.934 2.644 -0.372) 2.829 26.894 ( 1.477 0.231 1.948) 2.456 28.014 ( -6.322 3.027 17.718) 19.054 28.423 ( 3.163 -0.642 3.291) 4.610 28.727 ( 2.634 5.872 9.792) 11.717 28.883 ( 3.487 -2.424 2.664) 5.014 29.154 ( 4.091 0.464 0.619) 4.163 29.218 ( -0.676 1.210 1.387) 1.961 29.762 ( 3.427 -11.582 -11.008) 16.342 30.205 ( -1.605 6.070 -23.456) 24.282 ======================= Grid point 226 (119/186) ======================= q-point: (-0.12 0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( 0.143 5.276 5.310) 7.487 1.755 ( -3.964 7.132 0.732) 8.193 2.099 ( 3.094 3.991 5.443) 7.425 2.473 ( -11.899 -3.762 -1.338) 12.551 2.689 ( 5.138 2.434 3.398) 6.623 2.855 ( 3.292 2.777 -1.029) 4.428 3.397 ( 4.967 -0.033 12.508) 13.459 4.517 ( -7.855 -0.944 2.622) 8.335 4.610 ( 10.191 11.143 8.985) 17.572 4.769 ( -14.029 -2.952 11.564) 18.419 5.419 ( -2.063 1.904 -3.086) 4.172 5.777 ( -0.899 -3.075 -2.550) 4.095 6.034 ( -1.081 -8.111 6.003) 10.148 6.203 ( -2.565 1.371 4.150) 5.068 6.609 ( -4.579 4.191 10.391) 12.104 6.854 ( 1.431 -3.744 3.441) 5.282 7.292 ( -3.915 9.254 16.711) 19.499 7.418 ( -5.049 -1.247 23.146) 23.723 7.446 ( 0.872 -1.573 -3.822) 4.224 7.623 ( -1.149 0.718 -0.929) 1.643 8.108 ( -3.951 9.819 6.812) 12.586 8.464 ( 3.309 1.075 2.353) 4.200 8.677 ( 4.446 -1.096 -1.066) 4.701 8.851 ( -0.790 -4.755 9.449) 10.608 8.999 ( -3.729 7.086 10.998) 13.605 9.342 ( -8.928 -2.794 -1.959) 9.558 9.853 ( -3.684 0.676 -7.166) 8.085 10.187 ( 13.532 0.669 1.022) 13.587 10.646 ( -7.817 -2.567 -4.402) 9.331 11.029 ( 5.643 -4.887 -12.872) 14.880 11.282 ( 7.004 -4.663 -2.748) 8.851 11.476 ( 6.408 0.821 -18.970) 20.040 11.536 ( -5.177 7.186 0.628) 8.879 11.896 ( -0.781 1.379 -7.343) 7.512 12.108 ( 1.136 1.840 5.498) 5.908 12.645 ( 3.999 -4.491 1.338) 6.160 12.838 ( 1.895 7.136 -13.392) 15.292 13.444 ( 0.288 -2.927 -18.334) 18.569 14.000 ( 0.233 -0.690 0.522) 0.896 14.812 ( 4.021 -9.990 1.783) 10.915 15.238 ( -11.296 2.193 7.219) 13.584 15.652 ( -4.272 0.686 18.228) 18.734 15.876 ( 5.806 0.643 8.711) 10.488 16.362 ( -10.707 1.181 4.720) 11.760 17.959 ( 5.334 -8.195 0.767) 9.808 18.591 ( -6.754 -1.345 1.581) 7.065 19.605 ( 8.202 -3.583 -22.227) 23.961 19.819 ( 3.862 3.270 -18.287) 18.974 25.896 ( 4.493 -4.196 10.464) 12.136 26.263 ( -12.095 2.976 6.082) 13.862 26.574 ( 0.639 2.775 -2.753) 3.961 26.938 ( 7.042 2.620 0.140) 7.515 27.979 ( -4.369 1.111 17.831) 18.392 28.481 ( 3.379 -0.448 2.433) 4.188 28.692 ( 0.223 7.242 10.315) 12.605 28.911 ( -0.977 0.612 1.743) 2.090 29.079 ( -5.516 4.632 -5.510) 9.069 29.281 ( 5.838 -1.557 -0.099) 6.043 29.808 ( -4.961 1.047 -9.326) 10.615 30.186 ( 6.919 -11.103 -17.896) 22.168 ======================= Grid point 231 (120/186) ======================= q-point: (-0.50 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( -0.742 -0.000 0.518) 0.905 2.161 ( 4.171 0.000 2.337) 4.781 2.265 ( 3.058 0.000 0.518) 3.101 2.583 ( -2.839 -0.000 1.866) 3.397 2.683 ( -6.015 -0.000 4.051) 7.252 2.898 ( -5.031 -0.000 -6.656) 8.344 3.674 ( -13.223 -0.000 10.575) 16.932 4.490 ( 7.710 0.000 18.566) 20.103 4.604 ( -0.420 -0.000 0.775) 0.881 5.150 ( -13.287 -0.000 -0.806) 13.312 5.500 ( 4.003 0.000 10.257) 11.011 5.715 ( -11.133 -0.000 16.550) 19.946 5.818 ( 1.968 0.000 -12.298) 12.455 5.998 ( 3.882 0.000 -2.053) 4.391 6.585 ( -6.759 -0.000 15.337) 16.760 7.222 ( 1.230 0.000 11.185) 11.253 7.272 ( 0.984 0.000 -7.300) 7.366 7.451 ( -4.145 -0.000 9.624) 10.479 7.457 ( -7.198 -0.000 23.969) 25.026 7.915 ( 16.746 0.000 -5.085) 17.501 7.971 ( -2.932 -0.000 1.654) 3.367 8.306 ( 6.752 0.000 11.892) 13.675 8.456 ( -0.960 -0.000 -11.749) 11.788 8.679 ( 3.664 0.000 10.067) 10.714 9.568 ( -5.180 -0.000 -0.974) 5.271 9.722 ( -15.954 -0.000 -11.188) 19.486 9.946 ( -7.016 -0.000 3.179) 7.703 10.180 ( 10.625 0.000 3.015) 11.044 10.574 ( 0.532 0.000 -11.064) 11.077 10.785 ( -11.710 -0.000 2.766) 12.032 11.046 ( 7.776 0.000 -22.572) 23.874 11.290 ( 5.212 0.000 -10.351) 11.589 11.665 ( 7.332 0.000 15.490) 17.137 12.022 ( 0.391 0.000 6.135) 6.147 12.154 ( -0.159 -0.000 -4.830) 4.833 12.562 ( -9.675 -0.000 -0.111) 9.676 13.307 ( 3.169 0.000 -2.200) 3.858 13.419 ( 2.918 0.000 -8.257) 8.758 13.859 ( 11.848 0.000 -4.987) 12.854 14.293 ( -1.935 -0.000 -1.137) 2.244 15.504 ( 3.806 0.000 15.835) 16.286 15.559 ( -8.683 -0.000 8.481) 12.138 15.768 ( 2.200 0.000 6.523) 6.884 16.507 ( -4.178 -0.000 5.496) 6.904 17.865 ( -4.827 -0.000 -12.694) 13.581 18.662 ( -2.913 -0.000 7.671) 8.205 19.218 ( 6.668 0.000 -25.953) 26.796 19.900 ( 8.202 0.000 -19.083) 20.771 25.817 ( -8.434 -0.000 9.458) 12.672 26.504 ( 6.980 0.000 -6.140) 9.296 26.815 ( 1.614 0.000 4.314) 4.606 26.899 ( -19.951 -0.000 8.608) 21.729 28.157 ( -9.811 -0.000 16.047) 18.809 28.369 ( 4.217 0.000 4.917) 6.478 28.608 ( 14.819 0.000 6.862) 16.331 28.794 ( 2.200 0.000 7.822) 8.126 29.113 ( 2.978 0.000 10.538) 10.951 29.245 ( -3.223 -0.000 5.994) 6.806 29.473 ( 5.162 0.000 -25.065) 25.591 30.538 ( -1.192 -0.000 -28.631) 28.656 ======================= Grid point 232 (121/186) ======================= q-point: (-0.38 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( -3.391 7.435 1.507) 8.309 2.155 ( -0.878 6.281 3.200) 7.103 2.305 ( 3.755 3.715 1.510) 5.494 2.524 ( -10.145 0.112 4.801) 11.225 2.609 ( -5.212 -3.343 -3.096) 6.923 2.829 ( -5.633 -3.703 -4.950) 8.364 3.534 ( -7.289 5.264 10.172) 13.576 4.551 ( 2.865 3.749 8.170) 9.435 4.691 ( -3.635 -2.711 13.412) 14.158 4.978 ( -10.063 -1.991 0.453) 10.268 5.561 ( 3.047 4.935 12.474) 13.757 5.654 ( -6.122 -1.897 9.865) 11.764 5.792 ( -0.706 -0.992 -8.975) 9.058 6.073 ( 2.606 -5.193 -4.358) 7.263 6.569 ( -6.839 -3.001 15.633) 17.325 7.118 ( 0.248 11.331 -2.633) 11.636 7.364 ( -1.956 -4.269 4.296) 6.365 7.390 ( -2.135 2.837 14.337) 14.770 7.479 ( -2.637 0.768 21.484) 21.659 7.887 ( 0.501 6.953 -3.776) 7.928 8.141 ( 8.172 -7.399 -2.361) 11.274 8.412 ( 3.394 0.649 -4.034) 5.312 8.454 ( 2.814 -2.654 10.901) 11.567 8.766 ( 3.229 -0.335 10.190) 10.694 9.363 ( -12.125 7.849 -7.973) 16.498 9.532 ( -14.878 -2.559 -3.139) 15.419 9.863 ( -8.659 -2.209 -2.459) 9.269 10.231 ( 3.368 3.511 -4.750) 6.799 10.595 ( 4.150 1.572 3.074) 5.399 10.751 ( -2.171 -7.804 -0.932) 8.154 11.075 ( 8.384 -1.077 -22.874) 24.386 11.367 ( 10.241 -1.321 -9.569) 14.078 11.709 ( -5.759 0.700 9.264) 10.931 12.103 ( 7.424 1.784 14.487) 16.376 12.119 ( -1.470 1.105 -6.677) 6.926 12.466 ( -6.630 -1.543 3.344) 7.585 13.243 ( -3.332 4.626 -11.006) 12.395 13.391 ( 1.468 1.766 -11.915) 12.134 14.030 ( 13.433 2.046 5.298) 14.584 14.333 ( 3.855 -6.680 -5.258) 9.334 15.453 ( -7.733 2.515 5.549) 9.845 15.632 ( 3.946 -1.041 16.413) 16.913 15.805 ( -0.109 0.064 8.759) 8.760 16.451 ( -8.297 -0.472 6.794) 10.734 17.781 ( -0.405 0.256 -12.299) 12.308 18.640 ( -4.010 0.442 5.805) 7.069 19.270 ( 8.237 -6.364 -24.884) 26.973 19.927 ( 7.664 1.234 -18.464) 20.030 25.762 ( -5.827 -1.028 9.221) 10.956 26.551 ( 1.616 2.228 -3.788) 4.682 26.657 ( -16.349 0.845 6.449) 17.595 26.879 ( 3.701 -0.821 6.163) 7.235 28.080 ( -9.223 1.439 16.270) 18.758 28.435 ( 4.950 0.995 4.083) 6.494 28.808 ( 7.387 -1.845 2.660) 8.065 28.848 ( 6.024 2.065 9.725) 11.625 29.168 ( 2.642 0.941 8.183) 8.650 29.239 ( -1.319 -0.061 4.913) 5.087 29.491 ( 3.959 -6.056 -20.312) 21.562 30.379 ( -3.126 4.252 -29.286) 29.757 ======================= Grid point 233 (122/186) ======================= q-point: (-0.25 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( -6.405 8.219 0.999) 10.468 2.004 ( -5.431 11.124 4.695) 13.239 2.242 ( -2.133 4.839 -0.505) 5.313 2.382 ( -12.925 -1.492 3.875) 13.576 2.672 ( 2.624 -5.391 -0.554) 6.021 2.816 ( -4.425 -5.021 -1.416) 6.841 3.453 ( -0.267 3.996 9.580) 10.383 4.495 ( -23.516 -4.087 6.479) 24.733 4.626 ( 4.357 6.220 10.178) 12.699 4.996 ( 5.659 3.432 9.169) 11.308 5.519 ( -1.298 5.128 3.748) 6.482 5.707 ( 2.819 -1.150 5.391) 6.191 5.788 ( -3.086 -6.505 1.724) 7.404 6.152 ( 0.171 -5.030 -2.330) 5.546 6.610 ( -2.444 -4.762 10.796) 12.050 6.944 ( -1.355 11.530 -1.491) 11.705 7.337 ( -7.774 -1.857 18.674) 20.313 7.415 ( -2.793 -0.347 5.269) 5.973 7.531 ( 4.327 4.442 16.699) 17.813 7.760 ( -2.072 7.274 -4.859) 8.990 8.270 ( 0.542 -1.804 0.326) 1.911 8.445 ( 3.106 -2.315 -4.111) 5.648 8.577 ( 3.904 -3.352 12.250) 13.286 8.794 ( -4.592 1.711 10.206) 11.322 9.134 ( -5.397 3.106 -4.462) 7.661 9.346 ( -15.179 1.628 2.241) 15.430 9.794 ( -5.736 -4.336 -7.030) 10.056 10.237 ( 8.028 2.271 -3.065) 8.888 10.575 ( -6.725 -1.311 -2.336) 7.239 10.890 ( 7.500 -5.072 -4.162) 9.965 11.151 ( 10.058 -3.806 -16.512) 19.705 11.477 ( 10.432 -0.173 -12.007) 15.906 11.624 ( -9.648 0.144 6.184) 11.460 12.017 ( -4.310 3.716 -8.216) 9.994 12.205 ( 5.033 4.496 15.147) 16.582 12.477 ( -0.899 -3.988 5.193) 6.609 13.078 ( -1.073 7.498 -12.614) 14.714 13.345 ( -0.645 -1.800 -14.983) 15.105 14.117 ( 8.825 6.258 -0.208) 10.820 14.529 ( 8.496 -9.893 -0.643) 13.056 15.323 ( -9.202 3.449 5.211) 11.123 15.706 ( -0.939 2.759 16.084) 16.346 15.861 ( 3.631 -1.705 9.802) 10.591 16.366 ( -10.672 -0.729 8.030) 13.375 17.789 ( 4.544 -3.273 -7.620) 9.456 18.589 ( -5.158 0.949 3.338) 6.217 19.404 ( 8.611 -9.008 -23.228) 26.360 19.924 ( 6.530 3.157 -18.096) 19.495 25.779 ( -1.423 -3.872 9.108) 9.999 26.359 ( -17.036 3.670 7.448) 18.952 26.616 ( 1.185 0.266 -3.434) 3.642 26.976 ( 7.421 0.327 6.104) 9.615 28.010 ( -7.649 1.174 16.324) 18.066 28.494 ( 5.011 1.275 3.074) 6.016 28.848 ( -0.045 1.915 8.751) 8.958 28.924 ( 4.166 2.359 1.731) 5.091 29.186 ( -2.255 2.604 -0.582) 3.494 29.260 ( 4.390 -0.058 2.685) 5.146 29.604 ( 3.579 -11.120 -11.370) 16.302 30.167 ( -3.066 5.195 -26.632) 27.306 ======================= Grid point 234 (123/186) ======================= q-point: (-0.12 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -6.711 2.849 -1.265) 7.400 1.809 ( -4.333 9.079 7.242) 12.395 2.174 ( -4.004 -1.854 -1.217) 4.577 2.268 ( -9.940 0.283 5.697) 11.461 2.753 ( 1.694 -1.723 2.505) 3.480 2.864 ( 0.509 -5.383 0.711) 5.454 3.478 ( 3.260 0.245 7.534) 8.213 4.238 ( -27.551 -4.925 10.620) 29.935 4.690 ( 6.039 1.014 9.429) 11.243 5.031 ( 10.946 11.164 10.223) 18.680 5.438 ( -0.353 4.673 -4.534) 6.521 5.727 ( 0.571 -1.418 -3.650) 3.958 5.924 ( -0.528 -8.487 11.852) 14.586 6.186 ( -3.430 -1.874 5.795) 6.990 6.681 ( 1.588 3.468 7.770) 8.656 6.815 ( -0.478 -1.464 -2.533) 2.965 7.335 ( -9.209 -1.532 20.904) 22.894 7.388 ( -3.546 0.917 6.132) 7.143 7.540 ( 1.646 7.181 12.526) 14.532 7.627 ( -2.583 4.335 -4.612) 6.837 8.213 ( -2.579 7.441 3.615) 8.665 8.464 ( -3.845 -2.198 2.221) 4.954 8.681 ( -3.221 1.248 0.270) 3.465 8.808 ( 4.070 -10.343 9.823) 14.833 9.056 ( -7.940 6.690 10.077) 14.468 9.191 ( -5.209 -4.346 0.331) 6.792 9.805 ( 2.665 -3.118 -7.085) 8.187 10.346 ( 10.940 -0.863 -2.112) 11.175 10.476 ( -9.248 -2.426 -4.798) 10.697 11.006 ( 6.443 -3.258 -11.110) 13.250 11.301 ( 9.648 -5.134 -9.824) 14.696 11.507 ( -7.203 2.836 3.593) 8.535 11.537 ( 5.429 1.819 -13.032) 14.235 11.882 ( -2.978 3.340 -7.312) 8.572 12.202 ( -0.223 5.510 7.828) 9.575 12.546 ( -2.398 -5.631 2.382) 6.567 12.963 ( 5.856 6.821 -11.404) 14.521 13.332 ( -0.685 -4.282 -13.106) 13.804 14.105 ( 7.687 7.915 -7.511) 13.347 14.748 ( 4.645 -7.712 1.860) 9.193 15.183 ( -8.131 3.731 9.763) 13.242 15.667 ( -7.057 2.876 17.665) 19.239 15.987 ( 7.873 -1.212 6.395) 10.215 16.258 ( -11.236 0.728 8.169) 13.911 17.933 ( 8.154 -7.476 -1.083) 11.115 18.512 ( -5.954 1.061 1.884) 6.335 19.550 ( 8.176 -7.840 -21.954) 24.704 19.874 ( 4.850 5.481 -18.401) 19.803 25.898 ( 3.144 -7.216 8.276) 11.421 26.157 ( -13.170 1.397 8.749) 15.873 26.597 ( -0.091 1.785 -3.004) 3.495 27.082 ( 8.410 1.997 5.051) 10.012 27.978 ( -5.215 -0.329 16.068) 16.896 28.551 ( 5.379 0.963 1.931) 5.795 28.819 ( -2.097 5.424 8.682) 10.450 28.917 ( -0.204 2.620 2.617) 3.709 29.036 ( -9.634 5.725 -6.836) 13.127 29.322 ( 3.029 -1.191 -1.461) 3.567 29.723 ( -0.151 -3.403 -7.427) 8.171 30.075 ( 5.130 -5.905 -20.573) 22.010 ======================= Grid point 240 (124/186) ======================= q-point: (-0.38 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( -8.508 -0.000 0.095) 8.508 2.190 ( -9.322 -0.000 3.143) 9.837 2.386 ( -11.750 -0.000 -3.377) 12.226 2.406 ( 5.410 0.000 6.287) 8.294 2.466 ( -7.768 -0.000 4.654) 9.056 2.695 ( -7.438 -0.000 -3.439) 8.195 3.527 ( -3.349 -0.000 7.204) 7.944 4.442 ( -23.010 -0.000 5.964) 23.770 4.791 ( 5.540 0.000 19.797) 20.557 4.938 ( 7.644 0.000 1.578) 7.805 5.571 ( -7.470 -0.000 9.491) 12.078 5.726 ( 7.339 0.000 13.494) 15.361 5.745 ( -1.258 -0.000 -11.680) 11.748 6.044 ( 1.310 0.000 -3.381) 3.626 6.525 ( -4.604 -0.000 14.294) 15.017 7.221 ( -1.817 -0.000 -4.800) 5.133 7.293 ( -4.081 -0.000 11.744) 12.433 7.372 ( -6.583 -0.000 9.058) 11.197 7.571 ( 3.239 0.000 23.171) 23.397 7.950 ( 1.425 0.000 -6.729) 6.878 8.122 ( 2.155 0.000 -7.307) 7.618 8.388 ( -0.237 -0.000 -10.550) 10.552 8.526 ( -1.612 -0.000 23.547) 23.602 8.862 ( 4.638 0.000 11.737) 12.621 9.255 ( -9.862 -0.000 -12.961) 16.286 9.293 ( -13.828 -0.000 -1.575) 13.917 9.722 ( -10.380 -0.000 -0.066) 10.381 10.271 ( 3.837 0.000 -6.514) 7.561 10.579 ( -6.649 -0.000 0.353) 6.658 10.793 ( 11.936 0.000 2.341) 12.163 11.099 ( 9.902 0.000 -23.527) 25.526 11.476 ( 12.432 0.000 -8.322) 14.960 11.620 ( -11.903 -0.000 8.022) 14.354 12.067 ( -3.099 -0.000 -8.233) 8.797 12.211 ( -5.733 -0.000 17.085) 18.021 12.500 ( 12.816 0.000 9.534) 15.973 13.144 ( -6.319 -0.000 -20.696) 21.639 13.373 ( -1.078 -0.000 -12.051) 12.099 14.289 ( 16.344 0.000 12.485) 20.567 14.299 ( 4.796 0.000 -9.990) 11.081 15.380 ( -7.917 -0.000 3.087) 8.498 15.766 ( 7.260 0.000 16.856) 18.353 15.816 ( -3.077 -0.000 10.335) 10.783 16.345 ( -12.015 -0.000 10.787) 16.146 17.761 ( 4.199 0.000 -13.677) 14.307 18.613 ( -4.214 -0.000 5.013) 6.549 19.246 ( 8.776 0.000 -24.021) 25.574 19.969 ( 7.467 0.000 -18.111) 19.590 25.719 ( -4.080 -0.000 8.784) 9.685 26.422 ( -21.121 -0.000 9.489) 23.155 26.610 ( 3.783 0.000 -5.060) 6.318 26.976 ( 7.500 0.000 8.307) 11.192 28.030 ( -8.612 -0.000 15.546) 17.772 28.521 ( 5.139 0.000 3.433) 6.180 28.848 ( 0.058 0.000 4.994) 4.994 28.989 ( 7.485 0.000 3.386) 8.216 29.210 ( -1.090 -0.000 6.723) 6.811 29.265 ( 2.841 0.000 4.045) 4.943 29.429 ( 4.272 0.000 -16.745) 17.281 30.257 ( -4.212 -0.000 -30.197) 30.489 ======================= Grid point 241 (125/186) ======================= q-point: (-0.25 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( -13.996 5.615 0.081) 15.081 2.021 ( -19.303 -6.390 -1.484) 20.387 2.152 ( -5.656 14.731 7.367) 17.415 2.396 ( -2.840 5.100 6.398) 8.661 2.575 ( 0.629 -10.560 3.860) 11.261 2.654 ( -6.037 -7.633 1.058) 9.789 3.524 ( 1.333 1.545 5.809) 6.156 4.140 ( -29.042 -1.574 6.662) 29.838 4.848 ( 5.460 7.887 16.386) 18.988 5.137 ( 13.112 -2.729 4.129) 14.015 5.526 ( -4.405 -0.001 6.156) 7.570 5.681 ( -2.798 -1.062 -8.128) 8.661 5.847 ( 7.615 2.931 14.127) 16.314 6.077 ( 0.185 -4.152 -2.074) 4.645 6.559 ( -1.006 -4.117 10.181) 11.028 7.089 ( -2.477 10.990 0.307) 11.270 7.263 ( -9.070 -1.602 16.493) 18.890 7.359 ( -5.973 -3.110 8.031) 10.480 7.692 ( 5.501 2.324 16.093) 17.166 7.832 ( -1.193 9.994 -9.335) 13.727 8.189 ( -0.848 -8.748 -5.793) 10.526 8.352 ( -5.070 -4.320 -6.968) 9.639 8.577 ( -5.166 -4.301 19.388) 20.520 8.856 ( -4.981 9.439 11.796) 15.908 9.098 ( -1.570 0.797 -4.471) 4.806 9.198 ( -9.061 -1.545 0.935) 9.239 9.646 ( -4.505 -5.357 -0.441) 7.014 10.323 ( 7.408 -0.697 -5.729) 9.391 10.476 ( -7.693 1.361 -3.967) 8.762 10.944 ( 9.139 -1.375 -3.119) 9.754 11.176 ( 11.535 -2.936 -20.259) 23.497 11.504 ( -11.406 -0.893 9.425) 14.823 11.588 ( 10.899 1.399 -9.942) 14.819 11.970 ( -4.867 2.435 -7.662) 9.398 12.191 ( -8.271 -4.816 10.278) 14.044 12.670 ( 13.010 11.227 8.216) 19.048 13.029 ( -0.713 -4.263 -17.136) 17.672 13.287 ( -2.053 1.864 -13.183) 13.472 14.297 ( 8.242 4.803 -9.861) 13.720 14.564 ( 12.221 -4.709 8.731) 15.740 15.285 ( -6.408 2.653 5.448) 8.819 15.772 ( -5.465 3.525 13.564) 15.043 15.924 ( 5.520 -2.370 9.269) 11.046 16.252 ( -10.733 -0.917 17.100) 20.210 17.806 ( 8.411 -1.689 -9.818) 13.038 18.562 ( -4.185 1.775 3.115) 5.511 19.322 ( 8.460 -6.470 -22.443) 24.842 19.982 ( 6.650 2.086 -17.986) 19.289 25.738 ( -1.200 -3.596 8.375) 9.193 26.199 ( -17.866 1.134 10.292) 20.650 26.625 ( 1.268 0.360 -4.228) 4.428 27.105 ( 7.823 0.124 8.905) 11.854 27.983 ( -6.630 0.327 14.777) 16.200 28.584 ( 4.725 1.028 1.843) 5.175 28.852 ( -2.721 -0.369 4.922) 5.636 29.031 ( 2.799 3.446 2.086) 4.906 29.167 ( -6.329 2.427 -2.459) 7.210 29.302 ( 1.922 -0.313 -4.531) 4.932 29.514 ( 7.588 -6.339 -4.640) 10.922 30.095 ( -1.998 2.483 -24.397) 24.604 ======================= Grid point 242 (126/186) ======================= q-point: (-0.12 -0.38 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( -10.473 1.295 2.216) 10.783 1.899 ( -17.003 -7.353 7.875) 20.130 1.923 ( -5.785 9.476 3.356) 11.599 2.304 ( -2.666 4.971 4.363) 7.132 2.673 ( -4.791 -8.297 3.977) 10.373 2.784 ( 2.528 -8.869 5.988) 10.996 3.537 ( -1.034 2.085 5.050) 5.561 3.861 ( -24.480 -6.313 9.408) 26.975 4.850 ( 2.324 6.720 14.834) 16.450 5.292 ( 11.528 4.454 -0.740) 12.380 5.482 ( 0.668 3.076 -2.288) 3.891 5.701 ( 0.814 -5.112 2.131) 5.598 5.937 ( 4.363 1.428 11.775) 12.638 6.121 ( -2.928 -3.335 4.799) 6.537 6.681 ( 3.239 -8.216 1.868) 9.027 6.894 ( -2.263 12.584 2.781) 13.085 7.247 ( -10.353 -3.160 20.687) 23.348 7.351 ( -4.984 -2.396 7.996) 9.722 7.646 ( -3.513 7.143 -4.848) 9.320 7.708 ( 0.858 8.554 7.541) 11.436 8.228 ( -3.447 -0.779 -0.216) 3.540 8.336 ( -5.933 -6.866 -2.063) 9.305 8.662 ( -7.068 -1.563 11.169) 13.310 8.717 ( -2.060 -3.848 7.592) 8.758 9.060 ( -8.640 4.683 4.900) 10.981 9.126 ( 1.628 -2.603 6.203) 6.921 9.770 ( 6.264 -9.124 -0.316) 11.072 10.303 ( -9.429 1.228 -8.038) 12.451 10.456 ( 8.328 -2.787 -2.964) 9.269 11.026 ( 5.961 -0.204 -8.527) 10.406 11.297 ( 8.071 -4.153 -19.602) 21.601 11.443 ( -5.660 -1.593 11.062) 12.528 11.625 ( 6.697 4.376 -12.562) 14.894 11.859 ( -2.660 1.755 -4.854) 5.806 12.184 ( -7.151 -3.278 2.277) 8.190 12.563 ( -1.315 8.641 -7.364) 11.429 13.084 ( 7.676 3.961 -8.077) 11.826 13.252 ( 3.543 -3.000 -6.714) 8.163 14.291 ( 9.886 7.263 -13.354) 18.133 14.749 ( 4.919 -1.875 3.974) 6.596 15.209 ( -2.498 3.668 14.067) 14.750 15.671 ( -9.479 4.223 15.429) 18.594 16.021 ( -1.561 -5.076 1.139) 5.431 16.227 ( -1.000 3.079 19.258) 19.528 17.957 ( 10.680 -5.244 -2.413) 12.140 18.488 ( -3.290 2.887 1.739) 4.710 19.456 ( 7.566 -8.781 -21.329) 24.275 19.948 ( 5.431 4.810 -18.402) 19.781 25.837 ( -1.035 -7.142 6.840) 9.943 26.048 ( -9.516 -1.072 11.282) 14.799 26.603 ( -0.647 1.261 -3.580) 3.850 27.213 ( 5.135 0.718 7.902) 9.452 27.964 ( -4.210 -0.498 13.432) 14.085 28.634 ( 4.646 0.434 0.213) 4.671 28.817 ( -5.142 0.676 4.257) 6.710 28.937 ( -14.133 6.172 -11.651) 19.328 29.019 ( 1.528 5.713 5.336) 7.965 29.298 ( -1.301 -1.547 -5.528) 5.886 29.690 ( 6.660 -5.227 -0.975) 8.522 30.025 ( 5.541 -0.860 -17.145) 18.039 ======================= Grid point 249 (127/186) ======================= q-point: (-0.25 -0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -15.599 -0.000 1.337) 15.657 1.692 ( -19.404 -0.000 7.627) 20.849 2.269 ( -10.675 -0.000 8.965) 13.940 2.348 ( 0.045 0.000 7.911) 7.911 2.440 ( -11.217 -0.000 -2.415) 11.474 2.609 ( 5.089 0.000 11.281) 12.376 3.577 ( 3.045 0.000 3.712) 4.802 3.777 ( -30.566 -0.000 6.194) 31.187 5.011 ( 0.629 0.000 16.476) 16.488 5.316 ( 17.253 0.000 -0.694) 17.267 5.500 ( -2.630 -0.000 10.274) 10.605 5.613 ( -2.238 -0.000 -8.441) 8.733 6.013 ( 6.511 0.000 12.315) 13.930 6.047 ( 1.138 0.000 -2.702) 2.932 6.559 ( -0.081 -0.000 11.330) 11.331 7.127 ( -3.335 -0.000 -1.032) 3.490 7.195 ( -12.588 -0.000 23.381) 26.555 7.273 ( -5.374 -0.000 7.154) 8.948 7.839 ( 4.315 0.000 7.078) 8.289 7.917 ( 2.701 0.000 -4.759) 5.472 7.987 ( -7.796 -0.000 -9.715) 12.456 8.239 ( -3.176 -0.000 -6.428) 7.169 8.497 ( -12.246 -0.000 20.615) 23.978 8.882 ( -12.233 -0.000 17.256) 21.152 9.079 ( -1.664 -0.000 -1.224) 2.066 9.135 ( 3.099 0.000 -5.692) 6.481 9.576 ( -0.892 -0.000 10.107) 10.146 10.351 ( -11.490 -0.000 -5.941) 12.935 10.402 ( 9.564 0.000 -6.250) 11.425 11.032 ( 7.857 0.000 -6.168) 9.989 11.230 ( 11.836 0.000 -20.924) 24.039 11.404 ( -8.726 -0.000 11.155) 14.162 11.694 ( 9.581 0.000 -11.909) 15.285 11.903 ( -4.378 -0.000 -8.934) 9.949 12.078 ( -8.491 -0.000 11.059) 13.943 12.785 ( -7.679 -0.000 -29.115) 30.111 13.098 ( 22.744 0.000 12.202) 25.811 13.219 ( -3.351 -0.000 -14.447) 14.831 14.396 ( 10.547 0.000 -12.959) 16.708 14.726 ( 10.516 0.000 8.905) 13.780 15.275 ( -2.328 -0.000 10.388) 10.646 15.753 ( -8.476 -0.000 13.117) 15.618 15.930 ( -5.772 -0.000 2.432) 6.264 16.267 ( 1.878 0.000 27.633) 27.697 17.887 ( 11.385 0.000 -7.265) 13.506 18.542 ( -2.705 -0.000 1.923) 3.319 19.302 ( 7.957 0.000 -21.295) 22.733 20.016 ( 6.064 0.000 -17.909) 18.907 25.722 ( -1.472 -0.000 7.978) 8.113 26.039 ( -13.820 -0.000 11.772) 18.154 26.620 ( -0.284 -0.000 -4.216) 4.226 27.219 ( 4.484 0.000 9.465) 10.474 27.961 ( -4.868 -0.000 12.795) 13.690 28.640 ( 2.786 0.000 -0.495) 2.829 28.822 ( -4.115 -0.000 4.229) 5.900 29.045 ( -12.682 -0.000 -10.213) 16.283 29.082 ( 1.893 0.000 -2.684) 3.284 29.283 ( -0.360 -0.000 -6.532) 6.542 29.583 ( 9.830 0.000 -0.439) 9.840 30.047 ( 3.089 0.000 -12.733) 13.103 ======================= Grid point 250 (128/186) ======================= q-point: (-0.12 -0.25 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( -11.855 0.263 4.994) 12.866 1.610 ( -12.294 -6.896 15.804) 21.177 2.028 ( -8.379 12.831 8.449) 17.499 2.315 ( -5.768 1.263 0.689) 5.945 2.486 ( -3.091 -11.510 7.998) 14.353 2.747 ( 3.436 -5.488 10.912) 12.688 3.415 ( -27.681 0.447 8.784) 29.045 3.650 ( 1.319 -3.520 2.405) 4.463 4.985 ( -3.726 6.255 10.735) 12.971 5.438 ( 4.218 3.477 -3.971) 6.757 5.556 ( 8.196 0.609 -1.415) 8.339 5.643 ( 2.690 -6.898 6.531) 9.872 6.048 ( 1.548 2.033 0.487) 2.602 6.098 ( 0.428 -0.018 10.505) 10.514 6.630 ( 0.993 -3.968 5.745) 7.053 7.023 ( -3.999 7.909 8.688) 12.411 7.147 ( -9.651 -2.829 19.488) 21.930 7.266 ( -4.949 -3.635 7.896) 10.002 7.702 ( -3.071 9.852 -8.686) 13.489 7.820 ( -3.868 5.560 2.472) 7.210 8.123 ( 2.442 -10.143 -1.327) 10.517 8.197 ( -4.641 -0.360 0.798) 4.723 8.473 ( -10.076 -10.506 11.668) 18.656 8.756 ( -8.111 5.401 16.575) 19.227 9.032 ( -2.335 2.806 -0.837) 3.745 9.178 ( 4.298 -0.272 5.760) 7.192 9.714 ( 4.421 -9.709 10.675) 15.092 10.157 ( -13.812 0.909 -5.456) 14.878 10.514 ( 9.083 -1.443 -5.936) 10.946 11.083 ( 5.829 1.130 -8.949) 10.740 11.285 ( 5.494 0.321 -17.235) 18.092 11.395 ( -1.002 -4.304 5.866) 7.344 11.705 ( 3.088 4.360 -16.889) 17.714 11.847 ( 1.960 -0.100 -2.248) 2.984 12.049 ( -6.697 -3.736 6.182) 9.850 12.552 ( -5.718 5.141 -28.179) 29.209 13.112 ( -2.104 1.681 -15.808) 16.036 13.392 ( 18.118 0.540 1.719) 18.207 14.481 ( 14.837 5.902 -11.220) 19.516 14.826 ( 3.504 1.973 2.620) 4.799 15.309 ( 2.246 2.194 19.493) 19.744 15.648 ( -10.983 3.675 13.963) 18.141 15.872 ( -9.958 -5.197 5.222) 12.387 16.398 ( 7.337 3.527 19.175) 20.831 18.035 ( 10.296 -2.243 -0.608) 10.555 18.516 ( 1.389 2.157 0.608) 2.636 19.370 ( 7.260 -6.048 -20.444) 22.522 20.004 ( 4.969 2.764 -18.149) 19.019 25.741 ( -5.481 -3.743 7.734) 10.191 25.979 ( -3.246 -2.866 11.872) 12.637 26.588 ( -1.685 0.583 -4.045) 4.420 27.267 ( -1.637 -0.048 6.265) 6.475 27.942 ( -5.416 -0.529 9.864) 11.266 28.644 ( -3.427 -0.341 -4.598) 5.745 28.777 ( -4.452 0.176 3.891) 5.915 28.806 ( -9.731 4.803 -9.768) 14.600 29.092 ( 1.611 0.194 -2.595) 3.061 29.249 ( -1.562 0.831 -3.336) 3.777 29.721 ( 7.782 -3.479 -0.538) 8.541 30.087 ( 9.265 1.859 -5.298) 10.834 ======================= Grid point 258 (129/186) ======================= q-point: (-0.12 -0.12 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( -11.485 -0.000 4.639) 12.386 1.549 ( -6.143 -0.000 23.759) 24.540 2.087 ( -9.335 -0.000 12.792) 15.835 2.196 ( -2.290 -0.000 1.724) 2.866 2.450 ( 3.366 0.000 6.967) 7.737 2.790 ( 2.264 0.000 11.427) 11.649 3.104 ( -24.939 -0.000 13.031) 28.138 3.656 ( 1.362 0.000 -0.415) 1.424 4.977 ( -7.658 -0.000 2.183) 7.963 5.492 ( 1.905 0.000 -0.917) 2.114 5.607 ( 3.372 0.000 2.266) 4.063 5.694 ( 6.640 0.000 -0.794) 6.687 6.088 ( -6.579 -0.000 3.893) 7.644 6.107 ( 3.928 0.000 6.138) 7.287 6.642 ( -0.452 -0.000 8.945) 8.957 7.035 ( -12.662 -0.000 27.904) 30.642 7.111 ( 1.467 0.000 5.892) 6.072 7.213 ( -3.448 -0.000 6.630) 7.473 7.709 ( -7.169 -0.000 -8.451) 11.082 7.764 ( -1.229 -0.000 -5.146) 5.291 8.132 ( 2.201 0.000 8.069) 8.364 8.195 ( 1.555 0.000 -3.728) 4.039 8.271 ( -10.476 -0.000 15.202) 18.462 8.737 ( -8.444 -0.000 17.656) 19.571 9.077 ( 2.592 0.000 1.410) 2.950 9.243 ( 5.815 0.000 1.675) 6.052 9.741 ( 3.207 0.000 17.905) 18.190 9.959 ( -14.942 -0.000 -1.611) 15.028 10.594 ( 7.446 0.000 -5.897) 9.498 11.115 ( 5.027 0.000 -15.922) 16.696 11.324 ( 5.583 0.000 -18.514) 19.338 11.339 ( -3.429 -0.000 9.441) 10.045 11.688 ( 0.435 0.000 -18.676) 18.681 11.906 ( 8.239 0.000 -2.744) 8.684 11.981 ( -4.820 -0.000 9.471) 10.627 12.412 ( -3.577 -0.000 -33.818) 34.007 13.033 ( -1.722 -0.000 -19.376) 19.452 13.577 ( 12.066 0.000 -11.040) 16.355 14.745 ( 22.770 0.000 -7.083) 23.846 14.865 ( -0.957 -0.000 0.887) 1.305 15.440 ( 3.673 0.000 23.285) 23.573 15.584 ( -11.828 -0.000 14.104) 18.407 15.714 ( -11.292 -0.000 8.330) 14.032 16.577 ( 6.795 0.000 11.481) 13.341 18.125 ( 4.253 0.000 3.381) 5.434 18.590 ( 8.243 0.000 -0.390) 8.253 19.348 ( 7.119 0.000 -19.514) 20.772 20.016 ( 3.748 0.000 -18.008) 18.394 25.673 ( -5.412 -0.000 9.220) 10.691 25.982 ( 0.945 0.000 11.558) 11.597 26.551 ( -2.325 -0.000 -4.342) 4.925 27.204 ( -9.673 -0.000 -1.819) 9.843 27.872 ( -9.400 -0.000 8.515) 12.683 28.550 ( -5.956 -0.000 -2.402) 6.422 28.727 ( -4.949 -0.000 2.472) 5.533 28.773 ( -0.076 -0.000 -1.923) 1.924 29.072 ( 0.512 0.000 -9.023) 9.038 29.250 ( -0.054 -0.000 0.572) 0.574 29.780 ( 5.382 0.000 -0.741) 5.432 30.242 ( 13.368 0.000 -0.524) 13.378 ======================= Grid point 259 (130/186) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.427 ( 7.126 0.000 7.354) 10.240 1.617 ( -11.307 -0.000 4.235) 12.074 2.246 ( -4.358 -0.000 9.550) 10.498 2.420 ( 5.818 0.000 1.151) 5.931 2.578 ( 7.168 0.000 -2.205) 7.499 2.784 ( -10.752 -0.000 -6.762) 12.701 3.529 ( 9.482 0.000 26.437) 28.086 3.844 ( -1.822 -0.000 17.592) 17.686 4.567 ( -1.467 -0.000 -13.991) 14.068 5.156 ( -1.853 -0.000 -30.177) 30.234 5.722 ( 7.284 0.000 4.964) 8.815 5.756 ( -9.590 -0.000 1.855) 9.768 5.948 ( -5.750 -0.000 8.883) 10.582 6.265 ( 3.782 0.000 -5.571) 6.734 6.857 ( -0.141 -0.000 12.336) 12.337 7.259 ( -3.045 -0.000 2.241) 3.781 7.352 ( -3.753 -0.000 -3.987) 5.476 7.356 ( 0.473 0.000 6.690) 6.707 7.431 ( 0.442 0.000 6.607) 6.622 7.734 ( 2.152 0.000 -2.121) 3.022 8.213 ( -10.733 -0.000 4.741) 11.733 8.246 ( 6.343 0.000 -0.285) 6.350 8.630 ( 5.887 0.000 12.856) 14.139 9.230 ( -1.414 -0.000 -13.019) 13.096 9.307 ( -13.099 -0.000 41.710) 43.718 9.438 ( -13.333 -0.000 36.910) 39.244 9.945 ( 7.494 0.000 8.989) 11.703 10.253 ( -1.698 -0.000 16.125) 16.214 10.347 ( -5.873 -0.000 -16.367) 17.389 10.758 ( 11.023 0.000 -13.146) 17.156 11.058 ( 13.988 0.000 -29.662) 32.795 11.269 ( 0.696 0.000 -26.913) 26.922 11.366 ( -7.969 -0.000 2.043) 8.227 11.486 ( 11.874 0.000 -20.093) 23.339 12.109 ( -1.537 -0.000 6.238) 6.425 12.247 ( 10.912 0.000 5.051) 12.024 12.488 ( -4.269 -0.000 -9.273) 10.209 13.102 ( -2.106 -0.000 -24.929) 25.018 14.817 ( -10.659 -0.000 4.980) 11.765 15.058 ( 12.280 0.000 -6.926) 14.099 15.627 ( -8.894 -0.000 10.092) 13.452 15.762 ( 1.073 0.000 5.314) 5.421 16.098 ( 0.499 0.000 19.138) 19.145 16.571 ( -6.735 -0.000 -4.032) 7.850 18.315 ( -4.262 -0.000 11.836) 12.580 18.865 ( 1.659 0.000 9.159) 9.308 19.006 ( 8.621 0.000 -20.303) 22.058 19.548 ( 0.771 0.000 -21.447) 21.461 25.943 ( 5.355 0.000 11.546) 12.728 26.303 ( 1.930 0.000 9.108) 9.310 26.341 ( -2.838 -0.000 -8.030) 8.517 26.662 ( -5.043 -0.000 -9.904) 11.114 28.119 ( -3.340 -0.000 15.954) 16.300 28.573 ( -1.333 -0.000 -6.326) 6.465 28.676 ( 0.170 0.000 8.498) 8.500 28.861 ( 4.616 0.000 3.192) 5.612 28.883 ( -2.525 -0.000 -3.136) 4.026 29.164 ( 0.473 0.000 -10.017) 10.028 29.916 ( -3.154 -0.000 9.068) 9.601 30.362 ( 7.192 0.000 -11.299) 13.394 ======================= Grid point 260 (131/186) ======================= q-point: ( 0.12 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( -4.797 -3.435 2.150) 6.279 1.582 ( 10.099 -1.217 7.785) 12.809 2.219 ( -1.276 2.052 8.613) 8.945 2.467 ( 3.331 2.108 -4.890) 6.281 2.650 ( -7.501 -3.027 -5.407) 9.730 2.694 ( 6.789 -2.482 3.931) 8.228 3.708 ( 8.732 6.004 22.949) 25.278 3.997 ( 4.670 -13.238 12.920) 19.078 4.545 ( 6.891 2.064 -6.252) 9.530 5.030 ( -4.644 -2.389 -30.325) 30.771 5.556 ( -14.200 6.223 4.103) 16.037 5.842 ( 3.346 -0.600 5.656) 6.599 5.949 ( -0.887 -4.092 4.284) 5.991 6.262 ( 1.707 2.410 -5.419) 6.172 6.844 ( -0.377 6.430 12.863) 14.386 7.170 ( 0.441 8.623 -2.768) 9.067 7.295 ( -3.480 -2.128 2.408) 4.737 7.428 ( -2.747 -4.146 6.244) 7.983 7.519 ( -0.774 -8.478 5.338) 10.048 7.752 ( 0.922 -0.584 -0.394) 1.160 8.111 ( -9.081 -1.598 4.318) 10.181 8.343 ( 7.574 -1.078 0.401) 7.660 8.753 ( 4.649 -0.768 13.007) 13.835 9.166 ( -1.062 -0.839 -10.746) 10.831 9.260 ( -17.184 -1.452 37.990) 41.721 9.426 ( -6.852 1.736 31.862) 32.637 10.022 ( -0.792 7.335 2.157) 7.687 10.172 ( 9.050 3.783 5.678) 11.334 10.411 ( -4.342 -11.288 -1.205) 12.155 10.837 ( 7.354 -0.954 -11.539) 13.716 11.089 ( 9.720 2.776 -29.004) 30.715 11.162 ( 3.223 3.044 -32.428) 32.729 11.299 ( -6.883 -3.869 -0.053) 7.896 11.651 ( 17.511 -2.006 -7.729) 19.245 12.123 ( -0.301 -1.053 6.558) 6.649 12.336 ( -0.086 -2.208 -9.935) 10.178 12.513 ( 8.411 -2.856 4.297) 9.867 12.992 ( -2.690 -1.357 -24.613) 24.797 14.614 ( -15.595 7.368 4.666) 17.868 15.089 ( 3.221 5.038 -5.898) 8.399 15.558 ( -6.830 1.632 10.823) 12.901 15.831 ( 6.048 -0.075 5.749) 8.345 16.142 ( -2.667 1.161 18.602) 18.828 16.453 ( -10.212 -0.882 -1.976) 10.439 18.298 ( -2.039 2.072 10.581) 10.973 18.856 ( -2.169 3.989 7.908) 9.119 19.077 ( 7.500 -3.720 -17.886) 19.748 19.462 ( -0.482 0.965 -22.371) 22.397 26.081 ( 9.578 0.556 11.252) 14.787 26.285 ( -2.025 -0.203 -7.863) 8.122 26.388 ( 2.257 -3.785 8.085) 9.208 26.626 ( 1.131 -3.122 -8.312) 8.951 28.159 ( -1.469 -2.369 14.812) 15.072 28.534 ( -1.047 0.689 -3.833) 4.033 28.701 ( -1.347 -0.588 9.544) 9.656 28.854 ( -2.655 -1.974 -4.421) 5.522 28.930 ( 3.175 -0.268 4.003) 5.116 29.140 ( 1.532 -0.954 -12.093) 12.227 29.873 ( -6.774 1.809 8.816) 11.264 30.353 ( 4.941 5.787 -13.717) 15.686 ======================= Grid point 261 (132/186) ======================= q-point: ( 0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 0.246 -5.344 0.128) 5.352 1.708 ( 5.604 2.081 6.365) 8.732 2.226 ( 1.006 0.784 6.997) 7.112 2.404 ( -2.394 2.321 -8.698) 9.315 2.679 ( 2.816 -5.896 -0.367) 6.545 2.832 ( 6.699 -1.536 8.016) 10.559 3.776 ( 3.434 4.031 16.324) 17.162 4.310 ( 13.619 -8.156 1.617) 15.956 4.651 ( 5.826 -3.833 8.264) 10.814 4.924 ( -1.970 -4.489 -21.565) 22.115 5.283 ( -15.434 7.847 5.237) 18.089 5.827 ( -4.860 1.909 2.869) 5.958 6.040 ( 3.525 -2.861 -3.715) 5.866 6.229 ( 2.222 2.685 -2.789) 4.464 6.789 ( -1.557 5.442 10.429) 11.866 7.062 ( 3.555 9.026 -4.777) 10.813 7.291 ( -2.190 -1.226 1.735) 3.051 7.437 ( -3.486 -1.123 1.096) 3.823 7.628 ( -3.868 -8.005 7.979) 11.946 7.801 ( -0.883 -5.003 7.819) 9.325 8.073 ( -6.377 -4.832 5.498) 9.708 8.454 ( 6.227 -1.410 0.157) 6.386 8.834 ( -0.244 0.098 12.778) 12.781 9.171 ( -0.277 -3.676 -8.303) 9.084 9.213 ( -10.165 -1.850 34.068) 35.600 9.407 ( -5.304 4.933 24.955) 25.985 9.885 ( -3.567 6.095 2.828) 7.607 10.306 ( 14.002 4.270 2.656) 14.878 10.471 ( -5.358 -7.097 -3.166) 9.439 10.898 ( 5.806 -0.166 -6.809) 8.950 11.005 ( 3.091 3.353 -29.043) 29.399 11.094 ( 8.378 2.508 -31.388) 32.583 11.301 ( -5.499 -7.449 -0.344) 9.266 11.848 ( 12.778 1.579 0.093) 12.875 12.181 ( 0.080 -2.626 6.776) 7.267 12.334 ( 0.435 -6.530 -15.366) 16.702 12.687 ( 7.834 -1.860 4.272) 9.115 12.946 ( 3.044 -5.561 -19.016) 20.045 14.288 ( -16.941 11.235 2.981) 20.545 14.998 ( -1.240 6.268 -5.074) 8.159 15.485 ( -5.845 2.831 13.118) 14.637 15.935 ( 7.019 0.263 5.747) 9.076 16.128 ( -5.213 2.444 16.703) 17.668 16.343 ( -9.994 -2.319 -1.068) 10.315 18.282 ( -0.764 3.074 10.027) 10.515 18.773 ( -4.206 6.098 8.490) 11.267 19.155 ( 7.146 -3.549 -18.461) 20.112 19.375 ( -0.013 -0.531 -22.919) 22.925 26.194 ( 5.037 3.235 5.076) 7.848 26.251 ( 0.805 -0.387 -2.203) 2.378 26.488 ( 0.981 -3.012 5.451) 6.305 26.739 ( 8.690 -7.582 -2.921) 11.897 28.241 ( -0.342 -3.580 13.299) 13.776 28.504 ( -0.695 0.646 -1.372) 1.668 28.737 ( -1.787 -2.816 9.737) 10.292 28.830 ( -3.772 -2.666 -4.868) 6.711 28.949 ( -0.215 1.303 -0.521) 1.420 29.172 ( 4.566 -3.765 -8.622) 10.457 29.762 ( -9.169 3.363 6.701) 11.844 30.247 ( 3.755 9.816 -14.827) 18.175 ======================= Grid point 262 (133/186) ======================= q-point: ( 0.38 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( 0.676 -1.248 -0.732) 1.597 1.729 ( 0.861 0.367 4.126) 4.231 2.260 ( 1.596 -0.059 4.651) 4.918 2.312 ( -3.578 2.631 -4.298) 6.180 2.822 ( 5.549 -4.550 1.672) 7.368 2.944 ( 4.899 -0.115 7.550) 9.001 3.790 ( 1.788 6.025 11.422) 13.037 4.497 ( 0.282 -1.328 5.285) 5.456 4.762 ( 4.665 -5.583 -8.369) 11.089 5.008 ( -3.432 1.159 11.280) 11.848 5.095 ( 2.005 -7.182 -1.308) 7.571 5.726 ( -3.895 2.862 -2.138) 5.285 6.055 ( -0.027 0.410 -5.476) 5.492 6.235 ( 4.152 1.938 -2.337) 5.144 6.716 ( -3.619 4.529 3.677) 6.865 6.965 ( 4.429 9.938 -5.011) 11.978 7.292 ( -1.332 -2.077 -0.679) 2.560 7.422 ( -1.699 -2.258 0.515) 2.872 7.711 ( -5.037 -7.529 11.214) 14.416 7.879 ( -3.108 -3.069 13.957) 14.625 8.115 ( -3.565 -6.663 6.588) 10.025 8.511 ( 1.042 -0.231 -2.260) 2.499 8.837 ( -2.258 1.654 8.684) 9.124 9.161 ( -13.992 -4.891 25.606) 29.586 9.319 ( 7.682 3.080 13.172) 15.556 9.343 ( -3.197 0.509 9.680) 10.207 9.795 ( -1.505 4.799 5.933) 7.778 10.401 ( 11.084 5.139 -2.738) 12.521 10.453 ( -4.716 -1.767 -3.853) 6.340 10.852 ( 4.078 6.020 -17.855) 19.279 11.002 ( 8.700 1.232 -20.303) 22.123 11.070 ( 5.172 -2.537 -22.892) 23.606 11.350 ( -6.348 -10.278 0.419) 12.088 11.922 ( 5.241 3.787 4.167) 7.692 12.176 ( -4.181 0.398 -1.887) 4.605 12.408 ( 0.086 -6.610 -13.178) 14.743 12.814 ( 8.687 -2.926 7.481) 11.831 13.095 ( 9.996 -7.732 -10.430) 16.385 13.943 ( -13.931 9.126 -2.824) 16.892 14.872 ( -3.014 5.180 -4.451) 7.465 15.446 ( -3.179 1.267 15.462) 15.836 16.009 ( -1.541 1.898 12.644) 12.878 16.095 ( 1.714 1.387 5.984) 6.377 16.258 ( -8.512 -2.872 -0.692) 9.010 18.261 ( -0.938 3.318 9.547) 10.151 18.663 ( -3.574 6.600 9.939) 12.455 19.227 ( 9.072 -1.206 -19.822) 21.833 19.321 ( -0.303 -3.741 -22.639) 22.948 26.163 ( -2.622 2.038 0.019) 3.321 26.287 ( 4.432 2.768 3.567) 6.326 26.530 ( -0.694 -1.403 2.552) 2.993 26.986 ( 11.933 -7.559 2.233) 14.301 28.314 ( -1.829 -1.087 13.913) 14.075 28.497 ( 0.359 -1.176 -1.765) 2.151 28.753 ( -5.981 -1.972 -3.388) 7.151 28.832 ( -2.617 -4.157 5.826) 7.621 28.919 ( -0.333 -0.636 -1.914) 2.045 29.281 ( 6.550 -4.394 -4.601) 9.131 29.614 ( -9.076 3.088 3.209) 10.109 30.093 ( 3.636 11.423 -14.572) 18.869 ======================= Grid point 263 (134/186) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( -0.640 2.181 2.560) 3.423 1.768 ( -0.819 -3.278 0.196) 3.385 2.206 ( -4.852 4.509 2.155) 6.965 2.290 ( 0.275 -0.496 2.457) 2.522 2.895 ( 1.659 2.669 3.084) 4.403 3.014 ( 2.377 -0.282 5.181) 5.707 3.748 ( -0.920 5.657 10.162) 11.667 4.356 ( -17.601 7.141 14.763) 24.057 4.891 ( 7.507 -2.242 -8.994) 11.928 5.053 ( 2.975 -7.990 6.546) 10.749 5.254 ( 4.073 -5.056 -3.549) 7.399 5.721 ( 5.545 -1.818 -1.525) 6.031 6.020 ( -1.659 0.369 -3.750) 4.118 6.238 ( 3.137 3.197 -2.471) 5.115 6.617 ( -2.413 2.218 -6.175) 6.991 6.886 ( 2.964 6.422 1.113) 7.161 7.311 ( -0.880 -3.589 -2.818) 4.647 7.447 ( -1.292 -2.328 1.593) 3.103 7.768 ( -4.375 -2.597 10.565) 11.726 7.900 ( -4.645 -0.210 17.668) 18.270 8.183 ( -2.920 -5.304 4.753) 7.697 8.471 ( -1.737 3.335 -3.354) 5.039 8.818 ( -3.733 -0.835 6.420) 7.473 9.103 ( -14.485 -0.175 26.613) 30.300 9.325 ( -0.667 1.790 21.461) 21.546 9.449 ( 4.828 1.852 7.031) 8.728 9.781 ( 4.063 -0.284 1.765) 4.438 10.340 ( -4.219 6.964 2.940) 8.657 10.463 ( 7.653 2.422 -9.168) 12.186 10.792 ( 4.970 0.919 -21.101) 21.698 10.957 ( 5.993 4.787 -25.146) 26.289 11.144 ( 4.387 -5.325 -11.302) 13.242 11.419 ( -5.076 -9.809 -0.146) 11.046 11.930 ( 1.649 2.683 2.343) 3.925 12.080 ( -3.659 3.576 -4.308) 6.688 12.394 ( -5.580 -2.327 -8.966) 10.814 12.995 ( 7.064 0.650 7.240) 10.136 13.258 ( 6.373 -3.059 0.989) 7.139 13.752 ( -0.782 -3.446 -15.877) 16.265 14.772 ( -2.803 1.600 -2.394) 4.019 15.485 ( 0.051 -1.663 16.161) 16.246 15.949 ( -8.018 2.071 15.199) 17.308 16.120 ( 1.873 3.869 -3.195) 5.356 16.256 ( -0.833 -7.173 2.997) 7.818 18.237 ( -1.625 2.349 9.501) 9.921 18.592 ( -0.146 5.264 11.277) 12.446 19.224 ( 6.297 4.660 -21.912) 23.270 19.357 ( 3.642 -8.577 -21.053) 23.023 26.089 ( -4.581 2.760 3.007) 6.135 26.302 ( 3.319 3.822 3.759) 6.305 26.534 ( -1.432 -0.368 1.256) 1.940 27.204 ( 7.025 -4.302 0.916) 8.288 28.310 ( -4.515 2.488 14.725) 15.602 28.529 ( -1.415 -4.240 -3.104) 5.442 28.661 ( -5.655 0.422 -4.703) 7.367 28.832 ( -0.400 0.867 -2.468) 2.646 28.998 ( -0.976 -7.660 8.833) 11.732 29.338 ( 0.513 5.084 -2.607) 5.736 29.567 ( 1.118 -7.718 -1.116) 7.878 29.943 ( 4.231 10.161 -12.406) 16.585 ======================= Grid point 264 (135/186) ======================= q-point: (-0.38 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( -3.890 3.625 2.602) 5.920 1.818 ( 0.691 -5.728 1.261) 5.906 2.090 ( -6.622 4.435 8.529) 11.673 2.301 ( 0.215 -0.226 1.320) 1.357 2.825 ( -2.688 7.017 2.731) 7.995 3.043 ( 0.280 1.104 4.909) 5.040 3.669 ( -9.034 3.902 11.562) 15.183 4.081 ( -10.819 11.387 15.502) 22.068 4.873 ( -8.789 -2.459 -7.817) 12.017 5.268 ( 7.393 -8.485 4.620) 12.166 5.406 ( 13.496 -3.539 -5.935) 15.162 5.768 ( 3.386 4.076 -8.694) 10.181 5.983 ( -2.977 -1.141 -2.590) 4.108 6.236 ( 2.010 0.672 0.394) 2.156 6.582 ( -0.261 -2.151 -3.404) 4.035 6.897 ( 3.274 -2.228 2.215) 4.537 7.346 ( 0.162 -3.249 -3.121) 4.508 7.447 ( -2.677 -1.057 0.862) 3.004 7.723 ( -3.759 6.887 12.334) 14.618 7.905 ( -4.959 -0.627 12.534) 13.494 8.206 ( -2.535 -1.185 2.549) 3.785 8.381 ( -0.099 5.893 -0.308) 5.902 8.783 ( -10.684 -2.839 4.691) 12.009 9.053 ( -4.380 1.330 25.358) 25.768 9.361 ( -7.607 0.116 28.429) 29.429 9.466 ( 3.837 4.724 11.637) 13.133 9.902 ( 5.051 -6.116 -2.538) 8.329 10.189 ( -3.047 9.435 6.703) 11.968 10.466 ( 3.435 2.898 -8.418) 9.543 10.799 ( 7.241 -2.352 -25.364) 26.482 10.877 ( 4.993 4.836 -21.579) 22.671 11.224 ( 2.245 -5.726 -10.643) 12.292 11.479 ( -2.590 -6.026 -2.095) 6.886 11.881 ( -3.869 1.549 -9.667) 10.527 12.011 ( 3.471 5.693 6.098) 9.035 12.277 ( -8.846 1.677 -5.529) 10.565 12.946 ( -3.568 7.094 -2.889) 8.450 13.344 ( 3.105 -0.008 -4.201) 5.224 13.947 ( 15.776 -14.900 -9.920) 23.860 14.755 ( -1.332 -3.442 0.388) 3.711 15.589 ( 0.768 -4.214 14.053) 14.692 15.885 ( -5.972 1.513 14.631) 15.875 16.048 ( -3.072 3.279 -0.777) 4.560 16.397 ( 3.989 -7.658 1.554) 8.774 18.231 ( -2.357 -0.340 10.635) 10.898 18.597 ( 4.180 3.467 11.124) 12.379 19.144 ( 5.397 5.917 -22.093) 23.500 19.456 ( 5.345 -7.550 -20.997) 22.945 25.998 ( -5.377 3.449 6.181) 8.889 26.296 ( 2.691 4.656 5.063) 7.386 26.515 ( -1.960 0.284 -0.337) 2.009 27.246 ( -4.712 -0.098 -5.423) 7.185 28.250 ( -6.433 3.232 14.120) 15.849 28.518 ( -5.776 -4.008 -1.277) 7.145 28.630 ( 2.669 0.956 -1.797) 3.356 28.811 ( 1.314 1.561 -2.556) 3.271 29.104 ( -2.344 -4.819 7.157) 8.941 29.218 ( -1.727 5.774 -4.801) 7.705 29.764 ( 7.141 -9.768 -0.233) 12.102 29.858 ( 5.773 4.467 -8.574) 11.260 ======================= Grid point 265 (136/186) ======================= q-point: (-0.25 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( -5.302 5.352 3.329) 8.237 1.922 ( -7.978 -4.618 2.243) 9.487 2.011 ( 1.541 -1.429 12.012) 12.195 2.321 ( 1.950 -0.197 1.351) 2.380 2.684 ( -2.555 8.757 1.334) 9.219 3.020 ( -3.381 1.660 3.101) 4.879 3.496 ( -14.710 3.889 17.169) 22.941 3.920 ( -0.311 10.811 15.586) 18.970 4.756 ( -11.235 -5.110 -12.551) 17.603 5.436 ( 5.065 1.359 -3.595) 6.358 5.525 ( 5.709 0.521 -10.617) 12.066 5.742 ( 6.598 0.563 0.782) 6.668 5.969 ( -3.871 -4.680 -1.953) 6.380 6.240 ( 0.573 1.363 -1.994) 2.482 6.644 ( 0.084 -5.963 5.843) 8.349 7.032 ( 2.909 -9.557 0.629) 10.009 7.356 ( -0.842 1.079 0.604) 1.496 7.449 ( -0.325 -3.301 -2.881) 4.393 7.597 ( -2.820 11.057 12.426) 16.870 7.850 ( -4.729 4.224 4.762) 7.930 8.183 ( 0.362 2.143 0.316) 2.196 8.337 ( 0.918 2.599 5.330) 6.001 8.662 ( -12.211 1.296 8.117) 14.719 9.126 ( 0.148 -3.120 18.763) 19.022 9.338 ( -10.106 0.891 32.691) 34.230 9.507 ( 2.521 4.166 16.002) 16.726 9.955 ( -7.942 -2.810 2.693) 8.844 10.108 ( -0.132 2.418 8.494) 8.833 10.459 ( 7.484 1.722 -8.382) 11.368 10.787 ( 3.896 5.744 -20.373) 21.522 10.865 ( 10.658 -3.112 -26.982) 29.177 11.281 ( 1.189 -5.014 -11.811) 12.886 11.495 ( -1.533 -1.646 -4.990) 5.474 11.732 ( -5.711 4.667 -16.952) 18.487 12.029 ( 7.016 5.066 7.517) 11.463 12.146 ( -6.393 0.322 1.158) 6.505 12.776 ( -5.858 5.173 -8.607) 11.625 13.309 ( 0.801 2.149 -17.241) 17.393 14.378 ( 19.676 -15.618 -2.240) 25.221 14.818 ( -0.550 -5.817 1.784) 6.109 15.682 ( -3.570 -4.888 9.368) 11.153 15.860 ( -3.784 1.233 11.093) 11.785 15.969 ( -2.293 3.363 9.182) 10.044 16.547 ( 3.195 -6.547 -1.394) 7.417 18.264 ( -3.636 -3.715 12.820) 13.834 18.667 ( 6.795 1.898 8.978) 11.419 19.059 ( 6.872 6.206 -21.427) 23.342 19.540 ( 4.830 -5.701 -21.008) 22.297 25.916 ( -4.149 3.170 8.849) 10.275 26.281 ( 2.439 4.995 6.891) 8.853 26.474 ( -2.935 0.628 -2.356) 3.816 27.069 ( -13.716 2.739 -11.158) 17.893 28.176 ( -6.271 2.751 15.251) 16.718 28.537 ( 0.205 -3.482 1.016) 3.633 28.641 ( 0.816 0.355 -0.420) 0.984 28.803 ( 2.773 2.447 -1.235) 3.900 29.049 ( -2.874 5.238 -2.811) 6.603 29.190 ( -0.661 -2.074 -2.157) 3.064 29.846 ( 3.292 0.628 2.609) 4.247 30.033 ( 10.378 -9.773 -5.331) 15.220 ======================= Grid point 266 (137/186) ======================= q-point: (-0.12 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( -0.150 3.521 5.672) 6.677 1.778 ( -14.069 1.594 5.796) 15.299 2.184 ( 1.134 -8.517 8.540) 12.114 2.359 ( 4.003 1.217 1.942) 4.612 2.565 ( 2.676 6.914 -1.876) 7.648 2.930 ( -8.123 1.190 -1.865) 8.419 3.402 ( -4.386 0.873 24.090) 24.501 3.853 ( 0.792 8.121 17.267) 19.098 4.653 ( -8.297 -4.352 -14.981) 17.669 5.305 ( -0.997 5.425 -24.899) 25.502 5.615 ( 6.645 -0.921 1.537) 6.883 5.807 ( -0.250 0.332 6.000) 6.014 5.991 ( -5.940 -4.468 2.473) 7.833 6.228 ( 3.596 0.935 -4.019) 5.474 6.765 ( 0.117 -6.668 9.260) 11.412 7.194 ( -0.271 -10.186 0.788) 10.220 7.332 ( -1.316 0.913 3.979) 4.289 7.453 ( -3.003 5.999 7.329) 9.936 7.469 ( 1.889 5.370 -1.371) 5.855 7.747 ( -1.261 4.045 0.508) 4.267 8.186 ( 3.526 0.765 0.051) 3.609 8.321 ( -5.629 0.583 4.040) 6.953 8.563 ( -2.160 2.463 13.017) 13.423 9.229 ( -0.075 -4.176 5.154) 6.634 9.318 ( -11.336 0.342 37.708) 39.377 9.495 ( -5.454 4.959 24.661) 25.739 9.893 ( -4.182 0.044 7.231) 8.353 10.150 ( -2.919 -6.446 11.198) 13.246 10.501 ( 4.707 5.198 -9.172) 11.546 10.695 ( 6.159 3.232 -16.548) 17.950 10.962 ( 14.346 -2.040 -29.422) 32.797 11.306 ( 0.919 -3.057 -14.456) 14.805 11.455 ( -3.154 1.059 -2.643) 4.249 11.532 ( -1.508 4.185 -26.338) 26.711 12.105 ( 6.595 1.705 6.778) 9.610 12.113 ( 0.353 0.210 6.135) 6.149 12.611 ( -5.929 2.805 -10.987) 12.796 13.212 ( -0.721 1.432 -22.709) 22.765 14.779 ( 11.343 -11.197 -0.054) 15.939 14.890 ( 3.360 -2.948 -0.723) 4.528 15.694 ( -7.953 -2.784 9.357) 12.592 15.785 ( -5.393 2.250 3.886) 7.018 16.010 ( 2.579 0.533 19.087) 19.268 16.619 ( -1.009 -2.821 -4.177) 5.140 18.310 ( -5.076 -3.364 13.543) 14.850 18.769 ( 6.207 -0.760 6.912) 9.321 19.008 ( 8.182 4.673 -19.796) 21.924 19.578 ( 3.076 -2.893 -21.027) 21.447 25.885 ( -0.318 1.666 10.661) 10.795 26.275 ( 2.110 3.675 8.612) 9.598 26.410 ( -3.719 0.509 -5.094) 6.328 26.821 ( -11.785 2.250 -11.867) 16.875 28.129 ( -4.929 1.745 16.166) 16.991 28.590 ( 0.006 -2.775 -3.951) 4.828 28.644 ( 0.799 0.734 4.711) 4.835 28.811 ( 3.941 1.963 1.123) 4.544 28.945 ( -2.569 2.991 -3.049) 4.984 29.187 ( -0.067 -0.568 -6.581) 6.606 29.895 ( 0.579 -0.941 7.129) 7.214 30.248 ( 9.512 -5.941 -7.903) 13.720 ======================= Grid point 268 (138/186) ======================= q-point: ( 0.12 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.515 ( 2.297 0.000 0.578) 2.368 1.748 ( 11.412 0.000 8.219) 14.064 2.236 ( -1.504 -0.000 6.831) 6.995 2.500 ( -5.282 -0.000 -7.401) 9.092 2.538 ( 5.060 0.000 -4.264) 6.617 2.801 ( 8.151 0.000 8.581) 11.835 3.870 ( -0.679 -0.000 8.706) 8.733 4.118 ( 21.255 0.000 22.516) 30.963 4.652 ( 9.398 0.000 -1.563) 9.527 4.852 ( -4.349 -0.000 -31.265) 31.566 5.427 ( -14.716 -0.000 2.168) 14.875 5.866 ( -6.821 -0.000 6.024) 9.100 5.939 ( 5.842 0.000 3.612) 6.868 6.279 ( 1.434 0.000 -4.281) 4.515 6.932 ( -3.215 -0.000 17.432) 17.726 7.211 ( -4.189 -0.000 3.853) 5.691 7.248 ( 1.824 0.000 -10.602) 10.758 7.387 ( -2.774 -0.000 9.879) 10.261 7.460 ( -1.590 -0.000 8.851) 8.993 7.762 ( 1.196 0.000 -2.365) 2.650 8.006 ( -6.746 -0.000 0.726) 6.785 8.431 ( 7.114 0.000 -0.976) 7.181 8.830 ( 0.126 0.000 15.246) 15.247 9.104 ( 2.441 0.000 -15.436) 15.628 9.179 ( -16.755 -0.000 41.634) 44.879 9.502 ( -2.435 -0.000 29.864) 29.963 10.106 ( -3.334 -0.000 -14.166) 14.554 10.157 ( -1.397 -0.000 7.212) 7.345 10.450 ( 13.418 0.000 16.186) 21.024 10.830 ( 1.691 0.000 -17.036) 17.119 11.101 ( 3.473 0.000 -25.169) 25.408 11.137 ( 7.927 0.000 -35.240) 36.121 11.198 ( -4.253 -0.000 1.060) 4.383 11.883 ( 22.844 0.000 -3.623) 23.129 12.118 ( -1.560 -0.000 4.052) 4.342 12.252 ( -2.796 -0.000 -11.873) 12.198 12.654 ( 12.290 0.000 4.867) 13.219 12.867 ( -2.434 -0.000 -21.766) 21.901 14.460 ( -18.624 -0.000 3.117) 18.884 15.080 ( -5.478 -0.000 -3.582) 6.545 15.555 ( -2.649 -0.000 10.542) 10.870 15.932 ( 4.701 0.000 6.124) 7.720 16.168 ( -5.014 -0.000 18.662) 19.323 16.298 ( -10.378 -0.000 0.307) 10.383 18.320 ( -1.591 -0.000 7.215) 7.389 18.879 ( -4.839 -0.000 13.027) 13.897 19.085 ( 7.471 0.000 -18.440) 19.896 19.368 ( -1.285 -0.000 -25.408) 25.441 26.244 ( -0.063 -0.000 -9.373) 9.374 26.252 ( 7.944 0.000 8.204) 11.419 26.452 ( 8.403 0.000 14.451) 16.717 26.605 ( 4.248 0.000 -9.428) 10.340 28.179 ( -0.392 -0.000 13.229) 13.235 28.515 ( -0.638 -0.000 -2.831) 2.902 28.704 ( -3.033 -0.000 11.229) 11.631 28.793 ( -2.716 -0.000 -4.354) 5.132 28.986 ( 2.219 0.000 6.423) 6.796 29.095 ( 1.364 0.000 -16.634) 16.689 29.815 ( -9.748 -0.000 10.485) 14.317 30.390 ( 3.515 0.000 -17.285) 17.638 ======================= Grid point 269 (139/186) ======================= q-point: ( 0.25 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 6.956 -1.519 -0.660) 7.150 1.862 ( 6.192 4.847 6.517) 10.213 2.242 ( -0.941 -0.424 3.615) 3.759 2.421 ( 1.692 3.743 -4.613) 6.177 2.638 ( 4.887 -6.317 -2.502) 8.370 2.932 ( 6.071 -0.776 9.449) 11.258 3.911 ( 4.778 1.918 10.167) 11.396 4.477 ( 18.716 -1.256 12.926) 22.780 4.661 ( -2.145 2.024 -13.550) 13.867 4.816 ( 4.054 -7.244 -4.917) 9.648 5.234 ( -8.713 5.744 1.476) 10.540 5.781 ( -7.092 1.085 2.753) 7.685 6.014 ( 1.027 -2.858 -3.433) 4.584 6.282 ( 2.580 1.612 -1.119) 3.241 6.874 ( -6.262 6.358 16.215) 18.509 7.179 ( 1.849 4.282 -10.273) 11.282 7.238 ( -1.718 -3.941 7.020) 8.232 7.392 ( -2.572 0.791 3.938) 4.769 7.518 ( -1.788 -5.699 9.459) 11.188 7.779 ( 1.306 -1.672 1.253) 2.464 7.968 ( -2.991 -3.105 2.567) 5.018 8.494 ( 3.024 -0.650 -3.951) 5.018 8.858 ( -3.801 -0.076 13.796) 14.310 9.084 ( -13.405 0.203 28.214) 31.237 9.179 ( 3.691 -5.145 -0.101) 6.332 9.539 ( -0.560 5.322 22.712) 23.334 9.966 ( -0.113 6.860 -0.722) 6.899 10.250 ( -2.559 -9.716 -1.531) 10.164 10.599 ( 10.140 8.814 2.961) 13.758 10.868 ( 6.180 -8.551 -8.951) 13.836 11.011 ( 0.916 3.609 -21.581) 21.900 11.105 ( 6.714 1.341 -32.063) 32.786 11.183 ( -2.415 -1.618 1.005) 3.076 12.049 ( 5.617 5.126 0.053) 7.605 12.181 ( -0.475 -0.203 5.269) 5.295 12.232 ( 12.180 -5.824 -16.909) 21.638 12.766 ( 3.534 0.396 -4.814) 5.985 12.875 ( 8.795 -6.547 -7.317) 13.181 14.189 ( -18.431 5.948 1.059) 19.396 14.964 ( -8.856 1.557 -2.353) 9.295 15.539 ( -1.495 4.442 12.004) 12.887 15.967 ( -6.434 -4.417 8.002) 11.178 16.144 ( -6.440 1.722 17.279) 18.521 16.241 ( 1.235 0.938 -0.835) 1.761 18.307 ( -3.225 0.774 5.235) 6.197 18.836 ( -4.291 4.207 14.180) 15.401 19.108 ( 1.929 -3.511 -18.358) 18.790 19.292 ( 4.029 -0.591 -26.892) 27.199 26.204 ( -0.462 1.692 -5.704) 5.968 26.326 ( 1.043 -1.328 3.954) 4.299 26.569 ( 7.504 5.206 2.067) 9.364 26.770 ( 14.399 -7.818 5.568) 17.305 28.239 ( 0.180 -2.596 11.214) 11.511 28.497 ( -1.168 0.528 -0.525) 1.385 28.715 ( -3.102 -1.770 11.826) 12.353 28.744 ( -3.944 -0.486 -3.527) 5.313 28.978 ( 0.485 3.821 -3.610) 5.279 29.121 ( 3.043 -5.992 -8.222) 10.619 29.705 ( -10.722 2.201 9.805) 14.695 30.331 ( 2.945 4.925 -19.257) 20.094 ======================= Grid point 270 (140/186) ======================= q-point: ( 0.38 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( 7.044 0.242 -0.949) 7.111 1.831 ( 2.219 7.688 3.695) 8.814 2.241 ( -1.636 0.095 1.445) 2.185 2.392 ( 4.126 5.166 -0.624) 6.641 2.798 ( 4.529 -7.874 -0.774) 9.117 3.019 ( 1.991 0.237 7.427) 7.693 3.959 ( 4.673 7.189 9.577) 12.854 4.490 ( -7.489 3.850 8.476) 11.948 4.715 ( 4.701 -5.180 -12.948) 14.717 5.021 ( 5.483 -9.078 9.034) 13.931 5.129 ( 6.724 6.351 0.724) 9.277 5.703 ( -2.165 0.053 -2.461) 3.278 6.014 ( -1.988 -1.220 -6.268) 6.688 6.288 ( 1.155 1.179 -0.339) 1.685 6.750 ( -6.247 6.214 9.306) 12.816 7.101 ( 2.856 6.196 -11.691) 13.536 7.297 ( 0.985 0.954 5.433) 5.603 7.350 ( -3.355 -2.391 3.421) 5.355 7.616 ( -1.337 -6.011 11.904) 13.403 7.852 ( 0.374 -3.631 8.499) 9.250 8.023 ( -0.284 -4.959 4.737) 6.864 8.498 ( -0.640 -0.524 -5.121) 5.188 8.805 ( -11.291 -0.610 5.562) 12.602 9.033 ( -14.243 -2.674 39.411) 41.991 9.339 ( 10.618 -4.058 -5.106) 12.461 9.524 ( 2.200 6.846 15.952) 17.497 9.902 ( 1.410 6.134 6.244) 8.865 10.334 ( -1.904 -7.173 -1.346) 7.542 10.558 ( 4.150 5.451 -10.560) 12.588 10.870 ( -0.239 3.048 -24.900) 25.087 11.036 ( 4.772 0.776 -28.294) 28.704 11.093 ( 9.461 0.601 1.029) 9.536 11.190 ( -1.153 -5.403 3.325) 6.448 12.015 ( -0.298 3.195 -1.330) 3.474 12.157 ( -1.409 0.117 -2.555) 2.920 12.369 ( 8.704 2.828 -8.855) 12.735 12.894 ( 10.277 -6.601 6.705) 13.933 13.075 ( 10.019 -8.121 -9.131) 15.802 13.868 ( -15.314 8.282 -3.623) 17.783 14.818 ( -9.606 1.267 -1.912) 9.876 15.502 ( -1.707 3.444 14.225) 14.735 15.971 ( -8.731 -4.499 10.877) 14.655 16.104 ( -6.402 -1.097 11.874) 13.535 16.248 ( 6.811 4.925 -2.786) 8.854 18.255 ( -6.297 0.254 4.782) 7.911 18.773 ( -1.731 6.096 14.590) 15.907 19.113 ( -1.689 -7.814 -22.522) 23.899 19.295 ( 9.198 0.445 -23.382) 25.130 26.147 ( -2.367 2.352 -0.577) 3.387 26.361 ( 0.356 -1.525 0.166) 1.574 26.579 ( 4.846 4.619 0.722) 6.734 27.073 ( 13.662 -4.961 6.815) 16.054 28.318 ( -0.367 -2.916 10.641) 11.040 28.457 ( -4.722 0.401 1.342) 4.926 28.683 ( -2.629 0.717 -2.756) 3.876 28.769 ( -2.362 -4.722 12.187) 13.282 28.921 ( 1.284 2.531 -7.147) 7.690 29.244 ( 4.457 -8.101 -4.576) 10.317 29.565 ( -9.490 3.757 7.249) 12.519 30.209 ( 2.891 7.973 -19.494) 21.259 ======================= Grid point 271 (141/186) ======================= q-point: (-0.50 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 3.299 5.367 1.878) 6.573 1.791 ( 3.534 3.736 0.905) 5.222 2.196 ( -3.676 2.717 2.520) 5.220 2.373 ( 4.062 5.107 1.099) 6.618 2.920 ( 1.372 -3.001 -0.439) 3.329 3.022 ( -3.051 0.328 4.415) 5.376 3.875 ( -2.982 10.449 9.154) 14.208 4.344 ( -8.498 7.204 14.496) 18.282 4.833 ( 1.827 -6.244 -11.204) 12.956 5.053 ( -0.361 -0.362 9.716) 9.729 5.309 ( 15.036 -3.477 -3.664) 15.862 5.747 ( 4.845 -3.968 -4.570) 7.753 5.978 ( -1.983 0.017 -4.073) 4.530 6.257 ( -3.682 0.466 -1.962) 4.198 6.635 ( -0.322 5.435 -1.436) 5.630 6.997 ( 0.491 6.777 -7.153) 9.866 7.283 ( 0.522 0.975 1.536) 1.893 7.401 ( -1.230 -3.439 5.130) 6.298 7.728 ( -0.639 -4.940 14.831) 15.646 7.912 ( -2.042 -0.174 14.860) 15.001 8.100 ( -0.343 -4.313 2.625) 5.061 8.476 ( -0.334 0.593 -2.570) 2.659 8.681 ( -14.973 -4.557 5.390) 16.553 9.059 ( -8.158 -1.586 36.158) 37.101 9.435 ( 2.326 4.869 11.457) 12.664 9.552 ( 5.726 0.832 -0.588) 5.816 9.876 ( 3.852 4.614 5.703) 8.286 10.373 ( -2.154 -0.117 4.844) 5.303 10.496 ( 0.145 1.075 -15.194) 15.233 10.762 ( 1.324 -0.381 -24.634) 24.672 10.965 ( 4.238 1.989 -27.221) 27.620 11.108 ( -1.043 -0.681 -4.830) 4.988 11.358 ( 9.034 -2.992 7.581) 12.167 11.952 ( -1.229 3.396 -3.158) 4.797 12.127 ( -0.435 1.375 -1.528) 2.101 12.356 ( 3.307 5.689 -3.488) 7.448 13.107 ( 5.897 0.547 4.081) 7.192 13.268 ( 4.838 -6.009 1.709) 7.901 13.644 ( -0.759 -2.680 -14.848) 15.107 14.693 ( -8.639 -1.108 -1.172) 8.788 15.515 ( -0.890 -0.493 13.925) 13.962 15.942 ( -5.929 1.169 16.325) 17.407 16.078 ( -7.207 -2.446 2.592) 8.040 16.283 ( 8.471 1.623 -2.444) 8.964 18.190 ( -8.175 -1.765 6.445) 10.558 18.740 ( 1.491 5.669 14.466) 15.609 19.124 ( -0.953 -8.188 -26.371) 27.630 19.336 ( 10.027 0.261 -20.084) 22.449 26.077 ( -4.132 2.760 4.041) 6.405 26.379 ( 1.068 -0.562 -2.740) 2.994 26.572 ( 3.256 4.774 2.636) 6.352 27.239 ( 3.255 -0.405 0.862) 3.391 28.346 ( -3.873 3.141 12.000) 12.995 28.404 ( -4.785 -3.869 2.015) 6.475 28.660 ( 1.344 0.990 0.401) 1.717 28.844 ( 0.814 -1.258 4.775) 5.005 28.918 ( 0.399 -4.093 0.407) 4.133 29.377 ( -0.110 1.063 -2.536) 2.752 29.468 ( -0.527 -6.793 1.891) 7.071 30.065 ( 2.858 8.416 -17.516) 19.642 ======================= Grid point 272 (142/186) ======================= q-point: (-0.38 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( -0.009 7.866 3.462) 8.594 1.813 ( 4.138 0.370 0.874) 4.245 2.102 ( -4.975 4.615 6.339) 9.286 2.367 ( 4.364 3.780 0.727) 5.819 2.870 ( -4.477 5.071 1.441) 6.917 3.014 ( -3.898 -2.691 0.323) 4.747 3.686 ( -10.268 9.647 13.984) 19.851 4.234 ( 2.275 9.537 13.048) 16.322 4.709 ( -11.318 3.213 -7.686) 14.053 5.275 ( 10.355 -10.364 7.945) 16.666 5.495 ( 9.150 -2.391 -5.435) 10.907 5.810 ( 1.857 -1.506 -8.817) 9.135 5.912 ( -3.775 2.739 -5.224) 7.003 6.214 ( -2.607 -2.934 -3.847) 5.495 6.594 ( 3.212 2.773 -1.626) 4.544 6.913 ( -0.769 1.258 -2.985) 3.329 7.308 ( 1.828 -2.060 -0.594) 2.817 7.422 ( -1.433 -0.004 3.195) 3.502 7.808 ( -0.223 1.343 14.587) 14.650 7.909 ( -4.452 2.213 17.849) 18.528 8.153 ( -0.664 -3.401 3.116) 4.660 8.441 ( -0.945 2.806 -1.115) 3.164 8.617 ( -9.280 -4.742 7.551) 12.869 9.107 ( -4.863 0.034 31.019) 31.398 9.400 ( -4.896 4.318 19.615) 20.673 9.580 ( 3.124 2.108 0.904) 3.876 9.898 ( 1.716 1.241 0.789) 2.260 10.277 ( -6.919 6.081 -0.277) 9.216 10.475 ( 3.406 -1.433 -5.552) 6.669 10.760 ( 6.177 -4.153 -24.908) 25.996 10.906 ( 5.384 2.767 -23.998) 24.750 11.103 ( -1.422 -5.436 -11.347) 12.662 11.499 ( 7.986 1.714 5.502) 9.849 11.870 ( -1.087 5.105 -3.754) 6.429 12.101 ( -1.816 -0.182 -1.156) 2.161 12.287 ( 3.785 9.372 1.902) 10.285 12.994 ( -6.243 10.054 -3.244) 12.271 13.323 ( -0.006 -1.825 -10.027) 10.192 13.900 ( 15.596 -17.094 -2.984) 23.331 14.642 ( -6.192 -5.760 -0.542) 8.474 15.574 ( -1.068 -2.632 11.517) 11.862 15.916 ( -3.934 2.567 15.610) 16.301 16.016 ( -5.254 -0.350 2.817) 5.972 16.389 ( 6.801 -3.367 -2.091) 7.871 18.155 ( -7.990 -4.083 9.507) 13.073 18.750 ( 2.699 3.829 12.360) 13.218 19.126 ( 2.681 -4.046 -26.970) 27.403 19.397 ( 8.260 -2.177 -19.039) 20.867 26.002 ( -4.289 3.043 7.534) 9.187 26.385 ( 1.797 0.470 -4.233) 4.622 26.546 ( 1.882 5.604 4.075) 7.180 27.163 ( -8.984 3.814 -5.783) 11.345 28.272 ( -4.974 3.844 12.582) 14.065 28.439 ( -0.311 -3.349 3.569) 4.904 28.670 ( 1.447 1.652 3.425) 4.069 28.866 ( 3.942 2.034 -1.070) 4.563 29.017 ( -1.075 -6.992 5.016) 8.672 29.258 ( -3.394 6.173 -2.883) 7.612 29.685 ( 6.579 -13.287 -1.732) 14.927 29.947 ( 2.639 5.515 -12.576) 13.983 ======================= Grid point 273 (143/186) ======================= q-point: (-0.25 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 0.117 8.369 5.041) 9.771 1.835 ( -3.627 1.781 1.102) 4.188 2.043 ( 0.344 0.163 9.640) 9.648 2.384 ( 4.772 2.148 -0.701) 5.280 2.746 ( -3.556 5.153 0.871) 6.321 2.960 ( -7.348 0.161 -1.899) 7.591 3.508 ( -6.779 7.056 19.771) 22.060 4.199 ( 7.252 14.319 18.291) 24.335 4.521 ( -9.253 -2.495 -14.792) 17.625 5.474 ( -4.752 4.523 -13.575) 15.077 5.530 ( 4.560 -6.239 8.163) 11.241 5.816 ( -5.657 -1.333 -3.643) 6.859 5.858 ( 8.598 -1.637 -5.654) 10.420 6.218 ( -1.026 -2.355 -5.540) 6.107 6.624 ( 2.072 -1.477 5.234) 5.820 6.938 ( 0.197 -6.298 -2.990) 6.974 7.361 ( 1.211 -0.753 -1.601) 2.144 7.410 ( -0.011 -1.194 1.266) 1.740 7.765 ( -1.551 9.585 14.036) 17.067 7.874 ( -4.250 3.227 12.310) 13.417 8.199 ( 0.551 -1.010 5.489) 5.609 8.374 ( -3.671 2.507 0.078) 4.446 8.614 ( -1.619 0.016 11.108) 11.226 9.145 ( -3.799 -0.823 20.501) 20.866 9.348 ( -8.981 2.124 27.720) 29.216 9.603 ( -0.441 1.701 8.844) 9.017 9.870 ( -2.430 -0.188 0.244) 2.450 10.101 ( -8.810 2.849 -0.240) 9.262 10.568 ( 10.487 0.212 -3.224) 10.973 10.796 ( 2.271 -0.531 -19.299) 19.439 10.886 ( 11.221 -0.564 -24.750) 27.180 11.139 ( 0.399 -7.719 -18.747) 20.278 11.541 ( 4.451 5.022 1.252) 6.827 11.729 ( -3.214 8.834 -8.288) 12.532 12.086 ( -1.514 -1.073 2.526) 3.134 12.255 ( 8.888 8.233 6.071) 13.551 12.763 ( -6.550 8.141 -7.555) 12.894 13.262 ( -1.440 1.273 -20.423) 20.513 14.335 ( 10.276 -18.868 5.484) 22.174 14.696 ( -0.536 -9.520 -3.053) 10.012 15.621 ( -3.139 -2.162 10.299) 10.982 15.847 ( -6.129 2.284 4.154) 7.748 16.020 ( -0.762 -0.221 16.231) 16.250 16.505 ( 3.465 -4.415 -3.218) 6.469 18.173 ( -6.069 -5.848 12.671) 15.218 18.775 ( 1.106 1.184 7.212) 7.391 19.120 ( 6.676 0.842 -22.992) 23.957 19.461 ( 5.589 -3.871 -19.672) 20.814 25.951 ( -1.855 2.697 9.845) 10.375 26.382 ( 1.765 1.009 -5.245) 5.625 26.488 ( 0.045 6.999 5.350) 8.810 26.931 ( -11.504 5.302 -8.398) 15.199 28.212 ( -3.733 3.917 14.772) 15.731 28.500 ( 0.746 -3.406 0.562) 3.532 28.675 ( 1.017 1.970 6.040) 6.434 28.881 ( 3.570 2.626 0.604) 4.472 29.056 ( -2.599 1.597 -2.424) 3.897 29.157 ( -0.275 0.528 -4.058) 4.102 29.875 ( 0.550 -0.984 -0.944) 1.470 29.973 ( 7.687 -11.505 -7.114) 15.558 ======================= Grid point 274 (144/186) ======================= q-point: (-0.12 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( 4.788 5.363 6.729) 9.848 1.694 ( -8.725 5.307 2.962) 10.633 2.140 ( 1.585 -4.408 8.894) 10.052 2.420 ( 4.381 0.211 -2.957) 5.290 2.669 ( 1.784 4.260 1.117) 4.752 2.822 ( -9.571 2.258 -4.282) 10.725 3.503 ( 3.251 1.078 24.554) 24.791 4.111 ( 3.089 15.865 16.055) 22.782 4.477 ( 0.532 -4.960 -12.389) 13.356 5.249 ( -6.445 5.274 -25.036) 26.385 5.600 ( -8.899 -5.237 8.165) 13.164 5.804 ( 2.018 -0.141 0.183) 2.031 5.959 ( 3.796 -0.087 1.251) 3.998 6.224 ( 0.777 -2.419 -5.582) 6.133 6.717 ( 1.064 -5.226 9.107) 10.554 7.045 ( 0.119 -9.786 -2.684) 10.148 7.336 ( -1.919 1.315 2.067) 3.112 7.464 ( 1.266 -1.639 -1.309) 2.450 7.638 ( -1.475 11.135 10.146) 15.137 7.796 ( -2.850 5.369 6.732) 9.070 8.215 ( -4.544 0.978 7.555) 8.870 8.298 ( 1.152 2.706 -1.205) 3.179 8.662 ( 4.228 1.489 13.338) 14.071 9.180 ( -3.032 -2.957 7.041) 8.217 9.318 ( -10.336 0.928 36.501) 37.947 9.502 ( -12.984 3.982 14.028) 19.526 9.932 ( 6.691 -1.163 4.414) 8.100 10.028 ( -4.767 -5.704 3.873) 8.382 10.602 ( 0.604 6.813 -7.115) 9.869 10.775 ( 8.174 1.274 -9.703) 12.751 10.994 ( 12.985 -3.997 -28.192) 31.295 11.174 ( 1.459 -6.234 -25.837) 26.618 11.463 ( -6.608 6.789 2.604) 9.825 11.581 ( 8.616 6.659 -14.742) 18.328 12.106 ( 0.178 -0.001 6.828) 6.831 12.311 ( 10.195 4.685 4.199) 11.980 12.570 ( -4.104 5.750 -8.098) 10.747 13.133 ( -2.416 2.003 -24.222) 24.424 14.603 ( -8.702 -14.301 7.553) 18.366 14.895 ( 11.207 -10.638 -6.925) 16.933 15.609 ( -8.062 -0.875 10.464) 13.239 15.783 ( -0.555 1.359 4.462) 4.697 16.083 ( -0.805 -0.978 18.453) 18.496 16.544 ( -3.044 -1.957 -3.886) 5.310 18.239 ( -3.596 -5.242 13.531) 14.950 18.803 ( -0.239 -2.190 3.917) 4.494 19.104 ( 7.287 3.905 -18.420) 20.190 19.495 ( 2.637 -3.159 -20.677) 21.082 25.965 ( 3.293 1.294 11.113) 11.662 26.354 ( -1.814 0.746 -8.010) 8.246 26.409 ( 1.120 7.066 8.003) 10.734 26.727 ( -4.965 4.373 -8.361) 10.663 28.173 ( -2.601 3.524 15.386) 15.998 28.538 ( -0.566 -2.281 -2.677) 3.562 28.688 ( 0.583 1.350 8.191) 8.322 28.893 ( 2.859 1.976 2.707) 4.406 28.950 ( -2.502 4.329 -5.486) 7.423 29.159 ( 1.267 -0.600 -7.708) 7.835 29.881 ( -2.914 -1.941 4.600) 5.781 30.204 ( 6.800 -10.757 -9.276) 15.748 ======================= Grid point 277 (145/186) ======================= q-point: ( 0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( 10.792 0.000 -1.075) 10.846 1.985 ( 3.172 0.000 4.547) 5.544 2.245 ( 0.505 0.000 2.106) 2.166 2.481 ( 4.491 0.000 -1.762) 4.824 2.639 ( 5.154 0.000 -3.152) 6.042 3.013 ( 2.567 0.000 8.003) 8.405 4.051 ( 9.620 0.000 12.556) 15.818 4.568 ( -1.558 -0.000 -25.759) 25.806 4.715 ( -12.529 -0.000 10.127) 16.110 4.799 ( 20.678 0.000 15.066) 25.584 5.253 ( 5.863 0.000 -4.150) 7.183 5.705 ( -6.890 -0.000 1.315) 7.014 5.971 ( -2.194 -0.000 -5.206) 5.649 6.316 ( 0.740 0.000 -1.167) 1.382 6.882 ( -10.823 -0.000 21.767) 24.309 7.137 ( -0.562 -0.000 -3.542) 3.587 7.268 ( 3.567 0.000 -5.938) 6.927 7.382 ( -0.868 -0.000 6.277) 6.337 7.535 ( 2.310 0.000 11.064) 11.302 7.782 ( 1.295 0.000 -0.448) 1.371 7.951 ( 2.057 0.000 4.193) 4.670 8.483 ( -0.335 -0.000 -8.269) 8.275 8.789 ( -14.607 -0.000 4.748) 15.360 8.999 ( -15.770 -0.000 43.002) 45.802 9.269 ( 16.004 0.000 -5.638) 16.968 9.650 ( -0.185 -0.000 19.587) 19.588 10.006 ( 1.830 0.000 -10.871) 11.024 10.177 ( -0.759 -0.000 12.069) 12.093 10.670 ( -1.973 -0.000 -21.554) 21.644 10.919 ( -4.716 -0.000 -24.775) 25.220 10.983 ( 17.763 0.000 18.147) 25.394 11.078 ( 4.510 0.000 -29.550) 29.892 11.183 ( -0.096 -0.000 2.591) 2.593 12.068 ( -2.098 -0.000 -1.414) 2.530 12.133 ( -0.546 -0.000 -9.225) 9.241 12.478 ( 25.211 0.000 -1.060) 25.233 12.738 ( 0.459 0.000 -8.436) 8.448 12.955 ( 10.035 0.000 -1.174) 10.104 14.007 ( -17.049 -0.000 -0.905) 17.073 14.834 ( -12.079 -0.000 -0.596) 12.094 15.625 ( 2.090 0.000 10.019) 10.235 15.801 ( -13.338 -0.000 9.820) 16.563 16.123 ( -8.375 -0.000 18.323) 20.147 16.328 ( 7.981 0.000 -2.146) 8.264 18.265 ( -6.593 -0.000 3.259) 7.355 18.867 ( -3.686 -0.000 15.782) 16.207 18.986 ( -3.720 -0.000 -23.081) 23.379 19.293 ( 9.888 0.000 -25.107) 26.984 26.209 ( 2.206 0.000 -8.200) 8.492 26.296 ( -4.959 -0.000 7.554) 9.036 26.680 ( 5.846 0.000 -8.266) 10.125 26.980 ( 18.485 0.000 16.029) 24.467 28.258 ( 0.273 0.000 8.910) 8.914 28.476 ( -3.430 -0.000 0.336) 3.446 28.692 ( -5.042 -0.000 14.175) 15.045 28.701 ( -0.986 -0.000 -1.604) 1.883 29.023 ( 4.204 0.000 -21.862) 22.263 29.064 ( 0.456 0.000 8.742) 8.753 29.622 ( -10.414 -0.000 9.931) 14.390 30.325 ( 2.389 0.000 -21.998) 22.127 ======================= Grid point 278 (146/186) ======================= q-point: ( 0.38 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( 10.440 1.895 -0.749) 10.637 1.976 ( 2.463 6.407 1.900) 7.122 2.250 ( 0.025 1.361 2.024) 2.439 2.511 ( 4.673 3.586 -0.342) 5.900 2.741 ( 3.943 -6.359 -2.090) 7.769 3.040 ( -2.130 -0.048 4.170) 4.683 4.165 ( 4.833 8.745 10.712) 14.648 4.479 ( -5.005 1.976 8.019) 9.657 4.593 ( -5.119 -6.574 -10.224) 13.189 5.086 ( 11.168 -1.552 8.950) 14.395 5.318 ( 10.971 3.993 -2.819) 12.010 5.649 ( -2.217 -2.162 -2.935) 4.267 5.936 ( -2.466 -2.644 -6.422) 7.370 6.275 ( -5.446 1.007 -1.265) 5.681 6.797 ( -5.559 4.755 15.576) 17.208 7.133 ( 0.892 0.788 -8.842) 8.921 7.296 ( 3.596 -0.471 2.395) 4.346 7.392 ( 0.774 3.116 2.798) 4.259 7.607 ( 1.559 -1.591 12.382) 12.581 7.835 ( 1.503 -4.548 3.634) 6.012 8.031 ( 5.466 -0.864 5.996) 8.159 8.444 ( -2.451 -1.229 -6.756) 7.291 8.574 ( -21.141 -2.835 3.681) 21.645 9.007 ( -8.525 -1.279 39.048) 39.988 9.474 ( 16.699 -0.498 -4.377) 17.270 9.661 ( -1.477 4.910 13.515) 14.455 9.998 ( 2.784 1.793 -0.903) 3.433 10.240 ( -1.111 -4.387 7.520) 8.777 10.555 ( -3.035 1.614 -19.534) 19.834 10.759 ( -5.121 0.033 -24.638) 25.165 11.015 ( 3.763 1.495 -27.354) 27.652 11.156 ( -3.236 1.919 2.253) 4.385 11.287 ( 16.310 -1.909 17.166) 23.756 12.034 ( -0.371 1.908 -1.858) 2.689 12.113 ( 0.207 -1.061 -7.506) 7.583 12.593 ( 9.049 10.889 -2.072) 14.309 12.933 ( 15.360 -11.977 2.425) 19.628 13.080 ( 7.874 -3.261 -6.259) 10.574 13.766 ( -13.571 5.263 -4.270) 15.169 14.675 ( -12.908 -0.399 -0.316) 12.918 15.589 ( -2.245 6.088 11.459) 13.168 15.813 ( -3.928 -8.844 7.940) 12.518 16.067 ( -8.861 1.218 17.231) 19.414 16.390 ( 7.176 3.254 -3.676) 8.694 18.169 ( -9.816 0.175 3.564) 10.445 18.856 ( -1.937 2.084 9.772) 10.177 18.904 ( -2.820 -5.278 -21.121) 21.952 19.342 ( 10.531 -0.096 -22.636) 24.966 26.169 ( -1.378 4.061 -0.050) 4.289 26.297 ( -2.458 -4.382 0.510) 5.051 26.702 ( 5.427 3.206 -4.168) 7.557 27.226 ( 9.917 -0.405 9.994) 14.085 28.304 ( -0.144 -2.199 7.110) 7.444 28.418 ( -4.183 1.255 3.558) 5.633 28.674 ( -3.091 -0.159 9.770) 10.249 28.732 ( 0.662 -2.372 6.130) 6.606 28.970 ( 4.394 3.926 -13.219) 14.473 29.169 ( 2.914 -7.393 0.270) 7.951 29.518 ( -8.694 2.003 8.007) 11.988 30.246 ( 1.767 3.822 -22.900) 23.284 ======================= Grid point 279 (147/186) ======================= q-point: (-0.50 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( 5.479 6.701 2.091) 8.904 1.933 ( 5.870 6.751 0.173) 8.948 2.217 ( -1.482 3.361 2.486) 4.435 2.502 ( 4.003 5.142 0.463) 6.533 2.858 ( 1.045 -6.357 -2.080) 6.770 2.982 ( -6.937 1.374 0.252) 7.077 3.996 ( -9.202 12.468 11.542) 19.322 4.401 ( -2.218 3.869 5.049) 6.737 4.749 ( 5.179 -7.747 0.311) 9.324 5.123 ( 2.215 4.444 7.170) 8.721 5.444 ( 11.478 -0.695 -3.142) 11.921 5.687 ( 0.041 -5.335 -5.859) 7.924 5.945 ( 1.233 -2.882 -6.433) 7.156 6.155 ( -10.469 0.258 -2.187) 10.698 6.739 ( 2.171 5.851 4.279) 7.567 7.043 ( -1.826 6.601 -9.857) 12.003 7.341 ( 0.918 3.413 3.914) 5.273 7.385 ( 2.611 -1.349 5.507) 6.243 7.709 ( -0.487 -4.879 15.335) 16.099 7.939 ( 1.452 -2.760 10.321) 10.782 8.105 ( 3.968 0.872 -0.366) 4.079 8.414 ( -15.377 -7.158 7.766) 18.654 8.454 ( 0.419 -2.954 -1.285) 3.249 9.070 ( -5.961 -2.047 35.271) 35.829 9.576 ( -4.754 7.039 10.949) 13.858 9.622 ( 9.511 1.231 -8.658) 12.921 10.009 ( 2.957 4.481 7.053) 8.864 10.316 ( -2.740 -5.394 4.952) 7.818 10.401 ( -5.581 0.324 -19.173) 19.971 10.669 ( 1.822 -2.085 -22.971) 23.138 10.955 ( 5.046 1.482 -25.581) 26.116 11.078 ( -4.790 1.768 -0.482) 5.128 11.544 ( 13.855 1.150 16.462) 21.547 11.992 ( 0.469 3.379 -0.914) 3.532 12.097 ( -0.533 -0.073 -6.927) 6.948 12.544 ( 5.780 9.093 2.809) 11.134 13.168 ( 4.166 -1.079 -5.964) 7.355 13.246 ( 3.106 -4.562 1.522) 5.725 13.583 ( 3.373 -1.567 -7.823) 8.662 14.534 ( -11.582 -2.340 -1.557) 11.918 15.559 ( -0.244 1.922 11.663) 11.823 15.910 ( -2.104 -5.983 7.056) 9.487 15.994 ( -8.265 1.768 15.085) 17.292 16.408 ( 6.630 3.619 -5.165) 9.150 18.063 ( -10.944 -2.059 6.323) 12.806 18.848 ( -2.073 2.814 14.041) 14.469 18.902 ( 1.433 -9.212 -28.575) 30.058 19.395 ( 9.920 0.318 -20.650) 22.912 26.089 ( -4.281 3.452 5.940) 8.095 26.334 ( 0.475 -3.431 -4.569) 5.733 26.705 ( 4.936 4.781 0.223) 6.875 27.262 ( -4.506 3.040 1.627) 5.674 28.340 ( -1.328 -0.666 4.550) 4.787 28.390 ( -0.693 1.518 9.784) 9.925 28.707 ( 1.405 -0.817 9.724) 9.859 28.804 ( -0.216 -4.174 7.740) 8.797 28.949 ( 5.794 2.466 -9.630) 11.506 29.327 ( 3.563 -8.725 -3.265) 9.974 29.415 ( -5.367 1.812 6.092) 8.319 30.117 ( 0.820 5.619 -21.585) 22.319 ======================= Grid point 280 (148/186) ======================= q-point: (-0.38 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.807 ( 1.132 9.456 4.610) 10.580 1.925 ( 5.896 5.869 -0.671) 8.346 2.147 ( -1.788 5.136 5.396) 7.661 2.486 ( 4.386 4.662 -0.776) 6.448 2.849 ( -8.558 2.214 -1.439) 8.957 2.912 ( -2.602 -3.578 -2.211) 4.945 3.756 ( -10.055 10.456 16.983) 22.335 4.371 ( 2.532 1.379 -3.878) 4.833 4.731 ( -0.810 12.207 8.929) 15.146 5.279 ( 6.674 -9.825 9.006) 14.906 5.529 ( 1.505 0.468 -2.975) 3.367 5.709 ( -3.444 -4.141 -6.021) 8.079 5.936 ( 0.790 3.560 -9.904) 10.554 6.078 ( -4.188 -7.263 -5.593) 10.078 6.707 ( 4.497 6.223 -1.245) 7.778 6.889 ( -4.622 3.121 -5.964) 8.165 7.340 ( 2.813 1.569 2.269) 3.940 7.436 ( 1.629 0.809 2.378) 2.994 7.822 ( -2.976 -5.154 19.982) 20.849 7.971 ( -3.026 3.752 17.078) 17.745 8.154 ( 5.480 -1.476 -2.652) 6.265 8.359 ( -7.518 -4.219 -1.408) 8.735 8.561 ( 3.389 -3.456 12.547) 13.448 9.143 ( -5.042 -0.926 30.702) 31.127 9.430 ( -9.741 4.175 8.556) 13.620 9.650 ( 3.538 2.562 -3.049) 5.327 9.959 ( -2.011 5.808 1.935) 6.444 10.177 ( -11.872 1.876 -4.571) 12.859 10.496 ( 8.857 -6.103 -2.683) 11.086 10.680 ( 4.943 -4.177 -23.093) 23.983 10.929 ( 6.477 1.491 -21.059) 22.083 11.005 ( -2.519 -1.049 -8.062) 8.511 11.691 ( 8.091 5.293 11.203) 14.799 11.944 ( 0.708 5.970 -0.387) 6.024 12.066 ( 0.167 -0.145 -2.202) 2.213 12.510 ( 6.154 8.903 5.029) 11.934 13.033 ( -8.052 10.566 -5.289) 14.298 13.238 ( -0.792 -3.017 -14.988) 15.309 13.871 ( 14.129 -13.448 4.230) 19.960 14.460 ( -7.002 -6.559 -4.507) 10.600 15.591 ( 0.107 0.220 11.246) 11.249 15.897 ( -8.233 0.221 4.552) 9.410 15.990 ( -0.870 -1.364 15.227) 15.313 16.439 ( 5.557 0.350 -5.293) 7.682 18.013 ( -9.364 -5.356 10.531) 15.075 18.815 ( -3.886 1.044 5.639) 6.927 18.989 ( 6.307 -8.317 -22.954) 25.216 19.435 ( 8.484 0.811 -19.178) 20.986 26.020 ( -4.086 2.327 8.968) 10.126 26.364 ( 1.812 -1.691 -6.925) 7.355 26.693 ( 3.988 6.585 3.760) 8.568 27.084 ( -11.905 5.342 -2.850) 13.356 28.319 ( -2.173 3.539 10.509) 11.300 28.421 ( 0.569 -1.827 4.724) 5.097 28.757 ( 3.472 3.303 8.815) 10.034 28.890 ( -1.085 -4.825 6.218) 7.944 28.984 ( 6.695 -0.126 -5.720) 8.806 29.279 ( -3.906 4.786 -2.043) 6.507 29.567 ( 4.939 -13.234 -0.393) 14.131 29.980 ( -0.381 4.487 -17.145) 17.726 ======================= Grid point 281 (149/186) ======================= q-point: (-0.25 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( 0.206 8.662 5.431) 10.226 1.872 ( -1.491 7.084 -0.530) 7.258 2.111 ( 2.174 2.811 8.752) 9.446 2.471 ( 3.304 3.384 -5.473) 7.233 2.738 ( -4.753 0.707 1.780) 5.125 2.876 ( -4.381 0.934 -2.181) 4.982 3.613 ( -3.902 6.175 20.525) 21.786 4.370 ( 0.831 -0.879 -13.411) 13.465 4.602 ( 7.823 17.189 18.648) 26.541 5.347 ( -13.338 -0.605 -3.489) 13.800 5.491 ( -6.760 -0.945 2.444) 7.250 5.727 ( 2.838 -4.607 -2.354) 5.901 5.934 ( 6.713 -1.330 -6.973) 9.770 6.122 ( -0.737 -5.787 -8.288) 10.135 6.679 ( 2.397 2.908 1.238) 3.967 6.843 ( -1.518 -4.159 -4.683) 6.444 7.367 ( 1.708 0.214 -0.813) 1.904 7.428 ( 1.171 2.180 0.029) 2.474 7.880 ( -3.833 2.483 17.964) 18.536 7.911 ( -5.422 3.701 17.148) 18.362 8.234 ( 3.487 0.409 2.686) 4.420 8.332 ( -1.225 -1.686 -1.495) 2.565 8.682 ( 3.955 -0.071 15.723) 16.213 9.146 ( -6.196 1.091 14.416) 15.730 9.337 ( -8.763 -0.573 22.505) 24.158 9.599 ( -9.238 2.798 4.318) 10.574 9.904 ( 6.677 1.648 -2.320) 7.258 10.007 ( -9.961 1.899 1.120) 10.202 10.651 ( 5.731 -2.280 -7.540) 9.741 10.731 ( 4.660 -4.990 -17.078) 18.392 10.940 ( 7.903 -0.284 -13.384) 15.545 11.001 ( 3.902 -3.861 -22.789) 23.441 11.681 ( 0.273 7.728 5.359) 9.408 11.812 ( -0.868 9.042 -6.297) 11.053 12.116 ( 4.533 0.795 8.652) 9.799 12.494 ( 7.661 7.903 2.960) 11.397 12.778 ( -6.182 9.016 -6.791) 12.870 13.179 ( -1.437 0.497 -20.828) 20.884 14.177 ( -2.181 -13.789 10.206) 17.293 14.558 ( 6.782 -12.559 -8.530) 16.627 15.598 ( -5.688 0.327 11.059) 12.440 15.824 ( -2.239 1.323 3.730) 4.547 16.048 ( -1.752 -1.469 15.941) 16.105 16.483 ( 1.629 -1.739 -4.790) 5.350 18.054 ( -5.259 -7.720 14.157) 16.961 18.770 ( -4.416 -0.531 1.673) 4.752 19.100 ( 7.690 -5.007 -20.449) 22.413 19.450 ( 6.129 0.745 -18.673) 19.668 25.997 ( -1.083 0.790 10.372) 10.458 26.370 ( 1.195 0.288 -8.011) 8.105 26.635 ( -0.315 8.420 6.662) 10.742 26.868 ( -6.175 5.295 -4.495) 9.294 28.279 ( -2.323 3.787 13.178) 13.907 28.469 ( 0.406 -2.326 1.410) 2.750 28.773 ( 3.060 4.699 9.246) 10.814 28.927 ( -0.830 -0.774 2.031) 2.327 29.048 ( 3.205 0.784 -4.457) 5.545 29.164 ( -0.939 3.271 -5.233) 6.242 29.801 ( 1.726 -10.571 -2.109) 10.917 29.897 ( 0.975 -3.092 -10.408) 10.901 ======================= Grid point 282 (150/186) ======================= q-point: (-0.12 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( 2.526 3.756 5.745) 7.314 1.718 ( -4.293 8.194 0.765) 9.282 2.163 ( 2.390 -0.736 8.231) 8.603 2.441 ( 0.541 0.641 -9.021) 9.059 2.719 ( -0.462 1.039 4.259) 4.408 2.794 ( 0.354 4.128 0.731) 4.207 3.636 ( 2.226 0.068 21.209) 21.326 4.318 ( 4.499 5.438 -10.975) 13.048 4.599 ( 10.641 11.074 17.883) 23.572 5.125 ( -10.430 3.233 -16.285) 19.607 5.377 ( -15.659 -4.425 3.970) 16.750 5.818 ( 0.368 -3.021 1.916) 3.596 6.019 ( 5.253 -0.469 -4.084) 6.670 6.169 ( 2.024 -3.982 -6.022) 7.498 6.710 ( 1.098 -2.145 5.444) 5.953 6.916 ( 1.137 -8.725 -3.834) 9.598 7.339 ( -1.550 2.290 -1.043) 2.956 7.444 ( 1.103 -1.632 -1.859) 2.708 7.771 ( -5.397 8.969 13.029) 16.712 7.868 ( -3.534 4.761 13.456) 14.704 8.195 ( -5.931 3.539 6.018) 9.161 8.386 ( 7.213 1.274 0.519) 7.343 8.774 ( 2.721 0.488 14.788) 15.045 9.134 ( -1.439 -2.632 6.509) 7.167 9.331 ( -9.223 1.698 30.124) 31.550 9.413 ( -12.910 2.240 8.942) 15.864 9.894 ( -7.724 -1.464 2.863) 8.367 10.061 ( 13.429 -3.339 2.673) 14.094 10.622 ( -2.968 2.406 -9.495) 10.235 10.821 ( 5.365 -4.228 -9.443) 11.655 11.010 ( 8.978 0.088 -24.920) 26.488 11.040 ( 6.619 -5.482 -25.037) 26.471 11.507 ( -6.444 10.874 1.087) 12.686 11.741 ( 7.318 4.082 -3.749) 9.180 12.174 ( 2.678 2.555 9.732) 10.412 12.466 ( 2.868 7.191 -9.466) 12.229 12.637 ( 3.058 5.104 2.361) 6.402 13.063 ( -0.117 3.452 -22.254) 22.521 14.286 ( -13.065 -13.865 6.353) 20.082 14.834 ( 9.017 -12.494 -6.600) 16.762 15.527 ( -9.691 -0.113 11.287) 14.877 15.842 ( 4.235 0.820 5.644) 7.103 16.095 ( -3.433 -1.946 16.239) 16.711 16.466 ( -5.003 -0.271 -3.523) 6.125 18.174 ( -1.095 -7.128 14.582) 16.268 18.743 ( -4.466 -3.216 2.396) 6.002 19.159 ( 7.289 0.225 -19.154) 20.495 19.436 ( 2.898 0.171 -19.784) 19.996 26.053 ( 3.990 -1.475 10.247) 11.095 26.319 ( -2.357 2.144 -6.606) 7.335 26.533 ( -1.366 5.964 5.743) 8.391 26.768 ( 3.762 6.382 -3.951) 8.396 28.253 ( -1.380 3.565 13.990) 14.503 28.499 ( -0.258 -1.651 -0.554) 1.760 28.766 ( 0.714 4.657 9.476) 10.582 28.917 ( -1.925 0.614 -1.433) 2.477 28.973 ( -1.555 4.128 -4.312) 6.168 29.168 ( 4.707 0.591 -6.708) 8.216 29.802 ( -6.043 -2.555 0.771) 6.606 30.076 ( 4.823 -13.120 -9.690) 17.009 ======================= Grid point 286 (151/186) ======================= q-point: ( 0.38 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.970 ( 10.497 0.000 -0.409) 10.505 2.061 ( 3.388 0.000 1.054) 3.548 2.268 ( -0.621 -0.000 2.420) 2.498 2.588 ( 3.294 0.000 0.358) 3.313 2.734 ( 3.259 0.000 -2.180) 3.921 2.993 ( -6.395 -0.000 -0.856) 6.452 4.276 ( -16.583 -0.000 15.760) 22.877 4.443 ( 3.488 0.000 -17.449) 17.795 4.519 ( 8.326 0.000 17.975) 19.810 5.233 ( 6.264 0.000 3.636) 7.243 5.462 ( 8.707 0.000 -1.669) 8.866 5.597 ( -0.125 -0.000 -4.914) 4.915 5.859 ( -1.903 -0.000 -6.240) 6.524 6.176 ( -9.941 -0.000 -2.280) 10.199 6.832 ( -3.370 -0.000 18.224) 18.533 7.131 ( 2.229 0.000 -5.458) 5.896 7.394 ( 10.321 0.000 -6.047) 11.962 7.433 ( 0.031 0.000 5.370) 5.371 7.666 ( 1.371 0.000 8.537) 8.647 7.788 ( -2.950 -0.000 3.440) 4.532 8.157 ( 7.861 0.000 8.506) 11.583 8.306 ( -15.905 -0.000 8.014) 17.810 8.379 ( -2.278 -0.000 -8.635) 8.931 9.037 ( -6.345 -0.000 36.589) 37.135 9.638 ( 10.553 0.000 -9.580) 14.253 9.703 ( -4.479 -0.000 10.050) 11.002 10.049 ( 6.617 0.000 -0.144) 6.619 10.225 ( -3.935 -0.000 13.581) 14.140 10.419 ( -7.401 -0.000 -22.667) 23.844 10.643 ( 0.817 0.000 -22.213) 22.228 10.979 ( 3.954 0.000 -24.519) 24.835 11.109 ( -8.077 -0.000 4.351) 9.174 11.559 ( 16.834 0.000 21.116) 27.005 12.045 ( 0.562 0.000 -1.736) 1.825 12.090 ( 0.886 0.000 -6.773) 6.830 12.724 ( -1.113 -0.000 2.594) 2.823 13.075 ( 20.118 0.000 -10.089) 22.506 13.132 ( 6.851 0.000 0.066) 6.851 13.648 ( -7.786 -0.000 -4.134) 8.815 14.501 ( -13.520 -0.000 -0.646) 13.535 15.650 ( -2.838 -0.000 9.483) 9.898 15.750 ( 1.268 0.000 7.365) 7.474 16.026 ( -8.513 -0.000 18.272) 20.158 16.476 ( 5.247 0.000 -4.766) 7.088 18.044 ( -12.049 -0.000 3.674) 12.596 18.749 ( 0.909 0.000 -29.094) 29.109 18.888 ( -3.775 -0.000 14.604) 15.084 19.397 ( 10.518 0.000 -21.555) 23.985 26.171 ( -8.970 -0.000 9.000) 12.706 26.247 ( 5.392 0.000 -7.999) 9.647 26.774 ( 4.860 0.000 -2.151) 5.315 27.308 ( -2.858 -0.000 5.848) 6.509 28.317 ( 0.627 0.000 6.004) 6.036 28.435 ( 3.585 0.000 5.016) 6.166 28.637 ( -7.457 -0.000 15.221) 16.949 28.788 ( 5.514 0.000 5.739) 7.959 29.012 ( 6.532 0.000 -21.507) 22.477 29.158 ( 2.396 0.000 8.159) 8.503 29.458 ( -7.213 -0.000 7.447) 10.367 30.202 ( 0.299 0.000 -24.774) 24.776 ======================= Grid point 287 (152/186) ======================= q-point: (-0.50 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.039 ( 5.083 6.423 2.619) 8.599 2.092 ( 6.482 3.836 0.077) 7.533 2.254 ( -0.048 2.170 2.650) 3.425 2.598 ( 1.757 2.831 0.874) 3.445 2.783 ( -0.633 -3.836 -1.469) 4.156 2.879 ( -9.227 -0.307 -5.960) 10.989 4.035 ( -15.906 8.020 15.117) 23.364 4.430 ( 3.947 2.327 -9.627) 10.662 4.774 ( 9.364 -6.833 16.860) 20.461 5.220 ( -2.791 3.850 3.657) 5.998 5.549 ( 6.908 1.170 -1.052) 7.085 5.609 ( 0.820 -2.457 -5.687) 6.249 5.863 ( -0.314 -5.340 -7.644) 9.330 6.030 ( -9.463 1.384 -3.749) 10.272 6.839 ( -0.842 2.891 11.628) 12.012 7.089 ( -1.036 7.331 -6.090) 9.587 7.408 ( -2.017 1.913 4.633) 5.403 7.476 ( 9.343 3.779 -2.089) 10.293 7.686 ( -1.557 -2.079 8.532) 8.919 7.887 ( 1.563 -12.074 1.677) 12.290 8.113 ( -7.741 1.331 7.156) 10.626 8.301 ( 0.648 1.370 -2.077) 2.571 8.438 ( 7.963 -5.028 11.893) 15.170 9.098 ( -4.966 -1.335 34.017) 34.404 9.571 ( -8.984 5.330 -5.246) 11.689 9.683 ( -2.423 -1.288 -2.635) 3.804 10.106 ( -0.139 3.496 0.732) 3.575 10.204 ( -8.754 -0.041 5.564) 10.373 10.336 ( 9.043 -3.221 -11.316) 14.839 10.613 ( 4.308 -0.858 -20.394) 20.862 10.964 ( 6.150 0.989 -18.632) 19.645 11.006 ( -8.589 -0.158 2.175) 8.862 11.804 ( 11.264 2.459 17.853) 21.252 12.044 ( 3.362 1.763 2.675) 4.644 12.075 ( -0.179 0.256 -6.382) 6.389 12.686 ( -1.373 3.583 6.595) 7.630 13.144 ( 1.658 -2.490 -14.253) 14.563 13.237 ( -0.507 2.554 -7.540) 7.977 13.660 ( 14.169 -1.805 2.851) 14.565 14.349 ( -11.125 -1.913 -3.770) 11.901 15.644 ( 1.581 3.541 10.059) 10.780 15.807 ( -4.307 -5.175 5.467) 8.673 15.996 ( -4.199 0.855 17.330) 17.852 16.496 ( 3.841 2.190 -5.775) 7.274 17.914 ( -11.965 -1.578 5.941) 13.452 18.724 ( 4.049 -5.453 -28.772) 29.563 18.880 ( -3.799 0.164 12.338) 12.910 19.452 ( 9.871 0.291 -20.345) 22.615 26.076 ( -8.110 1.493 9.082) 12.267 26.310 ( 5.660 -1.679 -7.667) 9.676 26.818 ( 4.957 2.386 2.031) 5.864 27.195 ( -13.282 2.300 1.866) 13.608 28.350 ( 0.518 -0.526 5.271) 5.322 28.475 ( 2.098 5.185 7.804) 9.601 28.668 ( -1.094 -7.171 10.408) 12.686 28.873 ( 5.342 1.955 8.682) 10.380 29.015 ( 6.853 1.129 -14.935) 16.471 29.259 ( 2.660 -5.625 2.507) 6.708 29.396 ( -4.505 1.124 6.667) 8.125 30.089 ( -1.423 2.546 -24.663) 24.834 ======================= Grid point 288 (153/186) ======================= q-point: (-0.38 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( -0.321 9.725 4.202) 10.599 2.077 ( 2.643 7.281 -1.264) 7.848 2.239 ( 3.021 5.048 6.316) 8.631 2.568 ( -0.175 3.117 -4.475) 5.456 2.717 ( -9.566 -1.921 0.073) 9.757 2.842 ( -1.055 -3.350 -4.249) 5.513 3.809 ( -11.483 7.362 17.549) 22.227 4.419 ( 6.451 3.867 -8.922) 11.670 4.939 ( 2.975 4.872 16.761) 17.707 5.200 ( -6.178 -6.729 7.359) 11.731 5.560 ( -0.192 3.714 -3.916) 5.401 5.636 ( 2.676 -1.025 0.081) 2.866 5.882 ( -6.691 -4.441 -4.869) 9.392 5.947 ( 3.099 -3.377 -12.650) 13.454 6.811 ( -1.587 2.505 3.639) 4.694 6.895 ( -2.595 10.854 -5.230) 12.324 7.402 ( 1.351 0.984 1.750) 2.420 7.516 ( 5.617 4.154 -1.003) 7.058 7.749 ( -4.731 -6.763 15.188) 17.286 8.035 ( -3.980 3.135 16.494) 17.254 8.118 ( 5.071 -11.913 -4.117) 13.586 8.279 ( 0.402 0.307 -5.228) 5.253 8.658 ( 9.370 -1.420 18.796) 21.050 9.174 ( -4.566 -0.969 29.679) 30.044 9.333 ( -13.924 2.773 -3.824) 14.704 9.630 ( -7.975 -1.273 -1.020) 8.140 10.018 ( 0.824 5.026 -4.947) 7.100 10.081 ( -9.394 3.131 5.686) 11.418 10.521 ( 10.919 -4.930 -8.350) 14.603 10.626 ( 5.516 -2.247 -19.541) 20.429 10.887 ( -8.269 -1.513 -1.213) 8.494 11.019 ( 11.594 1.764 -15.795) 19.673 11.845 ( -0.877 4.128 5.820) 7.190 12.007 ( -2.051 4.163 -5.554) 7.238 12.160 ( 11.405 2.774 14.989) 19.038 12.653 ( -1.010 2.582 7.011) 7.540 13.029 ( -8.738 6.552 -12.813) 16.836 13.149 ( 1.011 -0.313 -13.794) 13.835 13.938 ( 12.959 -4.146 6.548) 15.100 14.280 ( -2.330 -6.754 -9.176) 11.629 15.634 ( -4.180 2.233 10.578) 11.591 15.824 ( -1.506 -1.737 5.195) 5.681 16.019 ( -1.355 -0.299 14.675) 14.741 16.486 ( 2.431 1.819 -5.949) 6.678 17.858 ( -8.708 -5.717 10.532) 14.813 18.742 ( -0.553 -2.529 -13.542) 13.787 18.918 ( 2.904 -5.621 -4.339) 7.672 19.490 ( 8.540 1.292 -19.372) 21.210 26.007 ( -6.067 0.038 9.785) 11.514 26.368 ( 5.457 -0.293 -8.035) 9.717 26.833 ( 1.189 5.593 6.115) 8.372 26.984 ( -11.211 2.775 0.209) 11.551 28.362 ( -2.670 1.192 8.869) 9.339 28.451 ( 1.057 2.480 5.385) 6.022 28.800 ( 1.748 -5.921 2.588) 6.694 28.922 ( 4.424 3.841 9.296) 10.988 29.058 ( 7.079 0.334 -7.543) 10.350 29.276 ( -3.377 2.711 -2.241) 4.876 29.465 ( 3.090 -9.299 4.443) 10.759 29.942 ( -2.911 2.790 -21.191) 21.572 ======================= Grid point 289 (154/186) ======================= q-point: (-0.25 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( -3.441 8.795 3.359) 10.024 1.959 ( -2.348 8.973 -0.579) 9.293 2.220 ( 1.189 4.898 7.419) 8.969 2.476 ( -3.883 1.201 -8.004) 8.977 2.707 ( 0.583 -1.782 4.988) 5.329 2.852 ( 0.008 -0.966 -1.754) 2.002 3.684 ( -6.059 3.477 17.914) 19.228 4.430 ( 10.206 5.167 -8.744) 14.398 4.910 ( -3.715 4.811 15.278) 16.442 5.167 ( -10.003 1.805 11.919) 15.665 5.415 ( -6.831 5.932 -9.016) 12.773 5.714 ( 1.923 -2.550 2.376) 3.981 5.920 ( 3.132 -6.708 -2.498) 7.813 6.020 ( 4.605 -6.179 -14.157) 16.118 6.737 ( -2.070 2.924 -5.696) 6.729 6.786 ( -0.074 2.060 2.135) 2.968 7.401 ( 0.981 1.996 -0.824) 2.371 7.493 ( 2.338 4.614 -3.083) 6.022 7.840 ( -6.375 -6.691 19.606) 21.675 7.974 ( -5.197 5.651 16.418) 18.124 8.255 ( -0.556 -0.571 -2.798) 2.909 8.341 ( 9.706 -5.195 -2.191) 11.224 8.799 ( 1.951 1.911 18.805) 19.002 9.104 ( -7.256 0.762 2.822) 7.822 9.289 ( -5.813 -3.609 25.056) 25.974 9.504 ( -11.641 2.046 3.916) 12.451 9.917 ( -11.063 2.710 7.674) 13.734 10.037 ( 10.155 1.395 -4.508) 11.198 10.597 ( -1.739 -2.665 -13.415) 13.787 10.682 ( 6.082 -3.580 -13.778) 15.481 10.870 ( 2.546 -5.815 -15.426) 16.681 11.090 ( 12.457 3.600 -12.684) 18.139 11.769 ( -3.938 5.481 4.623) 8.181 11.878 ( -2.550 6.244 -4.644) 8.189 12.276 ( 5.935 5.488 14.183) 16.325 12.641 ( 2.780 2.042 0.330) 3.465 12.788 ( -6.743 7.565 -8.161) 13.012 13.123 ( 2.262 -0.086 -14.586) 14.760 14.024 ( -5.533 -3.300 1.449) 6.603 14.479 ( 12.541 -12.105 -6.544) 18.618 15.551 ( -9.442 1.654 10.756) 14.408 15.867 ( 3.672 0.707 5.946) 7.024 16.052 ( -2.710 -0.965 13.065) 13.378 16.462 ( -1.045 0.737 -4.799) 4.967 17.934 ( -2.939 -9.400 14.747) 17.734 18.696 ( -4.592 -0.515 -2.483) 5.246 19.046 ( 7.214 -7.351 -16.128) 19.136 19.490 ( 6.382 2.767 -18.989) 20.223 26.001 ( -2.252 -2.217 9.546) 10.055 26.383 ( 2.137 2.189 -6.878) 7.528 26.686 ( -10.018 4.904 5.230) 12.320 26.930 ( 5.738 4.859 2.146) 7.820 28.328 ( -4.138 1.879 13.008) 13.779 28.468 ( 1.843 0.060 0.844) 2.027 28.873 ( 0.413 -2.837 -1.956) 3.470 28.940 ( 2.921 5.977 10.783) 12.670 29.099 ( 1.149 2.952 -5.079) 5.986 29.179 ( 0.977 1.608 -6.164) 6.445 29.662 ( 1.990 -11.159 0.159) 11.336 29.819 ( -2.510 -0.617 -14.195) 14.428 ======================= Grid point 290 (155/186) ======================= q-point: (-0.12 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( -3.441 3.069 1.864) 4.973 1.800 ( -2.402 8.618 1.461) 9.065 2.213 ( 1.050 0.468 4.814) 4.949 2.390 ( -4.982 0.799 -4.716) 6.907 2.774 ( 4.359 -0.183 4.440) 6.225 2.875 ( 4.111 1.221 3.030) 5.251 3.685 ( -1.577 -1.924 15.197) 15.399 4.470 ( 11.769 6.134 -5.092) 14.215 4.827 ( -10.201 -0.814 7.270) 12.552 5.063 ( -2.300 8.474 17.140) 19.258 5.215 ( -4.528 5.902 -11.044) 13.316 5.739 ( -4.060 -3.612 -0.919) 5.511 6.030 ( 3.039 -3.030 -3.584) 5.592 6.139 ( 6.416 -5.313 -7.683) 11.332 6.699 ( -0.720 -1.178 -2.341) 2.718 6.816 ( 1.010 -5.935 0.379) 6.032 7.358 ( -0.772 3.461 -2.717) 4.467 7.454 ( 0.777 2.257 -1.837) 3.012 7.850 ( -7.194 6.031 12.902) 15.956 7.895 ( -4.856 0.092 18.148) 18.787 8.216 ( -2.310 4.187 3.513) 5.933 8.480 ( 5.585 -0.809 -1.055) 5.741 8.813 ( -3.150 -0.906 10.268) 10.779 9.131 ( 2.938 -3.885 11.120) 12.140 9.331 ( -11.475 4.356 20.377) 23.788 9.344 ( -5.270 -0.395 15.149) 16.044 9.797 ( -7.402 -0.351 4.618) 8.732 10.194 ( 13.248 -2.852 -1.338) 13.618 10.532 ( -6.333 -2.423 -7.976) 10.469 10.767 ( 5.583 -4.801 -13.598) 15.464 10.943 ( 7.658 -5.197 -28.163) 29.645 11.116 ( 8.097 5.009 -15.197) 17.934 11.588 ( -6.744 11.453 1.184) 13.344 11.826 ( 2.529 0.215 2.240) 3.385 12.250 ( -3.203 3.333 3.160) 5.600 12.569 ( -0.087 9.387 -12.440) 15.585 12.718 ( 4.521 -0.177 6.890) 8.242 13.108 ( 6.930 4.027 -12.321) 14.699 13.990 ( -10.544 -7.187 -1.590) 12.859 14.754 ( 7.430 -10.384 -5.435) 13.877 15.460 ( -7.716 0.872 13.286) 15.389 15.932 ( 4.451 0.395 7.165) 8.444 16.068 ( -3.952 -1.546 11.571) 12.325 16.392 ( -5.895 1.537 -2.777) 6.695 18.116 ( 1.442 -9.210 15.298) 17.915 18.644 ( -5.615 -2.197 2.273) 6.443 19.162 ( 8.142 -4.171 -19.342) 21.396 19.437 ( 3.195 4.190 -19.699) 20.392 26.079 ( 2.037 -4.722 7.222) 8.866 26.309 ( -3.591 3.514 -1.563) 5.262 26.571 ( -3.070 2.382 2.427) 4.581 26.950 ( 9.337 7.165 1.821) 11.909 28.309 ( -3.279 0.984 14.399) 14.800 28.492 ( 1.910 -0.025 -1.288) 2.304 28.881 ( -1.044 0.767 -4.390) 4.578 28.887 ( -2.458 6.234 6.383) 9.254 28.974 ( -3.461 4.264 -2.589) 6.072 29.236 ( 6.990 -0.081 -4.017) 8.062 29.683 ( -6.520 -1.490 -2.897) 7.288 29.917 ( 3.886 -12.689 -9.173) 16.133 ======================= Grid point 295 (156/186) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -2.304 -0.000 2.206) 3.190 2.187 ( 6.542 0.000 0.273) 6.548 2.320 ( 6.445 0.000 5.416) 8.418 2.627 ( -1.131 -0.000 2.577) 2.814 2.677 ( -13.836 -0.000 -6.555) 15.310 2.757 ( -2.033 -0.000 -5.238) 5.619 3.932 ( -15.547 -0.000 14.920) 21.547 4.506 ( 9.519 0.000 -10.310) 14.032 4.903 ( 7.807 0.000 21.794) 23.150 5.143 ( -13.464 -0.000 2.995) 13.794 5.596 ( 2.284 0.000 -8.829) 9.119 5.660 ( 7.522 0.000 5.438) 9.282 5.778 ( -2.747 -0.000 -8.272) 8.716 5.926 ( -5.139 -0.000 -6.517) 8.299 6.869 ( -5.151 -0.000 14.717) 15.592 7.154 ( 1.762 0.000 -3.922) 4.299 7.352 ( -6.240 -0.000 3.015) 6.930 7.605 ( 1.372 0.000 3.143) 3.429 7.753 ( 2.005 0.000 -0.219) 2.017 7.760 ( 10.644 0.000 -8.457) 13.595 8.088 ( -4.500 -0.000 13.582) 14.308 8.271 ( -1.996 -0.000 -5.996) 6.320 8.634 ( 15.015 0.000 19.746) 24.807 9.144 ( -4.516 -0.000 32.276) 32.591 9.421 ( -15.552 -0.000 -18.227) 23.961 9.572 ( -9.745 -0.000 6.782) 11.873 10.095 ( 0.818 0.000 -12.080) 12.108 10.136 ( -10.587 -0.000 13.419) 17.093 10.447 ( 14.904 0.000 -11.500) 18.825 10.605 ( 5.315 0.000 -15.577) 16.459 10.865 ( -13.075 -0.000 3.629) 13.569 11.044 ( 12.558 0.000 -12.606) 17.794 11.904 ( -3.272 -0.000 5.182) 6.129 12.049 ( -1.302 -0.000 -5.336) 5.492 12.222 ( 15.752 0.000 17.680) 23.679 12.673 ( -7.215 -0.000 10.536) 12.769 13.040 ( -5.872 -0.000 -19.524) 20.388 13.229 ( 0.255 0.000 -12.025) 12.027 13.890 ( 20.849 0.000 5.352) 21.525 14.194 ( -7.893 -0.000 -7.733) 11.050 15.690 ( -9.077 -0.000 7.008) 11.468 15.769 ( 5.762 0.000 8.553) 10.313 16.022 ( -1.898 -0.000 15.480) 15.596 16.525 ( 1.607 0.000 -4.934) 5.189 17.778 ( -10.380 -0.000 6.425) 12.208 18.667 ( 8.514 0.000 -29.027) 30.250 18.857 ( -6.161 -0.000 12.114) 13.591 19.507 ( 9.504 0.000 -19.734) 21.903 26.006 ( -8.654 -0.000 9.552) 12.889 26.363 ( 7.800 0.000 -8.029) 11.195 26.916 ( 6.019 0.000 5.574) 8.204 27.018 ( -17.827 -0.000 2.979) 18.074 28.365 ( -1.239 -0.000 6.489) 6.606 28.559 ( -5.157 -0.000 12.518) 13.538 28.653 ( 9.064 0.000 -3.426) 9.690 28.975 ( 3.936 0.000 2.038) 4.432 29.063 ( 7.263 0.000 -5.818) 9.306 29.267 ( 1.884 0.000 4.415) 4.800 29.382 ( -2.413 -0.000 6.939) 7.346 29.988 ( -3.223 -0.000 -25.862) 26.062 ======================= Grid point 296 (157/186) ======================= q-point: (-0.38 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -6.009 5.388 1.016) 8.135 2.192 ( 1.085 7.098 -0.394) 7.191 2.388 ( -0.407 5.980 4.711) 7.623 2.485 ( -5.632 -0.910 -3.771) 6.838 2.629 ( -2.261 -2.868 4.107) 5.496 2.751 ( -2.448 -4.902 -2.848) 6.175 3.792 ( -10.832 2.980 15.389) 19.053 4.579 ( 12.095 4.515 -5.923) 14.204 4.939 ( -18.513 0.536 7.434) 19.957 5.107 ( 4.021 -5.367 17.562) 18.799 5.563 ( -1.182 3.132 -8.251) 8.905 5.722 ( -5.032 -2.515 -5.092) 7.588 5.769 ( 9.264 1.323 5.428) 10.819 5.889 ( 1.487 -3.016 -11.535) 12.015 6.809 ( -7.018 3.073 9.616) 12.295 7.042 ( 0.748 12.021 -2.823) 12.370 7.384 ( -0.005 -5.225 -0.355) 5.237 7.622 ( -3.511 -3.497 8.650) 9.969 7.681 ( 2.695 7.030 -4.107) 8.576 8.013 ( 8.379 -13.059 -8.482) 17.683 8.078 ( -3.600 1.994 17.601) 18.076 8.255 ( 1.022 -2.049 -5.196) 5.679 8.869 ( 10.317 2.128 21.392) 23.845 9.143 ( -14.095 1.481 -13.872) 19.832 9.207 ( -4.589 -1.710 29.348) 29.753 9.487 ( -10.502 -1.913 8.560) 13.683 10.011 ( -13.094 2.827 13.304) 18.880 10.081 ( 4.817 1.004 -9.854) 11.014 10.546 ( 8.166 -1.054 -25.313) 26.618 10.644 ( 4.622 1.033 -5.711) 7.419 10.740 ( -6.231 -3.706 -2.968) 7.834 11.170 ( 13.858 1.762 -8.058) 16.127 11.842 ( -6.613 1.019 4.947) 8.321 11.994 ( -3.016 1.783 -4.745) 5.898 12.459 ( 14.660 5.797 18.831) 24.558 12.613 ( -8.814 -1.553 9.836) 13.298 12.887 ( -7.908 -2.004 -20.292) 21.871 13.158 ( 0.168 3.498 -11.692) 12.205 14.056 ( 0.272 3.299 -7.090) 7.825 14.222 ( 16.025 -6.251 -1.253) 17.246 15.591 ( -9.422 0.801 8.881) 12.972 15.873 ( 5.666 -0.107 6.239) 8.429 16.047 ( -2.165 0.392 13.420) 13.599 16.509 ( 0.198 1.740 -3.207) 3.653 17.730 ( -5.446 -4.313 9.848) 12.051 18.693 ( 5.228 -0.020 -18.672) 19.390 18.849 ( -1.678 -5.017 1.688) 5.553 19.547 ( 8.487 1.107 -19.319) 21.130 25.949 ( -6.349 -1.195 9.493) 11.483 26.426 ( 6.689 0.833 -7.587) 10.148 26.786 ( -17.428 2.111 5.057) 18.269 27.016 ( 7.154 1.402 7.486) 10.449 28.352 ( -5.239 0.157 10.532) 11.764 28.526 ( 0.782 3.430 4.613) 5.801 28.763 ( 4.722 -4.008 -6.604) 9.054 29.016 ( 3.456 -1.074 -1.869) 4.073 29.135 ( 5.300 1.856 2.563) 6.173 29.265 ( -2.925 2.437 -1.967) 4.286 29.427 ( 2.072 -4.459 7.984) 9.376 29.851 ( -2.941 1.233 -22.317) 22.543 ======================= Grid point 297 (158/186) ======================= q-point: (-0.25 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( -8.989 7.302 0.546) 11.594 2.053 ( -3.269 8.972 -1.454) 9.660 2.247 ( -7.836 1.729 1.015) 8.088 2.452 ( -1.744 4.401 4.015) 6.207 2.704 ( 2.158 -4.807 3.344) 6.241 2.815 ( 1.276 -5.562 2.152) 6.099 3.702 ( -5.669 2.417 14.991) 16.208 4.660 ( 11.687 3.565 -1.048) 12.263 4.706 ( -21.126 -0.310 7.543) 22.434 5.239 ( 0.560 0.659 15.371) 15.395 5.425 ( -2.599 6.896 -9.619) 12.118 5.696 ( -2.015 -1.837 -3.275) 4.262 5.909 ( 7.271 -2.354 5.227) 9.260 5.957 ( 6.750 -6.068 -12.398) 15.365 6.713 ( -3.788 2.570 0.863) 4.658 6.889 ( 0.420 10.046 -0.190) 10.057 7.418 ( 0.008 -0.171 -1.935) 1.943 7.580 ( 1.052 6.769 -5.449) 8.753 7.700 ( -6.885 -9.297 14.996) 18.940 8.046 ( -4.251 5.015 15.912) 17.217 8.194 ( 1.191 -7.402 -6.518) 9.935 8.346 ( 5.221 -7.144 -3.663) 9.577 8.854 ( -5.883 4.235 3.417) 8.013 9.078 ( -0.354 -0.607 13.059) 13.078 9.275 ( -4.650 -2.687 25.300) 25.864 9.425 ( -7.087 0.575 13.196) 14.990 9.846 ( -11.769 3.272 11.936) 17.079 10.142 ( 9.168 -1.384 -6.580) 11.370 10.473 ( -7.024 0.154 -11.372) 13.367 10.682 ( 7.592 -3.108 -15.629) 17.651 10.796 ( 6.837 -3.924 -17.836) 19.500 11.256 ( 10.305 4.451 -8.843) 14.290 11.766 ( -6.623 1.120 7.475) 10.050 11.895 ( -3.511 3.983 -3.278) 6.240 12.406 ( -7.452 7.607 -2.956) 11.051 12.642 ( -4.344 -3.400 9.394) 10.894 12.801 ( 5.434 4.361 -7.482) 10.224 13.116 ( 2.551 -1.179 -6.121) 6.736 13.966 ( -0.787 3.291 -12.945) 13.379 14.510 ( 14.586 -6.289 -1.190) 15.929 15.504 ( -7.139 1.607 11.890) 13.961 15.952 ( 4.267 0.531 5.388) 6.894 16.044 ( -4.257 0.025 10.261) 11.109 16.460 ( -1.339 3.413 -1.396) 3.923 17.840 ( 1.118 -9.210 14.445) 17.167 18.646 ( -3.221 1.901 -2.150) 4.314 18.967 ( 6.562 -8.854 -14.830) 18.477 19.548 ( 6.692 3.153 -19.436) 20.796 25.956 ( -2.666 -3.755 8.521) 9.686 26.419 ( -1.604 4.022 -2.760) 5.134 26.604 ( -9.156 0.063 3.428) 9.777 27.105 ( 8.569 3.836 6.773) 11.577 28.316 ( -6.565 -0.062 13.865) 15.341 28.519 ( 3.119 2.227 -0.968) 3.953 28.825 ( 1.407 -2.938 -6.890) 7.621 29.077 ( 1.670 -0.023 5.582) 5.827 29.097 ( -6.624 6.298 -5.888) 10.873 29.185 ( 2.764 -0.197 -5.205) 5.896 29.576 ( 3.408 -7.492 5.088) 9.676 29.747 ( 0.024 1.567 -14.558) 14.642 ======================= Grid point 298 (159/186) ======================= q-point: (-0.12 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( -6.070 3.435 1.824) 7.210 1.882 ( -3.738 8.110 -0.458) 8.942 2.187 ( -4.375 -3.028 2.278) 5.788 2.359 ( -4.629 4.062 2.874) 6.796 2.807 ( 2.438 -4.208 3.308) 5.882 2.930 ( 4.276 -3.089 5.515) 7.632 3.687 ( -2.214 -0.372 12.733) 12.929 4.485 ( -23.688 -4.980 12.660) 27.317 4.783 ( 15.277 3.420 -2.310) 15.825 5.173 ( -2.121 9.551 2.342) 10.060 5.314 ( -0.254 4.188 -2.476) 4.872 5.695 ( 2.058 0.854 -0.953) 2.423 6.006 ( 2.078 -3.075 -2.462) 4.454 6.121 ( 7.553 -5.898 -5.055) 10.834 6.656 ( -1.168 0.374 -7.445) 7.545 6.807 ( 0.458 2.072 5.508) 5.902 7.385 ( -0.833 2.893 -3.048) 4.284 7.495 ( -0.321 3.673 -2.816) 4.639 7.782 ( -7.322 -6.539 14.956) 17.890 7.948 ( -5.342 6.074 13.412) 15.663 8.241 ( -0.390 -0.248 -0.724) 0.859 8.449 ( -2.179 -5.843 -2.988) 6.916 8.810 ( 0.734 0.933 6.743) 6.847 9.122 ( -4.988 -4.021 17.033) 18.198 9.322 ( -6.773 0.940 19.722) 20.874 9.371 ( -3.663 1.606 20.742) 21.124 9.760 ( -0.869 1.744 5.088) 5.448 10.276 ( 6.097 -4.359 -4.151) 8.567 10.382 ( -3.114 -3.414 -6.354) 7.856 10.765 ( 7.204 -1.021 -12.768) 14.696 10.873 ( 8.352 -5.854 -28.312) 30.093 11.230 ( 4.672 6.797 -13.575) 15.885 11.641 ( -7.812 8.260 2.806) 11.710 11.850 ( 1.219 -1.162 4.373) 4.686 12.193 ( -9.047 2.585 -10.602) 14.175 12.550 ( -9.057 2.038 -5.196) 10.638 12.871 ( 9.611 1.613 6.109) 11.502 13.189 ( 6.121 -1.059 -0.371) 6.223 13.862 ( -0.416 3.716 -15.096) 15.552 14.717 ( 6.300 -4.938 -2.961) 8.534 15.464 ( -2.538 1.972 15.518) 15.847 15.978 ( -4.801 0.688 12.799) 13.687 16.049 ( 1.590 -2.274 0.593) 2.837 16.371 ( -3.004 5.315 0.495) 6.125 18.072 ( 4.535 -9.776 15.548) 18.918 18.576 ( -4.702 0.431 3.362) 5.797 19.115 ( 7.824 -7.520 -19.048) 21.922 19.487 ( 4.312 5.962 -20.298) 21.591 26.037 ( 0.021 -5.897 5.468) 8.042 26.299 ( -6.290 2.877 4.742) 8.386 26.558 ( -1.674 0.093 -0.235) 1.693 27.167 ( 8.572 5.357 3.665) 10.752 28.297 ( -5.816 -1.288 15.180) 16.307 28.535 ( 4.213 1.289 -3.155) 5.418 28.837 ( -1.496 -1.593 -5.897) 6.289 28.857 ( -10.989 4.969 -9.038) 15.071 29.072 ( -0.014 6.588 11.024) 12.843 29.254 ( 3.082 -5.394 -5.367) 8.210 29.647 ( 1.007 4.317 -2.018) 4.871 29.782 ( 4.483 -9.407 -7.964) 13.115 ======================= Grid point 304 (160/186) ======================= q-point: (-0.38 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( -9.171 -0.000 -0.635) 9.193 2.154 ( -14.303 -0.000 -4.053) 14.866 2.360 ( 0.642 0.000 -0.877) 1.087 2.562 ( -3.643 -0.000 5.930) 6.960 2.614 ( 7.149 0.000 12.633) 14.516 2.634 ( -6.500 -0.000 -2.506) 6.966 3.746 ( -7.356 -0.000 14.427) 16.194 4.628 ( -22.113 -0.000 11.534) 24.940 4.823 ( 12.363 0.000 -10.354) 16.126 5.186 ( 3.296 0.000 17.950) 18.251 5.558 ( -0.742 -0.000 -5.584) 5.633 5.610 ( -4.421 -0.000 -8.294) 9.399 5.848 ( 2.879 0.000 -10.681) 11.062 5.931 ( 9.907 0.000 7.322) 12.319 6.782 ( -6.840 -0.000 11.841) 13.675 7.149 ( -0.459 -0.000 -2.324) 2.369 7.326 ( 2.457 0.000 -2.147) 3.263 7.547 ( -6.242 -0.000 8.176) 10.287 7.806 ( 1.821 0.000 -3.730) 4.151 7.907 ( 2.230 0.000 -13.911) 14.088 8.119 ( -2.644 -0.000 18.661) 18.847 8.240 ( 1.242 0.000 -3.781) 3.980 8.951 ( -5.861 -0.000 -17.208) 18.179 9.064 ( 2.813 0.000 19.864) 20.062 9.225 ( -5.720 -0.000 24.983) 25.629 9.416 ( -7.208 -0.000 25.075) 26.090 9.907 ( -13.738 -0.000 14.976) 20.322 10.118 ( 6.173 0.000 -9.073) 10.974 10.546 ( -11.230 -0.000 -3.485) 11.759 10.563 ( 10.553 0.000 -31.110) 32.851 10.758 ( 9.127 0.000 -7.819) 12.018 11.324 ( 11.621 0.000 -6.181) 13.163 11.770 ( -8.594 -0.000 7.491) 11.400 11.949 ( -3.982 -0.000 -2.991) 4.980 12.507 ( -12.078 -0.000 13.246) 17.926 12.648 ( -10.988 -0.000 -27.446) 29.564 12.787 ( 17.237 0.000 17.520) 24.578 13.125 ( -2.118 -0.000 -13.235) 13.403 14.029 ( 1.882 0.000 -15.859) 15.971 14.428 ( 18.012 0.000 2.690) 18.212 15.526 ( -6.458 -0.000 10.863) 12.638 15.949 ( 3.487 0.000 1.785) 3.917 16.063 ( -3.496 -0.000 12.983) 13.446 16.522 ( 0.381 0.000 1.567) 1.612 17.699 ( 0.590 0.000 11.225) 11.240 18.743 ( 11.735 0.000 -25.707) 28.259 18.756 ( -7.646 -0.000 9.821) 12.447 19.592 ( 7.935 0.000 -19.410) 20.970 25.900 ( -4.719 -0.000 9.271) 10.403 26.489 ( 5.645 0.000 -6.961) 8.962 26.593 ( -17.828 -0.000 7.415) 19.309 27.156 ( 8.241 0.000 9.437) 12.529 28.315 ( -7.017 -0.000 12.755) 14.558 28.578 ( 1.242 0.000 2.536) 2.823 28.759 ( 4.344 0.000 -12.953) 13.662 29.019 ( 2.143 0.000 -4.798) 5.255 29.206 ( -8.853 -0.000 -8.358) 12.175 29.214 ( 2.149 0.000 4.703) 5.171 29.459 ( 4.142 0.000 9.452) 10.319 29.784 ( 2.334 0.000 -15.437) 15.613 ======================= Grid point 305 (161/186) ======================= q-point: (-0.25 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( -11.232 4.565 0.532) 12.136 1.998 ( -10.429 -1.877 -0.170) 10.598 2.264 ( -3.045 10.381 3.154) 11.269 2.492 ( -6.356 4.562 1.709) 8.008 2.618 ( -2.510 -9.411 2.516) 10.060 2.796 ( 5.225 -4.838 11.988) 13.943 3.717 ( -3.745 1.074 13.311) 13.870 4.343 ( -29.438 -3.086 12.044) 31.956 4.953 ( 17.025 6.245 -6.350) 19.214 5.267 ( -1.567 -1.835 8.028) 8.382 5.470 ( -0.978 6.985 -3.959) 8.088 5.599 ( -0.004 -5.959 -7.329) 9.446 5.901 ( 5.007 -4.127 -7.363) 9.814 6.065 ( 8.837 1.079 6.816) 11.212 6.723 ( -3.741 3.375 7.106) 8.711 7.045 ( 0.680 10.627 -1.533) 10.758 7.386 ( 0.229 -3.112 -2.086) 3.753 7.544 ( -6.562 -6.820 11.435) 14.844 7.667 ( -1.437 9.483 -7.189) 11.986 8.006 ( -2.923 -11.365 -8.618) 14.559 8.124 ( -1.969 2.322 11.037) 11.449 8.262 ( -2.031 -5.825 0.074) 6.169 8.886 ( 5.412 3.216 -7.010) 9.422 9.078 ( -8.812 -0.206 17.073) 19.214 9.250 ( -5.939 -2.651 22.387) 23.312 9.438 ( -7.821 0.809 31.280) 32.253 9.818 ( -4.293 1.611 14.925) 15.614 10.188 ( 6.804 -1.680 -7.757) 10.454 10.377 ( -6.816 2.745 -6.862) 10.054 10.645 ( 9.998 -6.171 -26.600) 29.079 10.823 ( 7.688 0.838 -14.313) 16.268 11.389 ( 6.249 3.920 -9.259) 11.838 11.701 ( -7.852 -1.259 9.782) 12.607 11.880 ( -3.536 1.585 -0.511) 3.909 12.325 ( -11.831 5.790 -14.147) 19.330 12.476 ( -11.632 -5.387 -2.858) 13.133 12.972 ( 5.469 5.110 -3.349) 8.200 13.106 ( 6.205 -4.362 1.373) 7.708 14.005 ( 7.270 4.112 -16.236) 18.259 14.639 ( 12.720 -1.020 0.337) 12.765 15.514 ( -1.254 1.132 14.655) 14.752 15.980 ( -0.306 -1.978 -1.671) 2.608 16.034 ( -5.531 2.162 12.306) 13.664 16.518 ( 1.421 3.985 3.263) 5.343 17.834 ( 7.035 -5.626 15.130) 17.609 18.648 ( -4.394 4.238 2.830) 6.728 18.877 ( 8.035 -8.298 -18.210) 21.564 19.603 ( 6.770 2.244 -19.867) 21.109 25.905 ( -2.348 -2.904 8.358) 9.154 26.390 ( -13.039 2.825 7.928) 15.519 26.535 ( 1.022 -1.390 -3.932) 4.294 27.268 ( 6.403 1.894 6.920) 9.616 28.273 ( -7.132 -0.343 14.157) 15.856 28.581 ( 2.339 1.944 -2.201) 3.754 28.775 ( 1.450 -2.449 -11.146) 11.503 28.983 ( -12.634 3.450 -11.503) 17.431 29.062 ( -0.167 -4.060 -3.855) 5.601 29.230 ( 0.553 1.652 2.601) 3.130 29.577 ( 5.383 -3.112 7.416) 9.678 29.792 ( 7.255 2.906 -7.909) 11.119 ======================= Grid point 306 (162/186) ======================= q-point: (-0.12 -0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -7.970 1.813 2.379) 8.512 1.910 ( -3.754 3.460 0.619) 5.143 2.115 ( -6.629 2.486 7.929) 10.630 2.363 ( -5.247 3.715 1.569) 6.618 2.732 ( -1.441 -8.792 2.141) 9.163 2.952 ( 3.499 -4.059 9.972) 11.321 3.701 ( -3.980 1.104 11.183) 11.921 4.115 ( -25.039 -8.567 14.441) 30.147 4.995 ( 4.684 6.445 -4.440) 9.121 5.275 ( 2.137 1.192 -0.492) 2.496 5.366 ( 5.135 8.020 -3.041) 9.996 5.687 ( 2.616 -6.350 -7.072) 9.858 5.989 ( 2.900 -2.232 -3.260) 4.901 6.169 ( 5.608 -0.248 4.220) 7.023 6.651 ( -1.710 3.931 -0.437) 4.309 6.921 ( 2.869 9.086 2.040) 9.744 7.388 ( -1.142 0.319 -1.595) 1.988 7.520 ( -2.260 4.582 -4.709) 6.948 7.630 ( -6.412 -9.530 13.587) 17.792 7.971 ( -6.978 1.894 4.724) 8.637 8.180 ( 1.183 -6.402 -3.717) 7.497 8.320 ( -2.948 -5.470 2.432) 6.673 8.892 ( 0.043 4.166 5.730) 7.085 9.029 ( -9.138 -2.632 17.077) 19.546 9.321 ( -0.194 -4.201 16.737) 17.257 9.392 ( -11.432 2.183 32.631) 34.645 9.870 ( 7.626 2.596 9.272) 12.283 10.173 ( -7.089 -1.326 -3.108) 7.853 10.369 ( 6.639 -3.736 -7.021) 10.360 10.777 ( 8.752 -7.272 -22.111) 24.867 10.828 ( 6.514 2.110 -20.957) 22.047 11.319 ( 2.004 6.491 -12.272) 14.027 11.635 ( -7.771 3.230 4.633) 9.607 11.863 ( 1.621 -1.532 3.945) 4.531 12.059 ( -9.390 2.754 -18.515) 20.942 12.391 ( -11.583 -3.366 -1.504) 12.155 12.928 ( -0.909 -1.026 -5.870) 6.028 13.267 ( 7.731 -1.950 1.845) 8.184 13.981 ( 12.420 9.799 -14.395) 21.389 14.758 ( 5.459 0.537 -0.439) 5.503 15.555 ( 2.663 2.759 16.742) 17.175 15.938 ( -8.569 0.792 9.766) 13.016 16.024 ( -0.712 -2.883 0.448) 3.003 16.466 ( 1.749 7.614 2.742) 8.279 18.089 ( 8.226 -6.855 16.127) 19.358 18.561 ( -3.261 2.301 5.044) 6.432 19.029 ( 7.379 -8.678 -19.535) 22.614 19.557 ( 5.332 5.389 -20.699) 22.043 25.967 ( -2.036 -5.139 6.114) 8.242 26.260 ( -7.158 0.414 9.507) 11.907 26.537 ( -0.668 -0.311 -2.616) 2.718 27.299 ( 1.341 2.534 0.371) 2.891 28.249 ( -6.717 -1.566 14.665) 16.206 28.591 ( 3.705 0.405 -3.760) 5.294 28.703 ( -11.449 2.759 -9.862) 15.361 28.805 ( -1.082 -0.643 -4.993) 5.149 29.119 ( -1.637 -4.599 1.190) 5.024 29.209 ( 0.053 1.887 -0.464) 1.944 29.713 ( 5.146 -4.056 2.815) 7.131 29.809 ( 9.191 6.412 -5.969) 12.697 ======================= Grid point 313 (163/186) ======================= q-point: (-0.25 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 186 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -13.556 -0.000 -0.654) 13.571 1.899 ( -4.215 -0.000 11.239) 12.003 2.352 ( -5.995 -0.000 -4.629) 7.574 2.445 ( -3.010 -0.000 1.246) 3.258 2.450 ( -7.370 -0.000 8.023) 10.894 2.879 ( 4.498 0.000 14.303) 14.993 3.729 ( -2.529 -0.000 11.700) 11.970 3.983 ( -30.201 -0.000 12.539) 32.701 5.195 ( -8.257 -0.000 -1.544) 8.400 5.204 ( 17.390 0.000 -7.309) 18.863 5.463 ( -0.917 -0.000 -15.065) 15.093 5.594 ( 3.480 0.000 9.451) 10.071 5.932 ( 8.035 0.000 -4.627) 9.271 6.174 ( 3.884 0.000 4.447) 5.905 6.744 ( -1.766 -0.000 8.263) 8.449 7.137 ( 1.032 0.000 2.478) 2.685 7.352 ( -0.227 -0.000 -1.834) 1.848 7.449 ( -6.322 -0.000 9.814) 11.674 7.739 ( -5.431 -0.000 -14.764) 15.732 7.779 ( -1.653 -0.000 -3.131) 3.541 8.158 ( -3.100 -0.000 -2.171) 3.784 8.189 ( -0.153 -0.000 12.442) 12.443 8.974 ( -15.552 -0.000 15.138) 21.703 9.007 ( 12.011 0.000 -7.067) 13.935 9.236 ( -5.162 -0.000 25.087) 25.613 9.418 ( -14.438 -0.000 37.903) 40.560 9.884 ( 2.749 0.000 18.210) 18.416 10.252 ( 9.118 0.000 -9.197) 12.951 10.284 ( -9.431 -0.000 1.274) 9.517 10.635 ( 12.010 0.000 -31.522) 33.733 10.870 ( 6.969 0.000 -17.675) 18.999 11.440 ( 2.249 0.000 -11.919) 12.129 11.620 ( -8.145 -0.000 10.828) 13.550 11.858 ( -1.492 -0.000 2.359) 2.791 12.150 ( -11.349 -0.000 -33.202) 35.088 12.291 ( -10.689 -0.000 10.082) 14.694 12.941 ( -4.992 -0.000 -13.209) 14.121 13.216 ( 9.871 0.000 -0.870) 9.909 14.140 ( 16.014 0.000 -10.732) 19.278 14.772 ( 8.720 0.000 0.229) 8.723 15.601 ( 4.263 0.000 17.655) 18.163 15.928 ( -3.537 -0.000 -2.925) 4.590 16.006 ( -8.028 -0.000 11.696) 14.186 16.593 ( 3.045 0.000 2.662) 4.044 17.977 ( 12.282 0.000 17.682) 21.529 18.631 ( -6.571 -0.000 7.644) 10.080 18.859 ( 10.254 0.000 -22.463) 24.693 19.633 ( 6.296 0.000 -20.352) 21.303 25.884 ( -2.286 -0.000 8.224) 8.535 26.274 ( -11.821 -0.000 11.678) 16.617 26.529 ( 0.777 0.000 -4.857) 4.919 27.335 ( -1.007 -0.000 1.214) 1.578 28.229 ( -7.454 -0.000 14.022) 15.880 28.597 ( -0.532 -0.000 -3.166) 3.210 28.732 ( 1.138 0.000 -12.613) 12.664 28.814 ( -10.003 -0.000 -8.927) 13.407 29.015 ( -0.644 -0.000 -2.293) 2.382 29.244 ( -0.356 -0.000 0.080) 0.365 29.663 ( 6.134 0.000 8.470) 10.458 29.912 ( 11.018 0.000 -4.598) 11.939 ======================= Grid point 314 (164/186) ======================= q-point: (-0.12 -0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( -11.359 -1.160 1.176) 11.478 1.943 ( 1.222 -0.891 14.912) 14.988 2.131 ( -8.395 10.289 0.375) 13.285 2.348 ( -3.983 2.420 2.492) 5.285 2.568 ( -2.154 -11.353 1.696) 11.679 2.978 ( 1.384 -2.100 10.504) 10.801 3.649 ( -18.307 1.771 12.989) 22.517 3.802 ( -9.242 -7.585 13.481) 18.019 5.005 ( -10.296 5.518 -8.367) 14.369 5.366 ( 9.101 0.362 -4.202) 10.031 5.455 ( 4.954 -3.832 -15.750) 16.950 5.664 ( 4.704 1.083 6.939) 8.453 6.018 ( 5.283 1.352 -2.295) 5.917 6.208 ( -0.327 -1.656 1.923) 2.559 6.716 ( -0.632 5.570 6.048) 8.246 7.109 ( 4.177 8.992 3.613) 10.553 7.353 ( -1.974 -1.795 0.488) 2.713 7.469 ( -5.259 -7.976 10.645) 14.304 7.546 ( -3.124 6.024 -7.020) 9.764 7.835 ( -5.066 -7.774 -3.788) 10.023 8.137 ( 1.107 -1.530 -1.382) 2.340 8.264 ( 1.060 -3.099 7.588) 8.265 8.808 ( -17.270 -0.382 11.184) 20.578 9.095 ( 6.199 4.217 7.414) 10.544 9.323 ( -0.634 -3.760 21.077) 21.419 9.377 ( -11.409 -1.351 37.444) 39.167 9.993 ( 1.864 -2.579 14.596) 14.939 10.125 ( -6.402 6.823 3.981) 10.168 10.367 ( 7.182 -3.382 -8.841) 11.882 10.710 ( 8.781 -5.302 -26.703) 28.605 10.874 ( 7.382 1.857 -22.669) 23.913 11.368 ( 0.262 4.373 -11.926) 12.706 11.574 ( -6.988 -0.706 6.561) 9.611 11.865 ( -2.065 0.121 -18.157) 18.275 11.911 ( -3.387 -0.672 -7.770) 8.503 12.219 ( -8.900 -1.998 4.975) 10.390 12.835 ( -5.282 -1.207 -11.340) 12.568 13.298 ( 4.494 -1.985 -11.240) 12.266 14.295 ( 21.070 8.051 -6.320) 23.424 14.843 ( 4.083 2.080 1.418) 4.797 15.706 ( 4.684 3.595 16.323) 17.358 15.872 ( -6.278 -0.245 6.107) 8.762 15.951 ( -6.616 -2.850 5.912) 9.319 16.597 ( 2.867 5.140 0.195) 5.889 18.205 ( 8.909 -1.173 17.760) 19.904 18.580 ( -0.796 1.257 6.167) 6.344 18.949 ( 8.126 -6.034 -20.782) 23.116 19.614 ( 5.357 3.195 -20.879) 21.790 25.898 ( -3.758 -2.801 7.940) 9.220 26.213 ( -4.552 -1.289 11.403) 12.345 26.510 ( -1.559 -0.146 -3.692) 4.010 27.246 ( -10.391 -0.034 -7.876) 13.039 28.187 ( -7.803 -1.169 14.419) 16.437 28.574 ( -1.952 -0.093 -0.208) 1.965 28.661 ( 0.166 3.463 -7.654) 8.402 28.762 ( 0.109 -2.322 -4.242) 4.837 29.021 ( -1.859 -3.961 -2.422) 5.002 29.228 ( -0.755 1.061 -1.383) 1.899 29.767 ( 5.327 -0.568 6.302) 8.272 30.011 ( 11.783 4.888 -4.303) 13.462 ======================= Grid point 322 (165/186) ======================= q-point: (-0.12 -0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( -7.810 -0.000 3.316) 8.485 1.920 ( -12.478 -0.000 11.910) 17.250 2.207 ( 7.056 0.000 0.566) 7.079 2.326 ( -7.078 -0.000 9.641) 11.960 2.468 ( 3.238 0.000 -3.163) 4.527 2.986 ( -3.019 -0.000 5.475) 6.252 3.454 ( -17.294 -0.000 19.898) 26.364 3.754 ( -1.402 -0.000 12.935) 13.010 4.865 ( -12.001 -0.000 -11.919) 16.914 5.337 ( 0.831 0.000 -20.557) 20.573 5.519 ( 10.285 0.000 -5.088) 11.474 5.759 ( 2.550 0.000 10.531) 10.835 6.130 ( -7.851 -0.000 1.612) 8.015 6.136 ( 8.679 0.000 -2.978) 9.176 6.788 ( 0.283 0.000 7.743) 7.748 7.252 ( 3.109 0.000 7.339) 7.971 7.318 ( -1.141 -0.000 2.793) 3.017 7.379 ( -3.983 -0.000 9.587) 10.382 7.513 ( -4.762 -0.000 -10.849) 11.848 7.722 ( -0.689 -0.000 -1.678) 1.814 8.141 ( 2.646 0.000 -2.035) 3.338 8.305 ( 3.153 0.000 6.997) 7.675 8.625 ( -16.000 -0.000 12.198) 20.120 9.234 ( 6.469 0.000 -3.351) 7.285 9.330 ( -12.973 -0.000 39.866) 41.924 9.378 ( -1.198 -0.000 32.001) 32.023 9.962 ( -8.760 -0.000 8.712) 12.355 10.162 ( -2.250 -0.000 19.340) 19.470 10.425 ( 9.254 0.000 -11.766) 14.969 10.669 ( 5.195 0.000 -24.188) 24.740 10.912 ( 11.317 0.000 -28.409) 30.580 11.356 ( 0.241 0.000 -12.234) 12.236 11.509 ( -6.515 -0.000 8.047) 10.354 11.669 ( -5.269 -0.000 -39.291) 39.643 11.961 ( 6.506 0.000 7.012) 9.566 12.145 ( -5.313 -0.000 6.595) 8.469 12.710 ( -6.138 -0.000 -12.345) 13.786 13.268 ( 1.689 0.000 -18.912) 18.987 14.619 ( 23.126 0.000 -5.370) 23.741 14.902 ( 0.770 0.000 3.346) 3.434 15.807 ( -4.524 -0.000 0.536) 4.556 15.830 ( -11.562 -0.000 10.356) 15.522 15.880 ( 5.713 0.000 19.579) 20.396 16.655 ( 1.288 0.000 -3.141) 3.395 18.330 ( -0.685 -0.000 16.935) 16.949 18.644 ( 7.634 0.000 6.621) 10.105 18.939 ( 8.358 0.000 -20.915) 22.523 19.625 ( 4.371 0.000 -20.974) 21.424 25.862 ( -3.414 -0.000 9.656) 10.242 26.206 ( -0.762 -0.000 10.960) 10.986 26.467 ( -3.031 -0.000 -4.182) 5.165 27.029 ( -15.693 -0.000 -13.079) 20.428 28.137 ( -6.904 -0.000 15.725) 17.174 28.589 ( 1.771 0.000 5.028) 5.331 28.657 ( -0.766 -0.000 -9.625) 9.656 28.748 ( 2.914 0.000 -0.324) 2.932 28.962 ( -2.295 -0.000 -1.778) 2.904 29.215 ( -0.504 -0.000 -4.642) 4.669 29.848 ( 3.516 0.000 7.897) 8.645 30.179 ( 11.693 0.000 -5.828) 13.064 ======================= Grid point 323 (166/186) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 93 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( -9.328 -0.000 -6.762) 11.522 1.586 ( 9.328 0.000 6.762) 11.522 2.376 ( 3.538 0.000 -4.378) 5.629 2.376 ( -3.538 -0.000 4.378) 5.629 2.630 ( -11.693 -0.000 -6.809) 13.531 2.630 ( 11.693 0.000 6.809) 13.531 3.982 ( -10.787 -0.000 -15.112) 18.568 3.982 ( 10.787 0.000 15.112) 18.568 4.564 ( -5.500 -0.000 -23.583) 24.216 4.564 ( 5.500 0.000 23.583) 24.216 5.776 ( -10.371 -0.000 -0.405) 10.379 5.776 ( 10.371 0.000 0.405) 10.379 6.124 ( 4.677 0.000 -8.315) 9.540 6.124 ( -4.677 -0.000 8.315) 9.540 7.102 ( -1.589 -0.000 -12.147) 12.250 7.102 ( 1.589 0.000 12.147) 12.250 7.369 ( 4.134 0.000 -2.552) 4.858 7.369 ( -4.134 -0.000 2.552) 4.858 7.623 ( 1.927 0.000 -9.009) 9.213 7.623 ( -1.927 -0.000 9.009) 9.213 8.240 ( -7.931 -0.000 0.392) 7.941 8.240 ( 7.931 0.000 -0.392) 7.941 8.924 ( -4.412 -0.000 -16.202) 16.792 8.924 ( 4.412 0.000 16.202) 16.792 10.018 ( -1.877 -0.000 -19.415) 19.506 10.018 ( 1.877 0.000 19.415) 19.506 10.286 ( 20.525 0.000 -44.444) 48.954 10.286 ( -20.525 -0.000 44.444) 48.954 10.372 ( 8.096 0.000 -36.278) 37.170 10.372 ( -8.096 -0.000 36.278) 37.170 10.573 ( 0.246 0.000 -20.153) 20.155 10.573 ( -0.246 -0.000 20.153) 20.155 11.389 ( -11.075 -0.000 0.837) 11.106 11.389 ( 11.075 0.000 -0.837) 11.106 12.217 ( 1.047 0.000 -5.015) 5.123 12.217 ( -1.047 -0.000 5.015) 5.123 12.647 ( -2.802 -0.000 -19.487) 19.687 12.647 ( 2.802 0.000 19.487) 19.687 14.928 ( 11.647 0.000 -6.124) 13.159 14.928 ( -11.647 -0.000 6.124) 13.159 15.772 ( 5.971 0.000 -3.964) 7.167 15.772 ( -5.971 -0.000 3.964) 7.167 16.411 ( -2.642 -0.000 -12.159) 12.443 16.411 ( 2.642 0.000 12.159) 12.443 18.619 ( 8.065 0.000 -18.127) 19.840 18.619 ( -8.065 -0.000 18.127) 19.840 19.142 ( -0.629 -0.000 -18.297) 18.308 19.142 ( 0.629 0.000 18.297) 18.308 26.160 ( -5.259 -0.000 -10.180) 11.458 26.160 ( 5.259 0.000 10.180) 11.458 26.478 ( -2.700 -0.000 -8.799) 9.204 26.478 ( 2.700 0.000 8.799) 9.204 28.392 ( 2.411 0.000 -11.491) 11.741 28.392 ( -2.411 -0.000 11.491) 11.741 28.827 ( -2.689 -0.000 -4.686) 5.402 28.827 ( 2.689 0.000 4.686) 5.402 28.958 ( -3.543 -0.000 -8.462) 9.174 28.958 ( 3.543 0.000 8.462) 9.174 30.131 ( 4.094 0.000 -11.753) 12.445 30.131 ( -4.094 -0.000 11.753) 12.445 ======================= Grid point 325 (167/186) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( -3.043 -3.232 -5.635) 7.174 1.755 ( 11.203 -0.390 7.329) 13.393 2.330 ( -2.691 4.067 -4.651) 6.739 2.342 ( -0.523 3.564 1.078) 3.760 2.561 ( -3.358 -7.769 -2.370) 8.789 2.819 ( 10.834 -2.013 7.344) 13.243 3.842 ( -2.325 -0.574 -17.040) 17.208 4.184 ( 13.571 -0.832 6.900) 15.248 4.448 ( -3.839 -1.423 -16.971) 17.457 4.768 ( 6.523 -6.970 24.904) 26.671 5.621 ( -13.042 1.705 1.816) 13.278 5.876 ( 6.663 1.242 -1.347) 6.911 6.058 ( -5.874 3.087 3.103) 7.325 6.151 ( 3.580 0.235 -3.062) 4.717 6.986 ( 0.232 7.295 -11.943) 13.997 7.075 ( 0.756 9.772 10.315) 14.229 7.375 ( -2.914 -3.147 4.210) 6.009 7.411 ( 0.994 0.179 -3.879) 4.008 7.651 ( -0.008 -6.061 -4.327) 7.448 7.682 ( 0.355 -8.300 3.005) 8.835 8.165 ( -6.561 -2.163 1.940) 7.175 8.346 ( 6.984 -1.258 -0.136) 7.098 8.845 ( -1.111 -1.692 -15.218) 15.352 9.050 ( 3.911 -2.465 13.994) 14.738 9.867 ( -5.716 6.598 -7.619) 11.587 10.076 ( 0.646 2.586 19.535) 19.716 10.170 ( -15.795 2.133 32.079) 35.820 10.264 ( 3.662 6.779 -15.240) 17.077 10.340 ( 6.802 0.139 -31.088) 31.824 10.422 ( 4.917 -2.886 -16.198) 17.172 10.555 ( -1.898 -1.905 -0.530) 2.741 10.754 ( 7.890 -5.935 18.338) 20.827 11.300 ( -7.033 -3.390 0.921) 7.862 11.561 ( 13.457 -3.502 -4.013) 14.473 12.199 ( -2.304 -0.455 -2.579) 3.488 12.218 ( -2.350 -1.776 -1.183) 3.174 12.598 ( 2.019 -2.500 -11.904) 12.330 12.779 ( 4.798 -2.018 19.408) 20.094 14.709 ( -17.875 7.242 4.855) 19.888 14.966 ( 4.754 5.395 -6.006) 9.369 15.728 ( -3.292 0.905 5.439) 6.422 15.857 ( 8.843 -0.060 -2.870) 9.297 16.319 ( -5.226 -0.308 -11.530) 12.663 16.454 ( -1.047 1.876 12.373) 12.559 18.572 ( -5.780 1.998 10.757) 12.374 18.667 ( 8.233 -0.186 -11.978) 14.536 19.047 ( -4.496 -0.370 -17.106) 17.691 19.179 ( -2.735 1.701 17.595) 17.887 26.093 ( -1.043 -1.167 -10.312) 10.430 26.270 ( 6.413 0.874 7.580) 9.967 26.454 ( -0.242 -3.260 -7.441) 8.127 26.594 ( 7.384 -3.781 10.373) 13.282 28.395 ( 2.451 -0.765 -8.134) 8.529 28.418 ( -0.789 -1.416 9.104) 9.247 28.772 ( -3.542 -0.201 -4.614) 5.820 28.867 ( 0.479 -0.279 1.012) 1.154 28.897 ( -2.956 -1.517 -3.383) 4.742 29.041 ( 4.251 -1.319 5.726) 7.253 30.067 ( -7.076 4.387 9.063) 12.307 30.095 ( 0.934 3.644 -11.162) 11.779 ======================= Grid point 326 (168/186) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( 1.927 -5.107 -3.863) 6.687 1.859 ( 3.970 4.636 7.078) 9.346 2.225 ( 0.180 1.622 -9.562) 9.700 2.316 ( -0.734 0.915 2.221) 2.512 2.684 ( 3.442 -8.672 0.645) 9.352 2.981 ( 7.647 -0.768 6.046) 9.779 3.826 ( 5.520 -0.686 -12.914) 14.061 4.340 ( -0.655 -10.231 -23.878) 25.986 4.447 ( 13.865 4.499 14.191) 20.344 5.070 ( 6.335 -11.763 22.161) 25.877 5.412 ( -15.784 4.307 6.203) 17.497 5.840 ( -6.147 5.246 -3.465) 8.792 5.977 ( 1.564 2.157 -2.307) 3.524 6.180 ( 3.185 1.332 0.344) 3.469 6.845 ( 0.637 9.285 -11.317) 14.652 6.973 ( -0.223 7.974 5.568) 9.728 7.352 ( -1.818 3.081 1.539) 3.894 7.404 ( 0.039 -1.272 0.136) 1.280 7.744 ( -1.228 -8.494 -0.373) 8.590 7.850 ( 1.628 -11.523 0.849) 11.668 8.157 ( -3.642 -4.664 2.747) 6.524 8.425 ( 2.557 -1.646 -2.924) 4.219 8.837 ( 4.665 0.409 -9.526) 10.615 9.177 ( 1.645 -5.665 7.463) 9.513 9.697 ( -3.427 7.128 -0.195) 7.912 10.011 ( -16.253 4.277 26.533) 31.408 10.085 ( -0.903 5.660 4.958) 7.579 10.207 ( 4.706 0.695 -11.171) 12.142 10.331 ( 6.195 0.299 -18.485) 19.497 10.453 ( 4.154 -3.193 -19.843) 20.523 10.557 ( -1.499 -0.171 4.166) 4.431 10.958 ( 8.195 0.732 15.651) 17.682 11.311 ( -4.703 -7.340 2.663) 9.115 11.769 ( 11.636 -4.938 -7.686) 14.794 12.164 ( -2.978 -1.005 -3.641) 4.810 12.196 ( -2.008 -1.854 -5.200) 5.875 12.702 ( 7.654 -7.213 -1.600) 10.638 12.943 ( 4.871 -3.354 16.872) 17.878 14.340 ( -20.429 12.629 2.170) 24.116 14.890 ( 0.821 6.927 -5.126) 8.657 15.697 ( -1.891 1.960 6.950) 7.465 15.958 ( 8.601 0.192 -2.568) 8.978 16.220 ( -5.961 -1.295 -10.847) 12.444 16.416 ( -4.112 4.562 11.201) 12.774 18.496 ( -3.422 3.284 2.120) 5.195 18.746 ( 7.906 0.026 -2.906) 8.423 18.942 ( -6.106 -3.020 -15.976) 17.368 19.153 ( -4.621 3.309 15.305) 16.326 26.087 ( 1.149 -1.994 -8.335) 8.646 26.323 ( 2.848 1.859 2.903) 4.471 26.497 ( 1.237 -3.871 -3.907) 5.637 26.835 ( 12.859 -5.939 11.103) 17.997 28.415 ( 2.680 -0.836 -5.002) 5.736 28.465 ( 0.588 -1.759 5.071) 5.399 28.715 ( -3.880 -0.653 -5.188) 6.511 28.818 ( -4.336 -0.617 -6.030) 7.452 28.949 ( 0.574 -4.257 8.300) 9.346 29.135 ( 4.924 -1.905 2.056) 5.666 29.905 ( -9.160 7.712 6.264) 13.514 29.991 ( -0.900 5.711 -9.951) 11.509 ======================= Grid point 327 (169/186) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( 2.667 -3.815 -1.753) 4.973 1.805 ( -1.493 4.909 2.780) 5.835 2.220 ( 2.411 -0.300 -5.150) 5.694 2.310 ( -0.066 0.138 0.668) 0.686 2.847 ( 3.924 -6.748 0.367) 7.814 3.063 ( 3.390 1.170 3.236) 4.830 3.864 ( 4.176 0.790 -5.398) 6.870 4.426 ( 7.924 -9.641 -18.906) 22.654 4.651 ( 9.772 -0.847 11.247) 14.924 5.181 ( -12.237 4.796 9.234) 16.063 5.310 ( -3.426 -5.658 11.527) 13.290 5.674 ( -3.156 2.512 -2.600) 4.799 5.972 ( 1.540 1.029 -2.267) 2.928 6.195 ( 2.849 2.068 0.940) 3.644 6.654 ( -3.366 9.723 -7.051) 12.473 6.923 ( 1.255 2.155 -0.253) 2.507 7.300 ( -0.940 2.276 1.208) 2.743 7.438 ( 1.135 -1.585 1.315) 2.351 7.825 ( -1.226 -5.058 0.746) 5.258 8.007 ( 1.408 -7.280 0.403) 7.426 8.207 ( -1.661 -5.314 2.582) 6.138 8.435 ( -0.643 -0.542 -4.685) 4.760 8.859 ( 5.452 3.143 -2.847) 6.907 9.307 ( 0.966 -9.672 -1.706) 9.869 9.578 ( -0.801 8.385 4.417) 9.511 9.851 ( -11.508 2.539 15.124) 19.173 9.996 ( 0.473 4.926 -5.990) 7.770 10.236 ( 0.749 -0.839 1.813) 2.134 10.352 ( 4.129 -0.080 -8.500) 9.450 10.486 ( 3.432 -4.634 -19.506) 20.340 10.548 ( -1.062 2.504 9.001) 9.403 11.052 ( 6.099 3.905 8.468) 11.142 11.374 ( -3.539 -6.705 3.674) 8.425 11.875 ( 2.592 -1.279 -7.568) 8.101 12.128 ( -0.916 0.996 -1.446) 1.980 12.227 ( 1.877 -4.410 -3.921) 6.193 12.954 ( 10.765 -11.345 -2.748) 15.879 13.102 ( 5.315 -3.215 16.298) 17.442 13.894 ( -19.936 14.764 -1.766) 24.871 14.790 ( -0.440 4.889 -3.206) 5.863 15.679 ( -0.629 1.498 5.890) 6.110 16.043 ( 6.604 0.545 -2.740) 7.170 16.142 ( -4.183 -2.702 -8.719) 10.041 16.317 ( -5.270 5.638 8.802) 11.706 18.428 ( -1.551 2.027 -0.807) 2.677 18.807 ( 1.870 2.237 3.501) 4.556 18.905 ( 1.008 -6.222 -16.001) 17.198 19.087 ( -5.327 3.844 12.080) 13.750 26.106 ( 1.149 -1.637 -4.664) 5.074 26.331 ( 1.154 1.265 0.912) 1.940 26.543 ( 0.737 -2.227 -1.704) 2.899 27.096 ( 10.250 -4.097 8.091) 13.686 28.451 ( 3.686 -0.539 -3.596) 5.177 28.508 ( 1.022 -1.053 2.525) 2.921 28.653 ( -5.214 -0.879 -4.262) 6.791 28.758 ( -2.999 0.014 -2.541) 3.931 29.069 ( 0.089 -7.318 9.980) 12.376 29.222 ( 5.842 -0.800 -3.674) 6.947 29.695 ( -8.748 7.797 4.496) 12.552 29.868 ( -1.090 5.013 -7.248) 8.880 ======================= Grid point 328 (170/186) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( 0.000 -0.000 -0.000) 0.000 1.761 ( 0.000 0.000 -0.000) 0.000 2.230 ( 0.000 0.000 -0.000) 0.000 2.311 ( 0.000 -0.000 -0.000) 0.000 2.928 ( 0.000 -0.000 -0.000) 0.000 3.074 ( 0.000 -0.000 -0.000) 0.000 3.871 ( 0.000 -0.000 -0.000) 0.000 4.628 ( -0.000 0.000 0.000) 0.000 4.643 ( 0.000 -0.000 -0.000) 0.000 5.161 ( -0.000 0.000 -0.000) 0.000 5.213 ( 0.000 -0.000 -0.000) 0.000 5.688 ( 0.000 -0.000 -0.000) 0.000 5.973 ( 0.000 -0.000 -0.000) 0.000 6.201 ( 0.000 -0.000 -0.000) 0.000 6.531 ( 0.000 -0.000 -0.000) 0.000 6.920 ( 0.000 -0.000 -0.000) 0.000 7.280 ( 0.000 -0.000 -0.000) 0.000 7.462 ( 0.000 -0.000 -0.000) 0.000 7.853 ( 0.000 -0.000 -0.000) 0.000 8.069 ( 0.000 -0.000 -0.000) 0.000 8.246 ( 0.000 -0.000 -0.000) 0.000 8.419 ( 0.000 -0.000 -0.000) 0.000 8.865 ( 0.000 0.000 -0.000) 0.000 9.431 ( 0.000 0.000 0.000) 0.000 9.472 ( 0.000 -0.000 -0.000) 0.000 9.786 ( 0.000 -0.000 -0.000) 0.000 9.951 ( -0.000 -0.000 0.000) 0.000 10.250 ( 0.000 -0.000 -0.000) 0.000 10.365 ( 0.000 0.000 -0.000) 0.000 10.523 ( 0.000 -0.000 -0.000) 0.000 10.525 ( -0.000 0.000 0.000) 0.000 11.077 ( 0.000 0.000 -0.000) 0.000 11.407 ( 0.000 -0.000 0.000) 0.000 11.874 ( 0.000 0.000 -0.000) 0.000 12.112 ( -0.000 -0.000 -0.000) 0.000 12.272 ( 0.000 -0.000 -0.000) 0.000 13.097 ( 0.000 0.000 0.000) 0.000 13.328 ( -0.000 0.000 -0.000) 0.000 13.523 ( 0.000 -0.000 0.000) 0.000 14.745 ( 0.000 -0.000 -0.000) 0.000 15.677 ( 0.000 -0.000 -0.000) 0.000 16.062 ( 0.000 -0.000 -0.000) 0.000 16.155 ( 0.000 -0.000 -0.000) 0.000 16.232 ( 0.000 -0.000 -0.000) 0.000 18.403 ( 0.000 -0.000 -0.000) 0.000 18.797 ( 0.000 -0.000 -0.000) 0.000 18.964 ( 0.000 -0.000 0.000) 0.000 19.022 ( 0.000 -0.000 -0.000) 0.000 26.118 ( 0.000 -0.000 -0.000) 0.000 26.330 ( 0.000 -0.000 -0.000) 0.000 26.560 ( 0.000 -0.000 -0.000) 0.000 27.210 ( 0.000 -0.000 -0.000) 0.000 28.479 ( 0.000 -0.000 -0.000) 0.000 28.534 ( 0.000 -0.000 -0.000) 0.000 28.602 ( 0.000 -0.000 0.000) 0.000 28.734 ( 0.000 -0.000 0.000) 0.000 29.163 ( 0.000 0.000 -0.000) 0.000 29.259 ( 0.000 -0.000 0.000) 0.000 29.572 ( 0.000 -0.000 -0.000) 0.000 29.808 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 334 (171/186) ======================= q-point: ( 0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( 3.960 0.000 -3.998) 5.628 1.939 ( 12.239 0.000 8.263) 14.767 2.274 ( -6.995 -0.000 -4.183) 8.150 2.408 ( -1.549 -0.000 0.648) 1.679 2.457 ( 5.348 0.000 -4.380) 6.912 2.960 ( 8.893 0.000 6.408) 10.962 3.814 ( 7.631 0.000 -13.895) 15.853 4.196 ( 1.428 0.000 -28.566) 28.601 4.559 ( 14.273 0.000 17.522) 22.600 4.863 ( 4.822 0.000 21.790) 22.317 5.471 ( -13.994 -0.000 2.015) 14.138 5.925 ( 1.301 0.000 -4.824) 4.996 6.009 ( -9.232 -0.000 7.905) 12.154 6.191 ( 5.352 0.000 -4.520) 7.006 6.999 ( 0.164 0.000 -12.535) 12.536 7.231 ( 0.791 0.000 12.736) 12.760 7.292 ( -2.681 -0.000 3.413) 4.340 7.405 ( -0.512 -0.000 -3.397) 3.436 7.599 ( 2.848 0.000 -11.294) 11.648 7.635 ( -0.748 -0.000 7.244) 7.283 8.086 ( -4.717 -0.000 4.235) 6.339 8.392 ( 1.883 0.000 -2.980) 3.525 8.832 ( 8.899 0.000 -11.279) 14.367 9.092 ( -1.798 -0.000 10.821) 10.969 9.834 ( -2.007 -0.000 -15.091) 15.224 10.069 ( -17.474 -0.000 38.530) 42.307 10.087 ( -13.225 -0.000 28.107) 31.063 10.270 ( 9.097 0.000 -45.729) 46.625 10.371 ( -0.775 -0.000 16.723) 16.741 10.405 ( 8.280 0.000 -32.954) 33.978 10.561 ( 7.396 0.000 -22.401) 23.590 10.916 ( 10.847 0.000 31.879) 33.674 11.232 ( -2.088 -0.000 3.458) 4.039 11.682 ( 13.377 0.000 -10.358) 16.918 12.116 ( -5.938 -0.000 -5.665) 8.207 12.220 ( 3.420 0.000 -0.469) 3.452 12.596 ( 4.588 0.000 -3.128) 5.553 12.888 ( 4.483 0.000 17.524) 18.088 14.529 ( -21.116 -0.000 3.900) 21.473 14.989 ( -2.613 -0.000 -5.024) 5.663 15.737 ( -0.563 -0.000 7.052) 7.075 15.965 ( 8.913 0.000 -2.883) 9.368 16.191 ( -7.204 -0.000 -11.035) 13.179 16.487 ( -3.183 -0.000 12.978) 13.363 18.558 ( -6.964 -0.000 16.496) 17.905 18.721 ( 10.244 0.000 -19.473) 22.004 18.891 ( -8.782 -0.000 -19.692) 21.562 19.213 ( -4.419 -0.000 19.804) 20.291 26.054 ( 1.420 0.000 -9.732) 9.835 26.378 ( 4.384 0.000 5.036) 6.677 26.414 ( 2.809 0.000 -10.002) 10.389 26.746 ( 14.302 0.000 14.909) 20.660 28.404 ( 4.502 0.000 -9.532) 10.542 28.429 ( -1.565 -0.000 12.287) 12.386 28.712 ( -3.265 -0.000 -5.143) 6.092 28.807 ( -3.483 -0.000 -9.388) 10.013 28.896 ( -0.132 -0.000 6.752) 6.753 29.100 ( 3.510 0.000 5.751) 6.738 30.022 ( -10.140 -0.000 9.655) 14.001 30.074 ( -0.837 -0.000 -14.241) 14.266 ======================= Grid point 335 (172/186) ======================= q-point: ( 0.25 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( 8.441 -1.457 -2.036) 8.804 2.018 ( 0.765 7.753 7.194) 10.604 2.200 ( 2.057 -0.519 -7.342) 7.642 2.375 ( 3.356 3.589 -0.424) 4.932 2.599 ( 4.254 -9.501 -1.705) 10.548 3.063 ( 3.946 -0.608 2.428) 4.673 3.915 ( 13.770 2.101 -10.386) 17.375 4.163 ( 4.120 -6.760 -23.404) 24.707 4.753 ( 13.564 6.484 14.933) 21.191 5.063 ( 4.280 -9.260 18.950) 21.522 5.288 ( -13.665 2.143 3.864) 14.361 5.823 ( -7.080 6.273 -3.072) 9.945 5.955 ( -4.446 -2.644 0.780) 5.231 6.234 ( 3.413 0.677 -2.426) 4.241 6.924 ( 1.814 5.733 -13.237) 14.539 7.103 ( -4.712 11.953 6.293) 14.307 7.356 ( -1.819 -3.026 -0.579) 3.578 7.392 ( 1.317 0.336 5.817) 5.974 7.661 ( 4.095 -5.592 -4.853) 8.462 7.722 ( 1.050 -9.129 4.466) 10.217 8.082 ( -1.440 -2.212 4.710) 5.399 8.388 ( -1.096 -2.078 -5.833) 6.288 8.942 ( 10.174 2.679 -3.749) 11.169 9.089 ( -4.811 -5.545 2.763) 7.844 9.747 ( 1.195 3.336 -10.954) 11.513 9.939 ( -18.232 2.759 36.053) 40.495 10.065 ( -7.961 -2.098 13.856) 16.117 10.228 ( 6.927 1.262 -29.300) 30.134 10.356 ( 2.285 1.400 -17.450) 17.655 10.419 ( 5.110 0.663 -7.451) 9.059 10.573 ( 2.272 -1.041 -9.800) 10.114 11.164 ( 9.529 2.038 19.821) 22.087 11.252 ( 2.728 -1.385 12.365) 12.738 11.814 ( 9.932 -2.890 -13.205) 16.774 12.040 ( -4.108 -1.971 -7.393) 8.684 12.278 ( 8.895 2.959 0.327) 9.380 12.700 ( 6.413 -5.800 1.667) 8.806 13.012 ( 3.763 -2.390 14.767) 15.425 14.220 ( -21.546 7.140 2.148) 22.799 14.897 ( -6.124 2.257 -3.651) 7.479 15.744 ( -0.173 2.707 7.735) 8.197 16.011 ( -3.638 -3.273 -4.035) 6.343 16.123 ( 4.582 1.358 -9.498) 10.632 16.456 ( -5.226 3.255 12.653) 14.072 18.496 ( -6.786 2.819 9.339) 11.884 18.721 ( -8.843 -4.383 -21.040) 23.240 18.810 ( 8.941 -1.995 -13.241) 16.101 19.202 ( -4.975 2.895 19.712) 20.536 26.055 ( 1.998 -1.316 -7.979) 8.330 26.390 ( 2.841 2.643 -1.901) 4.321 26.469 ( 3.276 -2.941 -3.674) 5.734 27.016 ( 16.429 -1.583 13.908) 21.584 28.434 ( 3.927 -0.219 -4.735) 6.155 28.464 ( -0.520 -1.662 8.182) 8.366 28.651 ( -2.824 0.346 -6.393) 6.998 28.747 ( -1.931 -0.509 -5.978) 6.303 28.929 ( -0.936 -2.419 8.016) 8.425 29.169 ( 2.985 -1.681 4.190) 5.413 29.885 ( -11.164 4.409 7.337) 14.068 29.988 ( -1.716 2.573 -14.342) 14.672 ======================= Grid point 336 (173/186) ======================= q-point: ( 0.38 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( 8.103 0.162 -0.888) 8.153 1.902 ( -0.388 8.176 2.273) 8.495 2.221 ( 2.028 0.452 -3.109) 3.740 2.382 ( 5.156 3.755 -0.601) 6.407 2.772 ( 2.770 -9.069 -1.878) 9.667 3.085 ( -1.393 -0.267 -1.777) 2.273 3.946 ( 6.060 4.626 -10.799) 13.219 4.377 ( 17.187 -10.626 -11.745) 23.371 4.792 ( -3.978 6.379 12.933) 14.959 5.161 ( -0.359 0.618 5.386) 5.433 5.257 ( -1.123 -2.200 11.651) 11.910 5.661 ( -2.755 2.213 -3.445) 4.935 5.942 ( -3.581 -2.599 -0.255) 4.432 6.232 ( -0.701 1.063 -3.048) 3.303 6.753 ( -1.779 13.266 -8.112) 15.651 6.954 ( -1.160 3.774 -1.482) 4.217 7.347 ( 0.588 2.508 1.488) 2.975 7.435 ( 0.907 -0.992 4.660) 4.850 7.792 ( 5.393 -4.886 0.292) 7.283 7.901 ( 1.246 -11.461 3.952) 12.187 8.121 ( -1.216 -3.279 3.350) 4.843 8.398 ( 0.440 -2.592 -4.583) 5.283 8.894 ( -9.642 0.138 3.502) 10.259 9.220 ( 10.181 -5.239 -6.206) 13.024 9.700 ( 2.786 5.597 -2.727) 6.821 9.808 ( -9.809 3.102 18.376) 21.059 10.018 ( -4.459 0.830 2.465) 5.162 10.197 ( 0.753 -0.332 -12.461) 12.488 10.336 ( 2.191 -2.707 -17.174) 17.524 10.442 ( 4.477 0.200 -9.141) 10.180 10.572 ( -2.967 -0.928 3.587) 4.747 11.164 ( -0.947 5.198 3.997) 6.625 11.446 ( 11.928 1.941 20.824) 24.077 11.886 ( 4.496 0.110 -7.356) 8.622 12.021 ( -2.163 -4.148 -7.553) 8.884 12.360 ( 11.064 4.674 2.966) 12.372 12.911 ( 7.943 -10.080 -3.796) 13.383 13.156 ( 4.535 -5.239 12.369) 14.177 13.830 ( -19.168 12.149 0.887) 22.711 14.773 ( -7.268 1.500 -1.948) 7.673 15.708 ( -2.303 2.554 4.013) 5.285 16.011 ( -3.233 -5.758 -3.603) 7.522 16.143 ( 7.421 3.264 -6.840) 10.607 16.362 ( -6.033 5.629 11.257) 13.958 18.406 ( -5.602 0.564 1.768) 5.902 18.635 ( -7.606 -7.430 -15.930) 19.152 18.917 ( 8.495 -2.856 -10.520) 13.820 19.152 ( -4.513 5.221 19.063) 20.273 26.079 ( 1.463 -2.000 -5.095) 5.665 26.376 ( 1.152 2.526 -0.978) 2.944 26.534 ( 3.649 -1.741 -2.988) 5.028 27.227 ( 8.581 1.014 7.025) 11.136 28.465 ( 0.409 -0.655 -0.717) 1.054 28.508 ( -0.397 -1.703 4.779) 5.089 28.613 ( 2.775 0.437 -4.338) 5.168 28.732 ( 0.580 -0.119 -1.878) 1.969 29.001 ( -1.658 -5.988 9.670) 11.494 29.247 ( 3.316 -2.567 0.072) 4.194 29.693 ( -9.940 6.424 5.351) 12.989 29.877 ( -1.313 3.336 -12.831) 13.322 ======================= Grid point 337 (174/186) ======================= q-point: ( 0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 4.938 3.325 -1.743) 6.203 1.835 ( 2.958 5.835 3.219) 7.291 2.218 ( -0.132 0.496 -0.318) 0.604 2.383 ( 4.168 4.483 -0.067) 6.122 2.879 ( -0.517 -4.926 -3.407) 6.011 3.033 ( -5.457 -0.256 -3.265) 6.364 3.909 ( 2.983 4.007 -6.809) 8.445 4.600 ( -14.119 4.754 9.018) 17.414 4.694 ( 14.144 -3.365 -2.771) 14.800 5.154 ( -1.239 5.066 -1.055) 5.321 5.307 ( 10.436 -2.159 5.337) 11.918 5.677 ( 0.406 -2.089 -2.039) 2.948 5.930 ( -4.529 -1.973 0.632) 4.980 6.156 ( -5.954 0.375 -5.676) 8.234 6.587 ( 2.101 6.127 -0.559) 6.502 6.905 ( -1.104 1.191 -4.079) 4.390 7.321 ( 1.107 3.285 2.654) 4.366 7.459 ( -0.329 0.015 1.606) 1.639 7.905 ( 6.277 0.182 1.788) 6.529 8.054 ( 2.122 -4.383 0.956) 4.963 8.171 ( -2.999 -6.735 4.984) 8.900 8.429 ( 1.424 -1.266 -1.569) 2.469 8.797 ( -9.378 -2.394 5.298) 11.034 9.373 ( 6.075 -4.486 -9.180) 11.887 9.589 ( -1.993 10.088 5.486) 11.655 9.789 ( 3.104 -1.487 -2.656) 4.347 9.974 ( -0.496 1.562 2.299) 2.824 10.183 ( -1.774 -3.605 -9.428) 10.249 10.334 ( -1.437 -1.866 -6.681) 7.084 10.468 ( 2.967 -0.933 -6.687) 7.375 10.555 ( -4.382 -1.217 7.842) 9.066 11.072 ( -3.196 5.489 2.061) 6.678 11.582 ( 10.704 7.638 10.404) 16.768 11.911 ( 2.919 1.343 1.664) 3.618 12.032 ( -0.709 -3.811 -4.046) 5.603 12.419 ( 7.667 7.141 6.695) 12.434 13.054 ( 0.804 -4.579 -8.368) 9.573 13.272 ( -9.239 3.037 -6.155) 11.510 13.576 ( 6.291 -1.908 10.987) 12.804 14.681 ( -7.527 -2.468 0.424) 7.932 15.666 ( -1.045 0.588 -1.446) 1.878 16.033 ( -2.230 -1.948 -1.204) 3.197 16.183 ( 6.061 0.139 -4.974) 7.841 16.261 ( -3.153 3.736 9.052) 10.288 18.370 ( -3.544 -2.501 2.774) 5.148 18.616 ( -5.294 -9.172 -15.953) 19.148 19.015 ( 6.530 -2.386 -9.929) 12.121 19.090 ( -2.618 6.186 19.119) 20.265 26.106 ( 0.639 -1.500 -1.202) 2.026 26.344 ( -0.787 1.848 -0.995) 2.242 26.582 ( 3.875 0.639 -1.349) 4.153 27.225 ( -3.152 4.977 -2.032) 6.232 28.452 ( -3.312 -0.221 3.821) 5.061 28.519 ( -0.393 -0.192 -1.407) 1.474 28.693 ( 8.937 0.793 3.773) 9.733 28.748 ( 2.559 0.074 0.041) 2.560 29.099 ( -3.450 -6.745 9.639) 12.260 29.279 ( 0.596 2.800 -7.850) 8.355 29.561 ( -2.797 -0.074 5.508) 6.177 29.799 ( 0.014 0.527 -8.232) 8.249 ======================= Grid point 338 (175/186) ======================= q-point: (-0.38 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( 3.154 5.866 1.044) 6.742 1.811 ( 2.368 3.216 -0.591) 4.037 2.209 ( -0.905 0.530 4.404) 4.527 2.364 ( 2.387 3.993 -0.981) 4.754 2.848 ( -4.651 2.405 -2.944) 6.007 2.963 ( -5.964 -2.042 -4.733) 7.883 3.872 ( 1.081 3.221 0.682) 3.465 4.391 ( -14.500 1.403 1.392) 14.635 4.705 ( 2.152 13.517 11.611) 17.949 5.250 ( 13.397 -5.184 -9.306) 17.116 5.391 ( 2.090 7.262 -12.419) 14.538 5.700 ( 5.925 -3.209 2.355) 7.138 5.889 ( -8.076 -3.751 5.605) 10.522 6.107 ( -3.819 -3.977 -4.156) 6.905 6.623 ( 3.727 -3.521 3.375) 6.138 6.861 ( -3.472 -1.125 -2.630) 4.498 7.316 ( 2.122 1.342 1.460) 2.905 7.438 ( -1.449 1.395 -0.188) 2.020 7.946 ( 5.650 5.412 0.857) 7.870 8.069 ( 0.174 3.512 -0.230) 3.524 8.235 ( -0.741 -2.520 2.182) 3.415 8.443 ( -2.803 -1.098 1.919) 3.570 8.788 ( -0.841 -2.545 8.480) 8.893 9.335 ( -7.665 3.412 -8.731) 12.109 9.553 ( 7.840 0.018 -2.596) 8.258 9.872 ( 4.420 -4.569 -5.157) 8.186 9.986 ( 2.530 -0.415 0.744) 2.670 10.165 ( -6.259 -3.208 -0.530) 7.053 10.313 ( -1.417 -1.016 -3.403) 3.824 10.465 ( -3.557 -0.899 0.497) 3.702 10.592 ( 3.697 -0.953 5.960) 7.078 10.960 ( -4.234 3.983 -0.917) 5.885 11.582 ( 7.403 10.887 1.553) 13.257 11.885 ( -3.944 3.168 0.077) 5.060 12.112 ( 4.858 -2.072 8.191) 9.746 12.400 ( 4.578 9.591 6.862) 12.650 12.956 ( -12.599 9.801 -6.581) 17.266 13.017 ( -3.971 1.497 -10.337) 11.174 13.938 ( 18.237 -14.602 3.496) 23.623 14.663 ( -8.078 -8.181 3.019) 11.887 15.664 ( 2.575 -0.304 -4.288) 5.011 15.975 ( -6.452 1.239 -0.330) 6.578 16.237 ( 2.283 0.171 10.609) 10.853 16.289 ( 4.837 -3.513 -7.189) 9.350 18.400 ( -1.301 -3.998 5.798) 7.163 18.627 ( -4.615 -8.434 -14.798) 17.646 19.042 ( 1.020 3.392 9.105) 9.770 19.096 ( 3.980 -0.294 -2.020) 4.473 26.124 ( 0.080 0.103 3.642) 3.644 26.302 ( -2.121 0.496 -3.092) 3.782 26.600 ( 3.646 3.468 0.693) 5.080 27.032 ( -9.688 7.783 -6.286) 13.927 28.432 ( -1.823 0.251 3.813) 4.234 28.499 ( -1.326 0.716 -1.344) 2.019 28.771 ( 5.399 3.351 5.978) 8.724 28.818 ( 6.554 -0.815 1.908) 6.875 29.121 ( -1.884 3.950 -5.080) 6.705 29.149 ( -7.347 1.196 1.234) 7.546 29.669 ( 5.963 -8.084 -0.512) 10.059 29.821 ( 0.416 -5.063 0.002) 5.080 ======================= Grid point 339 (176/186) ======================= q-point: (-0.25 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 2.692 7.342 4.886) 9.221 1.778 ( -2.105 2.020 -5.853) 6.539 2.231 ( 1.076 -0.927 8.213) 8.335 2.328 ( -0.308 1.641 -4.133) 4.457 2.745 ( -0.777 4.827 -0.035) 4.889 2.874 ( -7.193 0.925 -5.678) 9.211 3.874 ( 3.035 2.145 11.308) 11.903 4.186 ( -13.658 0.017 -12.893) 18.782 4.644 ( 7.929 12.502 24.527) 28.649 5.059 ( -9.566 12.502 -23.612) 28.378 5.530 ( 16.431 -4.330 -7.494) 18.571 5.813 ( -5.939 -3.073 2.219) 7.046 5.930 ( 3.799 -6.322 8.690) 11.398 6.101 ( -3.869 -3.626 -3.786) 6.516 6.758 ( 1.817 -7.731 5.664) 9.755 6.851 ( -2.932 -5.298 -3.603) 7.046 7.347 ( 2.756 -0.971 -0.633) 2.989 7.402 ( -1.690 0.405 0.376) 1.779 7.906 ( 3.883 9.221 -0.270) 10.009 7.971 ( -1.717 9.075 0.499) 9.249 8.249 ( 3.490 2.225 -0.238) 4.146 8.389 ( -6.460 0.809 0.617) 6.539 8.879 ( 4.764 -0.131 12.889) 13.742 9.147 ( -7.673 3.637 -11.516) 14.308 9.687 ( 9.706 -4.539 -3.306) 11.213 9.931 ( -5.104 -5.048 -5.100) 8.806 10.056 ( 5.695 -4.526 -8.546) 11.223 10.135 ( -8.107 -3.808 14.108) 16.711 10.325 ( 3.379 -0.933 -3.109) 4.685 10.433 ( -4.954 -1.268 3.501) 6.198 10.670 ( 6.494 3.082 6.058) 9.401 10.853 ( -4.884 2.413 -5.140) 7.490 11.513 ( 6.914 11.043 -0.711) 13.049 11.724 ( -9.960 7.128 0.870) 12.278 12.218 ( 4.661 1.098 10.344) 11.399 12.337 ( 2.231 7.160 -0.793) 7.541 12.727 ( -4.313 6.537 5.148) 9.372 12.870 ( -5.419 3.942 -15.418) 16.811 14.377 ( 17.738 -15.156 -2.035) 23.420 14.708 ( -9.811 -12.009 4.668) 16.195 15.705 ( 5.401 -0.359 -4.225) 6.867 15.867 ( -7.933 0.924 1.206) 8.077 16.312 ( 1.899 -1.084 11.768) 11.970 16.368 ( 3.439 -3.831 -10.625) 11.807 18.482 ( 1.725 -4.437 5.620) 7.366 18.617 ( -5.189 -4.940 -8.305) 10.968 19.067 ( 2.281 1.189 10.519) 10.829 19.130 ( 2.471 -1.078 -8.284) 8.712 26.137 ( 0.764 1.371 8.002) 8.154 26.252 ( -3.227 -0.195 -6.716) 7.454 26.586 ( 3.552 5.723 2.820) 7.302 26.772 ( -9.140 8.306 -6.112) 13.780 28.424 ( -0.431 0.896 3.723) 3.853 28.461 ( -1.240 1.286 -2.707) 3.243 28.809 ( 4.432 2.971 6.186) 8.170 28.903 ( 4.397 1.054 2.938) 5.393 28.972 ( -1.531 5.087 -7.863) 9.489 29.079 ( -6.161 0.515 -0.079) 6.183 29.865 ( 6.296 -9.231 -4.454) 12.028 29.922 ( -1.076 -7.876 5.483) 9.657 ======================= Grid point 340 (177/186) ======================= q-point: (-0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( -6.391 4.393 -6.455) 10.090 1.651 ( 6.391 4.393 6.455) 10.090 2.303 ( -0.282 -2.612 -7.706) 8.141 2.303 ( 0.282 -2.612 7.706) 8.141 2.726 ( -6.987 4.546 -4.374) 9.414 2.726 ( 6.987 4.546 4.374) 9.414 3.984 ( -5.561 0.306 -22.223) 22.911 3.984 ( 5.561 0.306 22.223) 22.911 4.697 ( -8.283 9.368 -27.304) 30.031 4.697 ( 8.283 9.368 27.304) 30.031 5.739 ( -0.277 -2.683 -4.387) 5.149 5.739 ( 0.277 -2.683 4.387) 5.149 6.081 ( -0.330 -3.152 -8.247) 8.835 6.081 ( 0.330 -3.152 8.247) 8.835 6.907 ( -0.131 -8.592 -9.542) 12.841 6.907 ( 0.131 -8.592 9.542) 12.841 7.394 ( 2.065 -1.562 -4.029) 4.789 7.394 ( -2.065 -1.562 4.029) 4.789 7.800 ( 0.729 11.149 -5.012) 12.246 7.800 ( -0.729 11.149 5.012) 12.246 8.280 ( -6.211 2.439 -0.165) 6.675 8.280 ( 6.211 2.439 0.165) 6.675 8.975 ( -4.351 2.628 -16.490) 17.256 8.975 ( 4.351 2.628 16.490) 17.256 9.888 ( -8.690 -6.483 -4.273) 11.653 9.888 ( 8.690 -6.483 4.273) 11.653 10.165 ( 5.222 -5.356 -12.840) 14.860 10.165 ( -5.222 -5.356 12.840) 14.860 10.391 ( 4.012 -0.631 -15.902) 16.413 10.391 ( -4.012 -0.631 15.902) 16.413 10.708 ( -6.828 5.688 -5.571) 10.488 10.708 ( 6.828 5.688 5.571) 10.488 11.488 ( -10.515 7.405 0.687) 12.879 11.488 ( 10.515 7.405 -0.687) 12.879 12.257 ( -1.033 2.954 -7.321) 7.962 12.257 ( 1.033 2.954 7.321) 7.962 12.700 ( -2.843 3.677 -17.696) 18.296 12.700 ( 2.843 3.677 17.696) 18.296 14.751 ( 3.409 -11.814 -6.025) 13.693 14.751 ( -3.409 -11.814 6.025) 13.693 15.772 ( 2.585 0.102 -4.632) 5.306 15.772 ( -2.585 0.102 4.632) 5.306 16.388 ( -0.527 -1.775 -11.893) 12.037 16.388 ( 0.527 -1.775 11.893) 12.037 18.588 ( 5.217 -2.704 -19.909) 20.758 18.588 ( -5.217 -2.704 19.909) 20.758 19.123 ( 0.919 -0.867 -15.236) 15.288 19.123 ( -0.919 -0.867 15.236) 15.288 26.175 ( -3.323 0.873 -9.911) 10.490 26.175 ( 3.323 0.873 9.911) 10.490 26.566 ( -2.847 5.967 -7.797) 10.222 26.566 ( 2.847 5.967 7.797) 10.222 28.420 ( 1.671 1.532 -9.217) 9.492 28.420 ( -1.671 1.532 9.217) 9.492 28.843 ( -2.389 1.942 -6.290) 7.003 28.843 ( 2.389 1.942 6.290) 7.003 28.986 ( -2.237 1.417 -7.332) 7.796 28.986 ( 2.237 1.417 7.332) 7.796 30.023 ( 3.786 -7.252 -8.720) 11.957 30.023 ( -3.786 -7.252 8.720) 11.957 ======================= Grid point 344 (178/186) ======================= q-point: ( 0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.680 ( 11.800 0.000 -0.353) 11.805 2.048 ( -3.261 -0.000 -1.535) 3.604 2.266 ( 5.529 0.000 2.314) 5.994 2.457 ( 4.824 0.000 -0.565) 4.857 2.570 ( 5.745 0.000 -4.345) 7.204 3.073 ( -1.349 -0.000 -3.308) 3.572 4.065 ( 4.039 0.000 -22.533) 22.892 4.166 ( 22.739 0.000 -2.967) 22.932 4.984 ( -13.946 -0.000 15.758) 21.043 5.052 ( 13.726 0.000 10.450) 17.251 5.218 ( 1.061 0.000 3.889) 4.031 5.802 ( -10.230 -0.000 7.260) 12.544 5.828 ( -3.174 -0.000 -10.168) 10.652 6.245 ( -1.077 -0.000 -4.050) 4.191 6.951 ( 3.149 0.000 -11.668) 12.086 7.171 ( -7.373 -0.000 3.422) 8.128 7.280 ( -0.883 -0.000 3.745) 3.848 7.456 ( 3.118 0.000 9.984) 10.460 7.644 ( 5.993 0.000 -9.372) 11.124 7.708 ( 2.364 0.000 5.699) 6.170 8.105 ( 3.715 0.000 5.096) 6.307 8.329 ( -1.485 -0.000 -6.063) 6.242 8.875 ( -18.269 -0.000 5.471) 19.071 9.164 ( 17.621 0.000 -6.306) 18.715 9.744 ( 4.877 0.000 -18.788) 19.410 9.884 ( -15.857 -0.000 42.890) 45.728 10.017 ( -6.982 -0.000 15.669) 17.154 10.218 ( 7.800 0.000 -29.800) 30.804 10.281 ( -0.462 -0.000 -31.364) 31.367 10.492 ( -1.540 -0.000 18.791) 18.854 10.521 ( 2.691 0.000 -22.989) 23.146 11.260 ( 0.293 0.000 6.184) 6.191 11.478 ( 14.816 0.000 30.627) 34.023 11.854 ( 7.624 0.000 -13.570) 15.565 11.978 ( -0.400 -0.000 -6.167) 6.180 12.455 ( 15.786 0.000 -5.533) 16.728 12.734 ( 4.288 0.000 6.571) 7.847 13.077 ( 2.490 0.000 10.668) 10.954 14.016 ( -19.887 -0.000 2.345) 20.025 14.798 ( -9.927 -0.000 -2.206) 10.169 15.814 ( 1.877 0.000 8.237) 8.448 15.851 ( -9.050 -0.000 -5.626) 10.656 16.209 ( 8.420 0.000 -8.788) 12.171 16.451 ( -6.743 -0.000 13.756) 15.319 18.462 ( -10.152 -0.000 16.158) 19.082 18.474 ( -8.856 -0.000 -28.210) 29.568 18.866 ( 10.519 0.000 -16.632) 19.679 19.228 ( -5.214 -0.000 19.986) 20.655 26.047 ( 2.559 0.000 -8.180) 8.571 26.426 ( -2.763 -0.000 5.706) 6.340 26.494 ( 9.172 0.000 -10.365) 13.840 27.245 ( 12.625 0.000 9.875) 16.028 28.461 ( 2.365 0.000 -4.766) 5.320 28.469 ( -2.198 -0.000 12.443) 12.636 28.617 ( 1.988 0.000 -9.028) 9.244 28.731 ( 2.357 0.000 -1.357) 2.720 28.918 ( -2.391 -0.000 8.197) 8.538 29.201 ( 1.736 0.000 4.796) 5.100 29.797 ( -11.512 -0.000 7.428) 13.701 29.927 ( -1.655 -0.000 -17.566) 17.644 ======================= Grid point 345 (179/186) ======================= q-point: ( 0.38 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 10.896 2.111 0.064) 11.099 2.003 ( 2.210 4.270 0.227) 4.814 2.278 ( 1.660 3.944 0.878) 4.369 2.503 ( 6.041 3.210 -0.320) 6.848 2.683 ( 3.476 -7.237 -3.460) 8.742 3.013 ( -5.983 -0.941 -7.350) 9.524 4.030 ( 5.807 3.455 -17.181) 18.462 4.498 ( 22.090 -5.511 -0.449) 22.771 4.769 ( -17.327 4.864 11.403) 21.305 5.230 ( 7.230 -0.682 4.996) 8.815 5.307 ( 5.310 -0.642 8.101) 9.707 5.646 ( -4.260 4.211 -2.618) 6.537 5.822 ( -4.859 -5.719 -2.648) 7.958 6.177 ( -6.756 0.324 -5.665) 8.823 6.901 ( 2.980 10.303 -9.383) 14.251 7.012 ( -1.954 7.737 2.590) 8.390 7.343 ( 0.274 -4.126 1.528) 4.408 7.503 ( 1.822 3.358 9.292) 10.047 7.741 ( 3.877 -8.396 -7.444) 11.872 7.819 ( 3.264 -7.486 8.056) 11.471 8.156 ( 4.179 3.168 2.911) 5.998 8.336 ( -0.177 -4.406 -4.345) 6.191 8.692 ( -16.228 -3.628 9.740) 19.271 9.329 ( 11.726 -0.023 -10.364) 15.650 9.772 ( 8.861 0.219 -16.006) 18.296 9.828 ( -10.285 4.342 32.453) 34.320 9.954 ( -7.348 0.595 6.358) 9.735 10.154 ( -4.822 -1.176 -15.386) 16.167 10.246 ( 7.287 -2.621 -26.937) 28.028 10.484 ( 4.058 0.889 -9.275) 10.163 10.522 ( -3.937 -0.249 9.533) 10.317 11.234 ( -2.891 4.238 6.066) 7.945 11.741 ( 13.937 3.401 24.020) 27.978 11.911 ( 4.948 -1.733 -9.398) 10.762 11.974 ( 2.693 0.125 -1.552) 3.111 12.593 ( 14.028 5.192 -2.802) 15.218 12.863 ( 4.783 -6.778 -0.308) 8.301 13.154 ( 1.019 -4.339 3.460) 5.643 13.762 ( -13.554 6.481 5.797) 16.103 14.651 ( -12.243 -0.219 -1.311) 12.315 15.715 ( -3.175 2.795 -2.067) 4.708 15.909 ( -0.036 -5.225 3.861) 6.497 16.250 ( 6.573 2.841 -9.420) 11.832 16.385 ( -7.264 3.288 13.492) 15.673 18.298 ( -5.412 -1.954 -19.139) 19.986 18.412 ( -10.497 -4.532 6.597) 13.200 18.952 ( 9.922 -1.573 -15.623) 18.574 19.212 ( -5.304 2.370 19.187) 20.047 26.063 ( 3.159 -1.060 -7.440) 8.152 26.389 ( -4.558 0.972 5.427) 7.154 26.589 ( 9.801 0.039 -6.774) 11.914 27.339 ( 1.317 2.634 0.776) 3.045 28.457 ( -1.290 0.806 4.100) 4.373 28.498 ( -0.317 -1.370 4.485) 4.701 28.652 ( 6.245 -1.901 -8.001) 10.326 28.791 ( 7.263 1.641 5.672) 9.361 28.934 ( -3.593 -3.664 9.021) 10.378 29.249 ( 1.727 -1.949 2.597) 3.678 29.659 ( -9.547 3.609 5.862) 11.770 29.836 ( -1.563 1.024 -17.345) 17.445 ======================= Grid point 346 (180/186) ======================= q-point: ( 0.50 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( 8.462 6.073 -1.114) 10.475 1.984 ( 4.153 6.880 4.243) 9.088 2.252 ( 1.663 2.508 0.845) 3.126 2.503 ( 3.405 5.456 -0.733) 6.473 2.786 ( 0.240 -5.594 -4.480) 7.171 2.912 ( -8.454 -1.862 -6.228) 10.664 3.996 ( 6.091 4.932 -11.976) 14.312 4.493 ( -17.807 4.850 9.605) 20.806 4.856 ( 18.860 -3.531 0.464) 19.193 5.257 ( 2.037 5.828 5.477) 8.253 5.416 ( 8.481 -1.251 3.118) 9.122 5.618 ( -0.972 -4.279 -2.604) 5.102 5.826 ( -4.891 -3.610 -2.260) 6.485 6.035 ( -10.013 0.464 -6.856) 12.144 6.741 ( 3.420 11.697 -2.237) 12.390 6.925 ( -0.788 5.510 -3.092) 6.368 7.380 ( 1.563 1.050 1.451) 2.378 7.485 ( -0.395 3.100 4.522) 5.497 7.914 ( 4.238 -11.885 -5.896) 13.928 8.002 ( 1.726 -7.877 11.871) 14.351 8.152 ( 2.355 3.699 1.277) 4.567 8.348 ( -6.730 -4.980 -3.556) 9.096 8.693 ( 0.015 -4.771 13.567) 14.382 9.364 ( 0.344 0.698 -13.720) 13.742 9.710 ( -1.089 7.782 1.083) 7.932 9.810 ( 1.604 0.269 1.237) 2.044 9.944 ( -0.343 -4.152 -2.827) 5.034 10.081 ( -7.867 -2.521 1.038) 8.326 10.280 ( 7.338 -0.943 -21.659) 22.888 10.478 ( -6.300 1.834 12.693) 14.289 10.542 ( 8.199 -0.984 -3.818) 9.098 11.125 ( -5.982 5.907 4.714) 9.638 11.840 ( 6.203 7.011 4.746) 10.495 11.932 ( 1.281 0.250 -7.425) 7.538 12.086 ( 10.670 0.561 16.731) 19.851 12.651 ( 8.322 8.011 5.666) 12.867 12.948 ( -1.253 -4.447 -13.086) 13.878 13.157 ( -8.672 0.239 -7.897) 11.731 13.687 ( 7.947 -1.189 13.353) 15.584 14.504 ( -13.730 -3.193 -0.830) 14.120 15.677 ( 2.208 1.095 -2.100) 3.238 15.962 ( -3.246 -2.906 1.182) 4.514 16.254 ( 5.665 2.137 -9.359) 11.147 16.298 ( -4.925 3.288 13.020) 14.304 18.260 ( -1.861 -6.089 -10.369) 12.168 18.385 ( -8.199 -7.245 0.510) 10.953 19.037 ( 8.284 -1.400 -14.178) 16.480 19.172 ( -4.896 3.094 17.987) 18.897 26.100 ( 3.563 -1.239 -5.105) 6.347 26.328 ( -5.618 0.866 4.288) 7.121 26.679 ( 9.423 2.171 -2.895) 10.094 27.226 ( -7.497 5.780 -4.735) 10.584 28.444 ( -1.042 1.008 5.158) 5.358 28.509 ( -0.330 0.061 -1.064) 1.115 28.750 ( 5.809 -3.475 -4.115) 7.921 28.889 ( 8.996 3.893 10.231) 14.169 28.986 ( -4.718 -6.207 9.063) 11.955 29.284 ( -0.149 0.897 -4.851) 4.936 29.547 ( -3.484 0.691 7.307) 8.124 29.757 ( -1.194 -0.404 -13.727) 13.784 ======================= Grid point 347 (181/186) ======================= q-point: (-0.38 0.25 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 5.649 7.672 -0.508) 9.541 1.922 ( 0.932 8.144 1.857) 8.405 2.264 ( 3.727 2.516 5.603) 7.184 2.430 ( -1.897 5.239 -4.592) 7.220 2.798 ( -2.099 -1.029 -3.253) 4.006 2.846 ( -4.867 -2.740 -2.591) 6.157 3.977 ( 7.259 5.164 -4.279) 9.883 4.244 ( -15.192 4.216 3.057) 16.060 5.002 ( 9.539 10.131 12.748) 18.872 5.282 ( 1.044 0.927 -8.302) 8.418 5.483 ( 8.324 2.263 -9.877) 13.114 5.713 ( -3.505 -8.376 12.338) 15.319 5.757 ( -0.812 0.049 -3.245) 3.346 5.952 ( -6.591 -6.264 -5.641) 10.701 6.685 ( 4.903 3.903 -0.041) 6.267 6.815 ( -4.458 3.403 -1.819) 5.896 7.381 ( 2.425 2.669 1.765) 4.015 7.444 ( -1.741 2.330 0.522) 2.955 8.077 ( 6.245 -0.387 -2.340) 6.681 8.114 ( 1.499 1.179 0.385) 1.946 8.158 ( -0.327 -6.516 6.228) 9.019 8.313 ( -8.849 -6.163 -0.654) 10.804 8.852 ( 8.927 -1.597 13.932) 16.623 9.224 ( -9.539 2.222 -14.493) 17.493 9.675 ( 8.389 2.882 -5.177) 10.270 9.833 ( -3.328 -2.395 6.047) 7.306 9.974 ( 3.572 -2.285 -18.523) 19.002 10.026 ( -11.549 -3.553 17.537) 21.297 10.311 ( 8.508 0.244 -19.073) 20.886 10.413 ( -7.374 0.732 11.944) 14.056 10.680 ( 11.328 -0.328 2.285) 11.561 10.968 ( -8.469 5.012 1.808) 10.006 11.801 ( 3.916 8.414 1.310) 9.373 11.882 ( -1.859 3.922 -4.445) 6.212 12.269 ( 11.229 2.806 17.821) 21.250 12.587 ( -1.453 9.998 -0.742) 10.130 12.877 ( -2.452 1.770 -12.759) 13.113 12.983 ( -7.204 4.670 -1.655) 8.743 13.990 ( 16.610 -11.167 5.022) 20.635 14.405 ( -14.483 -8.643 0.061) 16.866 15.714 ( 6.307 0.800 -1.920) 6.641 15.901 ( -7.562 0.896 -0.342) 7.623 16.279 ( 0.721 -0.592 5.871) 5.944 16.287 ( 2.297 -1.025 -3.181) 4.055 18.326 ( -0.506 -7.027 2.785) 7.576 18.409 ( -4.036 -8.840 -8.052) 12.620 19.093 ( 5.844 -0.022 -10.493) 12.011 19.138 ( -3.665 1.768 13.290) 13.899 26.147 ( 3.619 -0.482 -1.202) 3.844 26.259 ( -5.303 0.474 1.321) 5.485 26.739 ( 8.681 5.011 0.309) 10.029 27.000 ( -10.106 7.592 -4.754) 13.504 28.442 ( 0.321 0.772 3.205) 3.312 28.486 ( -1.479 0.741 -1.396) 2.165 28.857 ( 6.576 -2.309 -1.956) 7.239 28.957 ( 5.775 4.626 8.785) 11.486 29.022 ( -6.094 -4.184 6.789) 10.037 29.160 ( -3.870 6.971 -9.307) 12.255 29.631 ( 3.385 -6.693 5.472) 9.284 29.738 ( -1.250 -4.571 -7.036) 8.483 ======================= Grid point 348 (182/186) ======================= q-point: (-0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( -0.600 7.195 -5.083) 8.830 1.809 ( 0.600 7.195 5.083) 8.830 2.305 ( -2.316 2.664 -9.987) 10.592 2.305 ( 2.316 2.664 9.987) 10.592 2.803 ( -1.830 0.589 -4.181) 4.602 2.803 ( 1.830 0.589 4.181) 4.602 4.026 ( 0.172 3.297 -19.744) 20.018 4.026 ( -0.172 3.297 19.744) 20.018 5.022 ( -9.843 12.509 -21.869) 27.049 5.022 ( 9.843 12.509 21.869) 27.049 5.645 ( 8.371 -3.561 -7.023) 11.492 5.645 ( -8.371 -3.561 7.023) 11.492 5.942 ( -5.885 -6.923 -7.919) 12.053 5.942 ( 5.885 -6.923 7.919) 12.053 6.739 ( -2.004 -2.227 -4.623) 5.509 6.739 ( 2.004 -2.227 4.623) 5.509 7.387 ( -0.951 1.609 -2.300) 2.964 7.387 ( 0.951 1.609 2.300) 2.964 8.058 ( -0.659 6.636 -0.753) 6.711 8.058 ( 0.659 6.636 0.753) 6.711 8.294 ( -3.355 -3.737 -2.568) 5.640 8.294 ( 3.355 -3.737 2.568) 5.640 9.024 ( -7.626 1.075 -16.347) 18.070 9.024 ( 7.626 1.075 16.347) 18.070 9.778 ( 0.654 -1.290 -8.868) 8.985 9.778 ( -0.654 -1.290 8.868) 8.985 10.025 ( 8.426 -4.487 -26.793) 28.443 10.025 ( -8.426 -4.487 26.793) 28.443 10.361 ( 7.583 -0.745 -17.043) 18.669 10.361 ( -7.583 -0.745 17.043) 18.669 10.807 ( -7.222 2.353 -3.426) 8.332 10.807 ( 7.222 2.353 3.426) 8.332 11.738 ( -4.586 8.942 -1.706) 10.194 11.738 ( 4.586 8.942 1.706) 10.194 12.381 ( -5.226 6.016 -13.922) 16.041 12.381 ( 5.226 6.016 13.922) 16.041 12.829 ( -0.570 5.128 -11.977) 13.041 12.829 ( 0.570 5.128 11.977) 13.041 14.376 ( -3.888 -13.657 -8.183) 16.389 14.376 ( 3.888 -13.657 8.183) 16.389 15.787 ( 0.196 1.020 -6.249) 6.335 15.787 ( -0.196 1.020 6.249) 6.335 16.322 ( 2.199 -2.495 -11.257) 11.738 16.322 ( -2.199 -2.495 11.257) 11.738 18.453 ( 4.423 -6.998 -24.093) 25.476 18.453 ( -4.423 -6.998 24.093) 25.476 19.117 ( 3.654 0.423 -13.835) 14.315 19.117 ( -3.654 0.423 13.835) 14.315 26.195 ( 0.261 0.401 -9.438) 9.450 26.195 ( -0.261 0.401 9.438) 9.450 26.762 ( -5.249 7.555 -5.656) 10.799 26.762 ( 5.249 7.555 5.656) 10.799 28.451 ( 0.048 0.772 -4.053) 4.126 28.451 ( -0.048 0.772 4.053) 4.126 28.942 ( -2.718 3.082 -6.298) 7.520 28.942 ( 2.718 3.082 6.298) 7.520 29.012 ( -0.196 1.723 -7.739) 7.931 29.012 ( 0.196 1.723 7.739) 7.931 29.792 ( -1.598 -8.332 -1.130) 8.558 29.792 ( 1.598 -8.332 1.130) 8.558 ======================= Grid point 354 (183/186) ======================= q-point: ( 0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 10.368 0.000 0.550) 10.383 2.092 ( 6.940 0.000 2.126) 7.259 2.321 ( -1.181 -0.000 2.721) 2.967 2.600 ( 4.955 0.000 0.999) 5.055 2.665 ( 3.794 0.000 -4.485) 5.875 2.871 ( -9.943 -0.000 -11.089) 14.894 4.076 ( 8.081 0.000 -18.356) 20.056 4.574 ( -17.663 -0.000 14.094) 22.597 4.779 ( 19.475 0.000 2.090) 19.587 5.307 ( 2.440 0.000 3.384) 4.172 5.400 ( 6.466 0.000 4.992) 8.169 5.666 ( -3.513 -0.000 7.484) 8.268 5.673 ( -2.413 -0.000 -13.100) 13.321 6.051 ( -9.815 -0.000 -6.340) 11.685 7.005 ( 6.484 0.000 -9.080) 11.158 7.093 ( -1.844 -0.000 5.762) 6.050 7.302 ( 2.905 0.000 -1.356) 3.206 7.578 ( 0.108 0.000 11.145) 11.145 7.728 ( 1.402 0.000 -4.353) 4.573 7.766 ( -0.602 -0.000 1.733) 1.834 8.226 ( -1.467 -0.000 -0.929) 1.736 8.276 ( -0.960 -0.000 -2.396) 2.581 8.593 ( 0.816 0.000 18.416) 18.434 9.375 ( 2.284 0.000 -15.641) 15.807 9.829 ( -12.122 -0.000 36.942) 38.880 9.838 ( 9.627 0.000 -28.540) 30.120 9.932 ( -7.075 -0.000 14.790) 16.395 9.960 ( -4.026 -0.000 -22.150) 22.513 10.276 ( 9.843 0.000 -18.911) 21.319 10.516 ( -5.917 -0.000 14.811) 15.949 10.536 ( 10.890 0.000 -9.840) 14.678 11.214 ( -8.336 -0.000 5.644) 10.068 11.928 ( 4.630 0.000 -8.515) 9.692 11.936 ( 3.438 0.000 2.496) 4.249 12.110 ( 13.662 0.000 22.666) 26.464 12.780 ( 12.373 0.000 -14.771) 19.268 12.872 ( 1.460 0.000 11.212) 11.307 13.086 ( -4.656 -0.000 -10.232) 11.241 13.730 ( -2.042 -0.000 12.181) 12.351 14.466 ( -15.500 -0.000 -2.028) 15.632 15.703 ( 1.272 0.000 -4.430) 4.609 15.893 ( -0.915 -0.000 6.129) 6.197 16.306 ( 4.894 0.000 -11.226) 12.247 16.363 ( -7.315 -0.000 14.657) 16.381 18.152 ( 0.597 0.000 -29.714) 29.720 18.281 ( -13.396 -0.000 19.272) 23.471 19.015 ( 10.286 0.000 -16.418) 19.374 19.216 ( -6.564 -0.000 18.161) 19.311 26.080 ( 5.230 0.000 -8.834) 10.266 26.340 ( -7.502 -0.000 8.021) 10.983 26.710 ( 11.862 0.000 -4.453) 12.670 27.312 ( -7.042 -0.000 -4.957) 8.612 28.487 ( 2.292 0.000 -2.069) 3.088 28.492 ( -2.456 -0.000 11.762) 12.016 28.680 ( 6.655 0.000 -10.895) 12.767 28.879 ( -5.542 -0.000 9.356) 10.874 28.962 ( 11.059 0.000 12.311) 16.549 29.262 ( 1.339 0.000 1.811) 2.252 29.596 ( -7.603 -0.000 6.723) 10.149 29.753 ( -2.182 -0.000 -19.769) 19.889 ======================= Grid point 355 (184/186) ======================= q-point: ( 0.50 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 320 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( 7.900 4.525 -0.299) 9.109 2.142 ( 2.707 6.254 3.929) 7.866 2.324 ( 4.863 1.389 4.590) 6.830 2.587 ( -2.784 5.880 -4.326) 7.813 2.713 ( 0.798 -3.757 -4.782) 6.133 2.746 ( -6.326 -4.405 -4.082) 8.722 4.111 ( 10.519 3.362 -15.080) 18.691 4.367 ( -17.295 3.374 12.703) 21.722 5.046 ( 16.664 -2.597 2.599) 17.065 5.312 ( -3.685 -0.334 2.882) 4.690 5.505 ( 4.385 -2.200 6.921) 8.484 5.571 ( 1.097 2.200 -8.819) 9.155 5.720 ( -0.865 -3.871 1.495) 4.238 5.895 ( -9.957 1.164 -6.465) 11.929 6.956 ( 4.027 12.619 -2.962) 13.573 7.011 ( -0.589 8.448 -0.019) 8.469 7.404 ( 5.537 -2.974 -2.934) 6.936 7.537 ( -5.220 4.706 7.729) 10.447 7.768 ( 2.835 -10.750 -2.404) 11.375 7.872 ( -4.509 -12.779 3.236) 13.932 8.208 ( -1.322 -0.785 1.263) 1.990 8.235 ( -1.136 2.083 -2.172) 3.216 8.788 ( 12.947 -2.271 18.844) 22.976 9.266 ( -9.505 0.721 -18.039) 20.402 9.760 ( 2.900 2.216 -17.736) 18.107 9.800 ( -9.474 -0.422 21.507) 23.505 9.912 ( 3.794 -0.759 -8.163) 9.034 9.953 ( -4.180 -2.340 2.046) 5.209 10.335 ( 9.689 0.941 -15.444) 18.256 10.464 ( -7.757 1.829 13.252) 15.464 10.689 ( 16.109 0.554 -2.011) 16.243 11.076 ( -12.971 2.311 3.184) 13.555 11.940 ( 1.390 1.907 -1.144) 2.623 11.948 ( 2.023 1.385 -3.981) 4.675 12.357 ( 14.470 2.663 23.726) 27.917 12.814 ( -8.626 2.056 -12.944) 15.690 12.860 ( 7.560 3.105 1.181) 8.258 13.019 ( -4.632 -3.005 -8.551) 10.179 13.834 ( 11.235 -1.058 12.025) 16.491 14.265 ( -16.586 -2.014 -3.893) 17.155 15.734 ( 6.090 0.495 -2.755) 6.703 15.887 ( -5.306 -1.308 3.065) 6.266 16.305 ( 4.122 1.749 -12.192) 12.988 16.318 ( -5.102 1.871 14.320) 15.316 18.133 ( 5.438 -5.087 -24.424) 25.534 18.215 ( -11.851 -4.311 18.704) 22.558 19.085 ( 9.280 -0.253 -16.047) 18.539 19.182 ( -7.324 0.950 17.137) 18.660 26.130 ( 6.613 -0.472 -8.172) 10.523 26.267 ( -8.135 0.076 7.879) 11.325 26.839 ( 11.854 2.000 -0.409) 12.029 27.154 ( -10.918 3.120 -5.467) 12.603 28.481 ( 0.117 1.905 4.735) 5.105 28.506 ( -0.129 0.410 -0.954) 1.047 28.756 ( 6.698 -3.489 -8.111) 11.083 28.865 ( -6.357 -4.094 9.030) 11.777 29.108 ( 8.448 3.882 12.338) 15.449 29.275 ( -0.668 0.776 -3.419) 3.569 29.544 ( -2.315 0.116 8.999) 9.292 29.665 ( -2.615 -1.432 -16.787) 17.050 ======================= Grid point 356 (185/186) ======================= q-point: (-0.38 -0.62 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( 0.945 8.396 -2.698) 8.870 2.035 ( -0.945 8.396 2.698) 8.870 2.407 ( -6.777 3.983 -9.688) 12.476 2.407 ( 6.777 3.983 9.688) 12.476 2.760 ( 1.076 -3.281 -3.709) 5.067 2.760 ( -1.076 -3.281 3.709) 5.067 4.154 ( 8.238 5.138 -16.047) 18.755 4.154 ( -8.237 5.138 16.047) 18.755 5.236 ( -3.193 1.264 -9.778) 10.364 5.236 ( 3.193 1.264 9.778) 10.364 5.576 ( 7.815 -1.596 -11.734) 14.188 5.576 ( -7.815 -1.596 11.734) 14.188 5.778 ( -4.530 -2.676 -2.848) 5.982 5.778 ( 4.530 -2.676 2.848) 5.982 6.843 ( -3.203 9.559 -0.369) 10.088 6.843 ( 3.203 9.559 0.369) 10.088 7.452 ( 1.584 2.343 -3.352) 4.385 7.452 ( -1.584 2.343 3.352) 4.385 8.003 ( 3.366 -13.785 -9.030) 16.819 8.003 ( -3.366 -13.785 9.030) 16.819 8.197 ( 0.680 1.745 -3.238) 3.741 8.197 ( -0.680 1.745 3.238) 3.741 9.041 ( -12.761 -0.021 -18.372) 22.369 9.041 ( 12.761 -0.021 18.372) 22.369 9.768 ( 8.088 -0.299 -16.829) 18.674 9.768 ( -8.088 -0.299 16.829) 18.674 9.939 ( 9.850 -1.577 -31.490) 33.033 9.939 ( -9.850 -1.577 31.490) 33.033 10.379 ( 8.802 1.827 -14.795) 17.313 10.379 ( -8.802 1.827 14.795) 17.312 10.870 ( -14.876 2.197 0.116) 15.038 10.870 ( 14.876 2.197 -0.116) 15.038 11.913 ( -0.238 3.784 -3.360) 5.066 11.913 ( 0.238 3.784 3.360) 5.066 12.551 ( -11.652 5.388 -19.833) 23.625 12.551 ( 11.652 5.388 19.833) 23.625 12.933 ( -1.191 1.788 -7.771) 8.062 12.933 ( 1.191 1.788 7.771) 8.062 14.095 ( -13.008 -5.978 -8.258) 16.527 14.095 ( 13.008 -5.978 8.258) 16.527 15.812 ( -0.730 0.403 -5.349) 5.414 15.812 ( 0.730 0.403 5.349) 5.414 16.293 ( 3.576 0.763 -12.482) 13.007 16.293 ( -3.576 0.763 12.482) 13.007 18.238 ( 8.337 -7.676 -25.602) 27.998 18.238 ( -8.337 -7.676 25.602) 27.998 19.134 ( 7.305 0.598 -15.955) 17.559 19.134 ( -7.305 0.598 15.955) 17.559 26.196 ( 4.856 -0.209 -9.086) 10.304 26.196 ( -4.856 -0.209 9.086) 10.304 26.941 ( -9.778 4.950 -3.919) 11.639 26.941 ( 9.778 4.950 3.919) 11.639 28.477 ( -0.483 1.340 -3.403) 3.689 28.477 ( 0.483 1.340 3.403) 3.689 28.877 ( 6.880 -4.994 -6.273) 10.565 28.877 ( -6.880 -4.994 6.273) 10.565 29.159 ( -5.238 5.837 -9.632) 12.421 29.159 ( 5.238 5.837 9.632) 12.421 29.621 ( -2.405 -3.906 -11.084) 11.995 29.621 ( 2.405 -3.906 11.084) 11.995 ======================= Grid point 365 (186/186) ======================= q-point: (-0.50 -0.50 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 93 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( -5.424 -0.000 1.490) 5.625 2.174 ( 5.424 0.000 -1.490) 5.625 2.481 ( -12.698 -0.000 -10.324) 16.365 2.481 ( 12.698 0.000 10.324) 16.365 2.685 ( -0.526 -0.000 -3.247) 3.290 2.685 ( 0.526 0.000 3.247) 3.290 4.240 ( 14.599 0.000 -15.409) 21.227 4.240 ( -14.599 -0.000 15.409) 21.227 5.209 ( -10.678 -0.000 -2.410) 10.947 5.209 ( 10.678 0.000 2.410) 10.947 5.545 ( -1.697 -0.000 -9.399) 9.551 5.545 ( 1.697 0.000 9.399) 9.551 5.772 ( -7.439 -0.000 -6.555) 9.915 5.772 ( 7.439 0.000 6.555) 9.915 7.085 ( 2.889 0.000 -5.302) 6.038 7.085 ( -2.889 -0.000 5.302) 6.038 7.474 ( 13.623 0.000 -10.381) 17.127 7.474 ( -13.623 -0.000 10.381) 17.127 7.716 ( 3.103 0.000 -1.158) 3.312 7.716 ( -3.103 -0.000 1.158) 3.312 8.220 ( -2.265 -0.000 -1.188) 2.558 8.220 ( 2.265 0.000 1.188) 2.558 9.035 ( -15.889 -0.000 -20.127) 25.643 9.035 ( 15.889 0.000 20.127) 25.643 9.760 ( 7.819 0.000 -23.039) 24.329 9.760 ( -7.819 -0.000 23.039) 24.329 9.923 ( 6.940 0.000 -29.254) 30.066 9.923 ( -6.940 -0.000 29.254) 30.066 10.415 ( 9.222 0.000 -13.009) 15.946 10.415 ( -9.222 -0.000 13.009) 15.946 10.905 ( -17.261 -0.000 1.692) 17.344 10.905 ( 17.261 0.000 -1.692) 17.344 11.962 ( 1.174 0.000 -3.079) 3.296 11.962 ( -1.174 -0.000 3.079) 3.296 12.632 ( -12.912 -0.000 -21.288) 24.897 12.632 ( 12.912 0.000 21.288) 24.897 12.944 ( 3.052 0.000 -15.580) 15.876 12.944 ( -3.052 -0.000 15.580) 15.876 14.027 ( -15.304 -0.000 -8.225) 17.375 14.027 ( 15.304 0.000 8.225) 17.375 15.812 ( 7.192 0.000 -3.502) 7.999 15.812 ( -7.192 -0.000 3.502) 7.999 16.322 ( 4.106 0.000 -13.976) 14.567 16.322 ( -4.106 -0.000 13.976) 14.567 18.114 ( 10.751 0.000 -24.981) 27.196 18.114 ( -10.751 -0.000 24.981) 27.196 19.143 ( 8.838 0.000 -16.653) 18.853 19.143 ( -8.838 -0.000 16.653) 18.853 26.192 ( 8.322 0.000 -9.119) 12.345 26.192 ( -8.322 -0.000 9.119) 12.345 27.012 ( -12.216 -0.000 -3.268) 12.646 27.012 ( 12.216 0.000 3.268) 12.646 28.508 ( 2.178 0.000 -8.550) 8.823 28.508 ( -2.178 -0.000 8.550) 8.823 28.783 ( 7.125 0.000 -10.043) 12.314 28.783 ( -7.125 -0.000 10.043) 12.314 29.250 ( -3.124 -0.000 -7.468) 8.095 29.250 ( 3.124 0.000 7.468) 8.095 29.568 ( -0.766 -0.000 -14.675) 14.695 29.568 ( 0.766 0.000 14.675) 14.695 =================== 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 3/38400 10.0 723.727 577.914 553.272 -0.000 192.530 0.000 3/38400 20.0 146.146 114.816 109.425 -0.000 15.881 0.000 3/38400 30.0 64.689 51.104 51.249 -0.000 5.286 0.000 3/38400 40.0 36.822 28.955 30.227 -0.000 2.712 0.000 3/38400 50.0 23.906 18.637 20.422 -0.000 1.601 0.000 3/38400 60.0 16.916 13.064 15.090 -0.000 1.000 0.000 3/38400 70.0 12.756 9.763 11.871 -0.000 0.641 0.000 3/38400 80.0 10.103 7.669 9.777 -0.000 0.413 0.000 3/38400 90.0 8.313 6.263 8.337 -0.000 0.261 0.000 3/38400 100.0 7.048 5.273 7.301 -0.000 0.156 0.000 3/38400 110.0 6.118 4.549 6.528 -0.000 0.081 0.000 3/38400 120.0 5.412 4.000 5.932 -0.000 0.026 0.000 3/38400 130.0 4.860 3.573 5.459 -0.000 -0.015 0.000 3/38400 140.0 4.417 3.231 5.075 -0.000 -0.046 0.000 3/38400 150.0 4.055 2.952 4.757 -0.000 -0.069 0.000 3/38400 160.0 3.753 2.721 4.488 -0.000 -0.088 0.000 3/38400 170.0 3.498 2.526 4.256 -0.000 -0.102 0.000 3/38400 180.0 3.280 2.359 4.054 -0.000 -0.114 0.000 3/38400 190.0 3.090 2.215 3.876 -0.000 -0.123 0.000 3/38400 200.0 2.923 2.088 3.718 -0.000 -0.130 0.000 3/38400 210.0 2.776 1.977 3.575 -0.000 -0.135 0.000 3/38400 220.0 2.645 1.878 3.445 -0.000 -0.140 0.000 3/38400 230.0 2.527 1.790 3.327 -0.000 -0.143 0.000 3/38400 240.0 2.421 1.710 3.218 -0.000 -0.145 0.000 3/38400 250.0 2.324 1.637 3.118 -0.000 -0.147 0.000 3/38400 260.0 2.236 1.571 3.025 -0.000 -0.148 0.000 3/38400 270.0 2.154 1.511 2.938 -0.000 -0.149 0.000 3/38400 280.0 2.080 1.456 2.857 -0.000 -0.149 0.000 3/38400 290.0 2.010 1.404 2.780 -0.000 -0.149 0.000 3/38400 300.0 1.946 1.357 2.709 -0.000 -0.149 0.000 3/38400 310.0 1.886 1.313 2.641 -0.000 -0.149 0.000 3/38400 320.0 1.830 1.272 2.577 -0.000 -0.148 0.000 3/38400 330.0 1.778 1.233 2.516 -0.000 -0.147 0.000 3/38400 340.0 1.729 1.197 2.458 -0.000 -0.146 0.000 3/38400 350.0 1.682 1.164 2.403 -0.000 -0.145 0.000 3/38400 360.0 1.639 1.132 2.350 -0.000 -0.144 0.000 3/38400 370.0 1.597 1.102 2.300 -0.000 -0.143 0.000 3/38400 380.0 1.558 1.073 2.252 -0.000 -0.142 0.000 3/38400 390.0 1.521 1.047 2.206 -0.000 -0.140 0.000 3/38400 400.0 1.485 1.021 2.162 -0.000 -0.139 0.000 3/38400 410.0 1.452 0.997 2.119 -0.000 -0.138 0.000 3/38400 420.0 1.420 0.974 2.079 -0.000 -0.136 0.000 3/38400 430.0 1.389 0.952 2.040 -0.000 -0.135 0.000 3/38400 440.0 1.360 0.931 2.002 -0.000 -0.133 0.000 3/38400 450.0 1.331 0.911 1.965 -0.000 -0.132 0.000 3/38400 460.0 1.305 0.892 1.930 -0.000 -0.130 0.000 3/38400 470.0 1.279 0.873 1.896 -0.000 -0.129 0.000 3/38400 480.0 1.254 0.856 1.864 -0.000 -0.127 0.000 3/38400 490.0 1.230 0.839 1.832 -0.000 -0.126 0.000 3/38400 500.0 1.207 0.823 1.801 -0.000 -0.125 0.000 3/38400 510.0 1.185 0.807 1.772 -0.000 -0.123 0.000 3/38400 520.0 1.164 0.792 1.743 -0.000 -0.122 0.000 3/38400 530.0 1.143 0.778 1.715 -0.000 -0.120 0.000 3/38400 540.0 1.124 0.764 1.688 -0.000 -0.119 0.000 3/38400 550.0 1.105 0.751 1.662 -0.000 -0.118 0.000 3/38400 560.0 1.086 0.738 1.637 -0.000 -0.116 0.000 3/38400 570.0 1.068 0.725 1.612 -0.000 -0.115 0.000 3/38400 580.0 1.051 0.713 1.588 -0.000 -0.114 0.000 3/38400 590.0 1.034 0.701 1.565 -0.000 -0.112 0.000 3/38400 600.0 1.018 0.690 1.542 -0.000 -0.111 0.000 3/38400 610.0 1.002 0.679 1.520 -0.000 -0.110 0.000 3/38400 620.0 0.987 0.669 1.499 -0.000 -0.108 0.000 3/38400 630.0 0.972 0.658 1.478 -0.000 -0.107 0.000 3/38400 640.0 0.958 0.648 1.458 -0.000 -0.106 0.000 3/38400 650.0 0.944 0.639 1.438 -0.000 -0.105 0.000 3/38400 660.0 0.931 0.629 1.419 -0.000 -0.104 0.000 3/38400 670.0 0.917 0.620 1.400 -0.000 -0.103 0.000 3/38400 680.0 0.905 0.612 1.382 -0.000 -0.101 0.000 3/38400 690.0 0.892 0.603 1.364 -0.000 -0.100 0.000 3/38400 700.0 0.880 0.595 1.347 -0.000 -0.099 0.000 3/38400 710.0 0.868 0.587 1.330 -0.000 -0.098 0.000 3/38400 720.0 0.857 0.579 1.313 -0.000 -0.097 0.000 3/38400 730.0 0.846 0.571 1.297 -0.000 -0.096 0.000 3/38400 740.0 0.835 0.563 1.281 -0.000 -0.095 0.000 3/38400 750.0 0.824 0.556 1.266 -0.000 -0.094 0.000 3/38400 760.0 0.814 0.549 1.251 -0.000 -0.093 0.000 3/38400 770.0 0.804 0.542 1.236 -0.000 -0.092 0.000 3/38400 780.0 0.794 0.535 1.222 -0.000 -0.091 0.000 3/38400 790.0 0.784 0.529 1.208 -0.000 -0.090 0.000 3/38400 800.0 0.775 0.522 1.194 -0.000 -0.089 0.000 3/38400 810.0 0.766 0.516 1.180 -0.000 -0.089 0.000 3/38400 820.0 0.757 0.510 1.167 -0.000 -0.088 0.000 3/38400 830.0 0.748 0.504 1.154 -0.000 -0.087 0.000 3/38400 840.0 0.740 0.498 1.142 -0.000 -0.086 0.000 3/38400 850.0 0.731 0.492 1.129 -0.000 -0.085 0.000 3/38400 860.0 0.723 0.487 1.117 -0.000 -0.084 0.000 3/38400 870.0 0.715 0.481 1.105 -0.000 -0.083 0.000 3/38400 880.0 0.707 0.476 1.094 -0.000 -0.083 0.000 3/38400 890.0 0.700 0.471 1.082 -0.000 -0.082 0.000 3/38400 900.0 0.692 0.466 1.071 -0.000 -0.081 0.000 3/38400 910.0 0.685 0.461 1.060 -0.000 -0.080 0.000 3/38400 920.0 0.678 0.456 1.050 -0.000 -0.080 0.000 3/38400 930.0 0.671 0.451 1.039 -0.000 -0.079 0.000 3/38400 940.0 0.664 0.446 1.029 -0.000 -0.078 0.000 3/38400 950.0 0.657 0.442 1.019 -0.000 -0.077 0.000 3/38400 960.0 0.651 0.437 1.009 -0.000 -0.077 0.000 3/38400 970.0 0.644 0.433 0.999 -0.000 -0.076 0.000 3/38400 980.0 0.638 0.429 0.990 -0.000 -0.075 0.000 3/38400 990.0 0.631 0.424 0.980 -0.000 -0.075 0.000 3/38400 1000.0 0.625 0.420 0.971 -0.000 -0.074 0.000 3/38400 Thermal conductivity related properties were written into "kappa-m8810.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 00:18:20]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|