----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 18:48:48]------------------------- 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 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3m (166) Number of symmetry operations in supercell: 36 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.685019873761806 1.550196946895870 4.087607223333328 b -2.685019873761800 1.550196946895870 4.087607223333328 c 0.000000000000003 -3.100393893791745 4.087607223333328 Atomic positions (fractional): *1 B 0.79831329939685 0.32442147691788 0.79831329939685 10.811 2 B 0.79831329939685 0.79831329939685 0.32442147691788 10.811 3 B 0.32442147691788 0.79831329939685 0.79831329939685 10.811 4 B 0.67557852308212 0.20168670060315 0.20168670060315 10.811 5 B 0.20168670060315 0.67557852308212 0.20168670060315 10.811 6 B 0.20168670060315 0.20168670060315 0.67557852308212 10.811 *7 B 0.99789027568921 0.66680780862137 0.99789027568921 10.811 8 B 0.99789027568921 0.99789027568921 0.66680780862137 10.811 9 B 0.66680780862137 0.99789027568921 0.99789027568921 10.811 10 B 0.33319219137863 0.00210972431079 0.00210972431079 10.811 11 B 0.00210972431079 0.33319219137863 0.00210972431079 10.811 12 B 0.00210972431079 0.00210972431079 0.33319219137863 10.811 *13 O 0.37814527527681 0.37814527527681 0.37814527527681 15.999 14 O 0.62185472472319 0.62185472472319 0.62185472472319 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.370039747523606 0.000000000000000 0.000000000000000 b -2.685019873761803 4.650590840687616 0.000000000000000 c 0.000000000000000 0.000000000000000 12.262821669999997 Atomic positions (fractional): *1 B 0.82463060749299 0.17536939250701 0.97368269190386 10.811 > 1 2 B 0.82463060749299 0.64926121498598 0.97368269190386 10.811 > 2 3 B 0.35073878501402 0.17536939250701 0.97368269190386 10.811 > 3 4 B 0.98259454831931 0.49129727415966 0.69298397476281 10.811 > 4 5 B 0.50870272584035 0.49129727415966 0.69298397476281 10.811 > 5 6 B 0.50870272584035 0.01740545168069 0.69298397476281 10.811 > 6 *7 B 0.77702748902261 0.22297251097739 0.22086278666660 10.811 > 7 8 B 0.77702748902261 0.55405497804523 0.22086278666660 10.811 > 8 9 B 0.44594502195477 0.22297251097739 0.22086278666660 10.811 > 9 10 B 0.88738831137856 0.44369415568928 0.44580388000007 10.811 > 10 11 B 0.55630584431072 0.44369415568928 0.44580388000007 10.811 > 11 12 B 0.55630584431072 0.11261168862144 0.44580388000007 10.811 > 12 13 B 0.49129727415966 0.50870272584035 0.30701602523719 10.811 > 1 14 B 0.49129727415966 0.98259454831931 0.30701602523719 10.811 > 2 15 B 0.01740545168069 0.50870272584035 0.30701602523719 10.811 > 3 16 B 0.64926121498598 0.82463060749299 0.02631730809614 10.811 > 4 17 B 0.17536939250701 0.82463060749299 0.02631730809614 10.811 > 5 18 B 0.17536939250701 0.35073878501402 0.02631730809614 10.811 > 6 19 B 0.44369415568928 0.55630584431072 0.55419611999993 10.811 > 7 20 B 0.44369415568928 0.88738831137856 0.55419611999993 10.811 > 8 21 B 0.11261168862144 0.55630584431072 0.55419611999993 10.811 > 9 22 B 0.55405497804523 0.77702748902261 0.77913721333340 10.811 > 10 23 B 0.22297251097739 0.77702748902261 0.77913721333340 10.811 > 11 24 B 0.22297251097739 0.44594502195477 0.77913721333340 10.811 > 12 25 B 0.15796394082632 0.84203605917368 0.64034935857052 10.811 > 1 26 B 0.15796394082632 0.31592788165265 0.64034935857052 10.811 > 2 27 B 0.68407211834736 0.84203605917368 0.64034935857052 10.811 > 3 28 B 0.31592788165265 0.15796394082632 0.35965064142948 10.811 > 4 29 B 0.84203605917368 0.15796394082632 0.35965064142948 10.811 > 5 30 B 0.84203605917368 0.68407211834736 0.35965064142948 10.811 > 6 31 B 0.11036082235595 0.88963917764405 0.88752945333327 10.811 > 7 32 B 0.11036082235595 0.22072164471189 0.88752945333327 10.811 > 8 33 B 0.77927835528810 0.88963917764405 0.88752945333327 10.811 > 9 34 B 0.22072164471189 0.11036082235595 0.11247054666673 10.811 > 10 35 B 0.88963917764405 0.11036082235595 0.11247054666673 10.811 > 11 36 B 0.88963917764405 0.77927835528810 0.11247054666673 10.811 > 12 *37 O 0.66666666666667 0.33333333333333 0.71147860861014 15.999 > 13 38 O 0.66666666666667 0.33333333333333 0.95518805805652 15.999 > 14 39 O 0.33333333333333 0.66666666666667 0.04481194194348 15.999 > 13 40 O 0.33333333333333 0.66666666666667 0.28852139138986 15.999 > 14 41 O 0.00000000000000 0.00000000000000 0.37814527527681 15.999 > 13 42 O 0.00000000000000 0.00000000000000 0.62185472472319 15.999 > 14 -------------------------------- super cell -------------------------------- Lattice vectors: a 5.370039747523606 0.000000000000000 0.000000000000000 b -2.685019873761803 4.650590840687616 0.000000000000000 c 0.000000000000000 0.000000000000000 12.262821669999997 Atomic positions (fractional): *1 B 0.82463060749299 0.17536939250701 0.97368269190386 10.811 > 1 2 B 0.82463060749299 0.64926121498598 0.97368269190386 10.811 > 2 3 B 0.35073878501402 0.17536939250701 0.97368269190386 10.811 > 3 4 B 0.98259454831931 0.49129727415966 0.69298397476281 10.811 > 4 5 B 0.50870272584035 0.49129727415966 0.69298397476281 10.811 > 5 6 B 0.50870272584035 0.01740545168069 0.69298397476281 10.811 > 6 *7 B 0.77702748902261 0.22297251097739 0.22086278666660 10.811 > 7 8 B 0.77702748902261 0.55405497804523 0.22086278666660 10.811 > 8 9 B 0.44594502195477 0.22297251097739 0.22086278666660 10.811 > 9 10 B 0.88738831137856 0.44369415568928 0.44580388000007 10.811 > 10 11 B 0.55630584431072 0.44369415568928 0.44580388000007 10.811 > 11 12 B 0.55630584431072 0.11261168862144 0.44580388000007 10.811 > 12 13 B 0.49129727415966 0.50870272584035 0.30701602523719 10.811 > 1 14 B 0.49129727415966 0.98259454831931 0.30701602523719 10.811 > 2 15 B 0.01740545168069 0.50870272584035 0.30701602523719 10.811 > 3 16 B 0.64926121498598 0.82463060749299 0.02631730809614 10.811 > 4 17 B 0.17536939250701 0.82463060749299 0.02631730809614 10.811 > 5 18 B 0.17536939250701 0.35073878501402 0.02631730809614 10.811 > 6 19 B 0.44369415568928 0.55630584431072 0.55419611999993 10.811 > 7 20 B 0.44369415568928 0.88738831137856 0.55419611999993 10.811 > 8 21 B 0.11261168862144 0.55630584431072 0.55419611999993 10.811 > 9 22 B 0.55405497804523 0.77702748902261 0.77913721333340 10.811 > 10 23 B 0.22297251097739 0.77702748902261 0.77913721333340 10.811 > 11 24 B 0.22297251097739 0.44594502195477 0.77913721333340 10.811 > 12 25 B 0.15796394082632 0.84203605917368 0.64034935857052 10.811 > 1 26 B 0.15796394082632 0.31592788165265 0.64034935857052 10.811 > 2 27 B 0.68407211834736 0.84203605917368 0.64034935857052 10.811 > 3 28 B 0.31592788165265 0.15796394082632 0.35965064142948 10.811 > 4 29 B 0.84203605917368 0.15796394082632 0.35965064142948 10.811 > 5 30 B 0.84203605917368 0.68407211834736 0.35965064142948 10.811 > 6 31 B 0.11036082235595 0.88963917764405 0.88752945333327 10.811 > 7 32 B 0.11036082235595 0.22072164471189 0.88752945333327 10.811 > 8 33 B 0.77927835528810 0.88963917764405 0.88752945333327 10.811 > 9 34 B 0.22072164471189 0.11036082235595 0.11247054666673 10.811 > 10 35 B 0.88963917764405 0.11036082235595 0.11247054666673 10.811 > 11 36 B 0.88963917764405 0.77927835528810 0.11247054666673 10.811 > 12 *37 O 0.66666666666667 0.33333333333333 0.71147860861014 15.999 > 13 38 O 0.66666666666667 0.33333333333333 0.95518805805652 15.999 > 14 39 O 0.33333333333333 0.66666666666667 0.04481194194348 15.999 > 13 40 O 0.33333333333333 0.66666666666667 0.28852139138986 15.999 > 14 41 O 0.00000000000000 0.00000000000000 0.37814527527681 15.999 > 13 42 O 0.00000000000000 0.00000000000000 0.62185472472319 15.999 > 14 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5896202 0.0000000 0.0000000 0.0000000 5.5896202 0.0000000 0.0000000 0.0000000 6.2657054 -------------------------- Born effective charges -------------------------- 1 B 1.3926397 -0.7740465 0.1815073 -0.7740465 0.4988478 -0.1047933 -0.0643049 0.0371264 0.3449642 2 B 0.0519519 -0.0000000 -0.0000000 0.0000000 1.8395356 0.2095866 -0.0000000 -0.0742529 0.3449642 3 B 1.3926397 0.7740465 -0.1815073 0.7740465 0.4988478 -0.1047933 0.0643049 0.0371264 0.3449642 4 B 1.3926397 0.7740465 -0.1815073 0.7740465 0.4988478 -0.1047933 0.0643049 0.0371264 0.3449642 5 B 1.3926397 -0.7740465 0.1815073 -0.7740465 0.4988478 -0.1047933 -0.0643049 0.0371264 0.3449642 6 B 0.0519519 -0.0000000 -0.0000000 0.0000000 1.8395356 0.2095866 -0.0000000 -0.0742529 0.3449642 7 B -0.0248084 -0.1649960 -0.2434816 -0.1649960 -0.2153294 0.1405742 -0.1790649 0.1033832 -0.1530003 8 B -0.3105899 -0.0000000 -0.0000000 0.0000000 0.0704521 -0.2811483 -0.0000000 -0.2067663 -0.1530003 9 B -0.0248084 0.1649960 0.2434816 0.1649960 -0.2153294 0.1405742 0.1790649 0.1033832 -0.1530003 10 B -0.0248084 0.1649960 0.2434816 0.1649960 -0.2153294 0.1405742 0.1790649 0.1033832 -0.1530003 11 B -0.0248084 -0.1649960 -0.2434816 -0.1649960 -0.2153294 0.1405742 -0.1790649 0.1033832 -0.1530003 12 B -0.3105899 -0.0000000 -0.0000000 0.0000000 0.0704521 -0.2811483 -0.0000000 -0.2067663 -0.1530003 13 O -2.4770244 0.0000000 -0.0000000 0.0000000 -2.4770244 -0.0000000 -0.0000000 0.0000000 -0.5758916 14 O -2.4770244 0.0000000 -0.0000000 0.0000000 -2.4770244 -0.0000000 -0.0000000 0.0000000 -0.5758916 ---------------------------------------------------------------------------- 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: 126/126 Permutation basis: 3957/3957 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 262 Number of blocks in projector: 170 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 117 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 96 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 49 Use standard eigh solver. Tree of FC basis block matrices: - (262, 250), data: False |-- (49, 46), data: True |-- (96, 92), data: True |-- (117, 112), data: True ----- Solver_atoms: 1 -- 42 / 42 Time (Solver_compr_matrix_reshape): 0.001 Solver_block: 100 / 160 - Time: 0.096 Solver_block: 160 / 160 - Time: 0.040 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.150 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xy) -0.00000000 (xy) Permutation basis: 126/126 Permutation basis: 3957/3957 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 262 Number of blocks in projector: 170 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 117 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 96 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 49 Use standard eigh solver. Tree of FC basis block matrices: - (262, 250), data: False |-- (49, 46), data: True |-- (96, 92), data: True |-- (117, 112), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xy) -0.00000000 (xy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 18:48:52]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 18:48:52]------------------------- 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 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3m (166) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.685019873761806 1.550196946895870 4.087607223333328 b -2.685019873761800 1.550196946895870 4.087607223333328 c 0.000000000000003 -3.100393893791745 4.087607223333328 Atomic positions (fractional): 1 B 0.79831329939685 0.32442147691788 0.79831329939685 10.811 2 B 0.79831329939685 0.79831329939685 0.32442147691788 10.811 3 B 0.32442147691788 0.79831329939685 0.79831329939685 10.811 4 B 0.67557852308212 0.20168670060315 0.20168670060315 10.811 5 B 0.20168670060315 0.67557852308212 0.20168670060315 10.811 6 B 0.20168670060315 0.20168670060315 0.67557852308212 10.811 7 B 0.99789027568921 0.66680780862137 0.99789027568921 10.811 8 B 0.99789027568921 0.99789027568921 0.66680780862137 10.811 9 B 0.66680780862137 0.99789027568921 0.99789027568921 10.811 10 B 0.33319219137863 0.00210972431079 0.00210972431079 10.811 11 B 0.00210972431079 0.33319219137863 0.00210972431079 10.811 12 B 0.00210972431079 0.00210972431079 0.33319219137863 10.811 13 O 0.37814527527681 0.37814527527681 0.37814527527681 15.999 14 O 0.62185472472319 0.62185472472319 0.62185472472319 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 5.370039747523606 0.000000000000000 0.000000000000000 b -2.685019873761803 4.650590840687616 0.000000000000000 c 0.000000000000000 0.000000000000000 12.262821669999997 Atomic positions (fractional): 1 B 0.82463060749299 0.17536939250701 0.97368269190386 10.811 > 1 2 B 0.82463060749299 0.64926121498598 0.97368269190386 10.811 > 2 3 B 0.35073878501402 0.17536939250701 0.97368269190386 10.811 > 3 4 B 0.98259454831931 0.49129727415966 0.69298397476281 10.811 > 4 5 B 0.50870272584035 0.49129727415966 0.69298397476281 10.811 > 5 6 B 0.50870272584035 0.01740545168069 0.69298397476281 10.811 > 6 7 B 0.77702748902261 0.22297251097739 0.22086278666660 10.811 > 7 8 B 0.77702748902261 0.55405497804523 0.22086278666660 10.811 > 8 9 B 0.44594502195477 0.22297251097739 0.22086278666660 10.811 > 9 10 B 0.88738831137856 0.44369415568928 0.44580388000007 10.811 > 10 11 B 0.55630584431072 0.44369415568928 0.44580388000007 10.811 > 11 12 B 0.55630584431072 0.11261168862144 0.44580388000007 10.811 > 12 13 B 0.49129727415966 0.50870272584035 0.30701602523719 10.811 > 1 14 B 0.49129727415966 0.98259454831931 0.30701602523719 10.811 > 2 15 B 0.01740545168069 0.50870272584035 0.30701602523719 10.811 > 3 16 B 0.64926121498598 0.82463060749299 0.02631730809614 10.811 > 4 17 B 0.17536939250701 0.82463060749299 0.02631730809614 10.811 > 5 18 B 0.17536939250701 0.35073878501402 0.02631730809614 10.811 > 6 19 B 0.44369415568928 0.55630584431072 0.55419611999993 10.811 > 7 20 B 0.44369415568928 0.88738831137856 0.55419611999993 10.811 > 8 21 B 0.11261168862144 0.55630584431072 0.55419611999993 10.811 > 9 22 B 0.55405497804523 0.77702748902261 0.77913721333340 10.811 > 10 23 B 0.22297251097739 0.77702748902261 0.77913721333340 10.811 > 11 24 B 0.22297251097739 0.44594502195477 0.77913721333340 10.811 > 12 25 B 0.15796394082632 0.84203605917368 0.64034935857052 10.811 > 1 26 B 0.15796394082632 0.31592788165265 0.64034935857052 10.811 > 2 27 B 0.68407211834736 0.84203605917368 0.64034935857052 10.811 > 3 28 B 0.31592788165265 0.15796394082632 0.35965064142948 10.811 > 4 29 B 0.84203605917368 0.15796394082632 0.35965064142948 10.811 > 5 30 B 0.84203605917368 0.68407211834736 0.35965064142948 10.811 > 6 31 B 0.11036082235595 0.88963917764405 0.88752945333327 10.811 > 7 32 B 0.11036082235595 0.22072164471189 0.88752945333327 10.811 > 8 33 B 0.77927835528810 0.88963917764405 0.88752945333327 10.811 > 9 34 B 0.22072164471189 0.11036082235595 0.11247054666673 10.811 > 10 35 B 0.88963917764405 0.11036082235595 0.11247054666673 10.811 > 11 36 B 0.88963917764405 0.77927835528810 0.11247054666673 10.811 > 12 37 O 0.66666666666667 0.33333333333333 0.71147860861014 15.999 > 37 38 O 0.66666666666667 0.33333333333333 0.95518805805652 15.999 > 38 39 O 0.33333333333333 0.66666666666667 0.04481194194348 15.999 > 37 40 O 0.33333333333333 0.66666666666667 0.28852139138986 15.999 > 38 41 O 0.00000000000000 0.00000000000000 0.37814527527681 15.999 > 37 42 O 0.00000000000000 0.00000000000000 0.62185472472319 15.999 > 38 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5896202 0.0000000 0.0000000 0.0000000 5.5896202 0.0000000 0.0000000 0.0000000 6.2657054 -------------------------- Born effective charges -------------------------- 1 B 1.3926397 -0.7740465 0.1815073 -0.7740465 0.4988478 -0.1047933 -0.0643049 0.0371264 0.3449642 2 B 0.0519519 -0.0000000 -0.0000000 0.0000000 1.8395356 0.2095866 -0.0000000 -0.0742529 0.3449642 3 B 1.3926397 0.7740465 -0.1815073 0.7740465 0.4988478 -0.1047933 0.0643049 0.0371264 0.3449642 4 B 1.3926397 0.7740465 -0.1815073 0.7740465 0.4988478 -0.1047933 0.0643049 0.0371264 0.3449642 5 B 1.3926397 -0.7740465 0.1815073 -0.7740465 0.4988478 -0.1047933 -0.0643049 0.0371264 0.3449642 6 B 0.0519519 -0.0000000 -0.0000000 0.0000000 1.8395356 0.2095866 -0.0000000 -0.0742529 0.3449642 7 B -0.0248084 -0.1649960 -0.2434816 -0.1649960 -0.2153294 0.1405742 -0.1790649 0.1033832 -0.1530003 8 B -0.3105899 -0.0000000 -0.0000000 0.0000000 0.0704521 -0.2811483 -0.0000000 -0.2067663 -0.1530003 9 B -0.0248084 0.1649960 0.2434816 0.1649960 -0.2153294 0.1405742 0.1790649 0.1033832 -0.1530003 10 B -0.0248084 0.1649960 0.2434816 0.1649960 -0.2153294 0.1405742 0.1790649 0.1033832 -0.1530003 11 B -0.0248084 -0.1649960 -0.2434816 -0.1649960 -0.2153294 0.1405742 -0.1790649 0.1033832 -0.1530003 12 B -0.3105899 -0.0000000 -0.0000000 0.0000000 0.0704521 -0.2811483 -0.0000000 -0.2067663 -0.1530003 13 O -2.4770244 0.0000000 -0.0000000 0.0000000 -2.4770244 -0.0000000 -0.0000000 0.0000000 -0.5758916 14 O -2.4770244 0.0000000 -0.0000000 0.0000000 -2.4770244 -0.0000000 -0.0000000 0.0000000 -0.5758916 ---------------------------------------------------------------------------- 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 7, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (xyx) 0.00000000 (xyx) 0.00000000 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 18:48:54]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 18:48:55]------------------------- 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 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3m (166) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.685019873761806 1.550196946895870 4.087607223333328 b -2.685019873761800 1.550196946895870 4.087607223333328 c 0.000000000000003 -3.100393893791745 4.087607223333328 Atomic positions (fractional): 1 B 0.79831329939685 0.32442147691788 0.79831329939685 10.811 2 B 0.79831329939685 0.79831329939685 0.32442147691788 10.811 3 B 0.32442147691788 0.79831329939685 0.79831329939685 10.811 4 B 0.67557852308212 0.20168670060315 0.20168670060315 10.811 5 B 0.20168670060315 0.67557852308212 0.20168670060315 10.811 6 B 0.20168670060315 0.20168670060315 0.67557852308212 10.811 7 B 0.99789027568921 0.66680780862137 0.99789027568921 10.811 8 B 0.99789027568921 0.99789027568921 0.66680780862137 10.811 9 B 0.66680780862137 0.99789027568921 0.99789027568921 10.811 10 B 0.33319219137863 0.00210972431079 0.00210972431079 10.811 11 B 0.00210972431079 0.33319219137863 0.00210972431079 10.811 12 B 0.00210972431079 0.00210972431079 0.33319219137863 10.811 13 O 0.37814527527681 0.37814527527681 0.37814527527681 15.999 14 O 0.62185472472319 0.62185472472319 0.62185472472319 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 5.370039747523606 0.000000000000000 0.000000000000000 b -2.685019873761803 4.650590840687616 0.000000000000000 c 0.000000000000000 0.000000000000000 12.262821669999997 Atomic positions (fractional): 1 B 0.82463060749299 0.17536939250701 0.97368269190386 10.811 > 1 2 B 0.82463060749299 0.64926121498598 0.97368269190386 10.811 > 2 3 B 0.35073878501402 0.17536939250701 0.97368269190386 10.811 > 3 4 B 0.98259454831931 0.49129727415966 0.69298397476281 10.811 > 4 5 B 0.50870272584035 0.49129727415966 0.69298397476281 10.811 > 5 6 B 0.50870272584035 0.01740545168069 0.69298397476281 10.811 > 6 7 B 0.77702748902261 0.22297251097739 0.22086278666660 10.811 > 7 8 B 0.77702748902261 0.55405497804523 0.22086278666660 10.811 > 8 9 B 0.44594502195477 0.22297251097739 0.22086278666660 10.811 > 9 10 B 0.88738831137856 0.44369415568928 0.44580388000007 10.811 > 10 11 B 0.55630584431072 0.44369415568928 0.44580388000007 10.811 > 11 12 B 0.55630584431072 0.11261168862144 0.44580388000007 10.811 > 12 13 B 0.49129727415966 0.50870272584035 0.30701602523719 10.811 > 1 14 B 0.49129727415966 0.98259454831931 0.30701602523719 10.811 > 2 15 B 0.01740545168069 0.50870272584035 0.30701602523719 10.811 > 3 16 B 0.64926121498598 0.82463060749299 0.02631730809614 10.811 > 4 17 B 0.17536939250701 0.82463060749299 0.02631730809614 10.811 > 5 18 B 0.17536939250701 0.35073878501402 0.02631730809614 10.811 > 6 19 B 0.44369415568928 0.55630584431072 0.55419611999993 10.811 > 7 20 B 0.44369415568928 0.88738831137856 0.55419611999993 10.811 > 8 21 B 0.11261168862144 0.55630584431072 0.55419611999993 10.811 > 9 22 B 0.55405497804523 0.77702748902261 0.77913721333340 10.811 > 10 23 B 0.22297251097739 0.77702748902261 0.77913721333340 10.811 > 11 24 B 0.22297251097739 0.44594502195477 0.77913721333340 10.811 > 12 25 B 0.15796394082632 0.84203605917368 0.64034935857052 10.811 > 1 26 B 0.15796394082632 0.31592788165265 0.64034935857052 10.811 > 2 27 B 0.68407211834736 0.84203605917368 0.64034935857052 10.811 > 3 28 B 0.31592788165265 0.15796394082632 0.35965064142948 10.811 > 4 29 B 0.84203605917368 0.15796394082632 0.35965064142948 10.811 > 5 30 B 0.84203605917368 0.68407211834736 0.35965064142948 10.811 > 6 31 B 0.11036082235595 0.88963917764405 0.88752945333327 10.811 > 7 32 B 0.11036082235595 0.22072164471189 0.88752945333327 10.811 > 8 33 B 0.77927835528810 0.88963917764405 0.88752945333327 10.811 > 9 34 B 0.22072164471189 0.11036082235595 0.11247054666673 10.811 > 10 35 B 0.88963917764405 0.11036082235595 0.11247054666673 10.811 > 11 36 B 0.88963917764405 0.77927835528810 0.11247054666673 10.811 > 12 37 O 0.66666666666667 0.33333333333333 0.71147860861014 15.999 > 37 38 O 0.66666666666667 0.33333333333333 0.95518805805652 15.999 > 38 39 O 0.33333333333333 0.66666666666667 0.04481194194348 15.999 > 37 40 O 0.33333333333333 0.66666666666667 0.28852139138986 15.999 > 38 41 O 0.00000000000000 0.00000000000000 0.37814527527681 15.999 > 37 42 O 0.00000000000000 0.00000000000000 0.62185472472319 15.999 > 38 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.5896202 0.0000000 0.0000000 0.0000000 5.5896202 0.0000000 0.0000000 0.0000000 6.2657054 -------------------------- Born effective charges -------------------------- 1 B 1.3926397 -0.7740465 0.1815073 -0.7740465 0.4988478 -0.1047933 -0.0643049 0.0371264 0.3449642 2 B 0.0519519 -0.0000000 -0.0000000 0.0000000 1.8395356 0.2095866 -0.0000000 -0.0742529 0.3449642 3 B 1.3926397 0.7740465 -0.1815073 0.7740465 0.4988478 -0.1047933 0.0643049 0.0371264 0.3449642 4 B 1.3926397 0.7740465 -0.1815073 0.7740465 0.4988478 -0.1047933 0.0643049 0.0371264 0.3449642 5 B 1.3926397 -0.7740465 0.1815073 -0.7740465 0.4988478 -0.1047933 -0.0643049 0.0371264 0.3449642 6 B 0.0519519 -0.0000000 -0.0000000 0.0000000 1.8395356 0.2095866 -0.0000000 -0.0742529 0.3449642 7 B -0.0248084 -0.1649960 -0.2434816 -0.1649960 -0.2153294 0.1405742 -0.1790649 0.1033832 -0.1530003 8 B -0.3105899 -0.0000000 -0.0000000 0.0000000 0.0704521 -0.2811483 -0.0000000 -0.2067663 -0.1530003 9 B -0.0248084 0.1649960 0.2434816 0.1649960 -0.2153294 0.1405742 0.1790649 0.1033832 -0.1530003 10 B -0.0248084 0.1649960 0.2434816 0.1649960 -0.2153294 0.1405742 0.1790649 0.1033832 -0.1530003 11 B -0.0248084 -0.1649960 -0.2434816 -0.1649960 -0.2153294 0.1405742 -0.1790649 0.1033832 -0.1530003 12 B -0.3105899 -0.0000000 -0.0000000 0.0000000 0.0704521 -0.2811483 -0.0000000 -0.2067663 -0.1530003 13 O -2.4770244 0.0000000 -0.0000000 0.0000000 -2.4770244 -0.0000000 -0.0000000 0.0000000 -0.5758916 14 O -2.4770244 0.0000000 -0.0000000 0.0000000 -2.4770244 -0.0000000 -0.0000000 0.0000000 -0.5758916 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (xyx) 0.00000000 (xyx) 0.00000000 (xxy) Max drift of fc2: -0.00000000 (xy) -0.00000000 (xy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 11 11 ] 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: 0.89, Number of G-points: 307, Lambda: 0.22 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/146) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 146 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 11.141 ( 0.000 0.000 0.000) 0.000 12.142 ( 0.000 0.000 0.000) 0.000 14.937 ( 0.000 0.000 0.000) 0.000 14.937 ( 0.000 0.000 0.000) 0.000 15.355 ( 0.000 0.000 0.000) 0.000 16.079 ( 0.000 0.000 0.000) 0.000 16.079 ( 0.000 0.000 0.000) 0.000 16.933 ( 0.000 0.000 0.000) 0.000 16.933 ( 0.000 0.000 0.000) 0.000 17.072 ( 0.000 0.000 0.000) 0.000 17.927 ( 0.000 0.000 0.000) 0.000 17.927 ( 0.000 0.000 0.000) 0.000 21.289 ( 0.000 0.000 0.000) 0.000 21.289 ( 0.000 0.000 0.000) 0.000 22.261 ( 0.000 0.000 0.000) 0.000 22.291 ( 0.000 0.000 0.000) 0.000 22.291 ( 0.000 0.000 0.000) 0.000 23.718 ( 0.000 0.000 0.000) 0.000 23.983 ( 0.000 0.000 0.000) 0.000 24.009 ( 0.000 0.000 0.000) 0.000 24.009 ( 0.000 0.000 0.000) 0.000 24.115 ( 0.000 0.000 0.000) 0.000 24.802 ( 0.000 0.000 0.000) 0.000 24.802 ( 0.000 0.000 0.000) 0.000 25.391 ( 0.000 0.000 0.000) 0.000 25.391 ( 0.000 0.000 0.000) 0.000 26.229 ( 0.000 0.000 0.000) 0.000 26.346 ( 0.000 0.000 0.000) 0.000 26.346 ( 0.000 0.000 0.000) 0.000 26.996 ( 0.000 0.000 0.000) 0.000 31.350 ( 0.000 0.000 0.000) 0.000 31.846 ( 0.000 0.000 0.000) 0.000 31.846 ( 0.000 0.000 0.000) 0.000 32.144 ( 0.000 0.000 0.000) 0.000 32.144 ( 0.000 0.000 0.000) 0.000 33.063 ( 0.000 0.000 0.000) 0.000 33.788 ( 0.000 0.000 0.000) 0.000 33.788 ( 0.000 0.000 0.000) 0.000 34.514 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/146) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( 54.006 31.180 62.992) 88.638 1.878 ( 72.781 42.020 30.680) 89.466 2.929 ( 122.276 70.596 19.086) 142.477 11.106 ( -2.187 -1.263 -3.404) 4.239 12.017 ( -14.780 -8.533 9.687) 19.625 14.794 ( -15.766 -9.103 2.477) 18.373 14.826 ( -3.880 -2.240 -12.451) 13.233 15.319 ( 2.346 1.354 -19.753) 19.938 15.751 ( -13.585 -7.843 -11.050) 19.188 15.971 ( 0.085 0.049 -17.547) 17.548 16.981 ( 2.429 1.402 -0.046) 2.805 17.292 ( 8.228 4.750 11.904) 15.230 17.314 ( 16.801 9.700 32.160) 37.558 18.069 ( 12.539 7.239 -2.212) 14.647 18.153 ( 16.397 9.467 12.410) 22.638 20.737 ( -30.891 -17.835 -26.380) 44.365 21.221 ( -3.881 -2.241 -7.459) 8.702 22.114 ( -12.888 -7.441 -3.329) 15.250 22.275 ( -2.982 -1.721 4.806) 5.912 22.710 ( 17.959 10.369 15.129) 25.669 23.630 ( -3.332 -1.924 -2.930) 4.836 23.875 ( -8.629 -4.982 0.669) 9.987 24.008 ( -1.418 -0.819 6.568) 6.769 24.108 ( 2.817 1.626 0.899) 3.374 24.181 ( 2.671 1.542 -2.641) 4.060 24.633 ( -14.108 -8.145 4.061) 16.789 24.768 ( -1.183 -0.683 -3.933) 4.163 25.080 ( -20.090 -11.599 -3.364) 23.441 25.208 ( -10.180 -5.877 1.320) 11.828 26.319 ( -0.571 -0.330 -0.647) 0.924 26.546 ( 0.126 0.072 4.514) 4.516 26.636 ( 27.954 16.139 -3.458) 32.463 27.070 ( 6.698 3.867 -1.894) 7.963 31.300 ( -3.764 -2.173 -0.354) 4.360 31.841 ( -0.472 -0.272 -0.137) 0.561 32.153 ( 0.383 0.221 1.375) 1.444 32.240 ( 7.938 4.583 -0.379) 9.174 33.085 ( 2.415 1.394 -1.907) 3.378 33.453 ( 15.869 9.162 -57.353) 60.209 33.777 ( -0.871 -0.503 -0.244) 1.035 33.840 ( 4.276 2.469 -0.485) 4.962 34.509 ( -0.790 -0.456 1.095) 1.425 ======================= Grid point 2 (3/146) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.355 ( 52.222 30.151 58.394) 83.941 3.732 ( 71.514 41.289 29.629) 87.732 5.768 ( 116.448 67.231 16.657) 135.490 10.958 ( -8.834 -5.100 -7.600) 12.721 11.701 ( -17.526 -10.119 12.276) 23.670 14.241 ( -31.911 -18.424 -3.300) 36.995 14.681 ( 2.189 1.264 -16.177) 16.374 14.951 ( -14.956 -8.635 -26.700) 31.798 15.759 ( 15.185 8.767 -3.062) 17.800 15.878 ( 0.546 0.315 -10.795) 10.813 17.030 ( 3.019 1.743 -3.753) 5.122 17.487 ( 3.204 1.850 8.685) 9.440 17.958 ( 15.973 9.222 29.528) 34.815 18.445 ( 21.247 12.267 0.326) 24.536 18.772 ( 24.535 14.165 20.501) 34.970 19.802 ( -32.289 -18.642 -27.120) 46.104 20.986 ( -10.124 -5.845 -14.283) 18.458 21.689 ( -21.378 -12.343 -3.863) 24.986 22.227 ( -6.262 -3.616 10.489) 12.740 22.934 ( -6.971 -4.025 4.648) 9.295 23.493 ( -14.590 -8.423 -6.729) 18.141 23.674 ( -9.895 -5.713 3.297) 11.892 23.993 ( -1.491 -0.861 2.287) 2.863 24.083 ( -9.650 -5.571 -2.437) 11.406 24.119 ( 5.986 3.456 -4.211) 8.094 24.437 ( -4.237 -2.446 5.490) 7.354 24.669 ( -7.204 -4.159 -0.221) 8.322 24.837 ( 2.900 1.675 4.524) 5.628 25.014 ( -6.627 -3.826 -4.471) 8.863 26.289 ( -0.811 -0.468 -2.699) 2.857 26.514 ( -7.810 -4.509 11.865) 14.903 27.223 ( 8.004 4.621 -4.935) 10.477 27.282 ( 29.124 16.815 -1.415) 33.660 31.202 ( -4.213 -2.432 -0.507) 4.891 31.820 ( -1.367 -0.789 0.031) 1.579 32.181 ( 0.866 0.500 2.065) 2.294 32.459 ( 11.032 6.369 -0.612) 12.753 33.133 ( 3.280 1.894 -3.581) 5.213 33.381 ( 5.603 3.235 -26.542) 27.319 33.747 ( -1.483 -0.856 -0.420) 1.763 33.953 ( 5.093 2.941 1.570) 6.087 34.495 ( -1.480 -0.855 1.874) 2.537 ======================= Grid point 3 (4/146) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.908 ( 49.154 28.379 50.719) 76.118 5.535 ( 69.019 39.848 27.765) 84.394 8.317 ( 94.304 54.446 9.551) 109.311 10.577 ( -16.979 -9.803 -5.150) 20.271 11.564 ( 1.471 0.849 9.333) 9.486 13.347 ( -42.461 -24.515 -9.196) 49.885 14.441 ( -13.767 -7.948 -19.681) 25.299 14.716 ( 10.433 6.023 -12.856) 17.618 15.807 ( -2.758 -1.592 -3.526) 4.751 16.209 ( 25.115 14.500 -2.245) 29.087 17.058 ( 3.012 1.739 -6.813) 7.649 17.602 ( 1.892 1.092 7.836) 8.134 18.225 ( -12.430 -7.177 8.938) 16.909 19.010 ( -4.494 -2.595 -2.068) 5.586 19.011 ( 10.846 6.262 -8.779) 15.294 19.436 ( 17.585 10.153 19.238) 27.972 20.579 ( -12.889 -7.441 -17.101) 22.670 21.151 ( -21.394 -12.352 -3.437) 24.941 22.148 ( -9.256 -5.344 15.568) 18.884 22.485 ( -29.070 -16.783 -5.939) 34.088 23.045 ( -12.896 -7.445 -6.287) 16.163 23.512 ( -6.647 -3.838 5.503) 9.445 23.846 ( -8.701 -5.023 -1.112) 10.108 23.967 ( -4.925 -2.843 2.347) 6.152 24.192 ( -0.925 -0.534 -7.182) 7.261 24.416 ( -1.751 -1.011 1.408) 2.464 24.695 ( 10.968 6.333 -0.763) 12.688 24.833 ( -5.012 -2.894 -7.991) 9.867 25.036 ( 8.753 5.054 7.562) 12.623 26.249 ( -0.785 -0.453 -2.868) 3.007 26.398 ( -11.341 -6.547 16.305) 20.912 27.337 ( 5.681 3.280 -6.133) 8.980 27.886 ( 24.418 14.098 -0.439) 28.199 31.113 ( -3.323 -1.919 -0.434) 3.862 31.779 ( -2.326 -1.343 0.356) 2.710 32.220 ( 1.160 0.670 1.949) 2.365 32.702 ( 10.462 6.040 -0.657) 12.098 33.166 ( 2.290 1.322 -5.067) 5.716 33.325 ( 3.151 1.819 -14.498) 14.948 33.708 ( -1.634 -0.944 -0.471) 1.945 34.083 ( 4.854 2.802 2.567) 6.164 34.470 ( -1.984 -1.146 2.099) 3.107 ======================= Grid point 4 (5/146) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.309 ( 44.716 25.817 40.324) 65.514 7.237 ( 63.779 36.823 24.592) 77.643 9.316 ( -10.807 -6.240 -13.475) 18.366 10.626 ( 16.660 9.618 9.031) 21.251 12.224 ( -48.470 -27.984 -13.509) 57.576 12.246 ( 63.043 36.398 6.317) 73.070 14.063 ( -8.936 -5.159 -12.129) 15.924 14.944 ( 15.944 9.205 -7.852) 20.015 15.680 ( -9.299 -5.369 4.452) 11.624 16.808 ( 23.619 13.637 8.061) 28.440 17.080 ( 8.400 4.850 -17.870) 20.333 17.554 ( -43.039 -24.849 1.509) 49.720 17.694 ( 0.836 0.482 9.088) 9.139 18.530 ( -20.268 -11.702 -20.682) 31.232 19.511 ( -20.510 -11.841 1.670) 23.741 19.579 ( 20.598 11.892 5.813) 24.485 20.480 ( 13.815 7.976 -3.506) 16.333 20.838 ( -4.565 -2.636 2.706) 5.926 21.830 ( -21.533 -12.432 -4.666) 25.298 22.043 ( -10.292 -5.942 16.015) 19.943 22.784 ( -7.648 -4.416 -4.843) 10.072 23.462 ( -1.350 -0.779 4.375) 4.644 23.685 ( -5.112 -2.951 -0.561) 5.929 23.759 ( -12.053 -6.959 -1.992) 14.059 24.118 ( -1.150 -0.664 -1.823) 2.255 24.338 ( -4.579 -2.644 -3.178) 6.170 24.701 ( -1.681 -0.971 -5.773) 6.091 24.943 ( 9.308 5.374 -1.971) 10.927 25.311 ( 12.288 7.095 0.262) 14.192 26.215 ( -0.567 -0.327 -2.011) 2.115 26.259 ( -11.833 -6.832 17.624) 22.300 27.395 ( 3.315 1.914 -5.029) 6.320 28.352 ( 16.495 9.523 -0.087) 19.047 31.048 ( -2.117 -1.222 -0.280) 2.460 31.726 ( -2.449 -1.414 0.462) 2.866 32.257 ( 0.983 0.567 1.324) 1.744 32.905 ( 7.691 4.440 -0.443) 8.892 33.158 ( 0.493 0.285 -5.182) 5.213 33.309 ( 2.174 1.255 -6.568) 7.031 33.671 ( -1.259 -0.727 -0.370) 1.500 34.203 ( 4.073 2.351 2.101) 5.151 34.436 ( -2.252 -1.300 1.661) 3.086 ======================= Grid point 5 (6/146) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.500 ( 36.821 21.259 27.260) 50.506 8.622 ( -30.700 -17.725 -18.072) 39.790 8.666 ( 42.460 24.514 15.558) 51.438 10.846 ( 2.005 1.158 2.832) 3.658 11.078 ( -37.462 -21.628 -11.872) 44.857 13.866 ( -3.072 -1.774 -4.101) 5.422 14.055 ( 79.356 45.816 -2.231) 91.660 15.285 ( 15.646 9.033 -1.699) 18.146 15.407 ( -23.605 -13.628 14.619) 30.929 16.400 ( -52.692 -30.422 -3.715) 60.957 17.036 ( -0.909 -0.525 4.702) 4.818 17.420 ( 20.037 11.568 -13.342) 26.707 17.800 ( 3.368 1.944 9.558) 10.318 17.959 ( -11.329 -6.541 -13.817) 19.027 18.945 ( -20.665 -11.931 -2.838) 24.030 19.984 ( 10.946 6.320 1.643) 12.746 20.787 ( 9.204 5.314 -0.257) 10.631 20.816 ( -2.657 -1.534 2.462) 3.934 21.527 ( -4.105 -2.370 -0.260) 4.747 21.941 ( -5.630 -3.251 7.673) 10.057 22.629 ( -3.127 -1.805 -2.423) 4.348 23.486 ( 0.748 0.432 1.172) 1.456 23.509 ( -6.504 -3.755 -1.539) 7.667 23.607 ( -1.859 -1.073 0.745) 2.273 24.097 ( -0.295 -0.170 -0.217) 0.404 24.211 ( -2.943 -1.699 -3.088) 4.592 24.659 ( -0.115 -0.067 -1.610) 1.615 25.068 ( 2.684 1.550 -0.111) 3.101 25.537 ( 7.489 4.324 -4.080) 9.562 26.144 ( -6.636 -3.831 9.868) 12.493 26.196 ( -0.207 -0.119 -0.706) 0.745 27.418 ( 1.104 0.638 -1.942) 2.323 28.609 ( 5.901 3.407 -0.008) 6.813 31.014 ( -0.735 -0.425 -0.098) 0.855 31.686 ( -1.093 -0.631 0.211) 1.279 32.280 ( 0.381 0.220 0.463) 0.639 33.037 ( 3.964 2.289 0.361) 4.592 33.120 ( -1.164 -0.672 -2.587) 2.915 33.314 ( 0.798 0.460 -1.897) 2.109 33.649 ( -0.471 -0.272 -0.140) 0.562 34.291 ( 2.445 1.411 0.790) 2.931 34.396 ( -1.826 -1.054 0.629) 2.200 ======================= Grid point 12 (7/146) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( -0.000 71.901 41.793) 83.165 2.178 ( -0.000 48.832 79.680) 93.453 3.323 ( -0.000 127.345 53.523) 138.136 11.080 ( 0.000 -1.724 -5.186) 5.465 12.112 ( 0.000 -19.600 15.786) 25.166 14.592 ( 0.000 -18.210 -19.201) 26.462 14.970 ( -0.000 2.305 1.213) 2.605 15.068 ( -0.000 -7.737 -34.270) 35.133 15.640 ( 0.000 -8.659 -11.871) 14.694 15.716 ( -0.000 3.302 -38.562) 38.703 17.220 ( -0.000 5.241 21.492) 22.122 17.353 ( -0.000 10.366 23.248) 25.454 17.607 ( -0.000 17.341 35.664) 39.656 18.030 ( -0.000 8.376 2.348) 8.699 18.228 ( -0.000 18.210 11.724) 21.658 20.710 ( 0.000 -14.687 -40.126) 42.729 20.777 ( 0.000 -27.415 -22.322) 35.353 22.257 ( 0.000 -5.029 2.465) 5.600 22.506 ( -0.000 7.733 5.097) 9.262 22.602 ( 0.000 0.440 20.986) 20.991 23.609 ( 0.000 -2.408 -4.529) 5.129 23.878 ( 0.000 -12.873 -0.984) 12.911 24.034 ( 0.000 -4.822 5.636) 7.417 24.138 ( -0.000 6.013 4.476) 7.496 24.188 ( -0.000 3.959 -1.434) 4.211 24.545 ( 0.000 -18.386 -1.304) 18.432 24.782 ( 0.000 -1.757 -3.592) 3.999 25.178 ( 0.000 -5.944 -2.104) 6.305 25.210 ( 0.000 -20.269 8.789) 22.093 26.318 ( -0.000 2.985 -0.344) 3.004 26.369 ( 0.000 -4.607 -9.657) 10.700 26.766 ( -0.000 29.265 7.567) 30.228 27.051 ( -0.000 8.744 -3.243) 9.326 31.301 ( 0.000 -4.263 -0.388) 4.281 31.871 ( 0.000 0.441 2.556) 2.594 32.129 ( 0.000 -0.832 -0.783) 1.143 32.241 ( -0.000 9.795 -0.650) 9.817 33.006 ( -0.000 38.862 -52.313) 65.168 33.075 ( -0.000 8.280 -9.589) 12.669 33.800 ( 0.000 -0.132 1.788) 1.793 33.803 ( -0.000 0.975 0.660) 1.177 34.521 ( 0.000 -0.960 2.127) 2.334 ======================= Grid point 13 (8/146) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.409 ( 35.556 47.344 59.047) 83.619 3.575 ( 40.114 54.783 52.465) 85.807 5.400 ( 53.516 114.853 40.772) 133.107 10.984 ( -4.448 -2.221 -7.002) 8.588 11.893 ( -12.329 -24.224 15.417) 31.249 14.312 ( 9.095 -16.520 -25.517) 31.729 14.554 ( -17.561 -10.275 -24.552) 31.887 14.813 ( -13.539 -15.765 -9.249) 22.746 15.503 ( 7.752 13.104 -35.356) 38.495 15.722 ( 11.624 4.554 -5.754) 13.746 17.265 ( -13.175 6.330 21.664) 26.134 17.673 ( -1.299 11.882 14.421) 18.731 18.112 ( 6.934 14.963 35.442) 39.091 18.265 ( 14.813 12.232 3.343) 19.499 18.706 ( 18.894 19.164 17.403) 32.048 19.884 ( -26.182 -19.815 -33.083) 46.612 20.567 ( 12.165 -25.791 -28.917) 40.612 22.076 ( -22.592 2.371 -5.506) 23.374 22.308 ( -6.945 -16.806 17.934) 25.541 22.912 ( 7.605 -8.358 3.967) 11.976 23.512 ( -6.868 -10.597 -6.756) 14.322 23.737 ( 4.420 -4.708 -4.098) 7.648 23.939 ( -8.709 -8.221 -1.414) 12.060 24.082 ( -3.043 -1.785 4.518) 5.732 24.211 ( -2.402 3.688 -2.130) 4.889 24.568 ( 4.703 -1.042 5.738) 7.491 24.697 ( 3.232 -6.730 -4.598) 8.767 24.817 ( -21.495 -11.831 7.638) 25.697 25.138 ( -6.119 -0.574 4.114) 7.396 26.220 ( 1.267 -8.956 -6.890) 11.370 26.490 ( 10.769 -4.731 5.068) 12.808 27.145 ( 3.304 12.675 -4.310) 13.789 27.197 ( 9.885 27.471 3.033) 29.352 31.211 ( -3.390 -5.447 -0.351) 6.425 31.902 ( -2.018 3.873 1.915) 4.769 32.120 ( 2.905 -3.490 0.342) 4.553 32.404 ( 5.697 11.155 -0.268) 12.529 33.072 ( 4.990 7.334 -13.171) 15.880 33.117 ( 5.448 14.670 -24.851) 29.368 33.775 ( -2.103 0.146 0.506) 2.168 33.891 ( 5.460 1.450 2.037) 6.005 34.521 ( -0.844 -1.451 2.780) 3.248 ======================= Grid point 14 (9/146) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.875 ( 37.791 32.963 60.761) 78.782 5.246 ( 51.760 56.597 36.118) 84.775 7.738 ( 67.235 91.295 25.967) 116.317 10.751 ( -14.419 -2.922 -5.863) 15.837 11.575 ( -5.261 -19.962 9.675) 22.798 13.812 ( -38.641 -10.101 -17.456) 43.587 14.258 ( 15.696 -12.795 -27.462) 34.121 14.337 ( -2.866 -17.123 -11.995) 21.102 15.532 ( 12.620 -3.956 -19.555) 23.608 16.057 ( 14.546 26.161 -7.632) 30.891 17.253 ( -12.477 3.235 21.506) 25.073 17.811 ( -5.967 12.550 11.062) 17.761 18.423 ( -3.542 5.770 6.865) 9.641 18.820 ( 18.733 11.068 10.852) 24.315 19.091 ( -16.617 -8.561 -14.085) 23.406 19.385 ( 20.747 15.347 16.041) 30.386 20.227 ( 3.783 -29.466 -25.736) 39.305 21.535 ( -31.752 -5.979 -3.847) 32.538 22.197 ( -0.192 -20.466 12.839) 24.161 22.644 ( -17.516 -25.335 -5.468) 31.283 23.117 ( -10.199 -10.554 -8.072) 16.750 23.635 ( -9.656 -4.037 2.298) 10.715 23.942 ( 1.959 4.761 -8.539) 9.971 24.023 ( -3.508 0.181 -2.855) 4.527 24.167 ( -1.725 2.727 -1.356) 3.500 24.478 ( 1.143 -17.472 2.583) 17.699 24.563 ( -10.649 3.971 6.388) 13.038 24.775 ( 4.684 -4.137 0.126) 6.251 25.131 ( -2.084 9.305 7.413) 12.078 26.142 ( 4.941 -9.468 -5.227) 11.891 26.570 ( -1.526 -5.662 11.041) 12.502 27.260 ( 3.468 7.498 -5.547) 9.951 27.715 ( 16.863 24.546 0.847) 29.792 31.103 ( -2.133 -6.067 -0.170) 6.433 31.887 ( -5.923 5.411 0.761) 8.059 32.163 ( 5.075 -4.379 1.766) 6.932 32.624 ( 7.498 10.390 -0.244) 12.816 33.114 ( 1.628 3.695 -6.032) 7.259 33.156 ( 6.234 7.371 -18.390) 20.770 33.741 ( -2.454 0.289 0.239) 2.483 34.025 ( 6.256 1.601 2.187) 6.818 34.505 ( -1.616 -1.886 2.824) 3.761 ======================= Grid point 15 (10/146) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.211 ( 36.414 27.701 49.080) 67.098 6.922 ( 52.407 53.608 30.514) 80.941 9.284 ( 11.140 21.548 -2.339) 24.369 10.600 ( 2.759 10.249 9.836) 14.471 11.736 ( 34.366 16.715 3.189) 38.349 12.796 ( -51.540 -11.935 -13.728) 54.656 13.968 ( -0.243 -4.706 -26.211) 26.631 14.476 ( 27.745 -11.667 -8.835) 31.369 15.541 ( 9.697 -16.159 -3.240) 19.122 16.561 ( 18.150 33.325 -14.283) 40.546 17.237 ( -10.120 0.027 23.662) 25.735 17.870 ( -11.137 3.189 7.524) 13.814 18.067 ( -24.629 1.240 -4.264) 25.026 18.698 ( -21.638 -3.986 -5.805) 22.755 19.391 ( 17.548 6.485 9.383) 20.929 19.714 ( -14.077 -15.169 -6.962) 21.834 19.994 ( 27.259 -4.321 -2.266) 27.692 20.997 ( -14.319 -7.613 -0.323) 16.220 21.937 ( -15.531 -25.767 -3.102) 30.245 22.143 ( -4.682 -14.856 5.780) 16.614 22.864 ( -7.650 -2.939 -6.588) 10.514 23.487 ( -3.598 -4.306 0.512) 5.634 23.780 ( -9.531 -0.033 -4.061) 10.360 23.945 ( -10.204 5.956 -8.140) 14.348 24.136 ( -1.962 0.686 -1.235) 2.418 24.426 ( 0.284 -16.026 7.692) 17.779 24.490 ( -0.121 -1.574 1.027) 1.883 24.836 ( 7.238 2.432 -1.880) 7.864 25.300 ( 2.833 11.729 2.623) 12.348 26.110 ( 4.993 -8.589 -2.901) 10.350 26.527 ( -8.601 -2.363 12.384) 15.262 27.329 ( 2.962 3.359 -4.151) 6.106 28.208 ( 15.472 17.588 0.099) 23.425 31.022 ( -0.417 -5.900 -0.074) 5.916 31.833 ( -6.523 4.830 0.414) 8.128 32.215 ( 3.828 -3.348 1.744) 5.376 32.838 ( 6.843 8.040 -0.167) 10.559 33.116 ( 0.753 3.122 -6.446) 7.202 33.206 ( 5.269 3.045 -8.784) 10.687 33.705 ( -2.468 0.755 0.337) 2.603 34.154 ( 5.400 1.191 1.901) 5.847 34.471 ( -2.189 -2.246 2.126) 3.789 ======================= Grid point 16 (11/146) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.365 ( 32.648 23.766 35.777) 53.951 8.464 ( 43.426 47.887 23.190) 68.679 8.862 ( -32.526 -14.196 -14.755) 38.434 10.743 ( 2.623 -11.259 4.318) 12.340 11.562 ( -49.117 -17.486 -13.754) 53.921 13.245 ( 62.676 52.272 -1.110) 81.620 13.846 ( 7.783 12.515 -20.447) 25.205 14.839 ( 32.019 -8.623 -4.067) 33.408 15.484 ( 3.328 -23.335 9.790) 25.523 16.879 ( -11.179 -3.717 -2.484) 12.040 17.261 ( -39.917 -4.601 6.668) 40.731 17.397 ( 0.693 20.378 8.181) 21.970 17.998 ( -12.052 0.438 -2.464) 12.309 18.087 ( -15.759 6.409 2.788) 17.239 19.126 ( -18.541 -19.647 -9.314) 28.575 19.815 ( 15.251 4.705 3.335) 16.305 20.313 ( 19.176 -12.371 -4.128) 23.190 20.959 ( 5.679 1.849 2.732) 6.568 21.473 ( -8.193 -18.671 -3.035) 20.614 22.008 ( -2.332 -11.790 3.059) 12.402 22.691 ( -5.386 0.308 -5.004) 7.358 23.455 ( 1.910 -1.284 1.149) 2.572 23.613 ( -6.372 1.505 -6.870) 9.490 23.733 ( -12.733 8.883 -8.863) 17.877 24.114 ( -1.174 0.175 0.384) 1.247 24.303 ( -7.337 -7.233 13.913) 17.312 24.514 ( 6.782 -9.340 0.422) 11.550 24.982 ( 7.647 -0.492 -0.528) 7.681 25.464 ( 4.428 12.140 -6.318) 14.384 26.088 ( 2.934 -8.451 0.297) 8.951 26.425 ( -11.793 2.262 7.137) 13.969 27.376 ( 2.978 -0.189 -0.395) 3.010 28.553 ( 8.424 10.531 -0.173) 13.486 30.973 ( 1.133 -5.310 -0.049) 5.430 31.777 ( -5.720 5.080 0.157) 7.651 32.248 ( 2.396 -2.955 1.086) 3.956 32.999 ( 4.592 5.044 0.051) 6.822 33.112 ( 0.070 1.864 -3.157) 3.667 33.258 ( 3.923 1.346 -4.224) 5.920 33.681 ( -2.085 1.486 0.703) 2.655 34.254 ( 3.913 0.586 1.208) 4.137 34.419 ( -2.384 -2.477 0.640) 3.497 ======================= Grid point 17 (12/146) ======================= q-point: (-0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.805 ( -39.750 -17.119 -14.693) 45.706 8.422 ( 27.001 17.483 15.940) 35.900 9.203 ( -32.367 11.814 -0.569) 34.460 10.607 ( 11.194 -11.148 2.668) 16.022 11.009 ( 5.964 10.963 0.976) 12.518 13.735 ( 7.803 1.473 -11.746) 14.179 14.710 ( 24.004 26.110 -19.624) 40.534 15.148 ( 0.966 -20.227 2.954) 20.464 15.325 ( -36.573 -21.821 12.515) 44.389 15.949 ( 11.255 0.817 2.366) 11.530 17.073 ( -5.096 5.177 -1.902) 7.509 17.715 ( -3.441 20.654 5.074) 21.545 17.958 ( 7.930 7.499 12.411) 16.528 18.111 ( -18.762 5.852 13.174) 23.661 18.788 ( 6.775 1.838 0.290) 7.026 19.993 ( 1.603 -6.369 -0.515) 6.588 20.361 ( 13.836 -20.965 -7.887) 26.328 21.043 ( -6.308 7.029 -4.265) 10.363 21.278 ( 12.869 -19.897 -1.513) 23.744 21.869 ( -1.124 -5.849 -7.760) 9.782 22.653 ( 0.813 4.615 -0.107) 4.687 23.419 ( 0.100 -4.138 -7.924) 8.940 23.547 ( -4.090 9.159 -3.526) 10.632 23.683 ( -0.627 13.836 -0.185) 13.852 24.105 ( -0.205 0.253 0.581) 0.666 24.277 ( -2.915 -3.622 16.638) 17.276 24.536 ( 6.612 -11.331 2.435) 13.343 25.045 ( 2.457 -4.299 0.536) 4.981 25.591 ( 3.230 9.134 -7.430) 12.210 26.026 ( -1.369 -7.968 -0.035) 8.084 26.303 ( -8.044 5.864 -2.242) 10.204 27.422 ( 2.002 -1.623 3.556) 4.392 28.678 ( -1.980 3.620 -0.254) 4.133 30.956 ( 2.685 -4.585 -0.031) 5.314 31.751 ( -3.773 6.334 -0.110) 7.373 32.253 ( 1.195 -3.241 0.221) 3.461 33.073 ( -1.050 0.904 -0.423) 1.449 33.123 ( 1.485 2.043 1.179) 2.788 33.302 ( 2.510 0.227 -0.668) 2.608 33.676 ( -1.478 2.330 1.253) 3.030 34.299 ( -0.403 -1.698 0.396) 1.789 34.368 ( 0.466 -0.928 -1.316) 1.676 ======================= Grid point 18 (13/146) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.634 ( -51.486 -22.427 -27.263) 62.426 8.007 ( -73.815 -16.004 -15.918) 77.190 9.221 ( 24.414 16.936 15.862) 33.682 10.630 ( 1.145 -11.171 -5.115) 12.339 11.860 ( 40.780 32.884 12.816) 53.931 13.169 ( -82.232 -31.908 -6.152) 88.420 14.033 ( -0.884 8.681 -4.268) 9.714 14.949 ( -2.268 -25.865 2.128) 26.051 15.331 ( 23.709 -8.623 -0.987) 25.248 16.887 ( 33.919 15.028 -2.319) 37.172 16.930 ( -4.725 4.580 -10.920) 12.749 17.715 ( -18.872 9.889 22.130) 30.719 17.918 ( -14.164 18.496 3.871) 23.616 18.501 ( 18.579 13.745 25.848) 34.673 19.257 ( 24.868 13.779 3.157) 28.605 19.735 ( -15.356 -13.599 -3.100) 20.745 20.247 ( 5.666 -26.091 -10.489) 28.686 20.882 ( -2.964 -2.829 -3.700) 5.521 21.497 ( 23.583 -2.302 -2.162) 23.793 21.794 ( 8.551 -0.600 -14.686) 17.005 22.777 ( 4.701 7.232 2.419) 8.959 23.379 ( 4.328 -2.958 -3.865) 6.513 23.580 ( 2.974 8.952 -6.285) 11.335 23.857 ( -0.466 15.830 2.976) 16.115 24.138 ( 1.093 3.754 2.802) 4.810 24.359 ( 1.481 -0.068 11.000) 11.100 24.554 ( 7.545 -15.915 5.902) 18.576 24.999 ( -1.887 -6.437 1.302) 6.833 25.538 ( -14.372 -0.026 0.437) 14.378 25.970 ( 8.272 1.040 -13.308) 15.703 26.257 ( -1.309 4.387 -3.367) 5.683 27.456 ( -0.532 -1.404 5.464) 5.666 28.553 ( -13.194 -2.017 -0.182) 13.348 30.973 ( 4.230 -3.844 0.015) 5.716 31.773 ( -1.816 7.704 -0.175) 7.917 32.229 ( 0.375 -3.984 -0.642) 4.053 33.003 ( -6.331 -1.228 0.439) 6.464 33.186 ( 1.484 0.959 3.010) 3.490 33.342 ( 1.588 -0.393 2.971) 3.392 33.695 ( -0.927 3.083 1.897) 3.737 34.219 ( -3.476 -3.732 -2.185) 5.548 34.394 ( 2.481 0.492 -1.286) 2.837 ======================= Grid point 19 (14/146) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.263 ( -58.517 -22.100 -30.796) 69.721 6.386 ( -81.765 -17.864 -16.391) 85.284 9.349 ( -54.878 -14.732 3.984) 56.961 10.496 ( 5.848 8.449 0.815) 10.307 11.591 ( -32.367 -21.510 -7.954) 39.669 13.038 ( 36.274 36.644 8.177) 52.206 14.277 ( 18.712 -1.325 2.374) 18.908 14.734 ( 0.415 -17.865 7.458) 19.364 15.586 ( 17.376 -10.673 2.818) 20.586 16.483 ( -23.534 -0.344 -15.845) 28.373 17.309 ( -1.321 -4.813 20.539) 21.136 17.762 ( -11.384 12.853 3.997) 17.629 18.156 ( 5.947 27.825 3.364) 28.651 18.945 ( 8.024 4.733 7.094) 11.709 19.246 ( -19.779 -13.470 2.451) 24.055 19.535 ( -13.971 2.620 -14.929) 20.614 20.141 ( 29.452 -21.388 1.835) 36.445 21.051 ( 17.404 12.716 4.577) 22.035 21.771 ( 19.937 -5.034 -16.074) 26.099 22.137 ( 30.704 8.231 4.273) 32.074 22.968 ( 8.075 6.085 2.619) 10.444 23.427 ( 4.251 2.421 -2.322) 5.415 23.738 ( 9.384 9.466 -4.089) 13.942 23.967 ( -0.013 6.249 -0.880) 6.311 24.266 ( 1.052 9.020 6.144) 10.964 24.443 ( -0.229 5.162 1.106) 5.285 24.544 ( 5.945 -23.688 7.389) 25.516 24.902 ( -2.754 -7.101 3.486) 8.377 25.208 ( -18.190 0.461 -4.217) 18.678 26.091 ( 12.524 1.829 -10.226) 16.272 26.275 ( 1.441 3.511 -3.124) 4.916 27.446 ( -4.026 -1.181 5.082) 6.590 28.207 ( -22.833 -5.050 0.077) 23.384 31.024 ( 5.612 -2.929 0.095) 6.331 31.828 ( -1.215 8.349 0.122) 8.438 32.182 ( 0.211 -4.988 -1.316) 5.163 32.847 ( -10.282 -2.339 0.625) 10.563 33.220 ( -0.841 -0.043 2.926) 3.045 33.406 ( 2.212 -0.283 7.197) 7.535 33.731 ( -0.704 3.614 2.672) 4.549 34.095 ( -3.728 -4.292 -3.756) 6.814 34.430 ( 2.240 0.519 -1.289) 2.636 ======================= Grid point 20 (15/146) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.800 ( -65.418 -17.256 -25.611) 72.342 4.689 ( -86.753 -13.606 -12.492) 88.697 7.396 (-126.514 -23.323 -3.907) 128.706 10.920 ( 11.588 11.397 8.925) 18.543 11.331 ( 16.846 -6.912 -10.399) 20.969 13.972 ( 29.558 30.310 1.106) 42.351 14.495 ( 17.012 -24.465 6.270) 30.451 14.885 ( 17.057 5.028 11.906) 21.400 15.773 ( 11.510 -6.318 4.252) 13.801 15.978 ( -21.200 -1.286 -11.737) 24.266 17.337 ( -11.081 -0.118 25.489) 27.794 17.648 ( -14.191 9.317 -4.780) 17.636 18.047 ( -23.217 -1.450 -16.736) 28.657 18.734 ( -22.834 -7.800 5.404) 24.727 18.954 ( -25.727 -6.632 -18.284) 32.251 19.557 ( 32.396 12.154 14.197) 37.401 20.565 ( 31.032 -11.483 0.318) 33.090 21.601 ( 19.994 19.859 1.892) 28.244 21.960 ( 18.324 -7.090 -4.127) 20.077 22.733 ( 21.113 3.889 1.152) 21.499 23.255 ( 20.224 2.745 3.933) 20.785 23.545 ( 7.685 4.267 -1.844) 8.981 23.970 ( 1.849 8.174 -3.552) 9.102 24.017 ( 3.933 6.281 0.061) 7.411 24.260 ( -6.722 -9.589 3.460) 12.211 24.447 ( 3.850 -4.551 -0.076) 5.961 24.515 ( 0.999 7.291 -0.288) 7.365 24.792 ( -1.743 -9.984 -0.497) 10.147 25.040 ( -1.746 3.159 1.061) 3.762 26.240 ( 8.840 -1.738 0.039) 9.009 26.326 ( 4.611 3.897 -6.845) 9.127 27.363 ( -7.895 -1.556 2.968) 8.577 27.710 ( -29.711 -4.477 0.466) 30.050 31.107 ( 6.616 -1.517 0.146) 6.789 31.882 ( -2.142 6.994 0.515) 7.332 32.129 ( 0.979 -5.072 -1.402) 5.353 32.631 ( -12.641 -2.014 0.401) 12.806 33.199 ( -3.159 -0.501 1.756) 3.649 33.517 ( 3.580 0.226 8.923) 9.617 33.779 ( -1.022 4.054 3.977) 5.771 33.960 ( -3.187 -4.652 -4.426) 7.168 34.461 ( 1.912 0.344 -0.862) 2.125 ======================= Grid point 21 (16/146) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -70.925 -0.000 0.000) 70.925 3.055 ( -90.029 -0.000 0.000) 90.029 4.942 (-142.011 -0.000 0.000) 142.011 11.084 ( 3.005 0.000 -0.000) 3.005 11.685 ( 24.350 0.000 -0.000) 24.350 14.574 ( 17.374 0.000 -0.000) 17.374 14.652 ( 18.965 0.000 -0.000) 18.965 15.381 ( 27.370 0.000 -0.000) 27.370 15.574 ( -16.233 -0.000 0.000) 16.233 15.948 ( 8.248 0.000 -0.000) 8.248 17.305 ( -19.459 -0.000 0.000) 19.459 17.336 ( -11.340 -0.000 0.000) 11.340 17.515 ( -23.218 -0.000 0.000) 23.218 18.329 ( -21.641 -0.000 0.000) 21.641 18.404 ( -23.973 -0.000 0.000) 23.973 20.332 ( 39.528 0.000 -0.000) 39.528 20.936 ( 21.067 0.000 -0.000) 21.067 22.022 ( 14.852 0.000 -0.000) 14.852 22.161 ( 10.040 0.000 -0.000) 10.040 22.842 ( -7.231 -0.000 0.000) 7.231 23.600 ( 6.831 0.000 -0.000) 6.831 23.724 ( 10.720 0.000 -0.000) 10.720 23.989 ( -0.188 -0.000 0.000) 0.188 23.996 ( 8.293 0.000 -0.000) 8.293 24.251 ( -1.983 -0.000 0.000) 1.983 24.495 ( -1.050 -0.000 0.000) 1.050 24.710 ( 19.348 0.000 -0.000) 19.348 24.772 ( 8.981 0.000 -0.000) 8.981 25.099 ( 4.775 0.000 -0.000) 4.775 26.367 ( 5.203 0.000 -0.000) 5.203 26.373 ( 3.201 0.000 -0.000) 3.201 27.154 ( -32.575 -0.000 0.000) 32.575 27.204 ( -10.176 -0.000 0.000) 10.176 31.215 ( 6.566 0.000 -0.000) 6.566 31.879 ( -2.517 -0.000 0.000) 2.517 32.117 ( 1.472 0.000 -0.000) 1.472 32.406 ( -12.340 -0.000 0.000) 12.340 33.141 ( -3.796 -0.000 0.000) 3.796 33.637 ( 4.752 0.000 -0.000) 4.752 33.834 ( -0.936 -0.000 0.000) 0.936 33.835 ( -2.720 -0.000 0.000) 2.720 34.488 ( 1.439 0.000 -0.000) 1.439 ======================= Grid point 24 (17/146) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.039 ( -0.000 70.680 40.064) 81.245 4.228 ( -0.000 45.029 71.507) 84.504 6.518 ( -0.000 122.034 46.490) 130.590 10.954 ( -0.000 -0.871 -6.915) 6.970 11.849 ( 0.000 -31.382 16.168) 35.302 13.787 ( 0.000 -18.297 -38.795) 42.893 14.189 ( 0.000 -29.476 -25.099) 38.714 15.047 ( -0.000 0.983 3.851) 3.974 15.321 ( -0.000 15.419 -35.546) 38.746 15.552 ( -0.000 9.395 -7.216) 11.847 17.680 ( -0.000 10.004 19.542) 21.953 17.889 ( -0.000 9.540 16.669) 19.206 18.278 ( -0.000 11.555 9.639) 15.048 18.502 ( -0.000 15.587 31.298) 34.964 18.807 ( -0.000 18.400 9.411) 20.667 19.811 ( 0.000 -12.802 -36.757) 38.923 19.855 ( 0.000 -28.165 -20.317) 34.728 22.129 ( 0.000 -18.213 8.068) 19.920 22.511 ( 0.000 -3.798 -6.863) 7.844 22.624 ( 0.000 -23.382 8.858) 25.004 23.367 ( 0.000 -22.585 -13.808) 26.471 23.565 ( -0.000 4.129 -6.779) 7.938 23.997 ( 0.000 -7.324 2.593) 7.770 24.110 ( 0.000 -1.098 -4.414) 4.549 24.280 ( -0.000 0.669 0.127) 0.681 24.504 ( 0.000 -1.925 10.556) 10.730 24.536 ( 0.000 -10.568 -1.648) 10.695 25.091 ( 0.000 -9.311 12.931) 15.935 25.187 ( -0.000 6.379 3.472) 7.263 25.990 ( 0.000 -17.574 -8.747) 19.630 26.382 ( -0.000 2.627 1.673) 3.114 27.223 ( -0.000 12.953 -4.351) 13.664 27.437 ( -0.000 28.098 4.963) 28.533 31.196 ( 0.000 -5.024 -0.854) 5.096 31.924 ( 0.000 -1.333 4.743) 4.927 32.099 ( -0.000 0.234 -1.654) 1.671 32.475 ( -0.000 14.127 -0.412) 14.133 32.985 ( -0.000 15.205 -21.719) 26.513 33.098 ( -0.000 8.909 -10.048) 13.429 33.833 ( 0.000 -0.225 2.922) 2.931 33.843 ( -0.000 1.642 1.256) 2.068 34.534 ( 0.000 -2.055 3.296) 3.884 ======================= Grid point 25 (18/146) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.219 ( 19.913 50.074 53.587) 75.997 5.394 ( 29.004 54.800 46.409) 77.447 8.211 ( 24.200 106.902 36.149) 115.414 10.882 ( -4.072 5.502 -6.057) 9.140 11.526 ( -10.973 -31.423 10.648) 34.946 13.471 ( 17.629 -15.588 -42.560) 48.632 13.782 ( 5.883 -29.418 -15.108) 33.590 14.609 ( -40.009 -5.218 0.587) 40.352 15.276 ( 2.793 13.585 -25.323) 28.873 15.937 ( 23.213 19.889 -3.728) 30.795 17.724 ( -16.558 3.384 21.173) 27.091 18.063 ( -1.013 10.265 5.151) 11.529 18.511 ( 2.503 6.369 -4.336) 8.102 18.803 ( 4.900 5.371 15.007) 16.675 19.125 ( 16.540 -2.570 -8.991) 19.000 19.287 ( -12.214 0.963 4.418) 13.024 19.784 ( 9.235 -4.451 -5.683) 11.722 21.933 ( -19.157 -15.500 -0.901) 24.658 22.020 ( -9.466 -31.462 7.423) 33.683 22.518 ( -2.830 -24.111 -5.512) 24.895 23.037 ( -3.015 -13.216 -12.311) 18.311 23.672 ( 14.849 -0.897 -12.059) 19.150 23.785 ( -11.601 -7.622 -2.471) 14.099 24.047 ( -2.821 -1.346 -5.005) 5.901 24.215 ( -1.733 -1.346 -5.278) 5.716 24.456 ( -4.776 -3.555 8.536) 10.407 24.629 ( 4.834 -3.715 3.501) 7.030 24.927 ( -13.980 0.572 11.941) 18.394 25.322 ( -2.162 8.102 9.127) 12.395 25.831 ( 8.596 -16.631 -7.322) 20.102 26.515 ( 8.084 -1.084 5.461) 9.815 27.298 ( -1.130 10.555 -4.752) 11.630 27.787 ( 6.793 25.345 2.637) 26.372 31.100 ( -3.864 -5.042 -0.404) 6.365 31.997 ( 5.168 -1.875 4.610) 7.175 32.060 ( -3.181 1.036 -1.718) 3.761 32.646 ( 3.597 13.283 0.063) 13.761 33.013 ( 4.493 9.074 -15.085) 18.168 33.108 ( -0.247 7.626 -8.812) 11.657 33.798 ( -3.135 0.687 1.448) 3.521 33.950 ( 5.845 0.988 2.464) 6.420 34.528 ( -0.961 -2.610 3.222) 4.257 ======================= Grid point 26 (19/146) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.376 ( 22.984 33.199 51.391) 65.356 6.885 ( 43.671 58.728 31.027) 79.491 9.494 ( 2.337 38.426 9.703) 39.701 10.841 ( -14.343 0.817 7.323) 16.125 11.430 ( 25.742 26.021 2.567) 36.692 13.284 ( -5.405 -7.760 -30.395) 31.833 13.603 ( 5.858 -14.543 -19.895) 25.331 13.910 ( -9.506 -18.676 1.483) 21.009 15.267 ( 3.210 1.523 -11.893) 12.412 16.524 ( 19.231 28.544 -3.866) 34.634 17.570 ( -11.552 -8.663 15.184) 20.953 18.109 ( -9.687 6.527 1.758) 11.813 18.370 ( -8.970 9.020 -6.482) 14.277 19.025 ( 8.156 -25.187 -19.522) 32.894 19.033 ( 1.657 7.817 6.167) 10.094 19.479 ( 3.460 4.924 18.637) 19.585 19.993 ( 2.345 12.179 10.693) 16.376 21.167 ( -29.060 -29.329 -1.320) 41.309 21.753 ( 0.843 -33.796 0.119) 33.807 22.121 ( -10.255 -13.325 -5.535) 17.702 22.817 ( -1.465 -9.605 -9.691) 13.723 23.500 ( -4.146 -9.440 -6.184) 12.023 23.755 ( 2.672 -3.771 -14.642) 15.354 23.962 ( 2.422 3.581 -9.587) 10.517 24.150 ( -1.409 -0.848 -2.120) 2.683 24.400 ( -8.991 -2.082 14.548) 17.228 24.681 ( 3.983 -1.099 2.554) 4.857 24.811 ( -12.401 1.780 8.791) 15.304 25.436 ( -1.538 9.384 6.811) 11.697 25.824 ( 11.896 -12.491 -5.598) 18.135 26.646 ( 1.940 -1.522 8.990) 9.322 27.318 ( -1.183 5.247 -4.875) 7.260 28.181 ( 10.675 20.644 0.833) 23.256 30.990 ( -2.764 -5.195 0.135) 5.887 31.994 ( -5.675 3.888 -1.120) 6.969 32.100 ( 6.067 -4.139 3.359) 8.076 32.836 ( 4.293 10.769 0.340) 11.598 33.076 ( 5.488 5.259 -10.356) 12.846 33.111 ( -0.131 5.215 -5.899) 7.875 33.767 ( -2.830 1.401 1.025) 3.320 34.078 ( 6.090 0.563 2.016) 6.439 34.497 ( -1.905 -3.090 2.469) 4.390 ======================= Grid point 27 (20/146) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.403 ( 24.325 26.998 38.067) 52.628 8.368 ( 40.662 47.726 17.854) 65.192 9.294 ( -30.496 1.372 0.903) 30.540 10.606 ( -1.299 -20.124 1.006) 20.191 12.143 ( -38.124 1.035 -8.612) 39.099 12.996 ( 26.321 50.921 -3.316) 57.417 13.527 ( 18.509 3.187 -22.665) 29.436 14.085 ( 35.958 -13.189 -5.310) 38.666 15.231 ( 3.779 -10.885 -0.525) 11.534 16.964 ( 5.430 13.122 2.281) 14.383 17.572 ( 6.576 7.360 8.609) 13.097 17.936 ( -21.511 5.267 13.890) 26.141 18.338 ( -18.005 7.209 2.113) 19.509 18.573 ( -31.342 -8.182 -2.951) 32.526 18.901 ( -2.334 -16.565 -10.129) 19.556 19.683 ( 7.936 2.868 7.311) 11.164 20.100 ( -3.060 0.526 0.970) 3.253 20.709 ( 8.127 -24.309 2.102) 25.718 21.400 ( -4.411 -23.705 -4.025) 24.445 21.880 ( -2.159 -11.283 -6.504) 13.201 22.656 ( 0.440 -6.359 -7.769) 10.050 23.369 ( 2.397 -7.412 -7.268) 10.654 23.638 ( -0.870 3.250 -6.898) 7.674 23.949 ( -4.211 10.124 -14.450) 18.139 24.122 ( 0.168 -2.872 1.974) 3.489 24.334 ( -5.788 -7.472 15.148) 17.855 24.650 ( -14.129 3.023 11.894) 18.715 24.814 ( 8.860 -2.731 -0.652) 9.294 25.526 ( -1.658 10.011 -1.329) 10.234 25.882 ( 10.551 -9.579 -2.181) 14.416 26.668 ( -7.339 2.420 6.441) 10.060 27.314 ( 2.172 -0.920 -1.819) 2.979 28.528 ( 8.896 14.268 0.001) 16.814 30.912 ( -0.661 -5.066 0.248) 5.115 31.932 ( -5.604 4.897 -1.096) 7.522 32.166 ( 3.944 -4.205 2.514) 6.290 32.993 ( 3.212 7.249 0.276) 7.933 33.112 ( 0.362 3.912 -3.736) 5.422 33.156 ( 5.440 2.248 -5.357) 7.959 33.748 ( -2.480 2.488 1.144) 3.695 34.189 ( 5.132 0.028 1.302) 5.294 34.439 ( -2.695 -3.481 1.035) 4.523 ======================= Grid point 28 (21/146) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.255 ( -28.113 -5.090 3.685) 28.807 8.314 ( 12.123 13.897 6.292) 19.485 9.813 ( 8.618 48.649 19.661) 53.175 10.398 ( -1.459 -22.067 -2.974) 22.314 11.148 ( -32.587 -6.288 -6.830) 33.884 13.429 ( 16.130 -7.667 -15.261) 23.491 14.203 ( 36.078 11.690 -12.802) 40.027 14.702 ( 26.378 12.546 -10.712) 31.112 15.336 ( 23.872 8.933 8.636) 26.911 16.767 ( -74.954 -17.433 12.096) 77.900 17.273 ( -14.571 1.491 4.000) 15.184 17.906 ( 8.254 8.569 0.644) 11.915 18.078 ( -2.379 10.304 18.513) 21.321 18.460 ( -3.291 3.636 2.976) 5.737 18.784 ( -1.871 9.638 5.617) 11.311 19.857 ( 6.253 -4.395 2.476) 8.034 19.986 ( 1.553 -9.875 -8.250) 12.961 20.745 ( 18.550 -27.720 -1.213) 33.376 21.130 ( -4.082 -7.860 -3.699) 9.598 21.651 ( 0.927 -15.150 -17.979) 23.529 22.636 ( 4.103 1.518 -1.261) 4.553 23.269 ( 2.737 -7.246 -10.587) 13.117 23.733 ( 0.223 11.992 -0.875) 12.026 23.852 ( -6.917 15.895 -6.085) 18.371 24.112 ( -0.179 -1.804 1.880) 2.612 24.301 ( 2.117 -14.477 13.094) 19.635 24.556 ( -10.639 3.421 10.726) 15.490 24.910 ( 6.992 -6.407 -0.000) 9.483 25.575 ( 0.910 9.192 -7.067) 11.630 25.938 ( 5.265 -7.028 0.850) 8.822 26.533 ( -13.832 4.270 -1.452) 14.549 27.364 ( 5.160 -3.030 3.093) 6.736 28.733 ( 2.084 7.679 -0.275) 7.962 30.872 ( 1.283 -4.564 0.129) 4.742 31.892 ( -4.632 6.627 -0.939) 8.140 32.188 ( 2.142 -4.787 1.483) 5.450 33.085 ( 1.360 3.511 -0.019) 3.765 33.134 ( 0.304 2.433 -0.381) 2.481 33.230 ( 4.888 0.804 -2.444) 5.524 33.750 ( -2.039 3.637 1.725) 4.512 34.268 ( 3.295 -0.662 1.029) 3.515 34.355 ( -2.727 -3.427 -1.218) 4.545 ======================= Grid point 29 (22/146) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.193 ( -53.484 -15.009 -15.486) 57.668 9.023 ( -16.218 14.248 3.594) 21.884 9.222 ( -38.331 4.418 6.159) 39.074 10.324 ( 11.171 -17.332 -6.483) 21.615 11.648 ( 36.986 37.612 14.470) 54.699 13.451 ( 9.639 -18.011 -11.179) 23.286 14.623 ( 12.595 8.001 -23.377) 27.733 14.752 ( -9.320 -19.312 2.687) 21.611 14.994 ( -67.682 -22.904 11.365) 72.351 16.358 ( 40.776 26.924 -3.475) 48.986 17.213 ( -16.124 6.719 2.411) 17.633 18.022 ( 7.357 -3.003 5.315) 9.560 18.378 ( -4.926 16.931 6.238) 18.704 18.602 ( 5.863 18.031 26.567) 32.639 19.065 ( 9.695 7.000 13.967) 18.387 19.785 ( -6.336 -10.867 1.329) 12.649 19.900 ( 3.796 -4.580 -12.151) 13.529 20.662 ( 11.019 -27.777 -4.591) 30.233 21.154 ( 10.317 2.819 -2.375) 10.956 21.406 ( 10.985 -16.065 -24.916) 31.616 22.766 ( 5.464 5.337 1.841) 7.856 23.210 ( 5.955 -5.052 -6.036) 9.870 23.715 ( -7.441 16.778 -7.243) 19.732 24.003 ( 0.519 9.447 -0.983) 9.512 24.169 ( 6.260 0.605 7.607) 9.870 24.306 ( 3.548 -11.881 11.193) 16.704 24.507 ( -6.443 2.716 6.697) 9.682 24.914 ( 2.916 -9.862 0.384) 10.292 25.648 ( 3.619 6.329 -5.541) 9.157 25.884 ( -5.919 -4.773 -1.702) 7.792 26.335 ( -8.246 3.453 -4.755) 10.125 27.451 ( 3.829 -1.745 4.316) 6.028 28.733 ( -7.560 2.265 -0.259) 7.897 30.868 ( 3.083 -3.675 -0.001) 4.797 31.895 ( -2.880 8.309 -0.616) 8.816 32.168 ( 0.786 -5.799 0.487) 5.872 33.091 ( -3.636 0.964 0.348) 3.778 33.175 ( 2.280 1.016 0.963) 2.676 33.301 ( 4.056 0.009 0.104) 4.058 33.775 ( -1.589 4.393 2.543) 5.319 34.226 ( -4.012 -4.372 -1.436) 6.105 34.342 ( 3.047 0.021 -1.009) 3.209 ======================= Grid point 30 (23/146) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.979 ( -61.871 -10.233 -12.217) 63.891 7.626 ( -85.886 -5.131 -6.567) 86.289 9.720 ( 7.195 11.474 10.786) 17.314 10.325 ( 14.977 -9.086 -6.527) 18.694 12.332 ( -50.325 -3.905 1.297) 50.493 13.027 ( 2.232 27.200 2.816) 27.436 13.876 ( 3.845 -23.834 -2.465) 24.267 14.591 ( 2.287 -2.073 -4.656) 5.586 15.137 ( 24.923 -10.200 3.604) 27.169 16.846 ( -27.262 2.206 -5.290) 27.857 17.090 ( 27.221 4.729 0.526) 27.634 18.207 ( -8.224 8.972 13.704) 18.328 18.528 ( -2.848 30.403 7.245) 31.384 18.976 ( -2.208 4.211 5.025) 6.918 19.231 ( 16.477 -22.950 -2.451) 28.358 19.584 ( -4.871 -14.372 2.865) 15.443 19.754 ( -13.073 9.959 -4.837) 17.131 20.786 ( 25.706 -4.635 7.293) 27.119 21.248 ( 15.726 -5.704 -18.499) 24.941 21.632 ( 33.537 -0.575 -2.679) 33.649 22.914 ( 5.508 3.495 0.967) 6.595 23.294 ( 10.087 -2.255 -0.786) 10.366 23.761 ( -0.431 16.052 -5.474) 16.965 24.025 ( -1.929 4.001 -2.049) 4.892 24.256 ( 7.562 -20.990 8.671) 23.936 24.417 ( -2.474 8.497 6.044) 10.717 24.516 ( 1.226 8.160 1.529) 8.392 24.834 ( 0.252 -11.837 0.059) 11.840 25.526 ( -20.090 -1.104 0.030) 20.121 25.841 ( 10.730 2.135 -7.371) 13.192 26.276 ( -0.505 1.583 -1.477) 2.224 27.503 ( 0.130 -0.571 2.730) 2.792 28.526 ( -17.252 -0.575 -0.104) 17.262 30.906 ( 4.761 -2.195 -0.027) 5.243 31.943 ( -1.532 9.001 -0.035) 9.131 32.112 ( 0.061 -7.080 -0.313) 7.087 32.996 ( -8.018 -0.307 0.336) 8.031 33.228 ( 1.813 0.230 1.014) 2.090 33.374 ( 4.164 -0.203 1.596) 4.464 33.817 ( -1.068 4.216 3.136) 5.362 34.092 ( -4.622 -4.149 -3.020) 6.907 34.385 ( 2.610 0.123 -0.559) 2.672 ======================= Grid point 31 (24/146) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.773 ( -67.233 -0.000 0.000) 67.233 6.085 ( -88.733 -0.000 0.000) 88.733 9.181 ( -84.109 -0.000 0.000) 84.109 10.717 ( 29.687 0.000 -0.000) 29.687 11.230 ( -32.658 -0.000 0.000) 32.658 13.791 ( 30.148 0.000 -0.000) 30.148 13.895 ( 20.883 0.000 -0.000) 20.883 14.685 ( 11.292 0.000 -0.000) 11.292 15.478 ( 19.484 0.000 -0.000) 19.484 16.355 ( -27.538 -0.000 0.000) 27.538 17.421 ( 9.560 0.000 -0.000) 9.560 18.046 ( -20.781 -0.000 0.000) 20.781 18.435 ( -27.011 -0.000 0.000) 27.011 19.141 ( -17.259 -0.000 0.000) 17.259 19.152 ( 13.712 0.000 -0.000) 13.712 19.239 ( -12.220 -0.000 0.000) 12.220 19.944 ( 30.453 0.000 -0.000) 30.453 21.401 ( 33.330 0.000 -0.000) 33.330 21.406 ( 18.650 0.000 -0.000) 18.650 22.253 ( 36.540 0.000 -0.000) 36.540 23.048 ( 8.546 0.000 -0.000) 8.546 23.440 ( 7.524 0.000 -0.000) 7.524 23.925 ( 11.061 0.000 -0.000) 11.061 24.007 ( -1.401 -0.000 0.000) 1.401 24.223 ( -1.159 -0.000 0.000) 1.159 24.416 ( -1.857 -0.000 0.000) 1.857 24.671 ( 2.825 0.000 -0.000) 2.825 24.698 ( -4.617 -0.000 0.000) 4.617 25.192 ( -15.260 -0.000 0.000) 15.260 26.031 ( 12.540 0.000 -0.000) 12.540 26.288 ( 1.245 0.000 -0.000) 1.245 27.475 ( -4.355 -0.000 0.000) 4.355 28.159 ( -24.901 -0.000 0.000) 24.901 30.987 ( 6.161 0.000 -0.000) 6.161 31.978 ( -2.648 -0.000 0.000) 2.648 32.062 ( 1.337 0.000 -0.000) 1.337 32.829 ( -11.235 -0.000 0.000) 11.235 33.241 ( -0.954 -0.000 0.000) 0.954 33.461 ( 5.194 0.000 -0.000) 5.194 33.851 ( -0.275 -0.000 0.000) 0.275 33.966 ( -4.850 -0.000 0.000) 4.850 34.425 ( 2.234 0.000 -0.000) 2.234 ======================= Grid point 36 (25/146) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.969 ( -0.000 68.267 36.410) 77.369 6.010 ( -0.000 38.440 57.148) 68.873 9.280 ( -0.000 86.135 29.114) 90.922 10.964 ( -0.000 22.853 -2.895) 23.036 11.468 ( 0.000 -25.005 13.876) 28.597 12.785 ( 0.000 -19.511 -43.788) 47.938 13.289 ( 0.000 -34.213 -12.032) 36.267 15.118 ( 0.000 0.257 5.907) 5.913 15.263 ( -0.000 18.011 -20.432) 27.237 15.732 ( -0.000 18.682 -6.193) 19.682 18.045 ( 0.000 -7.675 6.556) 10.094 18.065 ( 0.000 -6.068 -6.987) 9.254 18.402 ( -0.000 2.617 -17.322) 17.518 18.681 ( 0.000 -12.178 -8.718) 14.977 19.055 ( -0.000 10.989 20.608) 23.355 19.648 ( -0.000 9.725 18.829) 21.192 19.734 ( -0.000 18.977 9.310) 21.137 21.675 ( 0.000 -37.566 3.311) 37.712 22.033 ( 0.000 -40.050 4.983) 40.359 22.322 ( 0.000 -2.736 -8.415) 8.849 22.807 ( 0.000 -12.090 -17.511) 21.280 23.363 ( 0.000 -15.184 -11.843) 19.256 23.784 ( 0.000 -4.362 -6.063) 7.469 24.038 ( -0.000 1.303 -7.313) 7.428 24.179 ( 0.000 -1.382 -2.574) 2.921 24.538 ( 0.000 -4.778 3.654) 6.015 24.610 ( -0.000 3.908 8.130) 9.020 25.074 ( 0.000 -7.919 3.027) 8.477 25.501 ( -0.000 11.785 10.371) 15.698 25.561 ( 0.000 -15.999 0.972) 16.029 26.473 ( -0.000 2.585 3.838) 4.627 27.383 ( -0.000 9.420 -4.309) 10.358 27.980 ( -0.000 21.958 1.898) 22.040 31.090 ( 0.000 -4.250 -1.023) 4.371 31.920 ( 0.000 -5.237 3.298) 6.188 32.124 ( -0.000 3.369 0.272) 3.380 32.753 ( -0.000 13.849 0.056) 13.849 32.958 ( -0.000 7.617 -11.949) 14.170 33.128 ( -0.000 8.107 -8.126) 11.479 33.873 ( 0.000 -0.271 3.037) 3.049 33.899 ( -0.000 1.846 1.477) 2.364 34.531 ( 0.000 -3.213 3.113) 4.474 ======================= Grid point 37 (26/146) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.819 ( 8.519 34.399 47.168) 58.997 7.113 ( 24.722 62.508 31.261) 74.133 9.871 ( -3.422 11.113 2.955) 11.998 11.103 ( -24.660 -20.103 7.040) 32.585 11.659 ( 15.656 85.790 12.030) 88.032 12.573 ( 26.807 -18.599 -30.010) 44.330 13.006 ( 14.973 -28.922 -11.850) 34.657 14.578 ( -50.596 1.480 -0.145) 50.617 15.261 ( -2.865 9.826 -10.244) 14.481 16.325 ( 31.888 22.441 -1.154) 39.010 17.592 ( -9.135 -22.099 -9.850) 25.862 18.085 ( 17.068 -23.851 -19.432) 35.182 18.396 ( 4.311 6.990 -9.153) 12.297 18.604 ( -9.139 4.804 8.973) 13.678 19.338 ( -1.448 13.919 20.399) 24.738 19.775 ( -6.198 9.604 21.077) 23.977 20.129 ( 6.643 15.483 9.572) 19.377 21.311 ( 0.771 -40.438 -4.626) 40.709 21.409 ( -29.502 -34.588 4.765) 45.710 22.130 ( -8.411 -7.938 -8.276) 14.222 22.606 ( 2.849 -12.541 -13.741) 18.821 23.192 ( 8.934 -15.961 -15.129) 23.738 23.695 ( -2.723 -0.868 -3.643) 4.630 23.935 ( -3.540 1.487 -8.834) 9.633 24.148 ( -0.683 -0.545 -2.014) 2.196 24.534 ( 2.357 -1.806 1.611) 3.378 24.680 ( -3.626 3.065 6.047) 7.689 25.046 ( 1.027 -3.787 6.094) 7.248 25.443 ( 2.182 -13.248 2.607) 13.677 25.667 ( -2.038 9.870 6.078) 11.769 26.605 ( 7.148 1.292 6.304) 9.618 27.392 ( -4.170 5.889 -4.595) 8.555 28.239 ( 5.915 18.141 0.636) 19.092 31.007 ( -3.715 -3.725 -0.478) 5.282 31.934 ( 4.739 -5.416 1.107) 7.282 32.140 ( -2.515 3.657 1.718) 4.759 32.898 ( 1.999 11.498 -0.026) 11.670 32.975 ( 3.398 4.965 -8.275) 10.231 33.139 ( -1.070 6.829 -6.125) 9.236 33.842 ( -3.247 1.214 1.761) 3.888 33.998 ( 5.461 0.567 1.956) 5.828 34.509 ( -1.178 -3.628 2.446) 4.532 ======================= Grid point 38 (27/146) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.623 ( 14.109 27.910 35.030) 46.959 8.368 ( 28.945 49.858 18.157) 60.443 9.733 ( -9.779 -1.416 1.277) 9.963 10.516 ( -20.260 -20.963 1.022) 29.171 12.646 ( 18.216 -18.591 -18.961) 32.202 12.813 ( -2.197 54.726 6.790) 55.189 13.075 ( 26.024 -11.559 -14.709) 32.050 13.855 ( -19.844 27.795 -1.942) 34.207 15.193 ( -4.852 1.238 -3.757) 6.260 16.927 ( 13.244 3.787 5.237) 14.737 17.426 ( 14.447 -2.802 -1.711) 14.815 17.969 ( 20.276 -24.199 -16.326) 35.542 18.510 ( -4.745 4.860 -0.028) 6.792 18.574 ( -5.769 13.566 11.425) 18.651 19.511 ( -17.829 14.475 16.373) 28.204 19.844 ( -14.559 2.205 15.235) 21.188 20.251 ( -9.316 0.470 -0.016) 9.328 20.468 ( -24.140 -33.827 -0.340) 41.559 21.000 ( 8.616 -32.518 -10.696) 35.300 21.837 ( -8.905 -9.754 -9.074) 16.024 22.469 ( 5.522 -8.751 -7.605) 12.842 23.110 ( 7.424 -9.870 -12.644) 17.675 23.638 ( 0.062 0.717 -0.019) 0.720 23.903 ( 2.938 4.926 -8.687) 10.410 24.120 ( -0.623 -0.538 -0.758) 1.119 24.567 ( -4.862 2.183 3.518) 6.386 24.661 ( 0.683 -2.433 1.812) 3.110 25.011 ( -12.246 1.606 11.712) 17.021 25.495 ( 16.413 -11.394 0.247) 19.982 25.707 ( -5.475 7.509 0.191) 9.295 26.780 ( 3.776 2.740 7.301) 8.664 27.299 ( -5.061 0.168 -4.841) 7.005 28.521 ( 8.134 13.278 -0.009) 15.571 30.908 ( -3.340 -3.286 0.096) 4.686 31.962 ( 3.051 -2.607 -1.267) 4.209 32.146 ( -1.772 1.571 2.907) 3.750 33.030 ( 3.035 7.076 -1.335) 7.814 33.039 ( 4.225 3.529 -3.526) 6.537 33.139 ( -1.121 4.712 -3.685) 6.086 33.824 ( -2.358 2.457 1.331) 3.657 34.107 ( 5.487 -0.068 1.291) 5.637 34.456 ( -2.451 -3.807 1.294) 4.709 ======================= Grid point 39 (28/146) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.340 ( 13.863 22.144 16.068) 30.671 8.687 ( -21.756 -0.916 -0.008) 21.775 10.065 ( 6.347 -21.652 -10.769) 25.001 10.226 ( 15.920 48.172 29.641) 58.759 11.970 ( -67.046 -2.624 -5.892) 67.355 12.746 ( 24.332 -33.433 -15.363) 44.112 13.531 ( 36.443 -1.797 -10.415) 37.944 14.594 ( 14.358 46.681 -6.429) 49.260 15.199 ( 11.078 18.671 -0.841) 21.727 17.075 ( 13.297 -22.058 14.375) 29.496 17.634 ( 13.053 -5.503 -2.638) 14.409 18.189 ( -56.526 -6.204 4.444) 57.039 18.333 ( 23.502 18.227 -1.044) 29.760 18.537 ( -23.532 10.218 13.828) 29.144 19.097 ( -13.026 10.227 12.270) 20.611 19.807 ( -0.939 -0.874 8.890) 8.982 19.976 ( -11.495 -6.355 -9.237) 16.057 20.176 ( 11.150 -28.260 0.406) 30.383 20.824 ( 11.097 -19.820 -17.512) 28.682 21.483 ( -9.940 -12.133 -11.906) 19.692 22.546 ( 8.681 1.786 1.444) 8.979 23.039 ( 5.164 -8.329 -10.854) 14.624 23.737 ( 6.071 2.667 3.520) 7.507 23.978 ( 4.038 11.523 -7.512) 14.336 24.107 ( -0.117 -1.086 0.900) 1.415 24.417 ( -14.387 -0.299 4.586) 15.103 24.710 ( 6.990 -5.995 -1.095) 9.273 24.893 ( -13.239 1.564 11.891) 17.864 25.648 ( -3.362 4.190 -0.973) 5.459 25.706 ( 13.153 -4.964 -1.556) 14.145 26.804 ( -11.891 5.316 1.078) 13.070 27.241 ( 5.566 -4.471 -0.026) 7.140 28.744 ( 5.432 7.679 -0.202) 9.408 30.838 ( -1.477 -2.721 0.189) 3.102 31.973 ( 0.429 1.863 -1.974) 2.748 32.146 ( -0.824 -1.834 2.679) 3.350 33.111 ( 0.010 4.073 0.262) 4.081 33.123 ( 5.635 1.136 -2.375) 6.220 33.150 ( 0.768 2.622 -1.581) 3.157 33.829 ( -1.612 3.358 1.380) 3.972 34.199 ( 4.789 -0.372 0.681) 4.852 34.371 ( -3.683 -3.618 -0.152) 5.165 ======================= Grid point 40 (29/146) ======================= q-point: (-0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.862 ( -46.030 -6.385 -7.448) 47.064 9.094 ( 17.551 23.282 18.634) 34.603 9.834 ( 7.510 -23.756 -10.895) 27.193 10.502 ( -75.733 6.706 -2.601) 76.073 11.572 ( 31.913 40.856 19.851) 55.513 12.712 ( 27.594 -39.705 -16.714) 51.159 14.074 ( 34.982 2.343 -8.486) 36.073 14.677 ( -6.581 -3.874 0.945) 7.694 15.971 ( 26.897 33.991 -5.466) 43.689 16.601 ( -96.859 -7.294 2.228) 97.159 17.300 ( 25.074 -15.667 7.463) 30.494 17.730 ( -2.035 -4.211 -1.662) 4.963 18.600 ( -0.775 19.097 8.145) 20.775 18.829 ( 6.349 6.423 10.419) 13.788 19.297 ( -1.110 14.815 17.865) 23.235 19.776 ( -2.942 -1.062 -5.604) 6.418 19.851 ( 4.938 1.610 3.608) 6.324 20.092 ( 11.561 -22.860 -0.441) 25.621 20.692 ( 17.465 -21.709 -27.118) 38.880 21.175 ( -6.475 -4.169 -4.888) 9.122 22.747 ( 5.859 6.022 4.388) 9.479 22.990 ( 7.268 -6.994 -7.545) 12.596 23.873 ( 4.766 6.810 -4.083) 9.261 24.068 ( -5.487 3.489 -0.152) 6.505 24.120 ( -2.036 -2.671 5.253) 6.235 24.294 ( 3.791 4.703 2.358) 6.485 24.726 ( -0.450 -3.397 0.233) 3.435 24.770 ( -6.908 -3.759 5.745) 9.740 25.618 ( -0.443 3.212 -3.058) 4.457 25.854 ( 6.438 -2.626 0.638) 6.982 26.558 ( -17.287 2.021 -2.589) 17.596 27.355 ( 8.113 -1.756 2.062) 8.553 28.833 ( -1.140 2.733 -0.152) 2.966 30.810 ( 0.642 -1.713 0.063) 1.830 31.993 ( -0.434 5.139 -1.530) 5.379 32.117 ( -0.963 -4.482 1.668) 4.879 33.140 ( 0.116 1.809 0.403) 1.857 33.162 ( -0.264 0.397 -0.221) 0.526 33.216 ( 5.497 0.249 -0.795) 5.560 33.850 ( -0.948 2.952 1.379) 3.393 34.256 ( -3.416 -2.909 0.948) 4.586 34.279 ( 2.504 -0.112 -1.776) 3.072 ======================= Grid point 41 (30/146) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.910 ( -57.456 -0.000 0.000) 57.456 9.027 ( -82.407 -0.000 0.000) 82.407 9.683 ( 15.899 0.000 -0.000) 15.899 9.872 ( 15.555 0.000 -0.000) 15.555 12.634 ( 17.887 0.000 -0.000) 17.887 12.687 ( 33.947 0.000 -0.000) 33.947 14.502 ( -22.061 -0.000 0.000) 22.061 14.620 ( 31.009 0.000 -0.000) 31.009 14.833 ( -82.558 -0.000 0.000) 82.558 16.630 ( 29.664 0.000 -0.000) 29.664 17.306 ( -24.342 -0.000 0.000) 24.342 18.001 ( 38.077 0.000 -0.000) 38.077 18.754 ( -0.434 -0.000 0.000) 0.434 18.857 ( -0.696 -0.000 0.000) 0.696 19.302 ( -19.259 -0.000 0.000) 19.259 19.683 ( -6.419 -0.000 0.000) 6.419 19.999 ( -2.538 -0.000 0.000) 2.538 20.255 ( 25.537 0.000 -0.000) 25.537 20.824 ( 26.279 0.000 -0.000) 26.279 21.165 ( 11.578 0.000 -0.000) 11.578 22.864 ( 3.316 0.000 -0.000) 3.316 23.089 ( 11.004 0.000 -0.000) 11.004 23.907 ( -8.386 -0.000 0.000) 8.386 24.030 ( 8.437 0.000 -0.000) 8.437 24.082 ( -1.820 -0.000 0.000) 1.820 24.499 ( 8.083 0.000 -0.000) 8.083 24.600 ( -9.433 -0.000 0.000) 9.433 24.731 ( 1.662 0.000 -0.000) 1.662 25.671 ( 6.291 0.000 -0.000) 6.291 25.815 ( -11.093 -0.000 0.000) 11.093 26.328 ( -7.470 -0.000 0.000) 7.470 27.468 ( 4.720 0.000 -0.000) 4.720 28.754 ( -9.483 -0.000 0.000) 9.483 30.830 ( 2.796 0.000 -0.000) 2.796 32.029 ( -0.085 -0.000 0.000) 0.085 32.059 ( -1.505 -0.000 0.000) 1.505 33.106 ( -4.792 -0.000 0.000) 4.792 33.190 ( 2.707 0.000 -0.000) 2.707 33.302 ( 4.734 0.000 -0.000) 4.734 33.863 ( -0.453 -0.000 0.000) 0.453 34.148 ( -5.634 -0.000 0.000) 5.634 34.335 ( 3.224 0.000 -0.000) 3.224 ======================= Grid point 48 (31/146) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.387 ( -0.000 29.739 38.315) 48.502 7.759 ( -0.000 63.571 29.790) 70.205 9.814 ( 0.000 -16.155 -8.374) 18.197 11.417 ( 0.000 -4.712 17.435) 18.060 11.789 ( 0.000 -27.364 -28.057) 39.191 12.494 ( 0.000 -27.143 -13.144) 30.158 12.601 ( -0.000 105.002 13.697) 105.891 15.239 ( -0.000 4.266 2.224) 4.811 15.323 ( -0.000 6.715 -4.743) 8.221 16.064 ( -0.000 21.066 -3.535) 21.360 17.318 ( 0.000 -43.966 -8.061) 44.699 17.473 ( 0.000 -13.591 -26.375) 29.671 18.345 ( -0.000 4.220 -7.154) 8.306 18.882 ( -0.000 9.172 13.709) 16.494 19.644 ( -0.000 10.238 25.636) 27.605 20.023 ( 0.000 -3.780 12.453) 13.014 20.281 ( -0.000 20.577 6.128) 21.470 20.835 ( 0.000 -39.561 -8.296) 40.422 21.521 ( 0.000 -18.930 12.000) 22.413 22.075 ( 0.000 -12.412 -8.517) 15.053 22.317 ( 0.000 -10.750 -18.263) 21.192 22.856 ( 0.000 -11.934 -10.638) 15.987 23.680 ( 0.000 -0.946 -3.966) 4.077 23.924 ( -0.000 -0.434 -8.938) 8.949 24.132 ( 0.000 -0.895 -1.426) 1.683 24.484 ( 0.000 -3.272 0.932) 3.402 24.775 ( -0.000 3.356 0.351) 3.374 24.879 ( 0.000 -8.896 0.900) 8.942 25.446 ( 0.000 -5.865 7.991) 9.913 25.837 ( -0.000 7.994 6.715) 10.440 26.598 ( -0.000 2.806 5.524) 6.196 27.459 ( -0.000 4.615 -3.610) 5.859 28.345 ( -0.000 14.027 -0.147) 14.028 31.006 ( 0.000 -2.842 -0.830) 2.961 31.850 ( 0.000 -4.726 1.401) 4.929 32.204 ( -0.000 2.771 1.512) 3.157 32.922 ( -0.000 4.722 -7.074) 8.505 32.998 ( -0.000 8.496 0.481) 8.510 33.177 ( -0.000 6.651 -4.589) 8.081 33.908 ( 0.000 -0.240 2.208) 2.221 33.956 ( -0.000 1.847 1.180) 2.192 34.500 ( 0.000 -3.727 1.974) 4.218 ======================= Grid point 49 (32/146) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.958 ( 5.988 25.501 28.589) 38.775 8.672 ( 11.354 52.470 20.402) 57.430 9.576 ( 4.521 -17.465 -9.981) 20.618 10.902 ( -30.206 -11.998 3.680) 32.709 11.865 ( 22.643 -26.135 -9.523) 35.867 12.389 ( 24.650 -11.851 -10.510) 29.300 13.686 ( -5.399 84.442 7.218) 84.922 14.684 ( -46.135 16.670 -4.376) 49.249 15.289 ( -5.484 2.286 -2.743) 6.544 16.650 ( 20.792 -6.850 4.857) 22.424 17.002 ( 24.842 -22.816 0.500) 33.733 17.298 ( 14.726 -9.117 -18.415) 25.280 18.398 ( 8.099 0.910 -5.336) 9.741 18.983 ( -7.180 6.943 14.785) 17.842 19.890 ( -2.089 6.822 20.157) 21.383 19.967 ( -3.542 -9.110 5.426) 11.180 20.375 ( 4.855 -31.250 -16.180) 35.524 20.516 ( -10.220 13.452 2.766) 17.118 21.087 ( -44.861 -8.592 10.298) 46.823 21.781 ( -6.497 -14.762 -9.945) 18.948 22.181 ( 9.854 -8.984 -11.124) 17.365 22.816 ( 8.648 -5.200 -6.950) 12.253 23.637 ( -0.201 -0.874 -0.886) 1.261 23.851 ( 0.900 1.933 -7.144) 7.455 24.114 ( -0.174 -0.565 -0.976) 1.141 24.495 ( 3.715 -2.753 0.465) 4.647 24.808 ( -4.564 4.247 0.092) 6.235 24.957 ( 18.454 -7.477 1.220) 19.948 25.372 ( -8.622 -3.296 6.389) 11.226 25.892 ( -5.484 5.093 3.088) 8.096 26.736 ( 7.599 2.333 5.386) 9.601 27.401 ( -7.573 1.752 -3.452) 8.505 28.511 ( 5.749 9.504 -0.352) 11.113 30.944 ( -3.392 -1.992 -0.342) 3.948 31.855 ( 3.991 -3.390 0.394) 5.251 32.221 ( -1.957 1.968 1.389) 3.104 32.945 ( 3.546 2.423 -4.419) 6.163 33.080 ( 1.076 5.600 -0.022) 5.702 33.193 ( -1.898 4.954 -2.285) 5.776 33.891 ( -2.170 1.253 1.248) 2.799 34.030 ( 4.464 0.481 1.006) 4.601 34.464 ( -1.514 -3.288 1.147) 3.797 ======================= Grid point 50 (33/146) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.499 ( 8.619 22.418 16.763) 29.289 8.943 ( -10.308 -3.826 -2.226) 11.218 9.717 ( 8.654 -0.549 -7.117) 11.219 10.686 ( 1.258 26.307 24.961) 36.286 11.785 ( 21.252 -36.956 -19.850) 47.026 12.792 ( 27.379 -2.421 -5.233) 27.979 13.248 ( -64.238 3.090 0.723) 64.316 14.904 ( -2.114 37.912 -3.724) 38.154 15.285 ( 5.569 30.833 -5.302) 31.777 16.531 ( 13.338 -45.878 6.725) 48.249 17.346 ( 19.985 -0.393 2.098) 20.098 17.900 ( 44.160 14.027 1.266) 46.352 18.490 ( 5.377 -1.816 -4.738) 7.393 19.105 ( -5.308 13.998 19.777) 24.804 19.804 ( -1.147 -18.155 -5.059) 18.882 19.825 ( -38.196 -20.606 -7.016) 43.963 19.995 ( -9.946 5.462 13.864) 17.916 20.121 ( -32.857 -1.594 -1.804) 32.945 20.519 ( -7.827 0.533 -9.590) 12.390 21.460 ( -7.823 -10.861 -6.459) 14.862 22.350 ( 17.449 -0.033 -0.213) 17.450 22.831 ( 3.480 -4.033 -5.622) 7.745 23.681 ( 4.163 -0.076 2.392) 4.801 23.911 ( 7.065 5.009 -4.296) 9.668 24.104 ( -0.025 -0.288 -0.236) 0.373 24.546 ( 5.138 -3.178 0.200) 6.045 24.692 ( -12.134 1.593 0.182) 12.239 25.180 ( -8.539 1.359 6.157) 10.615 25.319 ( 19.522 -5.233 -0.930) 20.233 25.813 ( -8.716 2.477 0.232) 9.064 26.945 ( 7.993 3.766 4.469) 9.902 27.200 ( -11.508 -2.582 -3.729) 12.369 28.695 ( 7.183 4.566 -0.176) 8.513 30.866 ( -3.539 -1.123 0.018) 3.713 31.908 ( 4.588 -1.288 -0.365) 4.779 32.201 ( -2.941 0.748 0.979) 3.189 33.017 ( 5.554 0.861 -1.814) 5.906 33.139 ( 1.365 2.335 -0.114) 2.707 33.178 ( -2.520 2.331 -0.698) 3.503 33.885 ( -1.209 1.628 0.698) 2.145 34.117 ( 4.899 -0.077 0.413) 4.917 34.403 ( -3.157 -2.139 0.274) 3.823 ======================= Grid point 51 (34/146) ======================= q-point: (-0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.455 ( -29.216 -0.000 0.000) 29.216 9.049 ( 18.153 0.000 -0.000) 18.153 9.567 ( -4.881 -0.000 0.000) 4.881 11.613 ( 19.920 0.000 -0.000) 19.920 11.630 ( 33.295 0.000 -0.000) 33.295 11.901 ( -74.672 -0.000 0.000) 74.672 13.437 ( 36.648 0.000 -0.000) 36.648 14.832 ( -11.215 -0.000 0.000) 11.215 15.784 ( 17.490 0.000 -0.000) 17.490 16.636 ( 29.677 0.000 -0.000) 29.677 17.683 ( 12.835 0.000 -0.000) 12.835 18.125 ( -70.648 -0.000 0.000) 70.648 18.653 ( 25.431 0.000 -0.000) 25.431 18.844 ( -12.206 -0.000 0.000) 12.206 19.332 ( -2.238 -0.000 0.000) 2.238 19.723 ( 11.900 0.000 -0.000) 11.900 19.800 ( -8.687 -0.000 0.000) 8.687 20.004 ( 2.231 0.000 -0.000) 2.231 20.313 ( -7.900 -0.000 0.000) 7.900 21.253 ( -7.598 -0.000 0.000) 7.598 22.661 ( 16.075 0.000 -0.000) 16.075 22.805 ( 0.673 0.000 -0.000) 0.673 23.776 ( 5.986 0.000 -0.000) 5.986 24.082 ( 6.719 0.000 -0.000) 6.719 24.109 ( 3.684 0.000 -0.000) 3.684 24.449 ( -16.167 -0.000 0.000) 16.167 24.612 ( 4.825 0.000 -0.000) 4.825 25.005 ( -12.728 -0.000 0.000) 12.728 25.638 ( 17.067 0.000 -0.000) 17.067 25.687 ( -6.610 -0.000 0.000) 6.610 26.874 ( -18.571 -0.000 0.000) 18.571 27.184 ( 11.220 0.000 -0.000) 11.220 28.818 ( 4.361 0.000 -0.000) 4.361 30.813 ( -1.821 -0.000 0.000) 1.821 31.972 ( 3.515 0.000 -0.000) 3.515 32.153 ( -3.401 -0.000 0.000) 3.401 33.115 ( 6.088 0.000 -0.000) 6.088 33.153 ( -1.138 -0.000 0.000) 1.138 33.167 ( 0.521 0.000 -0.000) 0.521 33.882 ( -0.724 -0.000 0.000) 0.724 34.200 ( 4.685 0.000 -0.000) 4.685 34.326 ( -4.543 -0.000 0.000) 4.543 ======================= Grid point 60 (35/146) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.318 ( -0.000 20.342 20.260) 28.710 9.244 ( 0.000 -19.451 -12.576) 23.162 9.258 ( -0.000 48.033 17.927) 51.270 10.862 ( 0.000 -35.061 -12.551) 37.240 11.635 ( 0.000 1.681 9.510) 9.657 11.935 ( 0.000 -9.763 -8.897) 13.209 14.629 ( -0.000 79.083 4.367) 79.204 15.281 ( -0.000 7.039 -10.885) 12.963 15.393 ( -0.000 1.541 0.741) 1.710 16.349 ( -0.000 8.996 -1.461) 9.114 16.356 ( 0.000 -55.350 12.043) 56.645 17.017 ( 0.000 -2.866 -10.487) 10.872 18.289 ( 0.000 -0.825 -3.126) 3.233 19.115 ( 0.000 -3.206 6.516) 7.262 19.915 ( 0.000 -8.769 3.314) 9.375 20.001 ( 0.000 -13.840 -11.168) 17.784 20.128 ( -0.000 5.396 11.717) 12.900 20.819 ( -0.000 15.740 5.318) 16.614 21.591 ( 0.000 1.514 10.702) 10.808 21.623 ( 0.000 -16.107 -7.281) 17.677 21.892 ( 0.000 -7.279 -12.457) 14.427 22.648 ( 0.000 -1.766 -2.610) 3.152 23.616 ( 0.000 -0.792 -1.672) 1.850 23.795 ( -0.000 -0.936 -4.648) 4.741 24.104 ( 0.000 -0.433 -0.430) 0.610 24.451 ( 0.000 -0.968 0.222) 0.993 24.692 ( 0.000 -3.154 -0.788) 3.251 24.891 ( -0.000 1.049 0.902) 1.384 25.472 ( 0.000 -1.414 3.538) 3.810 25.998 ( -0.000 2.445 1.764) 3.015 26.713 ( -0.000 1.465 2.877) 3.228 27.473 ( -0.000 1.203 -1.510) 1.931 28.526 ( -0.000 4.854 -0.377) 4.868 30.959 ( 0.000 -1.003 -0.320) 1.053 31.796 ( 0.000 -1.877 0.414) 1.922 32.260 ( -0.000 1.016 0.721) 1.246 32.906 ( -0.000 1.290 -2.343) 2.674 33.108 ( -0.000 2.725 -0.439) 2.760 33.243 ( -0.000 3.109 -0.783) 3.206 33.927 ( 0.000 -0.099 0.797) 0.803 33.999 ( -0.000 1.052 0.456) 1.147 34.458 ( 0.000 -1.954 0.621) 2.050 ======================= Grid point 61 (36/146) ======================= q-point: (-0.45 -0.55 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.595 ( 7.339 0.000 -0.000) 7.339 8.987 ( -7.919 -0.000 0.000) 7.919 9.676 ( 4.009 0.000 -0.000) 4.009 10.718 ( 16.109 0.000 -0.000) 16.109 11.430 ( -13.474 -0.000 0.000) 13.474 12.233 ( 29.577 0.000 -0.000) 29.577 14.440 ( -64.816 -0.000 0.000) 64.816 15.177 ( -6.543 -0.000 0.000) 6.543 15.425 ( 4.384 0.000 -0.000) 4.384 16.081 ( 4.466 0.000 -0.000) 4.466 16.912 ( 34.761 0.000 -0.000) 34.761 17.221 ( 34.271 0.000 -0.000) 34.271 18.331 ( 6.527 0.000 -0.000) 6.527 19.174 ( 7.226 0.000 -0.000) 7.226 19.813 ( -9.836 -0.000 0.000) 9.836 19.861 ( -2.754 -0.000 0.000) 2.754 20.167 ( -3.987 -0.000 0.000) 3.987 20.748 ( -16.826 -0.000 0.000) 16.826 21.129 ( -53.793 -0.000 0.000) 53.793 21.466 ( -3.712 -0.000 0.000) 3.712 21.999 ( 19.847 0.000 -0.000) 19.847 22.726 ( 6.233 0.000 -0.000) 6.233 23.631 ( 2.663 0.000 -0.000) 2.663 23.810 ( 4.465 0.000 -0.000) 4.465 24.101 ( 0.014 0.000 -0.000) 0.014 24.466 ( 2.570 0.000 -0.000) 2.570 24.853 ( -5.683 -0.000 0.000) 5.683 24.881 ( 21.329 0.000 -0.000) 21.329 25.398 ( -8.758 -0.000 0.000) 8.758 25.962 ( -6.196 -0.000 0.000) 6.196 26.808 ( 8.434 0.000 -0.000) 8.434 27.387 ( -9.710 -0.000 0.000) 9.710 28.601 ( 5.742 0.000 -0.000) 5.742 30.922 ( -3.250 -0.000 0.000) 3.250 31.824 ( 3.843 0.000 -0.000) 3.843 32.251 ( -1.919 -0.000 0.000) 1.919 32.935 ( 3.510 0.000 -0.000) 3.510 33.129 ( 0.993 0.000 -0.000) 0.993 33.234 ( -2.314 -0.000 0.000) 2.314 33.915 ( -1.211 -0.000 0.000) 1.211 34.044 ( 3.749 0.000 -0.000) 3.749 34.436 ( -1.739 -0.000 0.000) 1.739 ======================= Grid point 135 (37/146) ======================= q-point: ( 0.09 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.785 ( 0.000 -0.000 79.492) 79.492 1.785 ( 0.000 -0.000 79.492) 79.492 2.895 ( 0.000 -0.000 125.170) 125.170 11.056 ( -0.000 0.000 -6.554) 6.554 12.488 ( 0.000 -0.000 21.317) 21.317 14.697 ( -0.000 0.000 -29.762) 29.762 14.697 ( -0.000 0.000 -29.762) 29.762 14.883 ( -0.000 0.000 -34.675) 34.675 15.508 ( -0.000 0.000 -23.009) 23.009 15.508 ( -0.000 0.000 -23.009) 23.009 17.529 ( 0.000 -0.000 33.416) 33.416 17.531 ( 0.000 -0.000 33.134) 33.134 17.531 ( 0.000 -0.000 33.134) 33.134 18.064 ( 0.000 -0.000 12.607) 12.607 18.064 ( 0.000 -0.000 12.607) 12.607 20.665 ( -0.000 0.000 -41.834) 41.834 20.665 ( -0.000 0.000 -41.834) 41.834 22.214 ( -0.000 0.000 -4.354) 4.354 22.677 ( 0.000 -0.000 20.377) 20.377 22.677 ( 0.000 -0.000 20.377) 20.377 23.625 ( -0.000 0.000 -7.676) 7.676 24.018 ( -0.000 0.000 -8.625) 8.625 24.095 ( 0.000 -0.000 7.413) 7.413 24.095 ( 0.000 -0.000 7.413) 7.413 24.172 ( 0.000 -0.000 3.978) 3.978 24.756 ( -0.000 0.000 -3.103) 3.103 24.756 ( -0.000 0.000 -3.103) 3.103 25.365 ( 0.000 0.000 -2.089) 2.089 25.365 ( 0.000 0.000 -2.089) 2.089 26.237 ( 0.000 -0.000 0.685) 0.685 26.418 ( 0.000 -0.000 6.003) 6.003 26.418 ( 0.000 0.000 6.003) 6.003 26.945 ( -0.000 0.000 -5.812) 5.812 31.344 ( -0.000 0.000 -0.763) 0.763 31.871 ( 0.000 -0.000 2.175) 2.175 31.871 ( 0.000 0.000 2.175) 2.175 32.153 ( 0.000 -0.000 0.849) 0.849 32.153 ( 0.000 -0.000 0.849) 0.849 33.005 ( -0.000 0.000 -5.153) 5.153 33.806 ( 0.000 -0.000 1.564) 1.564 33.806 ( 0.000 -0.000 1.564) 1.564 34.551 ( 0.000 -0.000 3.150) 3.150 ======================= Grid point 136 (38/146) ======================= q-point: ( 0.18 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.027 ( 47.428 27.382 63.889) 84.149 3.274 ( 59.444 34.320 61.077) 91.880 4.319 ( 52.251 30.167 96.182) 113.539 10.974 ( -2.987 -1.724 -7.287) 8.062 12.399 ( -20.647 -11.921 21.673) 32.219 14.303 ( 0.599 0.346 -34.346) 34.352 14.398 ( -8.522 -4.920 -43.393) 44.494 14.891 ( 19.851 11.461 -31.507) 38.963 15.051 ( -20.251 -11.692 -15.583) 28.100 15.580 ( 8.540 4.931 -10.370) 14.310 17.495 ( -11.096 -6.406 32.149) 34.608 17.743 ( -3.015 -1.741 26.229) 26.459 18.116 ( 16.799 9.699 16.041) 25.171 18.153 ( 6.076 3.508 27.291) 28.179 18.527 ( 21.975 12.687 19.260) 31.856 19.932 ( -23.871 -13.782 -40.060) 48.627 20.544 ( 5.960 3.441 -40.922) 41.497 22.051 ( -12.323 -7.115 -4.091) 14.806 22.653 ( -8.351 -4.822 17.332) 19.834 22.993 ( 8.304 4.794 7.982) 12.476 23.508 ( -1.899 -1.096 -8.064) 8.357 23.860 ( -6.147 -3.549 -5.960) 9.269 24.106 ( -8.958 -5.172 -2.722) 10.696 24.138 ( -1.376 -0.794 2.602) 3.049 24.171 ( -2.891 -1.669 6.139) 6.988 24.658 ( -5.902 -3.408 -2.110) 7.135 24.739 ( 1.274 0.735 4.546) 4.778 25.008 ( -14.460 -8.349 -3.729) 17.109 25.284 ( -13.111 -7.570 6.241) 16.375 26.283 ( -2.064 -1.192 -2.271) 3.292 26.624 ( 25.523 14.736 2.025) 29.540 26.685 ( 5.335 3.080 8.302) 10.338 26.965 ( 6.265 3.617 -6.873) 9.979 31.289 ( -3.821 -2.206 -0.535) 4.444 31.861 ( -1.230 -0.710 1.863) 2.343 32.190 ( 1.102 0.636 1.983) 2.356 32.226 ( 8.624 4.979 -1.331) 10.047 32.430 ( 31.062 17.933 -20.586) 41.355 32.990 ( 2.366 1.366 -6.644) 7.184 33.791 ( -1.567 -0.905 1.449) 2.318 33.870 ( 3.653 2.109 2.267) 4.789 34.566 ( -0.998 -0.576 3.747) 3.920 ======================= Grid point 137 (39/146) ======================= q-point: ( 0.27 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.658 ( 57.546 33.224 50.523) 83.474 4.858 ( 40.738 23.520 65.675) 80.783 6.529 ( 87.763 50.670 50.315) 113.143 10.793 ( -8.856 -5.113 -6.616) 12.180 11.984 ( -22.728 -13.122 9.223) 27.817 13.826 ( -15.898 -9.179 -37.938) 42.146 14.243 ( 10.407 6.009 -18.735) 22.258 14.393 ( -23.952 -13.828 -21.402) 34.971 15.210 ( 27.977 16.153 -28.773) 43.261 15.706 ( 6.623 3.824 -2.585) 8.073 17.495 ( -10.213 -5.896 32.114) 34.210 17.841 ( -3.419 -1.974 22.184) 22.533 18.376 ( 6.969 4.023 6.080) 10.085 18.725 ( 12.816 7.400 13.236) 19.854 19.165 ( -16.605 -9.587 -15.776) 24.830 19.206 ( 24.723 14.274 16.002) 32.726 20.310 ( -1.539 -0.889 -37.133) 37.176 21.636 ( -21.393 -12.351 -2.203) 24.800 22.569 ( -8.982 -5.186 13.484) 17.011 22.962 ( -13.519 -7.805 -1.324) 15.666 23.316 ( -21.026 -12.139 -9.121) 25.936 23.679 ( -5.824 -3.362 -5.867) 8.924 23.795 ( 4.039 2.332 -16.664) 17.304 24.033 ( -8.303 -4.794 -0.555) 9.604 24.164 ( -1.740 -1.005 4.645) 5.061 24.548 ( -3.189 -1.841 2.055) 4.217 24.682 ( -5.373 -3.102 0.592) 6.233 24.992 ( 6.054 3.495 8.366) 10.902 25.021 ( -13.830 -7.985 8.338) 18.015 26.222 ( -1.240 -0.716 -3.200) 3.506 26.752 ( -3.467 -2.001 8.047) 8.988 27.099 ( 8.010 4.625 -4.189) 10.154 27.273 ( 28.840 16.651 0.522) 33.305 31.191 ( -4.194 -2.421 -0.399) 4.859 31.840 ( -1.869 -1.079 1.620) 2.698 32.230 ( 0.915 0.528 2.365) 2.590 32.447 ( 11.074 6.393 -0.457) 12.795 32.816 ( 17.272 9.972 -18.877) 27.461 33.007 ( 3.801 2.194 -7.472) 8.666 33.759 ( -2.116 -1.222 1.473) 2.853 33.992 ( 5.388 3.111 2.078) 6.560 34.560 ( -2.022 -1.167 3.701) 4.375 ======================= Grid point 138 (40/146) ======================= q-point: ( 0.36 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.153 ( 34.737 20.055 55.128) 68.176 6.324 ( 59.002 34.065 41.596) 79.824 8.664 ( 65.010 37.533 19.602) 77.584 10.546 ( -4.212 -2.432 2.995) 5.712 11.680 ( -2.464 -1.422 -1.252) 3.108 13.021 ( -37.291 -21.530 -21.019) 47.917 13.800 ( -7.770 -4.486 -35.198) 36.323 14.447 ( 15.729 9.081 -7.848) 19.786 15.714 ( 34.512 19.926 -27.119) 48.204 15.830 ( 2.691 1.554 6.651) 7.342 17.503 ( -10.250 -5.918 32.155) 34.264 17.934 ( -2.242 -1.295 20.377) 20.541 18.136 ( -19.182 -11.075 -18.281) 28.720 18.758 ( -3.974 -2.294 3.351) 5.682 19.351 ( 10.115 5.840 17.813) 21.300 19.817 ( 14.162 8.176 14.354) 21.759 19.924 ( -3.509 -2.026 -37.677) 37.894 21.129 ( -19.288 -11.136 0.811) 22.287 22.341 ( -31.166 -17.993 -6.897) 36.642 22.457 ( -8.945 -5.164 10.799) 14.943 22.877 ( -9.822 -5.671 -8.858) 14.390 23.523 ( -3.677 -2.123 -5.997) 7.348 23.790 ( 0.664 0.383 -17.435) 17.452 23.805 ( -8.908 -5.143 -5.413) 11.624 24.151 ( -1.755 -1.014 2.894) 3.533 24.515 ( -3.016 -1.741 4.926) 6.032 24.689 ( 6.174 3.564 -0.239) 7.133 24.814 ( -10.224 -5.903 11.111) 16.211 25.164 ( 4.561 2.633 3.313) 6.222 26.182 ( -0.191 -0.110 -3.102) 3.110 26.683 ( -7.598 -4.387 7.612) 11.615 27.240 ( 6.026 3.479 -0.525) 6.978 27.882 ( 24.325 14.044 0.051) 28.088 31.103 ( -3.256 -1.880 -0.348) 3.776 31.799 ( -2.724 -1.573 1.276) 3.394 32.265 ( 0.661 0.381 2.128) 2.260 32.693 ( 10.470 6.045 -0.095) 12.090 32.978 ( 7.340 4.238 -10.392) 13.410 33.064 ( 6.801 3.926 -8.218) 11.366 33.721 ( -2.197 -1.268 1.634) 3.017 34.127 ( 5.035 2.907 1.588) 6.027 34.528 ( -2.924 -1.688 2.892) 4.445 ======================= Grid point 139 (41/146) ======================= q-point: ( 0.45 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.250 ( 31.304 18.074 40.335) 54.162 7.898 ( 54.223 31.305 33.850) 71.175 9.031 ( -22.165 -12.797 -11.025) 27.867 10.859 ( 6.685 3.860 10.078) 12.695 11.894 ( -48.054 -27.744 -15.672) 57.659 12.303 ( 64.503 37.241 -1.057) 74.489 13.510 ( 4.591 2.650 -35.548) 35.942 14.813 ( 19.688 11.367 -2.628) 22.885 15.903 ( -3.981 -2.299 14.486) 15.198 16.322 ( 34.770 20.075 -24.675) 47.126 17.516 ( -8.869 -5.121 30.496) 32.169 17.606 ( -26.414 -15.250 4.031) 30.765 18.050 ( -0.560 -0.323 20.315) 20.326 18.218 ( -38.064 -21.976 -5.038) 44.240 19.366 ( -20.342 -11.745 -16.641) 28.786 19.700 ( 14.452 8.344 4.098) 17.184 20.283 ( 18.647 10.766 -10.090) 23.779 20.933 ( -2.684 -1.550 5.242) 6.090 21.730 ( -17.355 -10.020 -4.765) 20.598 22.297 ( -12.145 -7.012 7.242) 15.784 22.652 ( -4.918 -2.839 -6.617) 8.719 23.446 ( 0.664 0.384 -4.351) 4.418 23.579 ( -4.857 -2.804 -12.134) 13.368 23.582 ( -6.589 -3.804 -13.174) 15.214 24.133 ( -1.584 -0.914 2.306) 2.943 24.465 ( -5.942 -3.431 9.989) 12.118 24.742 ( -4.557 -2.631 13.364) 14.362 24.892 ( 11.265 6.504 -3.553) 13.484 25.248 ( 3.935 2.272 -4.970) 6.734 26.167 ( 0.621 0.358 -2.234) 2.347 26.521 ( -11.174 -6.451 5.348) 13.967 27.363 ( 4.066 2.347 2.839) 5.487 28.347 ( 16.485 9.518 -0.328) 19.038 31.041 ( -1.987 -1.147 -0.334) 2.318 31.741 ( -2.887 -1.667 0.798) 3.428 32.288 ( 0.165 0.095 1.483) 1.496 32.902 ( 7.848 4.531 0.035) 9.062 33.040 ( 3.751 2.166 -4.446) 6.207 33.167 ( 6.474 3.738 -6.173) 9.695 33.688 ( -1.763 -1.018 1.887) 2.775 34.236 ( 3.748 2.164 0.996) 4.441 34.470 ( -3.585 -2.070 1.289) 4.336 ======================= Grid point 140 (42/146) ======================= q-point: ( 0.55 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.101 ( -16.805 -9.702 14.688) 24.337 8.245 ( 4.955 2.861 -4.029) 6.997 9.048 ( 15.793 9.118 17.952) 25.590 10.868 ( -20.498 -11.835 -6.186) 24.464 10.883 ( -3.156 -1.822 0.029) 3.645 13.464 ( 12.693 7.328 -29.945) 33.340 13.894 ( 65.018 37.538 -7.622) 75.463 15.253 ( 17.385 10.037 -1.455) 20.127 15.860 ( -11.352 -6.554 19.382) 23.399 16.388 ( -70.027 -40.430 3.142) 80.921 16.798 ( 18.263 10.544 -18.316) 27.931 17.574 ( -3.165 -1.827 22.101) 22.401 17.942 ( 8.718 5.033 14.266) 17.461 18.212 ( -1.120 -0.647 22.148) 22.186 18.838 ( -13.489 -7.788 -7.168) 17.146 19.999 ( 8.229 4.751 -0.640) 9.524 20.518 ( 12.085 6.977 -20.624) 24.902 20.850 ( -7.249 -4.185 0.674) 8.398 21.502 ( -2.527 -1.459 -2.286) 3.706 22.000 ( -14.880 -8.591 -2.740) 17.399 22.581 ( 1.595 0.921 -1.872) 2.626 23.401 ( -0.608 -0.351 -8.000) 8.030 23.410 ( -1.104 -0.637 -12.288) 12.354 23.504 ( 4.848 2.799 -0.911) 5.672 24.118 ( -0.863 -0.498 1.645) 1.924 24.421 ( -4.754 -2.745 11.686) 12.911 24.776 ( -2.414 -1.394 15.613) 15.860 25.072 ( 4.308 2.487 -0.018) 4.974 25.313 ( 9.526 5.500 -14.428) 18.143 26.177 ( 1.258 0.727 -0.875) 1.696 26.252 ( -14.491 -8.367 0.293) 16.736 27.461 ( 1.940 1.120 4.898) 5.386 28.602 ( 6.031 3.482 -0.570) 6.988 31.010 ( -0.526 -0.303 -0.276) 0.666 31.692 ( -1.550 -0.895 0.335) 1.821 32.292 ( -0.573 -0.331 0.621) 0.907 33.038 ( 3.623 2.092 -0.686) 4.240 33.093 ( 2.781 1.606 0.633) 3.273 33.258 ( 4.659 2.690 -3.044) 6.181 33.672 ( -0.955 -0.552 2.154) 2.420 34.309 ( 2.008 1.159 0.804) 2.454 34.387 ( -3.554 -2.052 -1.274) 4.297 ======================= Grid point 141 (43/146) ======================= q-point: (-0.36 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.983 ( -50.655 -29.246 -17.379) 61.019 8.393 ( -58.040 -33.510 -8.258) 67.526 9.008 ( 28.476 16.441 16.715) 36.886 10.776 ( -5.679 -3.279 -3.164) 7.281 11.366 ( 43.271 24.983 13.516) 51.761 13.634 ( 19.610 11.322 -23.238) 32.446 13.980 ( -76.785 -44.332 -4.457) 88.775 15.251 ( 4.273 2.467 -1.762) 5.239 15.356 ( 1.477 0.853 3.437) 3.836 16.512 ( 42.184 24.355 5.038) 48.970 16.815 ( -5.408 -3.122 -13.469) 14.846 17.651 ( -2.726 -1.574 12.842) 13.222 18.087 ( -20.665 -11.931 25.583) 34.984 18.479 ( 18.559 10.715 30.528) 37.299 18.976 ( 21.952 12.674 0.181) 25.349 19.937 ( -12.787 -7.383 -2.115) 14.916 20.501 ( 0.674 0.389 -23.765) 23.777 20.744 ( -0.249 -0.144 -3.777) 3.788 21.537 ( 8.302 4.793 1.382) 9.685 21.676 ( -5.135 -2.965 -15.303) 16.411 22.672 ( 6.072 3.506 0.811) 7.058 23.326 ( 1.428 0.824 -11.084) 11.206 23.473 ( 10.186 5.881 -4.355) 12.542 23.636 ( 4.652 2.686 5.335) 7.570 24.125 ( 0.586 0.338 1.819) 1.941 24.420 ( -1.970 -1.137 7.647) 7.978 24.854 ( -1.618 -0.934 17.403) 17.503 25.081 ( -2.636 -1.522 0.938) 3.186 25.449 ( 8.348 4.820 -12.247) 15.586 25.892 ( -12.300 -7.102 -9.917) 17.322 26.210 ( 1.676 0.967 0.798) 2.093 27.519 ( -0.391 -0.226 5.539) 5.558 28.603 ( -5.610 -3.239 -0.553) 6.501 31.014 ( 0.989 0.571 -0.166) 1.154 31.685 ( 0.778 0.449 0.156) 0.912 32.271 ( -1.336 -0.771 -0.304) 1.573 33.037 ( -2.928 -1.690 0.359) 3.400 33.183 ( 3.020 1.744 2.671) 4.393 33.337 ( 3.554 2.052 -0.049) 4.104 33.678 ( -0.047 -0.027 2.348) 2.348 34.265 ( -4.662 -2.692 -2.009) 5.746 34.370 ( 2.037 1.176 -1.140) 2.614 ======================= Grid point 142 (44/146) ======================= q-point: (-0.27 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.640 ( -56.694 -32.732 -15.922) 67.373 6.845 ( -69.884 -40.348 -9.874) 81.297 9.607 ( 2.026 1.170 12.191) 12.414 10.516 ( -14.521 -8.384 -0.018) 16.767 12.097 ( -66.550 -38.423 -5.127) 77.016 12.482 ( 44.760 25.842 9.554) 52.560 13.995 ( 25.506 14.726 -17.672) 34.347 15.074 ( -10.085 -5.822 3.002) 12.025 15.677 ( 12.090 6.980 2.329) 14.153 16.438 ( -16.431 -9.487 -14.638) 23.963 17.542 ( 40.513 23.390 0.318) 46.781 17.647 ( -5.810 -3.355 14.491) 15.969 17.874 ( -17.327 -10.004 31.897) 37.653 18.942 ( 4.337 2.504 9.751) 10.962 19.358 ( 5.478 3.163 -11.169) 12.836 19.533 ( -20.133 -11.624 5.659) 23.927 20.326 ( 5.062 2.922 -17.904) 18.834 20.838 ( 11.948 6.898 3.008) 14.121 21.624 ( 11.965 6.908 -18.546) 23.127 21.959 ( 24.737 14.282 7.511) 29.534 22.854 ( 9.586 5.535 1.165) 11.130 23.311 ( 3.681 2.125 -8.489) 9.494 23.710 ( 11.746 6.782 -4.544) 14.305 23.779 ( 3.598 2.077 8.052) 9.061 24.182 ( 3.198 1.847 2.557) 4.492 24.431 ( -0.818 -0.472 2.816) 2.970 24.954 ( -0.610 -0.352 15.625) 15.641 24.996 ( -6.128 -3.538 2.554) 7.523 25.237 ( -19.229 -11.102 -5.843) 22.959 25.811 ( 13.975 8.068 -20.764) 26.297 26.261 ( 1.654 0.955 2.358) 3.034 27.520 ( -3.035 -1.752 4.913) 6.035 28.352 ( -15.980 -9.226 -0.097) 18.452 31.051 ( 2.373 1.370 -0.053) 2.741 31.725 ( 2.399 1.385 0.495) 2.814 32.229 ( -1.804 -1.042 -1.154) 2.381 32.922 ( -7.557 -4.363 0.998) 8.783 33.242 ( 0.337 0.195 2.154) 2.189 33.431 ( 3.898 2.251 3.204) 5.525 33.703 ( 0.664 0.383 2.397) 2.517 34.132 ( -4.818 -2.782 -4.457) 7.129 34.407 ( 1.865 1.077 -0.659) 2.252 ======================= Grid point 143 (45/146) ======================= q-point: (-0.18 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.230 ( -60.548 -34.957 -3.663) 70.010 5.156 ( -73.984 -42.714 -5.068) 85.579 8.294 (-104.071 -60.085 7.929) 120.432 10.755 ( 20.623 11.907 10.412) 25.990 11.346 ( -3.973 -2.294 -9.078) 10.171 13.466 ( 37.890 21.876 2.019) 43.798 14.497 ( 29.632 17.108 -17.603) 38.478 14.931 ( -5.246 -3.029 6.310) 8.747 15.887 ( 5.888 3.399 0.433) 6.812 15.949 ( -16.974 -9.800 -10.449) 22.212 17.616 ( -6.547 -3.780 13.543) 15.510 17.741 ( -17.071 -9.856 36.103) 41.133 17.955 ( -6.291 -3.632 -11.220) 13.367 18.922 ( -10.299 -5.946 0.691) 11.912 18.984 ( -20.460 -11.813 -20.416) 31.224 19.406 ( 14.975 8.646 11.702) 20.879 20.514 ( 18.197 10.506 -22.908) 31.085 21.304 ( 21.774 12.571 10.063) 27.082 21.918 ( 19.726 11.389 -2.988) 22.972 22.576 ( 20.090 11.599 1.003) 23.219 23.182 ( 19.068 11.009 7.239) 23.177 23.379 ( 8.032 4.637 -7.093) 11.676 23.880 ( 5.847 3.376 -3.597) 7.650 23.927 ( 4.899 2.828 6.992) 8.994 24.289 ( 2.991 1.727 0.955) 3.583 24.416 ( -1.613 -0.931 0.477) 1.922 24.684 ( -17.791 -10.272 -4.245) 20.977 24.918 ( -5.247 -3.029 -0.151) 6.060 25.048 ( 0.304 0.175 10.277) 10.283 26.020 ( 15.652 9.037 -16.710) 24.614 26.313 ( 0.981 0.567 3.004) 3.210 27.447 ( -6.234 -3.599 2.990) 7.795 27.904 ( -23.473 -13.552 1.137) 27.129 31.118 ( 3.540 2.044 -0.003) 4.088 31.789 ( 2.412 1.392 1.358) 3.098 32.178 ( -1.633 -0.943 -1.774) 2.589 32.720 ( -10.658 -6.154 0.908) 12.341 33.229 ( -2.279 -1.316 0.549) 2.688 33.551 ( 4.236 2.446 2.917) 5.696 33.740 ( 0.954 0.551 2.286) 2.537 33.988 ( -4.325 -2.497 -6.149) 7.921 34.445 ( 1.714 0.990 -0.014) 1.980 ======================= Grid point 144 (46/146) ======================= q-point: (-0.09 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.939 ( -59.215 -34.188 29.223) 74.358 3.472 ( -74.778 -43.173 7.870) 86.704 5.786 (-120.938 -69.824 17.766) 140.773 11.062 ( 3.128 1.806 -0.621) 3.665 11.582 ( 21.744 12.554 4.391) 25.489 14.197 ( 27.722 16.005 -6.537) 32.671 14.928 ( 0.015 0.008 7.125) 7.125 14.987 ( 26.768 15.455 -33.533) 45.606 15.597 ( -8.603 -4.967 2.412) 10.223 15.939 ( 1.628 0.940 -12.610) 12.750 17.477 ( -20.481 -11.825 -6.492) 24.524 17.504 ( -12.060 -6.963 12.437) 18.671 17.662 ( -14.511 -8.378 38.132) 41.651 18.375 ( -19.135 -11.047 -13.245) 25.761 18.567 ( -20.353 -11.751 9.706) 25.427 20.131 ( 35.575 20.539 -0.082) 41.079 20.677 ( 15.218 8.786 -34.658) 38.858 21.866 ( 19.297 11.141 12.109) 25.360 22.348 ( 11.553 6.670 14.748) 19.886 22.741 ( -0.828 -0.478 -11.590) 11.630 23.589 ( 14.602 8.430 -5.737) 17.810 23.607 ( 5.100 2.945 2.686) 6.473 23.942 ( 2.027 1.170 0.413) 2.376 24.116 ( 8.756 5.055 1.856) 10.279 24.202 ( -4.621 -2.668 3.653) 6.466 24.375 ( -1.301 -0.751 0.360) 1.544 24.645 ( 14.696 8.485 -4.468) 17.548 24.855 ( -0.871 -0.503 7.156) 7.227 25.116 ( 1.132 0.654 3.824) 4.042 26.241 ( 12.949 7.476 -12.525) 19.505 26.341 ( -0.330 -0.190 2.043) 2.078 27.278 ( -9.512 -5.492 -0.188) 10.985 27.338 ( -27.439 -15.842 3.644) 31.892 31.208 ( 4.305 2.486 -0.109) 4.973 31.845 ( 1.126 0.650 2.323) 2.662 32.137 ( -0.600 -0.347 -1.833) 1.959 32.472 ( -11.322 -6.537 0.483) 13.082 33.156 ( -3.470 -2.004 -1.602) 4.316 33.606 ( 0.695 0.401 -14.026) 14.049 33.776 ( 0.744 0.429 2.056) 2.228 33.852 ( -3.389 -1.957 -4.830) 6.216 34.484 ( 1.405 0.811 0.974) 1.892 ======================= Grid point 147 (47/146) ======================= q-point: ( 0.18 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.308 ( -0.000 40.085 65.750) 77.005 3.816 ( -0.000 59.369 66.616) 89.232 5.126 ( -0.000 56.096 94.571) 109.956 10.931 ( -0.000 -1.600 -7.370) 7.542 12.578 ( 0.000 -27.558 23.123) 35.974 13.749 ( 0.000 -14.632 -51.821) 53.847 14.332 ( -0.000 -5.014 -33.505) 33.878 14.485 ( -0.000 28.657 -44.791) 53.174 15.198 ( 0.000 -5.945 0.050) 5.945 15.395 ( -0.000 0.658 -6.479) 6.512 17.803 ( 0.000 -3.424 27.452) 27.665 17.965 ( 0.000 -2.732 22.874) 23.037 18.199 ( -0.000 10.709 24.551) 26.785 18.446 ( -0.000 12.306 27.700) 30.311 18.536 ( -0.000 15.886 13.385) 20.773 19.779 ( 0.000 -12.483 -38.307) 40.289 20.055 ( 0.000 -10.566 -36.241) 37.750 22.145 ( -0.000 4.018 -8.468) 9.373 22.783 ( 0.000 -11.159 10.680) 15.446 22.915 ( 0.000 -3.680 5.737) 6.816 23.446 ( -0.000 -1.103 -10.019) 10.080 23.732 ( 0.000 -15.925 -11.842) 19.846 24.130 ( 0.000 -6.856 -3.911) 7.893 24.156 ( 0.000 -5.454 5.628) 7.837 24.268 ( -0.000 2.142 5.848) 6.228 24.642 ( 0.000 -5.499 -7.589) 9.372 24.689 ( 0.000 -6.569 13.802) 15.285 25.103 ( -0.000 -0.642 -4.375) 4.422 25.418 ( 0.000 -7.243 8.445) 11.126 26.255 ( 0.000 -14.109 0.347) 14.113 26.315 ( -0.000 4.443 0.130) 4.445 26.933 ( -0.000 10.408 -6.958) 12.520 26.947 ( -0.000 26.051 8.307) 27.343 31.286 ( 0.000 -4.333 -0.751) 4.397 31.949 ( -0.000 1.860 4.150) 4.548 32.121 ( 0.000 -2.713 0.240) 2.723 32.162 ( -0.000 17.678 -5.894) 18.634 32.390 ( -0.000 21.479 -5.557) 22.186 32.939 ( -0.000 3.318 -7.873) 8.543 33.832 ( -0.000 0.685 1.977) 2.092 33.852 ( 0.000 0.464 2.714) 2.754 34.596 ( 0.000 -1.274 4.273) 4.459 ======================= Grid point 148 (48/146) ======================= q-point: ( 0.27 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.575 ( 39.532 42.006 55.620) 80.130 5.053 ( 24.276 41.202 63.217) 79.267 6.657 ( 30.424 77.555 66.376) 106.518 10.825 ( -4.377 -1.936 -6.809) 8.323 12.191 ( -19.556 -28.871 4.506) 35.161 13.393 ( 13.359 -13.059 -48.761) 52.217 13.983 ( -1.553 -5.333 -23.459) 24.107 14.589 ( -3.474 22.946 -32.548) 39.974 14.850 ( -9.618 -8.665 0.858) 12.974 15.619 ( 14.415 9.558 -1.354) 17.348 17.880 ( -10.155 -0.569 27.952) 29.745 18.082 ( -2.790 -2.357 21.367) 21.677 18.399 ( -0.817 5.845 3.773) 7.005 18.744 ( 2.565 8.328 8.846) 12.417 18.993 ( 20.162 8.265 1.507) 21.842 19.301 ( -10.771 0.583 0.254) 10.790 19.879 ( 11.443 -10.462 -24.215) 28.753 21.940 ( -19.864 2.474 -7.411) 21.346 22.618 ( -4.386 -19.908 8.536) 22.100 22.949 ( 1.879 -12.392 -1.524) 12.626 23.315 ( -7.739 -18.897 -10.546) 22.983 23.488 ( 8.019 -3.465 -15.879) 18.124 23.871 ( -15.451 -3.546 -7.535) 17.553 24.091 ( -4.159 -8.604 -2.376) 9.847 24.235 ( -3.469 -1.766 1.709) 4.252 24.552 ( -0.800 -1.850 -2.069) 2.889 24.738 ( -0.575 -5.614 2.444) 6.150 25.042 ( -7.333 4.949 13.177) 15.871 25.309 ( -9.959 -2.931 10.693) 14.903 26.095 ( 2.817 -13.515 -3.569) 14.259 26.600 ( 18.456 -4.483 4.718) 19.570 27.018 ( 2.326 13.126 -6.174) 14.691 27.295 ( 5.100 27.164 5.180) 28.120 31.203 ( -2.886 -5.359 -0.293) 6.094 31.952 ( -5.389 4.869 2.173) 7.581 32.141 ( 6.027 -5.160 1.903) 8.159 32.384 ( 7.598 12.288 -1.739) 14.551 32.610 ( 8.603 18.137 -10.747) 22.770 32.933 ( 1.704 4.577 -8.524) 9.825 33.808 ( -2.946 -0.152 2.240) 3.704 33.943 ( 5.035 1.597 2.512) 5.849 34.601 ( -1.190 -2.011 4.175) 4.784 ======================= Grid point 149 (49/146) ======================= q-point: ( 0.36 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.115 ( 45.902 39.217 48.770) 77.611 6.265 ( 28.646 29.032 51.620) 65.788 8.463 ( 41.727 70.033 36.076) 89.147 10.670 ( -6.960 3.022 -1.185) 7.679 11.639 ( -9.998 -21.800 -6.887) 24.953 13.087 ( -2.642 -2.437 -42.712) 42.863 13.691 ( -13.367 -13.146 -24.744) 31.044 14.229 ( -4.085 -5.909 1.264) 7.294 15.068 ( 24.777 7.011 -15.361) 29.984 15.981 ( 9.376 21.491 3.086) 23.650 17.867 ( -10.612 -7.830 21.422) 25.156 18.092 ( -7.146 -3.373 3.249) 8.544 18.259 ( -10.021 1.835 1.503) 10.298 18.854 ( 0.598 11.788 9.601) 15.215 19.274 ( 19.312 -11.404 -24.371) 33.120 19.504 ( 4.888 6.588 16.876) 18.764 19.905 ( 3.710 4.223 9.062) 10.664 21.462 ( -28.103 -5.457 -3.013) 28.786 22.398 ( -4.138 -27.916 3.337) 28.418 22.532 ( -18.369 -28.822 -3.239) 34.331 22.903 ( -6.125 -7.783 -10.778) 14.638 23.535 ( -3.069 3.399 -12.809) 13.603 23.619 ( 3.961 1.868 -16.841) 17.401 23.827 ( -7.554 -7.904 -13.661) 17.498 24.192 ( -1.572 -1.922 2.348) 3.417 24.528 ( -1.156 -1.255 1.920) 2.568 24.698 ( -0.206 1.387 1.325) 1.929 25.015 ( -11.368 -8.027 22.457) 26.419 25.285 ( -5.038 9.308 5.489) 11.922 26.036 ( 7.371 -11.456 -3.778) 14.137 26.757 ( 1.356 -3.625 4.608) 6.017 27.167 ( 6.485 6.014 -1.441) 8.961 27.745 ( 13.987 24.424 1.770) 28.201 31.101 ( -2.247 -5.681 0.049) 6.110 31.907 ( -6.169 4.076 0.854) 7.443 32.212 ( 5.105 -4.391 2.760) 7.278 32.620 ( 7.663 10.815 -0.077) 13.255 32.830 ( 9.005 10.878 -9.506) 17.023 32.959 ( 3.334 4.897 -8.037) 9.984 33.772 ( -2.955 -0.369 2.324) 3.778 34.070 ( 5.685 1.761 1.788) 6.214 34.576 ( -2.406 -2.700 3.379) 4.950 ======================= Grid point 150 (50/146) ======================= q-point: ( 0.45 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.247 ( 24.992 19.588 40.320) 51.322 7.673 ( 47.526 40.962 35.550) 72.114 9.264 ( -15.789 6.110 1.947) 17.042 10.863 ( 3.171 2.989 10.518) 11.385 11.699 ( 39.933 26.787 -4.177) 48.267 12.430 ( -42.480 -4.940 -18.974) 46.787 13.217 ( 1.063 4.374 -39.053) 39.311 14.387 ( 25.757 -12.125 -0.279) 28.469 15.430 ( 25.671 -8.319 -6.309) 27.713 16.401 ( 5.683 33.616 2.725) 34.202 17.678 ( -3.410 -8.798 -0.746) 9.465 17.993 ( -15.361 3.655 26.800) 31.106 18.282 ( -5.332 4.326 17.937) 19.207 18.785 ( -35.613 -9.256 10.118) 38.162 19.126 ( 9.144 -17.326 -31.286) 36.914 19.652 ( 1.350 4.582 6.665) 8.200 20.089 ( 3.566 2.953 5.048) 6.850 21.036 ( -8.283 -6.967 3.641) 11.419 21.804 ( -16.427 -22.729 -7.695) 29.081 22.247 ( 0.245 -24.614 2.676) 24.761 22.688 ( -4.978 -3.516 -8.807) 10.710 23.420 ( -0.974 0.474 -5.302) 5.411 23.499 ( -2.073 -4.681 -19.089) 19.764 23.609 ( -4.662 9.057 -19.191) 21.727 24.172 ( -1.493 -1.303 2.483) 3.177 24.504 ( 0.039 -3.110 0.566) 3.162 24.786 ( 4.780 4.777 1.207) 6.865 24.917 ( -9.394 -9.950 25.417) 28.867 25.313 ( -5.063 9.528 -0.741) 10.815 26.046 ( 7.266 -7.934 -2.434) 11.030 26.691 ( -8.735 -1.162 2.124) 9.065 27.314 ( 6.355 0.707 2.712) 6.946 28.211 ( 14.465 17.607 0.207) 22.788 31.021 ( -0.763 -5.433 0.024) 5.486 31.842 ( -6.137 3.385 0.306) 7.015 32.261 ( 2.798 -3.285 2.312) 4.895 32.839 ( 6.628 8.198 0.225) 10.544 32.976 ( 4.587 6.255 -4.842) 9.144 33.038 ( 7.187 4.792 -6.923) 11.070 33.739 ( -2.696 0.023 2.514) 3.686 34.186 ( 4.919 1.255 0.890) 5.154 34.517 ( -3.490 -3.283 1.925) 5.164 ======================= Grid point 151 (51/146) ======================= q-point: ( 0.55 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.072 ( 23.282 17.194 19.343) 34.811 8.518 ( -26.811 -16.503 -1.369) 31.513 9.138 ( 18.103 37.771 29.633) 51.308 10.782 ( 0.034 -17.193 -1.609) 17.268 11.271 ( -45.770 -14.031 -11.581) 49.253 13.063 ( 24.993 22.604 -24.967) 41.939 13.321 ( 43.881 48.105 -11.636) 66.144 14.762 ( 33.172 -13.830 -3.843) 36.144 15.634 ( 18.849 -19.725 0.939) 27.300 16.832 ( 1.452 36.566 -1.727) 36.635 17.381 ( -68.391 -28.724 12.906) 75.292 17.844 ( -9.743 -4.967 13.876) 17.668 18.066 ( -4.826 7.849 24.696) 26.359 18.448 ( -3.527 8.497 19.497) 21.558 18.820 ( -2.309 -12.621 -17.403) 21.622 19.861 ( 10.299 4.341 0.364) 11.182 20.128 ( 7.130 -8.213 -10.083) 14.831 21.008 ( -0.661 -0.281 1.822) 1.959 21.373 ( -4.663 -19.057 -5.965) 20.506 21.968 ( -3.503 -25.590 -5.800) 26.472 22.572 ( 0.230 1.480 -5.382) 5.586 23.284 ( 0.675 -4.184 -15.242) 15.820 23.447 ( -6.303 9.584 -13.587) 17.782 23.525 ( 1.838 12.831 -1.810) 13.088 24.145 ( -1.876 -1.115 1.854) 2.863 24.486 ( 1.664 -3.695 -0.517) 4.085 24.864 ( -5.778 -10.397 26.131) 28.711 24.957 ( 8.637 1.155 -1.252) 8.804 25.305 ( -3.990 10.651 -5.137) 12.480 26.077 ( 5.178 -5.968 -0.748) 7.937 26.482 ( -14.966 -0.490 -1.123) 15.016 27.436 ( 5.309 -1.416 4.278) 6.963 28.546 ( 8.088 10.649 -0.481) 13.380 30.971 ( 0.864 -4.914 -0.097) 4.991 31.778 ( -5.380 3.990 -0.005) 6.698 32.277 ( 1.125 -3.009 1.439) 3.521 32.996 ( 4.311 5.117 -0.550) 6.713 33.069 ( 3.307 3.779 -0.356) 5.034 33.161 ( 6.845 3.541 -4.452) 8.900 33.722 ( -2.186 0.957 2.785) 3.668 34.272 ( 3.725 0.723 0.125) 3.797 34.423 ( -4.349 -3.742 -0.017) 5.737 ======================= Grid point 152 (52/146) ======================= q-point: (-0.36 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.482 ( -49.407 -23.117 -10.951) 55.636 8.831 ( 19.139 13.936 18.342) 29.949 9.208 ( -55.008 -2.725 2.209) 55.120 10.636 ( 6.521 -16.315 -1.964) 17.680 11.116 ( 27.632 25.790 9.791) 39.045 13.261 ( 15.286 17.741 -29.025) 37.294 14.398 ( 16.890 14.653 -6.457) 23.274 15.057 ( 21.386 -18.223 -6.025) 28.736 15.615 ( -69.924 -32.550 9.399) 77.699 16.012 ( 28.558 3.333 1.590) 28.795 17.013 ( -14.459 20.494 -2.502) 25.206 17.911 ( -4.121 6.985 11.414) 14.002 18.443 ( -2.587 -6.755 13.798) 15.579 18.527 ( 7.961 9.975 28.613) 31.330 18.875 ( 9.080 18.123 13.415) 24.308 19.963 ( 1.835 -5.149 -3.815) 6.666 20.036 ( 7.825 -15.934 -17.394) 24.853 20.917 ( -11.222 6.562 -5.738) 14.210 21.210 ( 13.921 -21.498 -4.758) 26.050 21.607 ( -1.720 -17.061 -12.612) 21.286 22.634 ( 4.633 6.038 -2.529) 8.020 23.223 ( 5.789 -0.605 -8.716) 10.480 23.359 ( -2.497 10.292 -11.694) 15.777 23.735 ( 3.036 15.359 3.289) 15.997 24.135 ( 0.257 0.392 1.737) 1.799 24.475 ( 0.597 -2.505 0.280) 2.590 24.861 ( -0.658 -15.595 21.607) 26.655 25.063 ( 4.303 -4.075 0.594) 5.956 25.355 ( 2.493 14.971 -9.098) 17.695 26.005 ( -9.959 -8.986 -2.252) 13.602 26.250 ( -6.543 3.366 -1.340) 7.479 27.524 ( 3.208 -2.033 4.137) 5.616 28.667 ( -1.960 3.910 -0.709) 4.431 30.954 ( 2.599 -4.333 -0.165) 5.055 31.749 ( -3.471 5.681 -0.010) 6.658 32.262 ( -0.079 -3.335 0.470) 3.369 33.067 ( -0.303 1.769 0.032) 1.795 33.158 ( 3.516 1.797 1.767) 4.326 33.268 ( 5.607 2.379 -2.443) 6.562 33.727 ( -1.631 2.272 3.066) 4.150 34.297 ( -4.825 -3.969 -2.473) 6.719 34.331 ( 2.689 0.401 0.052) 2.720 ======================= Grid point 153 (53/146) ======================= q-point: (-0.27 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.272 ( -58.341 -24.142 -3.184) 63.219 7.792 ( -78.781 -17.539 -2.961) 80.764 9.550 ( 20.682 15.259 13.269) 28.925 10.536 ( 2.259 -14.474 -2.849) 14.924 12.127 ( 36.243 30.088 10.913) 48.353 13.076 ( -74.852 -31.178 -1.062) 81.093 13.703 ( 0.264 22.838 -23.103) 32.487 14.854 ( 8.877 -31.744 -6.992) 33.695 15.429 ( 18.530 -3.909 5.126) 19.619 16.720 ( -19.821 9.518 -6.536) 22.938 16.924 ( 38.821 10.827 4.113) 40.512 18.035 ( -4.903 20.042 10.381) 23.097 18.340 ( -14.233 -3.651 25.241) 29.206 18.969 ( 4.318 2.254 10.318) 11.410 19.292 ( 6.228 13.739 -0.219) 15.086 19.760 ( -11.056 -11.861 2.596) 16.421 19.880 ( 8.398 -16.129 -14.590) 23.313 20.832 ( 3.577 6.631 -0.285) 7.540 21.213 ( 15.979 -10.649 -19.026) 27.032 21.670 ( 24.507 -0.418 4.307) 24.886 22.776 ( 6.769 7.486 -3.237) 10.599 23.286 ( 1.904 8.590 -6.241) 10.788 23.432 ( 11.407 2.672 -5.937) 13.134 23.915 ( 0.454 9.341 2.643) 9.718 24.211 ( 1.863 7.737 3.085) 8.535 24.460 ( -0.325 -1.287 0.239) 1.349 24.839 ( 2.493 -20.297 13.682) 24.604 25.041 ( -0.535 -7.948 2.099) 8.238 25.512 ( -3.286 11.588 -2.777) 12.361 25.618 ( -10.123 -0.954 -12.808) 16.353 26.263 ( 1.211 1.575 2.592) 3.266 27.559 ( 0.146 -2.399 2.921) 3.783 28.546 ( -12.837 -1.660 -0.472) 12.952 30.972 ( 4.297 -3.708 -0.161) 5.678 31.774 ( -1.389 7.437 0.434) 7.578 32.218 ( -0.794 -3.998 -0.423) 4.098 33.018 ( -5.917 -1.325 0.884) 6.127 33.234 ( 2.322 0.260 1.232) 2.642 33.367 ( 5.681 1.259 -1.103) 5.923 33.755 ( -1.240 3.681 3.199) 5.032 34.148 ( -5.127 -4.099 -4.131) 7.756 34.377 ( 2.307 0.486 0.014) 2.358 ======================= Grid point 154 (54/146) ======================= q-point: (-0.18 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.045 ( -62.737 -21.275 13.050) 67.519 6.233 ( -84.327 -15.855 3.030) 85.858 9.489 ( -62.124 -22.515 8.772) 66.658 10.617 ( 19.422 9.045 9.264) 23.342 11.448 ( -41.504 -21.928 -3.883) 47.101 13.163 ( 31.507 32.971 3.025) 45.705 14.069 ( 23.379 23.025 -23.232) 40.206 14.673 ( 12.170 -30.868 -6.339) 33.781 15.674 ( 14.001 -7.915 0.415) 16.089 16.303 ( -28.036 6.404 0.322) 28.760 17.495 ( 16.298 -9.159 2.207) 18.825 18.235 ( -16.678 -5.564 28.400) 33.402 18.261 ( -13.279 20.912 6.632) 25.645 18.915 ( 2.699 4.867 -3.463) 6.555 19.139 ( -20.156 -1.297 -17.149) 26.496 19.474 ( -8.668 -13.306 6.612) 17.201 19.963 ( 22.283 -4.252 -14.940) 27.163 21.205 ( 17.497 16.951 8.264) 25.725 21.453 ( 32.989 -2.870 -9.314) 34.399 22.247 ( 30.688 2.815 4.753) 31.181 22.975 ( 12.357 5.046 -1.925) 13.486 23.396 ( 2.709 14.441 -1.137) 14.737 23.647 ( 14.477 2.211 -3.729) 15.112 23.992 ( 0.644 2.166 2.757) 3.564 24.338 ( -0.075 7.763 -0.206) 7.766 24.458 ( -0.677 3.606 1.274) 3.884 24.688 ( -4.849 -24.167 3.110) 24.844 24.911 ( -3.673 -9.120 -2.190) 10.073 25.227 ( -13.207 -0.992 6.380) 14.701 25.788 ( 11.647 15.139 -12.511) 22.834 26.325 ( 1.446 0.589 4.541) 4.802 27.517 ( -3.715 -3.278 0.898) 5.036 28.212 ( -21.957 -5.012 0.365) 22.524 31.024 ( 5.728 -2.840 -0.132) 6.395 31.844 ( -0.612 8.267 1.389) 8.405 32.155 ( -0.735 -4.774 -1.151) 4.965 32.863 ( -10.243 -3.007 0.836) 10.708 33.248 ( -0.898 -0.639 -0.577) 1.244 33.460 ( 5.827 -0.541 -2.953) 6.555 33.799 ( -1.092 4.452 2.295) 5.126 33.991 ( -4.885 -3.359 -4.385) 7.374 34.422 ( 2.158 0.516 0.657) 2.315 ======================= Grid point 155 (55/146) ======================= q-point: (-0.09 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.010 ( -60.917 -12.526 41.477) 74.754 4.731 ( -85.556 -7.828 16.196) 87.427 7.572 (-123.311 -30.608 19.388) 128.524 11.021 ( -1.193 -2.668 -4.501) 5.366 11.265 ( 29.961 5.831 8.954) 31.809 13.925 ( 23.429 26.673 -5.532) 35.930 14.479 ( 21.231 20.984 -36.112) 46.853 14.591 ( 19.585 -31.566 0.187) 37.149 15.735 ( 5.238 -4.172 -12.194) 13.912 15.963 ( -23.255 7.695 4.445) 24.895 17.424 ( -4.705 -18.302 0.408) 18.902 17.934 ( -19.231 -7.624 7.080) 21.865 18.177 ( -19.940 -0.168 33.271) 38.789 18.592 ( -22.764 0.028 -9.965) 24.849 18.979 ( -21.998 3.590 12.399) 25.506 19.584 ( 31.422 -0.854 -11.971) 33.636 20.219 ( 22.667 11.132 -25.164) 35.650 21.759 ( 19.979 14.584 11.683) 27.355 21.963 ( 30.355 -10.969 1.007) 32.292 22.662 ( 15.492 6.583 -6.463) 18.031 23.243 ( 18.357 0.167 -5.463) 19.153 23.642 ( 7.998 3.867 8.734) 12.458 23.890 ( 4.378 11.649 -4.883) 13.369 24.039 ( 1.467 -1.059 2.575) 3.147 24.280 ( -2.973 -8.107 -0.454) 8.647 24.429 ( 5.466 -3.998 -3.140) 7.464 24.541 ( -4.179 12.160 3.400) 13.300 24.783 ( 1.716 -13.108 1.746) 13.335 25.143 ( -2.423 -4.135 6.737) 8.268 26.036 ( 10.937 12.655 -10.580) 19.792 26.392 ( 0.647 2.474 5.379) 5.956 27.376 ( -8.108 -4.342 -1.741) 9.361 27.736 ( -28.116 -6.004 1.815) 28.807 31.107 ( 6.637 -1.482 -0.168) 6.803 31.916 ( -1.876 5.908 2.598) 6.721 32.097 ( 0.779 -3.593 -1.521) 3.979 32.640 ( -12.732 -2.879 0.384) 13.059 33.187 ( -3.556 -0.881 -2.979) 4.721 33.458 ( 0.735 -2.651 -14.674) 14.929 33.803 ( -1.265 -0.720 -2.648) 3.021 33.896 ( -3.683 2.982 2.035) 5.157 34.471 ( 2.026 0.368 1.656) 2.642 ======================= Grid point 159 (56/146) ======================= q-point: ( 0.27 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.109 ( -0.000 51.802 53.362) 74.370 5.738 ( -0.000 38.903 61.801) 73.026 7.711 ( -0.000 89.003 55.754) 105.024 10.796 ( -0.000 -0.698 -7.209) 7.242 12.112 ( 0.000 -31.917 0.813) 31.927 12.717 ( -0.000 -11.081 -51.176) 52.362 13.690 ( 0.000 -16.738 -24.425) 29.610 14.639 ( -0.000 29.080 -14.747) 32.606 15.191 ( 0.000 -2.032 7.703) 7.967 15.379 ( -0.000 8.842 -6.530) 10.992 18.175 ( 0.000 -1.945 12.978) 13.123 18.178 ( 0.000 -0.109 21.262) 21.262 18.341 ( 0.000 -12.590 -25.313) 28.271 18.768 ( -0.000 -1.097 -15.325) 15.365 18.980 ( -0.000 13.344 24.674) 28.051 19.556 ( -0.000 2.924 0.261) 2.936 19.591 ( -0.000 10.451 19.850) 22.433 22.107 ( -0.000 4.217 -8.951) 9.895 22.492 ( 0.000 -27.196 2.710) 27.330 22.727 ( 0.000 -18.455 -0.914) 18.478 23.026 ( 0.000 -29.602 -14.894) 33.138 23.317 ( -0.000 3.698 -15.045) 15.493 23.921 ( 0.000 -18.610 -11.500) 21.876 23.950 ( -0.000 -0.391 -8.737) 8.746 24.226 ( 0.000 -3.442 -0.040) 3.442 24.608 ( -0.000 4.218 4.494) 6.163 24.685 ( 0.000 -7.746 3.383) 8.452 25.328 ( -0.000 13.626 9.665) 16.706 25.348 ( 0.000 -12.918 7.018) 14.702 25.939 ( 0.000 -19.440 6.544) 20.512 26.416 ( -0.000 4.869 1.391) 5.064 27.110 ( -0.000 14.639 -5.183) 15.529 27.545 ( -0.000 24.345 4.371) 24.735 31.176 ( 0.000 -5.229 -0.747) 5.282 32.046 ( 0.000 -4.366 4.622) 6.358 32.068 ( -0.000 2.449 0.253) 2.462 32.438 ( -0.000 17.193 -2.807) 17.420 32.652 ( -0.000 14.528 -6.475) 15.906 32.911 ( -0.000 6.940 -8.864) 11.257 33.885 ( -0.000 1.255 2.413) 2.720 33.899 ( 0.000 -0.027 2.856) 2.856 34.619 ( 0.000 -2.872 4.076) 4.986 ======================= Grid point 160 (57/146) ======================= q-point: ( 0.36 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.251 ( 28.071 50.408 46.126) 73.868 6.609 ( 11.212 29.402 51.911) 60.704 9.048 ( 12.621 78.515 35.334) 87.020 10.768 ( 1.504 11.306 -4.156) 12.139 11.573 ( -19.349 -24.674 -9.668) 32.812 12.519 ( 20.580 -5.777 -41.035) 46.269 13.399 ( 6.562 -19.027 -20.417) 28.669 14.640 ( -40.877 -7.145 2.564) 41.576 14.877 ( 5.684 21.143 -5.208) 22.504 15.902 ( 25.952 17.701 2.312) 31.498 17.842 ( -7.663 -16.820 -21.569) 28.405 18.258 ( 2.442 -1.286 10.619) 10.972 18.352 ( 8.395 -5.361 -2.837) 10.357 18.690 ( 2.205 -7.110 -5.272) 9.122 19.193 ( -9.719 15.606 20.271) 27.367 19.719 ( 1.853 10.785 21.270) 23.920 19.966 ( 7.673 10.988 15.459) 20.460 21.854 ( -24.780 -3.688 -6.078) 25.780 22.132 ( -2.352 -37.681 1.837) 37.799 22.431 ( -9.269 -33.894 -2.274) 35.212 22.731 ( 4.400 -11.239 -14.270) 18.690 23.267 ( 8.905 -3.809 -23.311) 25.243 23.600 ( -6.558 -7.166 -13.448) 16.590 23.795 ( -7.800 2.082 -14.169) 16.308 24.198 ( -0.533 -3.089 1.832) 3.630 24.585 ( -1.941 -0.733 1.969) 2.861 24.703 ( -0.230 0.378 2.456) 2.496 25.283 ( -1.857 -9.756 15.701) 18.578 25.500 ( -3.538 11.539 6.138) 13.540 25.773 ( -0.182 -16.515 4.660) 17.161 26.622 ( 12.497 0.085 3.905) 13.093 27.193 ( -1.224 11.075 -4.074) 11.864 27.844 ( 5.539 22.798 2.238) 23.567 31.092 ( -2.842 -5.220 -0.226) 5.948 32.019 ( -1.324 -1.453 -1.742) 2.626 32.117 ( 2.130 -0.334 5.776) 6.165 32.633 ( 5.067 14.487 -1.541) 15.425 32.767 ( 4.065 10.535 -5.624) 12.615 32.930 ( 0.744 8.144 -8.044) 11.472 33.847 ( -3.729 0.204 2.662) 4.586 34.002 ( 5.393 0.822 2.116) 5.851 34.603 ( -1.398 -3.648 3.369) 5.159 ======================= Grid point 161 (58/146) ======================= q-point: ( 0.45 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.410 ( 14.347 22.086 37.807) 46.076 7.610 ( 37.913 45.147 34.584) 68.350 9.684 ( -12.387 13.843 6.881) 19.810 10.934 ( -15.573 -18.660 -3.471) 24.551 11.481 ( 31.689 61.547 6.854) 69.565 12.550 ( 12.264 6.800 -34.585) 37.319 13.137 ( -9.627 -8.286 -22.998) 26.273 13.964 ( -13.439 -21.669 2.870) 25.659 15.111 ( 7.709 6.366 -1.432) 10.099 16.535 ( 18.661 27.025 5.330) 33.272 17.551 ( 3.517 -9.333 -7.250) 12.330 18.300 ( 15.601 -18.437 -17.522) 29.839 18.455 ( 3.027 3.443 12.686) 13.489 18.594 ( -12.531 -2.050 14.757) 19.468 19.335 ( -10.459 15.665 16.295) 24.906 19.898 ( -11.698 3.520 15.687) 19.882 20.189 ( -2.565 4.916 6.357) 8.436 21.160 ( -27.907 -28.195 0.686) 39.676 21.679 ( -4.406 -36.149 -6.719) 37.031 22.015 ( -5.137 -20.014 -3.853) 21.019 22.579 ( 0.974 -9.688 -10.867) 14.591 23.151 ( 8.799 -10.036 -24.940) 28.287 23.458 ( -0.795 8.069 -12.077) 14.546 23.630 ( -3.803 9.453 -15.790) 18.792 24.179 ( -0.097 -2.658 2.312) 3.524 24.581 ( -4.394 1.471 2.969) 5.503 24.707 ( 2.715 -1.062 -0.469) 2.953 25.249 ( -10.753 -8.205 26.059) 29.360 25.532 ( -7.826 10.436 0.893) 13.075 25.748 ( 11.826 -13.373 0.136) 17.852 26.783 ( 1.507 0.767 3.090) 3.522 27.238 ( 2.175 2.909 -2.076) 4.184 28.199 ( 9.739 19.509 0.742) 21.817 30.994 ( -2.431 -5.217 0.227) 5.760 31.960 ( -3.669 1.218 -1.662) 4.208 32.190 ( 3.174 -2.660 4.411) 6.050 32.842 ( 5.133 11.022 -0.132) 12.159 32.904 ( 6.337 7.008 -4.740) 10.571 32.975 ( 1.558 7.683 -5.938) 9.834 33.812 ( -3.088 0.519 2.735) 4.158 34.113 ( 5.361 0.513 1.077) 5.493 34.549 ( -2.829 -4.263 2.146) 5.548 ======================= Grid point 162 (59/146) ======================= q-point: ( 0.55 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.063 ( 13.660 18.409 16.380) 28.174 8.647 ( 8.916 11.310 13.769) 19.925 9.616 ( -4.135 28.066 23.855) 37.065 10.511 ( -1.879 -25.207 -8.187) 26.569 11.969 ( -51.044 -2.267 -7.061) 51.580 12.754 ( 19.815 22.240 -24.497) 38.566 13.091 ( 32.068 49.851 -6.980) 59.684 13.948 ( 31.351 -19.308 -6.906) 37.462 15.236 ( 9.747 -6.880 -0.472) 11.940 17.101 ( 10.023 28.481 5.092) 30.620 17.673 ( 11.931 -2.187 11.732) 16.875 18.211 ( 5.154 -18.426 -22.791) 29.757 18.479 ( -11.240 -3.952 22.763) 25.693 18.555 ( -24.920 0.557 18.298) 30.921 19.016 ( -36.586 7.183 16.667) 40.840 19.816 ( 0.827 5.092 4.516) 6.856 20.057 ( -10.600 -6.660 -4.034) 13.152 20.750 ( 8.402 -27.313 0.791) 28.588 21.263 ( -1.217 -27.958 -8.600) 29.276 21.676 ( -6.669 -21.049 -9.910) 24.202 22.496 ( 3.846 0.227 -6.382) 7.455 23.046 ( 6.995 -5.073 -19.554) 21.378 23.491 ( 1.171 11.990 -15.375) 19.532 23.628 ( 1.008 15.715 -5.885) 16.811 24.172 ( -0.396 -2.056 2.114) 2.975 24.479 ( -7.554 -0.920 1.235) 7.710 24.792 ( 8.453 -2.548 -1.039) 8.890 25.159 ( -12.725 -9.476 26.962) 31.284 25.485 ( -7.896 9.280 -1.426) 12.268 25.856 ( 12.282 -8.841 -0.181) 15.134 26.719 ( -11.901 3.278 -0.540) 12.356 27.317 ( 7.607 -3.172 0.718) 8.273 28.528 ( 8.370 13.972 -0.090) 16.287 30.917 ( -0.810 -4.987 0.230) 5.057 31.902 ( -4.219 3.236 -1.372) 5.492 32.230 ( 1.815 -3.634 2.952) 5.021 32.998 ( 2.240 7.404 -0.061) 7.736 33.043 ( 7.398 4.406 -4.354) 9.649 33.052 ( 3.220 5.644 -1.652) 6.705 33.796 ( -2.367 1.569 2.908) 4.064 34.205 ( 4.597 0.149 -0.022) 4.599 34.457 ( -4.122 -4.663 0.682) 6.261 ======================= Grid point 163 (60/146) ======================= q-point: (-0.36 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.983 ( -35.707 -9.961 -7.648) 37.852 8.855 ( 11.411 14.740 22.125) 28.931 10.202 ( -34.702 25.702 13.769) 45.325 10.255 ( 8.449 -25.633 -9.551) 28.630 11.143 ( -6.829 13.968 7.569) 17.292 12.971 ( 16.868 10.868 -24.356) 31.557 13.898 ( 32.684 -10.075 -14.533) 37.162 14.556 ( 29.210 27.028 -0.363) 39.797 15.455 ( 26.732 2.346 2.082) 26.916 16.951 ( -92.463 -24.582 5.438) 95.829 17.453 ( -3.032 17.020 8.317) 19.185 17.878 ( 7.167 -10.306 -3.910) 13.148 18.370 ( 5.386 3.972 5.016) 8.363 18.708 ( 8.371 10.599 19.535) 23.749 19.197 ( -0.274 18.389 29.466) 34.734 19.738 ( -5.825 -9.358 -11.653) 16.040 19.932 ( 1.331 -1.261 4.885) 5.218 20.651 ( 12.009 -33.124 -8.269) 36.191 20.994 ( 7.335 -16.168 -8.556) 19.709 21.269 ( -7.175 -17.834 -12.042) 22.684 22.589 ( 5.038 8.423 -4.633) 10.853 23.015 ( 8.143 -2.903 -11.134) 14.096 23.471 ( -3.144 15.992 -17.701) 24.061 23.849 ( 3.602 16.751 1.497) 17.200 24.156 ( -0.582 -0.028 2.256) 2.330 24.388 ( 0.005 -4.337 -0.075) 4.338 24.887 ( 7.574 -6.994 0.073) 10.310 25.030 ( -11.234 -11.025 20.350) 25.727 25.456 ( -3.942 8.998 -1.584) 9.950 25.948 ( 5.773 -6.220 -0.003) 8.487 26.486 ( -16.457 3.469 -1.159) 16.859 27.423 ( 7.593 -3.733 1.001) 8.520 28.724 ( 1.852 7.888 -0.477) 8.117 30.874 ( 1.062 -4.484 0.081) 4.609 31.869 ( -3.540 5.624 -0.923) 6.709 32.225 ( 0.407 -4.519 1.637) 4.824 33.083 ( 1.495 4.241 -0.207) 4.501 33.136 ( 2.246 2.165 0.454) 3.152 33.171 ( 6.367 2.954 -2.745) 7.537 33.806 ( -1.660 2.829 3.037) 4.470 34.268 ( 2.878 -0.068 -2.006) 3.509 34.336 ( -4.305 -4.511 0.499) 6.256 ======================= Grid point 164 (61/146) ======================= q-point: (-0.27 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.057 ( -53.787 -12.589 4.232) 55.402 9.023 ( -70.199 -0.961 2.118) 70.238 9.510 ( 7.220 15.945 13.002) 21.804 10.144 ( 14.457 -23.256 -8.379) 28.636 11.986 ( 31.478 38.970 14.800) 52.236 13.171 ( 16.480 -5.583 -13.065) 21.758 14.031 ( 12.386 -4.166 -27.205) 30.181 14.820 ( -45.199 -11.733 5.926) 47.071 15.263 ( -32.230 -17.971 9.428) 38.087 16.314 ( 41.667 22.482 -1.149) 47.359 17.319 ( -28.093 5.443 6.645) 29.377 18.056 ( 24.960 1.548 -3.177) 25.209 18.542 ( -0.426 4.694 7.245) 8.643 19.053 ( 1.734 3.178 15.302) 15.725 19.373 ( -8.514 -6.445 4.926) 11.760 19.570 ( -2.260 5.379 -14.560) 15.686 19.993 ( -2.510 1.822 16.584) 16.872 20.444 ( 18.306 -26.636 -15.338) 35.775 20.993 ( -2.980 -1.570 -4.177) 5.366 21.164 ( 28.485 -9.744 3.050) 30.259 22.717 ( 4.994 9.489 -7.862) 13.296 23.115 ( 11.615 -1.864 -1.599) 11.872 23.475 ( -2.318 19.857 -14.235) 24.542 23.968 ( -0.655 4.178 -1.353) 4.440 24.265 ( 4.280 6.494 1.553) 7.931 24.389 ( 4.126 -1.270 1.449) 4.554 24.837 ( -8.128 -15.643 14.330) 22.718 24.915 ( 3.036 -11.573 -0.381) 11.971 25.521 ( 2.392 11.181 -4.408) 12.254 25.846 ( -12.101 -3.552 -1.249) 12.674 26.325 ( -5.475 2.514 4.138) 7.309 27.500 ( 4.806 -3.156 -0.331) 5.759 28.725 ( -7.534 2.722 -0.484) 8.025 30.869 ( 2.970 -3.604 0.001) 4.670 31.884 ( -1.895 7.827 -0.229) 8.056 32.181 ( -0.615 -5.619 0.550) 5.679 33.100 ( -3.265 0.889 0.452) 3.413 33.194 ( 3.103 0.012 0.707) 3.182 33.273 ( 5.240 1.886 -2.639) 6.163 33.835 ( -1.074 3.189 2.506) 4.196 34.173 ( -5.443 -3.256 -3.038) 7.033 34.338 ( 2.750 -0.197 0.745) 2.856 ======================= Grid point 165 (62/146) ======================= q-point: (-0.18 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.075 ( -59.153 -7.346 20.311) 62.973 7.642 ( -85.324 -1.824 7.917) 85.710 9.853 ( 0.775 -3.845 -0.445) 3.948 10.284 ( 25.477 -2.659 4.252) 25.966 12.426 ( -66.353 -12.319 7.545) 67.907 13.093 ( 17.068 27.531 1.977) 32.453 13.790 ( 1.749 -6.181 -7.072) 9.554 14.121 ( 8.404 2.545 -25.688) 27.147 15.337 ( 15.631 -12.325 5.922) 20.768 16.893 ( -26.656 6.737 6.094) 28.162 17.080 ( 25.304 0.685 1.878) 25.383 18.417 ( -0.934 -12.411 -0.116) 12.447 18.657 ( 6.972 28.789 2.801) 29.754 19.039 ( -5.225 -16.793 -7.148) 18.984 19.068 ( 2.020 -10.747 2.541) 11.227 19.360 ( -13.902 3.956 -11.439) 18.433 19.968 ( -12.594 -4.714 11.828) 17.910 20.682 ( 38.187 -5.801 -13.302) 40.851 21.160 ( 12.197 13.645 6.641) 19.469 21.723 ( 33.759 -4.203 10.857) 35.710 22.842 ( 7.280 6.828 -7.223) 12.320 23.310 ( 12.188 -2.098 2.381) 12.594 23.603 ( 3.488 23.844 -8.579) 25.579 23.978 ( 1.835 -0.489 -1.624) 2.498 24.294 ( 2.637 -7.523 -2.774) 8.441 24.539 ( 0.913 7.043 3.056) 7.731 24.611 ( -6.528 -13.993 5.020) 16.237 24.819 ( 0.564 -12.952 -0.749) 12.986 25.507 ( -15.313 1.474 -2.070) 15.523 25.732 ( 4.510 11.515 -1.094) 12.415 26.349 ( 0.333 -0.443 7.303) 7.324 27.509 ( 0.651 -2.995 -2.207) 3.777 28.524 ( -16.941 -0.268 -0.107) 16.944 30.906 ( 4.733 -2.109 0.027) 5.182 31.951 ( -0.436 8.934 0.775) 8.979 32.106 ( -1.089 -6.928 -0.272) 7.019 33.005 ( -7.893 -1.135 0.459) 7.988 33.233 ( 1.352 -0.730 -0.571) 1.639 33.342 ( 4.229 0.593 -4.413) 6.140 33.847 ( -1.141 -0.023 -0.863) 1.431 34.048 ( -5.219 0.834 -0.127) 5.287 34.391 ( 2.673 0.138 1.002) 2.858 ======================= Grid point 166 (63/146) ======================= q-point: (-0.09 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.285 ( -56.696 2.684 41.711) 70.437 6.306 ( -84.340 4.995 19.218) 86.646 9.281 ( -70.250 -9.213 8.275) 71.333 10.732 ( 19.407 -12.091 2.129) 22.965 11.313 ( -29.803 10.841 6.304) 32.334 13.707 ( 29.224 -15.799 -8.402) 34.267 13.896 ( 20.139 5.653 0.090) 20.918 14.209 ( 6.084 25.819 -32.227) 41.740 15.491 ( 10.817 -3.608 -4.791) 12.369 16.537 ( -28.840 6.099 8.286) 30.620 17.286 ( 4.155 -11.463 -0.495) 12.203 18.098 ( -11.659 -17.413 1.715) 21.026 18.566 ( -7.189 -14.479 -0.074) 16.166 18.980 ( -18.652 12.783 3.294) 22.850 19.053 ( 8.859 -10.381 -5.610) 14.755 19.445 ( 0.642 25.384 2.107) 25.479 19.830 ( 8.367 -1.583 -2.467) 8.865 21.226 ( 37.495 -9.358 -4.496) 38.906 21.660 ( 20.490 15.253 8.696) 26.984 22.226 ( 27.028 -4.209 -3.008) 27.519 22.985 ( 9.636 1.593 -5.271) 11.099 23.498 ( 10.485 -4.123 4.146) 12.005 23.954 ( 11.838 21.809 2.206) 24.912 23.998 ( 3.250 0.236 -2.708) 4.237 24.177 ( -2.891 -15.040 -0.560) 15.325 24.340 ( -3.558 -6.261 -7.394) 10.321 24.645 ( 0.616 -6.280 0.123) 6.311 24.727 ( -1.892 2.774 1.723) 3.774 25.276 ( -12.174 -2.383 6.585) 14.045 25.952 ( 7.886 13.255 -5.418) 16.347 26.423 ( 2.533 -1.496 9.784) 10.217 27.426 ( -4.220 -2.908 -4.105) 6.566 28.165 ( -24.437 -0.550 0.505) 24.448 30.988 ( 6.072 0.004 0.041) 6.073 31.994 ( -2.483 -5.800 1.045) 6.395 32.061 ( 1.514 6.174 0.210) 6.361 32.831 ( -11.274 -0.960 0.134) 11.315 33.207 ( -2.042 -0.730 -3.090) 3.775 33.337 ( 0.432 -0.537 -10.553) 10.575 33.781 ( -1.393 -3.278 -2.685) 4.460 34.024 ( -3.714 5.103 2.914) 6.951 34.447 ( 2.581 0.012 1.831) 3.164 ======================= Grid point 171 (64/146) ======================= q-point: ( 0.36 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.865 ( -0.000 54.093 42.594) 68.850 7.158 ( -0.000 25.663 44.582) 51.441 9.778 ( -0.000 33.744 11.431) 35.627 10.969 ( -0.000 53.633 4.937) 53.860 11.650 ( 0.000 -10.458 -0.555) 10.473 11.860 ( -0.000 -7.441 -38.303) 39.019 12.950 ( 0.000 -27.035 -17.990) 32.474 14.965 ( -0.000 14.327 -4.802) 15.110 15.355 ( 0.000 0.267 16.697) 16.699 15.567 ( -0.000 21.257 -8.034) 22.725 17.551 ( 0.000 -15.275 -30.488) 34.101 17.875 ( 0.000 -23.481 -15.764) 28.281 18.322 ( 0.000 -1.624 8.962) 9.108 18.869 ( -0.000 6.627 22.200) 23.168 19.629 ( -0.000 10.909 27.185) 29.292 19.934 ( -0.000 18.730 7.779) 20.281 20.115 ( -0.000 5.632 18.335) 19.180 21.705 ( 0.000 -47.062 -0.043) 47.062 22.123 ( -0.000 2.141 -10.651) 10.864 22.160 ( 0.000 -35.694 5.866) 36.173 22.402 ( 0.000 -11.237 -17.467) 20.769 22.925 ( 0.000 -11.797 -25.547) 28.139 23.504 ( -0.000 2.983 -17.017) 17.276 23.819 ( -0.000 1.929 -11.583) 11.743 24.184 ( 0.000 -3.117 1.797) 3.598 24.574 ( 0.000 -5.091 -0.079) 5.091 24.747 ( -0.000 3.011 2.093) 3.667 25.130 ( 0.000 -13.489 2.138) 13.658 25.716 ( -0.000 10.153 8.533) 13.262 25.768 ( 0.000 -16.351 16.200) 23.017 26.546 ( -0.000 5.277 2.497) 5.838 27.294 ( -0.000 9.901 -3.158) 10.392 28.013 ( -0.000 19.589 0.891) 19.609 31.071 ( 0.000 -4.381 -0.600) 4.422 31.958 ( 0.000 -5.214 0.006) 5.214 32.175 ( -0.000 2.114 4.177) 4.681 32.703 ( -0.000 12.779 -4.445) 13.530 32.810 ( -0.000 10.048 -1.380) 10.142 32.961 ( -0.000 10.142 -6.821) 12.223 33.931 ( 0.000 -0.452 2.050) 2.099 33.946 ( -0.000 1.030 2.602) 2.799 34.599 ( 0.000 -4.398 2.823) 5.226 ======================= Grid point 172 (65/146) ======================= q-point: ( 0.45 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.722 ( 5.280 21.782 31.412) 38.588 7.852 ( 18.669 49.564 35.755) 63.903 9.812 ( -0.798 -10.209 -8.436) 13.268 11.115 ( -26.954 -9.560 -5.421) 29.109 11.944 ( 13.620 90.026 12.895) 91.959 12.015 ( 24.855 1.343 -21.771) 33.069 12.661 ( 13.469 -26.241 -18.425) 34.777 14.552 ( -50.099 -0.783 -2.364) 50.161 15.187 ( -5.696 8.374 2.480) 10.427 16.336 ( 36.774 21.677 2.184) 42.744 17.285 ( 7.563 -9.398 -14.723) 19.034 17.645 ( 10.939 -25.448 -11.234) 29.891 18.428 ( 7.189 -2.728 9.223) 12.008 19.025 ( -9.129 4.515 25.167) 27.150 19.802 ( -10.185 14.964 18.928) 26.190 20.145 ( -1.346 4.139 11.411) 12.213 20.296 ( 2.161 4.708 4.877) 7.115 21.166 ( -1.725 -52.560 -8.208) 53.225 21.536 ( -38.103 -25.667 5.644) 46.287 21.950 ( -5.545 -10.039 -6.773) 13.319 22.312 ( 7.654 -12.555 -11.485) 18.658 22.731 ( 8.921 -1.706 -26.349) 27.870 23.435 ( 0.432 8.709 -16.324) 18.507 23.690 ( -5.103 5.889 -11.372) 13.785 24.168 ( 0.017 -3.038 2.188) 3.744 24.556 ( 3.406 -2.782 0.538) 4.431 24.768 ( -2.880 2.284 0.132) 3.678 25.183 ( 15.940 -11.654 4.137) 20.174 25.643 ( -9.248 -13.740 16.056) 23.067 25.800 ( -6.298 7.324 5.433) 11.082 26.709 ( 9.046 3.128 2.652) 9.932 27.305 ( -5.282 5.741 -2.837) 8.301 28.248 ( 5.997 16.810 0.121) 17.848 30.999 ( -2.879 -3.856 -0.151) 4.815 31.931 ( 2.186 -4.092 -1.089) 4.765 32.209 ( -1.090 1.039 4.047) 4.318 32.811 ( 4.737 7.711 -4.540) 10.124 32.922 ( 1.814 9.795 -0.169) 9.963 33.016 ( -0.509 9.995 -4.428) 10.943 33.890 ( -3.280 0.295 2.323) 4.030 34.037 ( 4.829 0.114 1.498) 5.057 34.558 ( -1.614 -4.842 1.850) 5.429 ======================= Grid point 173 (66/146) ======================= q-point: ( 0.55 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.208 ( 6.284 19.588 16.636) 26.456 8.773 ( 10.019 25.119 19.008) 33.055 9.715 ( 13.417 -4.622 -5.559) 15.241 10.610 ( -23.181 -2.186 10.037) 25.355 12.201 ( 17.670 -10.268 -21.352) 29.556 12.643 ( 14.923 -0.333 -22.554) 27.046 13.009 ( -5.281 45.162 10.279) 46.617 13.783 ( -17.815 24.584 -3.570) 30.570 15.156 ( -2.909 0.046 -0.921) 3.052 17.046 ( 19.681 7.782 -1.528) 21.219 17.433 ( 19.875 1.156 3.152) 20.156 17.656 ( 23.343 -10.935 -1.647) 25.830 18.600 ( 6.230 -5.940 10.112) 13.279 19.077 ( -11.393 7.038 27.288) 30.397 19.892 ( -17.283 12.339 16.076) 26.634 20.079 ( -22.663 0.350 4.069) 23.028 20.194 ( -14.574 -6.830 -2.715) 16.322 20.451 ( -20.736 -39.729 -2.009) 44.860 20.717 ( -1.232 -38.527 -13.199) 40.744 21.659 ( -10.393 -12.572 -5.992) 17.377 22.348 ( 11.605 -0.434 -2.126) 11.806 22.711 ( 8.468 2.671 -24.749) 26.294 23.449 ( 2.498 11.405 -16.658) 20.342 23.693 ( 2.920 12.465 -4.631) 13.614 24.161 ( 0.394 -2.669 2.375) 3.594 24.621 ( 6.351 -3.337 0.502) 7.192 24.676 ( -10.088 1.825 -0.254) 10.255 25.401 ( 4.628 -9.985 16.497) 19.831 25.491 ( 4.054 -11.308 3.512) 12.515 25.745 ( -9.599 4.616 2.780) 11.008 26.882 ( 2.386 4.804 2.220) 5.806 27.210 ( -3.641 -1.168 -3.438) 5.143 28.521 ( 8.093 12.792 -0.052) 15.137 30.911 ( -2.986 -3.439 0.193) 4.558 31.925 ( 1.384 -1.144 -1.827) 2.561 32.221 ( -0.930 -1.065 3.432) 3.712 32.940 ( 6.440 4.931 -3.161) 8.705 33.043 ( 2.844 6.726 -0.570) 7.325 33.069 ( -0.972 7.852 -1.621) 8.077 33.869 ( -2.124 1.135 2.449) 3.435 34.125 ( 4.737 -0.224 0.305) 4.752 34.478 ( -3.228 -4.850 0.736) 5.872 ======================= Grid point 174 (67/146) ======================= q-point: ( 0.64 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.388 ( -17.856 7.277 1.117) 19.314 8.988 ( 5.363 6.524 11.848) 14.550 9.783 ( 5.054 -21.024 -10.998) 24.259 10.879 ( 10.915 43.324 27.315) 52.366 11.856 ( -50.548 -0.512 -5.091) 50.806 12.397 ( 12.947 -30.054 -14.441) 35.769 13.173 ( 29.187 6.174 -19.525) 35.654 14.587 ( 18.029 52.040 5.278) 55.327 15.178 ( 11.533 7.400 -1.335) 13.768 17.177 ( 18.745 -22.487 -4.067) 29.556 17.805 ( 9.003 -3.875 14.515) 17.514 18.033 ( -16.685 12.991 -6.268) 22.056 18.561 ( -19.017 -3.023 14.296) 23.983 18.845 ( -19.749 2.410 8.699) 21.715 19.490 ( -8.195 -6.280 12.894) 16.519 19.747 ( -6.647 -4.831 -4.873) 9.553 20.023 ( -2.718 -11.002 3.627) 11.899 20.198 ( 4.402 -11.661 10.618) 16.373 20.376 ( 8.456 -24.344 -18.506) 31.727 21.324 ( -11.113 -7.922 -3.629) 14.122 22.575 ( 5.793 12.259 -2.402) 13.770 22.716 ( 12.195 -2.003 -15.503) 19.826 23.472 ( 2.191 13.805 -19.659) 24.121 23.928 ( 7.870 14.715 1.133) 16.726 24.163 ( 0.596 -1.876 2.312) 3.036 24.484 ( -12.198 -0.699 0.736) 12.240 24.690 ( 6.589 -5.991 -0.174) 8.907 25.250 ( -12.139 -14.787 16.078) 24.990 25.622 ( -5.141 5.407 0.147) 7.462 25.713 ( 12.577 -6.058 1.315) 14.022 26.818 ( -16.330 5.725 1.770) 17.394 27.220 ( 10.153 -4.360 -3.003) 11.450 28.740 ( 5.272 7.756 -0.167) 9.380 30.842 ( -1.502 -2.873 0.166) 3.246 31.932 ( 0.354 2.462 -1.604) 2.960 32.204 ( -1.196 -3.298 2.323) 4.208 33.071 ( 6.085 3.661 -2.225) 7.442 33.112 ( 0.270 4.202 -0.133) 4.213 33.132 ( 1.769 3.191 -0.059) 3.649 33.873 ( -1.212 1.594 2.371) 3.104 34.196 ( 4.072 -0.049 -0.971) 4.186 34.371 ( -4.357 -4.132 0.209) 6.008 ======================= Grid point 175 (68/146) ======================= q-point: (-0.27 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.870 ( -43.721 -0.965 8.336) 44.519 9.325 ( 18.165 0.221 -5.935) 19.112 9.642 ( 7.482 -9.235 1.887) 12.034 10.528 ( -77.934 4.892 5.130) 78.256 12.020 ( 26.824 40.718 18.244) 52.061 12.354 ( 33.537 -45.310 -14.212) 58.135 13.633 ( 23.058 25.625 -23.630) 41.793 14.893 ( 1.662 -7.241 11.895) 14.025 15.919 ( 32.025 34.640 -0.317) 47.177 16.647 ( -97.484 -11.335 2.088) 98.163 17.401 ( 31.912 -18.594 1.503) 36.965 17.774 ( -13.790 -5.913 5.878) 16.114 18.677 ( -0.091 13.725 1.445) 13.801 18.982 ( 5.003 -22.208 0.397) 22.768 19.436 ( 19.685 17.751 -7.281) 27.488 19.613 ( -11.727 -18.466 -8.937) 23.631 19.752 ( -3.931 -5.789 -6.079) 9.269 20.225 ( 3.694 -14.113 -4.014) 15.130 20.635 ( 23.687 5.432 34.848) 42.485 21.122 ( -6.739 2.468 -0.825) 7.224 22.657 ( 4.269 9.275 -16.211) 19.158 22.919 ( 11.617 2.539 4.550) 12.732 23.522 ( 3.521 17.532 -20.009) 26.835 24.068 ( -5.389 3.406 0.316) 6.383 24.243 ( 0.686 0.531 2.182) 2.348 24.351 ( 3.854 0.508 2.753) 4.764 24.714 ( 4.595 -7.553 -0.942) 8.891 24.974 ( -12.837 -16.890 8.970) 23.033 25.600 ( -2.550 6.006 1.226) 6.640 25.848 ( 5.578 -2.713 -1.190) 6.316 26.588 ( -16.231 2.415 5.607) 17.341 27.336 ( 9.115 -2.292 -3.773) 10.128 28.829 ( -1.257 3.137 -0.223) 3.387 30.811 ( 0.593 -1.830 0.071) 1.925 31.966 ( 0.165 5.601 -0.832) 5.665 32.149 ( -1.713 -5.421 1.145) 5.800 33.147 ( 0.155 2.227 -0.136) 2.236 33.157 ( 0.892 -0.223 0.003) 0.920 33.193 ( 4.718 2.300 -1.184) 5.381 33.881 ( -0.911 0.025 1.218) 1.521 34.214 ( -2.416 0.175 -2.452) 3.447 34.300 ( 0.947 -1.395 1.636) 2.349 ======================= Grid point 176 (69/146) ======================= q-point: (-0.18 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.154 ( -51.846 2.645 20.697) 55.887 9.131 ( -76.492 5.233 6.314) 76.930 9.437 ( 17.843 -25.033 -10.957) 32.636 10.068 ( 12.802 14.958 9.159) 21.715 12.377 ( 33.048 -46.307 -11.456) 58.032 12.940 ( 19.507 37.070 9.477) 42.948 14.052 ( 9.529 36.179 -22.241) 43.524 14.732 ( -71.864 -2.816 4.374) 72.052 15.094 ( -17.673 -15.432 11.017) 25.920 16.637 ( 27.866 6.204 1.556) 28.591 17.429 ( -20.160 -8.097 10.726) 24.229 17.946 ( 33.365 -3.623 -4.728) 33.892 18.686 ( -3.713 2.490 -7.060) 8.356 18.788 ( 9.691 -27.627 -6.500) 29.991 19.083 ( -12.252 -17.910 -15.108) 26.441 19.576 ( -8.792 8.457 -1.424) 12.282 20.066 ( 7.687 2.540 2.888) 8.596 20.150 ( 15.225 9.555 -1.384) 18.028 21.141 ( 7.087 5.627 -1.523) 9.177 21.372 ( 20.421 7.772 30.968) 37.901 22.724 ( 6.804 6.237 -11.432) 14.693 23.161 ( 8.495 3.337 6.107) 10.982 23.664 ( 7.378 22.353 -16.852) 28.950 23.961 ( -5.568 -3.387 0.812) 6.567 24.185 ( -0.088 -8.069 1.679) 8.242 24.485 ( 5.105 -11.319 -1.950) 12.570 24.653 ( -8.790 -12.320 3.060) 15.440 24.729 ( 1.709 3.178 0.467) 3.639 25.661 ( -0.836 6.362 -0.524) 6.439 25.822 ( -4.044 1.853 -0.516) 4.478 26.452 ( -6.985 -1.769 10.141) 12.441 27.409 ( 5.062 -1.321 -4.896) 7.165 28.753 ( -9.469 0.452 -0.134) 9.480 30.831 ( 2.831 -0.053 0.097) 2.834 32.034 ( 0.541 7.437 -0.038) 7.457 32.059 ( -1.930 -7.568 0.444) 7.822 33.105 ( -4.539 -0.674 -0.077) 4.590 33.188 ( 2.083 -0.854 -0.273) 2.268 33.269 ( 3.052 2.038 -2.732) 4.575 33.842 ( -1.785 -3.482 -1.468) 4.179 34.156 ( -4.062 3.377 0.671) 5.325 34.349 ( 3.138 -0.065 1.043) 3.307 ======================= Grid point 177 (70/146) ======================= q-point: (-0.09 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.546 ( -50.160 9.882 35.543) 62.266 7.918 ( -80.448 8.393 18.747) 83.029 9.456 ( 15.920 -19.047 -11.618) 27.408 10.495 ( 12.442 7.713 7.563) 16.477 12.297 ( -10.264 -15.185 -3.844) 18.727 13.004 ( -35.516 -15.196 0.784) 38.639 13.871 ( 0.276 22.097 -5.515) 22.777 14.301 ( -2.429 33.572 -17.397) 37.889 15.232 ( 16.271 -0.987 3.083) 16.590 17.018 ( 8.822 -1.042 -4.965) 10.177 17.145 ( -16.188 -4.024 20.291) 26.267 17.963 ( 0.926 -22.250 -7.777) 23.589 18.381 ( -10.322 -25.886 -4.923) 28.299 18.710 ( 16.675 -25.595 -13.319) 33.325 19.173 ( 24.628 21.239 -9.244) 33.810 19.528 ( -10.098 11.967 4.558) 16.308 19.990 ( -7.714 -0.110 9.052) 11.894 20.688 ( 19.314 14.368 -0.994) 24.093 21.447 ( 21.969 6.773 0.392) 22.993 21.857 ( 13.912 0.901 10.170) 17.257 22.820 ( 7.011 1.280 -6.580) 9.700 23.356 ( 6.977 1.510 4.551) 8.466 23.848 ( 1.530 -9.388 -3.233) 10.046 23.985 ( 11.783 20.590 -1.146) 23.750 24.109 ( -0.963 -8.656 1.672) 8.868 24.255 ( -3.082 -12.169 -9.524) 15.757 24.533 ( 0.791 -10.700 2.448) 11.005 24.826 ( -0.949 9.682 -0.441) 9.738 25.533 ( -13.737 -0.153 0.467) 13.746 25.925 ( 6.308 9.551 -0.422) 11.454 26.442 ( 0.063 -5.542 11.753) 12.994 27.404 ( 0.115 -0.722 -5.323) 5.373 28.528 ( -17.180 0.699 0.056) 17.195 30.907 ( 4.733 2.101 0.142) 5.180 31.945 ( -1.907 -8.897 -0.094) 9.100 32.125 ( 1.056 7.102 1.110) 7.266 32.991 ( -8.016 -0.347 -0.096) 8.024 33.188 ( 0.159 -1.582 -2.644) 3.085 33.284 ( -0.251 1.970 -5.752) 6.085 33.754 ( -1.717 -4.039 -1.774) 4.734 34.151 ( -3.145 4.777 2.143) 6.108 34.410 ( 3.071 -0.146 1.421) 3.386 ======================= Grid point 183 (71/146) ======================= q-point: ( 0.45 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.086 ( -0.000 18.620 23.467) 29.957 8.453 ( -0.000 50.638 32.402) 60.118 9.553 ( 0.000 -20.266 -13.949) 24.603 11.288 ( 0.000 -11.974 -17.684) 21.356 11.629 ( -0.000 3.483 -0.471) 3.514 12.126 ( 0.000 -25.471 -19.067) 31.817 12.858 ( -0.000 96.496 9.741) 96.987 15.061 ( -0.000 6.907 -7.240) 10.006 15.531 ( 0.000 -6.627 10.026) 12.018 15.932 ( -0.000 26.363 -7.965) 27.540 16.993 ( 0.000 -5.056 -14.351) 15.216 17.317 ( 0.000 -29.780 11.970) 32.095 18.379 ( 0.000 -5.856 8.866) 10.626 19.292 ( 0.000 -2.025 20.930) 21.027 20.125 ( -0.000 4.472 13.905) 14.606 20.193 ( 0.000 -12.465 4.363) 13.207 20.312 ( 0.000 -1.047 -4.071) 4.204 20.692 ( 0.000 -27.075 -2.476) 27.188 21.792 ( 0.000 -12.849 8.826) 15.588 21.904 ( 0.000 -14.131 -6.856) 15.706 21.985 ( 0.000 -11.482 -7.214) 13.561 22.472 ( -0.000 7.608 -23.814) 25.000 23.390 ( -0.000 10.021 -17.613) 20.264 23.701 ( -0.000 3.867 -10.201) 10.910 24.154 ( 0.000 -2.846 2.049) 3.507 24.497 ( 0.000 -2.998 0.430) 3.028 24.735 ( 0.000 -2.562 -3.348) 4.216 25.000 ( 0.000 -5.788 6.208) 8.488 25.714 ( 0.000 -14.569 15.507) 21.277 25.949 ( -0.000 4.627 3.612) 5.870 26.669 ( -0.000 4.072 0.377) 4.089 27.404 ( -0.000 4.975 -0.994) 5.073 28.339 ( -0.000 13.452 -0.393) 13.458 30.993 ( 0.000 -2.779 -0.217) 2.788 31.858 ( 0.000 -4.243 -0.568) 4.281 32.257 ( 0.000 0.660 2.964) 3.037 32.810 ( -0.000 6.385 -3.147) 7.118 32.988 ( -0.000 8.102 -1.490) 8.238 33.101 ( -0.000 9.968 -1.918) 10.151 33.940 ( 0.000 -0.657 0.643) 0.919 33.999 ( 0.000 0.415 2.623) 2.656 34.535 ( 0.000 -4.879 1.141) 5.011 ======================= Grid point 184 (72/146) ======================= q-point: ( 0.55 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.423 ( 4.071 16.325 11.705) 20.496 9.068 ( -5.876 11.531 8.805) 15.653 9.407 ( 13.679 8.120 4.133) 16.436 10.947 ( -7.059 -10.109 -0.265) 12.332 11.594 ( 4.534 -21.888 -15.434) 27.163 12.096 ( 24.366 4.772 -16.087) 29.585 13.849 ( -2.584 80.655 7.127) 81.010 14.556 ( -48.415 9.245 -5.123) 49.556 15.250 ( -8.529 0.036 -1.619) 8.681 16.691 ( 29.156 7.122 -1.278) 30.040 17.001 ( 22.260 -2.605 -6.077) 23.221 17.251 ( 15.462 -26.795 20.110) 36.898 18.452 ( 7.494 -8.027 8.935) 14.157 19.337 ( 1.857 -9.674 12.367) 15.810 20.002 ( -5.654 -17.241 -0.301) 18.147 20.074 ( -0.593 -23.696 -7.926) 24.994 20.197 ( -2.934 -2.801 2.965) 5.024 20.571 ( -15.041 15.916 5.461) 22.569 21.270 ( -52.606 -12.855 5.037) 54.387 21.626 ( -6.090 -14.263 -3.692) 15.942 22.030 ( 18.708 -3.658 -1.029) 19.090 22.516 ( 6.074 13.079 -20.619) 25.161 23.394 ( 2.370 11.337 -16.301) 19.996 23.707 ( 3.008 8.124 -4.485) 9.755 24.147 ( 0.347 -2.464 2.279) 3.374 24.502 ( 3.088 -3.077 0.018) 4.360 24.786 ( 3.743 2.104 -2.427) 4.932 25.053 ( 11.182 -8.087 5.237) 14.760 25.605 ( -7.926 -14.232 13.870) 21.395 25.945 ( -6.504 2.318 1.743) 7.121 26.778 ( 8.859 2.133 -1.884) 9.305 27.358 ( -9.222 2.831 -0.154) 9.648 28.506 ( 5.975 9.492 -0.101) 11.216 30.941 ( -3.041 -1.975 0.105) 3.628 31.846 ( 3.112 -2.586 -1.051) 4.180 32.263 ( -1.601 -0.398 2.226) 2.770 32.883 ( 3.751 4.792 -1.262) 6.215 33.059 ( 1.447 5.967 -1.531) 6.328 33.163 ( -1.653 6.968 -0.620) 7.188 33.919 ( -1.453 -0.062 0.985) 1.756 34.055 ( 3.452 -0.389 1.347) 3.726 34.480 ( -1.766 -4.200 0.283) 4.565 ======================= Grid point 185 (73/146) ======================= q-point: (-0.36 -0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.692 ( 8.725 7.178 -3.975) 11.977 8.863 ( -9.246 -9.608 -0.564) 13.346 9.720 ( -5.098 5.290 8.497) 11.232 11.118 ( 25.443 -0.316 1.288) 25.478 11.360 ( 10.027 -12.448 -6.293) 17.178 12.561 ( 26.008 16.613 -13.998) 33.887 13.286 ( -66.963 -0.752 2.647) 67.020 14.966 ( 6.144 54.243 7.491) 55.102 15.156 ( 1.842 13.801 -5.679) 15.037 16.651 ( 9.152 -38.275 6.203) 39.840 17.486 ( 22.954 -19.511 7.711) 31.097 17.808 ( 40.551 19.152 -7.883) 45.534 18.576 ( 8.592 -5.720 10.175) 14.494 19.354 ( 1.044 -23.690 -10.903) 26.099 19.655 ( -18.017 6.250 11.534) 22.287 19.830 ( -13.013 -17.823 0.304) 22.071 20.055 ( -6.331 -6.195 -3.975) 9.709 20.139 ( -51.128 -7.206 -2.408) 51.689 20.560 ( -9.747 8.813 16.005) 20.708 21.405 ( -7.504 -3.473 1.446) 8.394 22.343 ( 17.781 -0.402 -6.398) 18.902 22.605 ( 4.224 16.520 -9.415) 19.478 23.419 ( 2.048 12.029 -17.550) 21.375 23.893 ( 9.163 8.206 0.473) 12.310 24.151 ( 0.597 -1.777 2.598) 3.204 24.526 ( 3.541 -2.453 -2.098) 4.791 24.735 ( -10.350 1.049 2.591) 10.720 25.304 ( 15.818 -6.696 -0.531) 17.185 25.410 ( -4.652 -14.104 12.540) 19.438 25.829 ( -9.025 1.084 1.155) 9.163 26.950 ( 12.175 -0.170 -4.733) 13.064 27.171 ( -15.378 2.253 2.050) 15.676 28.694 ( 7.141 4.731 0.147) 8.567 30.868 ( -3.499 -1.270 0.160) 3.726 31.889 ( 4.091 0.136 -1.160) 4.254 32.231 ( -2.607 -1.875 1.488) 3.540 32.999 ( 5.280 3.446 0.127) 6.306 33.125 ( 1.733 3.371 -0.857) 3.886 33.174 ( -2.205 2.968 -0.011) 3.697 33.909 ( -0.728 -0.359 1.176) 1.429 34.120 ( 4.112 -0.425 0.012) 4.134 34.403 ( -3.245 -2.508 -0.237) 4.108 ======================= Grid point 186 (74/146) ======================= q-point: (-0.27 -0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.605 ( -25.244 2.371 11.801) 27.967 8.712 ( 13.620 -19.525 -21.514) 32.087 9.740 ( -2.790 13.782 7.872) 16.115 11.103 ( 35.507 -54.535 -21.082) 68.405 11.925 ( -67.418 10.864 5.976) 68.549 12.124 ( 17.276 32.156 15.426) 39.629 13.288 ( 31.183 22.309 -9.182) 39.426 14.968 ( -7.860 -5.968 8.459) 12.998 15.824 ( 17.394 23.467 3.296) 29.396 16.654 ( 29.953 -23.926 1.438) 38.362 17.627 ( 8.938 -11.800 -5.614) 15.832 18.071 ( -43.317 0.188 -4.935) 43.597 18.691 ( -24.296 -17.181 -3.418) 29.953 18.752 ( 1.382 -9.142 0.349) 9.252 19.153 ( 8.249 2.147 -1.540) 8.662 19.675 ( -8.599 1.906 -10.416) 13.640 19.840 ( 5.562 -5.716 -5.087) 9.460 19.977 ( -7.719 4.110 10.520) 13.680 20.756 ( 8.628 5.606 23.614) 25.758 21.341 ( -8.499 10.143 10.350) 16.800 22.472 ( 9.200 5.647 -17.949) 20.945 22.879 ( 8.487 12.248 7.370) 16.624 23.456 ( 3.938 13.964 -19.080) 23.970 24.084 ( 5.209 -0.924 -0.022) 5.290 24.199 ( 5.347 -0.954 3.393) 6.404 24.461 ( -13.034 -0.499 -0.514) 13.054 24.624 ( 1.268 -0.527 1.852) 2.305 25.070 ( -12.725 -17.257 3.552) 21.734 25.638 ( 14.847 -0.947 0.339) 14.881 25.725 ( -4.923 0.964 2.935) 5.812 26.898 ( -12.423 -4.291 0.051) 13.143 27.143 ( 6.904 4.622 -1.662) 8.473 28.820 ( 4.215 0.248 0.131) 4.225 30.813 ( -1.849 -0.225 0.005) 1.863 31.965 ( 3.785 2.668 -0.486) 4.656 32.160 ( -3.550 -3.450 0.466) 4.972 33.119 ( 4.717 2.557 0.420) 5.382 33.153 ( -0.594 -0.289 0.100) 0.668 33.170 ( 0.596 1.068 0.146) 1.232 33.890 ( -1.036 -2.546 0.557) 2.804 34.185 ( 3.821 0.416 -0.944) 3.958 34.332 ( -3.328 0.161 0.274) 3.343 ======================= Grid point 187 (75/146) ======================= q-point: (-0.18 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.158 ( -42.624 7.644 17.340) 46.647 8.642 ( 24.277 -26.708 -20.455) 41.486 9.999 ( 5.265 18.755 3.695) 19.827 10.596 ( -53.613 -24.378 3.830) 59.020 11.226 ( 21.181 -25.827 -9.357) 34.688 13.017 ( 22.689 36.273 8.560) 43.632 13.989 ( 26.145 30.340 -6.810) 40.626 14.860 ( -3.003 -8.100 8.440) 12.077 16.159 ( 27.871 -28.570 9.126) 40.943 16.531 ( -82.942 -9.789 -3.958) 83.611 17.142 ( 15.942 2.762 -4.980) 16.929 17.783 ( 4.936 9.958 1.841) 11.266 18.237 ( -1.366 -19.912 -15.230) 25.106 18.706 ( -2.827 -12.064 -1.593) 12.493 19.040 ( -8.565 -18.624 -4.832) 21.061 19.704 ( 1.647 7.109 -2.619) 7.753 19.957 ( 0.762 -2.807 3.693) 4.701 20.127 ( 17.105 32.867 0.906) 37.063 21.060 ( 5.357 2.467 3.618) 6.920 21.541 ( 2.879 13.407 22.678) 26.501 22.573 ( 7.804 7.075 -10.007) 14.529 23.171 ( 5.559 9.169 9.264) 14.170 23.571 ( 8.944 17.313 -17.949) 26.493 24.080 ( -3.585 -3.064 0.391) 4.732 24.178 ( -11.469 -9.216 3.144) 15.046 24.254 ( 3.952 -10.603 -1.145) 11.373 24.700 ( -11.118 -15.092 -0.244) 18.747 24.746 ( 4.939 8.902 0.056) 10.181 25.711 ( 0.200 -0.039 4.080) 4.085 25.822 ( 4.859 3.320 -2.067) 6.237 26.654 ( -11.505 -5.577 4.144) 13.440 27.276 ( 6.039 3.243 -3.465) 7.680 28.835 ( -1.230 -2.421 0.053) 2.716 30.809 ( 0.766 1.549 -0.024) 1.728 32.030 ( -1.221 -5.263 1.628) 5.642 32.079 ( 0.209 4.138 -1.634) 4.454 33.134 ( -0.564 -1.662 -0.154) 1.762 33.164 ( -0.100 -0.402 0.025) 0.415 33.227 ( 3.252 1.976 0.230) 3.812 33.827 ( -2.124 -4.569 -0.608) 5.075 34.231 ( 0.427 2.381 -0.687) 2.514 34.317 ( 0.477 1.165 1.005) 1.611 ======================= Grid point 188 (76/146) ======================= q-point: (-0.09 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.674 ( -42.516 11.419 26.063) 51.159 8.703 ( 28.508 -23.381 -18.737) 41.358 9.403 ( -68.787 -1.427 15.726) 70.576 10.412 ( 15.424 9.602 1.511) 18.232 11.362 ( 34.277 -32.547 -11.382) 48.619 13.599 ( 5.143 19.987 0.391) 20.642 14.509 ( -8.944 32.785 -15.016) 37.153 14.872 ( -23.837 14.164 -1.952) 27.796 15.076 ( -40.113 0.169 14.188) 42.549 16.498 ( 40.716 -35.064 9.683) 54.599 17.224 ( 7.114 -15.772 2.653) 17.504 17.869 ( -9.815 -3.410 -6.149) 12.073 18.067 ( 5.254 -10.593 -11.973) 16.827 18.371 ( -13.095 -19.575 2.158) 23.650 18.844 ( 12.205 -3.350 -7.170) 14.546 19.804 ( -2.411 11.447 2.021) 11.872 20.063 ( 6.500 8.802 1.917) 11.109 20.732 ( 10.494 30.597 2.039) 32.411 21.175 ( 10.720 -0.552 -0.431) 10.743 21.828 ( 4.849 5.718 6.689) 10.047 22.686 ( 4.657 1.883 -3.924) 6.375 23.367 ( 2.483 5.863 5.555) 8.450 23.747 ( -0.844 -1.363 -6.533) 6.727 23.955 ( 5.063 -0.727 1.485) 5.326 24.015 ( -1.183 -8.628 -1.300) 8.805 24.148 ( -1.255 -4.172 -2.248) 4.903 24.482 ( -2.097 -5.942 0.786) 6.350 24.909 ( 2.425 9.055 -0.032) 9.374 25.693 ( -6.244 -0.974 -2.167) 6.681 25.914 ( 4.373 5.975 1.198) 7.500 26.483 ( -4.517 -8.918 6.197) 11.762 27.354 ( 2.499 2.714 -2.871) 4.674 28.736 ( -7.618 -2.011 -0.018) 7.879 30.869 ( 3.199 3.572 0.072) 4.795 31.904 ( -3.478 -8.347 -0.031) 9.043 32.166 ( 2.159 5.545 0.422) 5.965 33.086 ( -3.732 -0.646 -0.109) 3.789 33.152 ( 0.183 -1.701 -1.034) 1.999 33.277 ( 0.569 2.203 -1.745) 2.867 33.737 ( -2.181 -4.232 -0.629) 4.802 34.247 ( -1.649 3.567 0.804) 4.011 34.364 ( 2.905 0.252 0.507) 2.959 ======================= Grid point 195 (77/146) ======================= q-point: (-0.45 -0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.470 ( 0.000 -3.361 -10.096) 10.641 9.102 ( 0.000 -2.062 3.932) 4.440 9.697 ( -0.000 19.643 22.084) 29.556 10.606 ( 0.000 -23.250 -11.602) 25.984 11.572 ( -0.000 -0.644 -14.027) 14.042 11.744 ( -0.000 9.952 -7.778) 12.631 14.703 ( -0.000 80.733 -0.041) 80.733 15.074 ( -0.000 5.394 -5.621) 7.791 15.459 ( 0.000 -7.636 6.404) 9.966 16.267 ( -0.000 15.572 -4.820) 16.301 16.675 ( 0.000 -69.113 13.058) 70.336 16.975 ( -0.000 7.541 6.776) 10.138 18.394 ( 0.000 -5.915 11.213) 12.678 19.168 ( 0.000 -13.346 -0.960) 13.380 19.911 ( 0.000 -10.092 -3.534) 10.693 20.008 ( 0.000 -4.100 10.979) 11.719 20.165 ( 0.000 -6.257 -8.986) 10.949 20.894 ( -0.000 9.162 1.224) 9.243 21.547 ( 0.000 -7.691 1.126) 7.773 21.692 ( 0.000 -13.829 -2.715) 14.093 21.871 ( -0.000 4.261 12.169) 12.893 22.418 ( -0.000 15.983 -18.436) 24.399 23.372 ( -0.000 12.882 -14.739) 19.575 23.719 ( -0.000 7.477 -1.964) 7.730 24.137 ( 0.000 -1.775 1.926) 2.619 24.464 ( 0.000 -1.678 0.973) 1.940 24.649 ( -0.000 -0.009 -2.469) 2.469 25.010 ( 0.000 -4.124 6.536) 7.728 25.625 ( 0.000 -14.217 9.913) 17.332 26.018 ( 0.000 -0.216 0.081) 0.231 26.684 ( -0.000 1.097 -5.557) 5.664 27.476 ( -0.000 2.081 1.728) 2.705 28.524 ( -0.000 5.287 0.269) 5.294 30.959 ( 0.000 -0.797 0.325) 0.860 31.786 ( 0.000 -1.552 -1.118) 1.913 32.284 ( 0.000 -1.129 1.243) 1.679 32.893 ( -0.000 3.931 1.059) 4.071 33.088 ( -0.000 4.272 -1.163) 4.427 33.231 ( -0.000 4.283 -0.430) 4.305 33.925 ( 0.000 -0.584 -0.961) 1.125 34.033 ( 0.000 -1.220 2.516) 2.797 34.461 ( 0.000 -2.691 -0.393) 2.719 ======================= Grid point 196 (78/146) ======================= q-point: (-0.36 -0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.256 ( 6.808 -22.612 -23.313) 33.183 9.160 ( -7.904 8.682 9.670) 15.211 9.705 ( 13.505 -34.511 -1.147) 37.077 10.620 ( -8.522 10.239 -4.428) 14.038 11.434 ( 6.858 17.368 -0.582) 18.682 12.151 ( 27.473 16.138 -5.114) 32.270 14.417 ( -59.240 -5.857 -0.676) 59.533 15.252 ( -6.862 4.866 -1.843) 8.611 15.497 ( 0.947 42.044 10.993) 43.468 16.041 ( 7.145 -56.809 -3.810) 57.384 16.933 ( 42.094 2.503 1.098) 42.183 17.279 ( 18.371 7.062 7.466) 21.050 18.498 ( 6.530 -1.727 13.431) 15.034 19.093 ( 0.219 -11.189 -2.570) 11.483 19.755 ( -4.124 -2.412 -8.373) 9.640 19.944 ( -5.437 -4.427 -10.801) 12.877 20.130 ( 0.782 5.311 14.416) 15.383 20.762 ( -12.812 -9.150 -1.337) 15.800 21.054 ( -46.528 -9.433 -4.534) 47.690 21.583 ( -4.183 10.599 10.682) 15.619 22.104 ( 8.993 6.407 4.719) 12.008 22.586 ( 10.002 16.870 -9.599) 21.835 23.399 ( -0.018 12.569 -13.922) 18.756 23.836 ( 4.732 6.121 0.955) 7.796 24.146 ( 0.728 -0.937 2.506) 2.773 24.460 ( 1.447 -0.097 -0.585) 1.564 24.822 ( 11.261 4.463 -0.347) 12.118 25.000 ( 3.098 -6.887 6.043) 9.672 25.475 ( -7.872 -14.217 6.424) 17.475 25.950 ( -5.249 -2.443 -1.087) 5.891 26.714 ( 8.230 -0.588 -8.191) 11.627 27.428 ( -8.924 1.538 3.406) 9.675 28.608 ( 5.602 0.253 0.579) 5.637 30.927 ( -3.450 0.073 0.406) 3.475 31.808 ( 4.050 0.555 -1.240) 4.272 32.259 ( -1.835 -2.119 0.592) 2.865 32.969 ( 2.992 2.750 2.946) 5.020 33.119 ( 1.049 1.461 -0.659) 1.916 33.236 ( -2.262 1.270 -0.001) 2.594 33.910 ( -0.121 -1.026 -0.742) 1.271 34.055 ( 2.613 -1.931 1.306) 3.502 34.426 ( -1.598 -0.475 -0.889) 1.889 ======================= Grid point 197 (79/146) ======================= q-point: (-0.27 -0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.970 ( 13.761 -30.493 -28.185) 43.744 9.067 ( -3.011 -14.441 7.303) 16.460 9.797 ( 23.706 -16.047 -3.968) 28.900 10.222 ( -22.404 -2.234 -12.912) 25.955 12.131 ( 26.430 36.605 10.959) 46.460 12.822 ( 25.860 20.831 -0.225) 33.208 13.290 ( -59.087 -6.395 5.467) 59.683 15.042 ( -1.344 -36.799 4.614) 37.111 15.382 ( 9.971 -45.516 2.669) 46.671 16.348 ( 10.629 47.053 -7.099) 48.758 17.426 ( 13.505 4.845 7.262) 16.081 17.808 ( 29.165 0.048 -4.199) 29.465 18.696 ( -3.825 -9.575 4.865) 11.401 18.845 ( 3.090 -13.413 3.412) 14.180 19.657 ( -10.877 -10.968 -12.830) 20.080 19.742 ( -4.214 3.763 -10.648) 12.054 19.868 ( -52.007 11.280 0.781) 53.223 20.308 ( -11.417 6.637 8.598) 15.758 20.750 ( 8.326 0.483 9.603) 12.719 21.693 ( -7.659 12.758 11.871) 19.035 22.301 ( 6.828 11.623 -6.538) 14.982 22.916 ( 10.294 15.748 5.420) 19.579 23.412 ( 0.491 12.261 -14.855) 19.267 23.959 ( 5.288 -0.794 0.230) 5.352 24.175 ( 0.701 -1.020 3.650) 3.854 24.521 ( 4.137 4.767 -2.115) 6.657 24.760 ( -12.533 -5.613 5.109) 14.652 25.115 ( -7.375 -12.315 -1.558) 14.438 25.362 ( 15.720 0.320 3.172) 16.040 25.819 ( -4.977 -3.813 0.664) 6.305 26.774 ( 7.349 -3.329 -10.570) 13.297 27.310 ( -9.755 3.068 5.887) 11.799 28.702 ( 6.970 -4.636 0.440) 8.382 30.866 ( -3.867 0.954 0.077) 3.984 31.903 ( 5.634 2.718 -0.653) 6.289 32.190 ( -3.426 -3.260 -0.082) 4.730 33.079 ( 4.050 1.828 3.551) 5.688 33.133 ( 1.241 -2.333 -0.257) 2.655 33.199 ( -2.450 0.038 0.776) 2.570 33.881 ( -0.940 -3.105 0.098) 3.246 34.105 ( 4.479 -0.924 -0.416) 4.592 34.390 ( -2.429 1.780 -0.879) 3.137 ======================= Grid point 198 (80/146) ======================= q-point: (-0.18 -0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.744 ( 22.736 -33.142 -29.966) 50.133 8.949 ( -13.587 -2.920 16.059) 21.237 9.631 ( 16.106 -49.288 -22.308) 56.448 10.185 ( 5.224 19.011 -0.381) 19.719 12.143 ( -64.919 5.542 9.513) 65.846 12.997 ( 25.126 32.489 5.393) 41.424 13.700 ( 34.670 18.911 8.866) 40.476 14.757 ( 23.766 -56.640 4.206) 61.568 15.208 ( 6.394 -24.732 -0.825) 25.559 16.759 ( 1.623 22.460 -10.521) 24.855 17.710 ( 11.852 -3.787 -5.468) 13.591 17.868 ( -23.946 10.307 -6.740) 26.927 18.465 ( -33.210 -4.501 8.323) 34.532 18.573 ( -13.482 -9.765 11.112) 20.015 18.945 ( -6.471 -16.777 -1.883) 18.079 19.641 ( 6.509 1.624 -5.926) 8.952 20.093 ( -0.917 11.052 0.935) 11.130 20.157 ( 3.950 19.157 -0.569) 19.568 21.067 ( 5.914 11.502 5.648) 14.113 21.754 ( -3.028 9.119 3.303) 10.160 22.516 ( 5.534 13.011 1.897) 14.265 23.245 ( 4.764 10.303 6.477) 13.069 23.490 ( 6.565 16.556 -9.720) 20.290 23.992 ( 2.542 -4.672 -1.840) 5.628 24.185 ( -0.729 -2.317 1.860) 3.059 24.406 ( -18.234 -10.388 4.009) 21.365 24.699 ( 3.596 1.831 -1.781) 4.411 24.763 ( -9.171 -8.237 -2.094) 12.503 25.654 ( 8.831 -0.093 0.125) 8.832 25.774 ( 3.126 0.901 3.410) 4.713 26.693 ( -2.412 -6.167 -9.305) 11.421 27.288 ( -2.129 4.379 4.687) 6.759 28.749 ( 5.381 -7.774 0.202) 9.457 30.834 ( -1.488 2.535 -0.164) 2.944 32.014 ( 2.056 0.161 1.540) 2.574 32.091 ( -1.906 -0.968 -2.142) 3.027 33.105 ( 0.877 -4.192 -0.151) 4.285 33.171 ( -0.933 -0.179 1.417) 1.706 33.198 ( 3.349 1.017 3.060) 4.649 33.818 ( -2.143 -4.459 0.397) 4.963 34.176 ( 4.880 0.091 -1.116) 5.007 34.369 ( -2.206 2.967 -0.527) 3.735 ======================= Grid point 207 (81/146) ======================= q-point: (-0.36 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.741 ( 0.000 -30.999 -29.443) 42.754 8.860 ( 0.000 -65.972 -17.874) 68.350 9.492 ( -0.000 20.302 8.292) 21.930 11.246 ( -0.000 -1.991 -21.441) 21.533 11.256 ( -0.000 42.652 23.600) 48.746 12.087 ( -0.000 23.907 4.137) 24.262 14.512 ( 0.000 -82.301 -7.441) 82.637 15.333 ( 0.000 -18.446 -3.698) 18.813 15.454 ( 0.000 -3.351 1.608) 3.716 16.291 ( -0.000 62.422 6.684) 62.778 16.337 ( 0.000 -4.672 -1.212) 4.827 17.408 ( -0.000 12.863 23.051) 26.397 18.527 ( 0.000 -3.020 16.769) 17.039 19.023 ( 0.000 -9.558 0.570) 9.575 19.632 ( 0.000 -7.218 -22.785) 23.901 19.865 ( -0.000 -0.043 -9.285) 9.285 20.320 ( -0.000 16.953 13.476) 21.656 20.661 ( 0.000 -18.226 -8.890) 20.279 21.334 ( 0.000 -8.306 -10.789) 13.616 21.856 ( -0.000 16.279 12.792) 20.704 22.258 ( -0.000 9.243 18.694) 20.854 22.533 ( -0.000 21.017 -12.819) 24.618 23.454 ( -0.000 14.086 -10.189) 17.385 23.893 ( -0.000 7.648 3.233) 8.303 24.147 ( 0.000 0.029 1.830) 1.830 24.455 ( 0.000 -0.553 0.696) 0.889 24.704 ( -0.000 6.977 1.484) 7.133 24.999 ( 0.000 -8.664 7.524) 11.475 25.458 ( 0.000 -11.072 2.118) 11.272 25.930 ( 0.000 -5.894 -4.897) 7.663 26.571 ( -0.000 -0.131 -9.107) 9.108 27.534 ( 0.000 -0.504 3.529) 3.565 28.540 ( 0.000 -4.929 0.861) 5.004 30.972 ( -0.000 1.219 0.787) 1.451 31.769 ( -0.000 1.964 -1.758) 2.636 32.254 ( 0.000 -2.726 0.081) 2.727 32.997 ( -0.000 1.596 5.560) 5.784 33.104 ( 0.000 -2.055 -0.625) 2.148 33.265 ( 0.000 -0.217 0.967) 0.991 33.891 ( -0.000 -0.306 -2.394) 2.414 34.016 ( 0.000 -3.888 1.978) 4.362 34.435 ( -0.000 1.327 -1.445) 1.962 ======================= Grid point 208 (82/146) ======================= q-point: (-0.27 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.220 ( 7.401 -37.932 -35.440) 52.437 8.223 ( 20.571 -68.137 -19.097) 73.692 9.750 ( 0.404 17.618 5.227) 18.381 10.744 ( -30.288 9.095 -10.327) 33.268 12.145 ( 23.633 37.944 15.759) 47.399 12.582 ( 23.224 23.857 8.461) 34.353 13.500 ( 2.015 -95.861 -9.816) 96.383 14.710 ( -42.047 -16.441 -0.555) 45.151 15.393 ( -6.521 2.420 5.361) 8.782 16.593 ( 18.637 8.741 -0.252) 20.587 17.036 ( 16.917 28.022 1.850) 32.784 17.790 ( 7.478 19.795 23.326) 31.494 18.679 ( 6.625 -7.649 18.594) 21.170 18.773 ( -12.571 -15.605 -4.074) 20.448 19.429 ( 5.654 -10.227 -18.996) 22.302 19.738 ( -5.539 -0.594 -15.079) 16.075 20.394 ( -2.344 -16.119 -7.824) 18.071 20.695 ( 5.130 26.223 10.782) 28.813 20.892 ( -34.334 8.860 -5.453) 35.876 22.007 ( -8.061 11.296 6.788) 15.448 22.421 ( -2.150 16.672 8.292) 18.743 22.894 ( 15.820 19.463 3.121) 25.275 23.481 ( -4.035 13.209 -9.369) 16.689 23.949 ( -1.898 3.330 2.275) 4.457 24.186 ( 1.129 0.141 3.661) 3.834 24.478 ( 3.086 2.580 -1.149) 4.184 24.890 ( -6.976 -11.344 7.019) 15.054 24.975 ( 13.946 3.232 1.763) 14.424 25.299 ( -5.864 -3.901 -0.713) 7.080 25.799 ( -1.167 -8.157 -5.643) 9.987 26.562 ( 5.816 -0.171 -9.396) 11.051 27.494 ( -5.857 -1.336 4.396) 7.444 28.521 ( 5.481 -10.182 0.514) 11.575 30.955 ( -4.098 2.003 0.537) 4.593 31.830 ( 5.172 3.686 -1.628) 6.557 32.205 ( -2.239 -3.502 -0.098) 4.158 33.062 ( 1.185 -3.915 0.213) 4.096 33.082 ( 2.170 -1.438 5.996) 6.537 33.249 ( -2.347 -0.883 2.361) 3.444 33.865 ( -0.558 -1.688 -1.296) 2.200 34.017 ( 3.313 -2.858 0.249) 4.382 34.432 ( -1.118 2.507 -1.689) 3.223 ======================= Grid point 209 (83/146) ======================= q-point: (-0.18 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.770 ( 19.144 -41.044 -38.461) 59.417 7.947 ( 39.658 -66.788 -18.151) 79.768 9.770 ( -16.624 0.678 4.380) 17.205 10.436 ( -13.124 23.155 -6.651) 27.435 12.634 ( 14.477 -61.907 -9.697) 64.313 13.028 ( 11.532 25.034 11.084) 29.707 13.395 ( 30.509 20.146 19.066) 41.233 13.874 ( -25.877 -22.728 1.398) 34.469 15.321 ( -9.280 2.106 5.707) 11.097 16.908 ( 10.346 2.190 1.947) 10.753 17.306 ( 3.667 1.758 -12.544) 13.187 18.244 ( -10.409 4.936 10.157) 15.359 18.548 ( 7.853 18.032 10.898) 22.485 18.740 ( -0.987 -18.932 12.541) 22.730 19.237 ( -13.243 -13.557 -6.187) 19.937 19.448 ( 0.854 -6.297 -18.719) 19.769 20.177 ( -2.780 -10.652 -6.671) 12.872 20.499 ( -24.067 34.181 3.584) 41.957 21.174 ( 7.536 24.972 4.580) 26.483 21.947 ( -11.063 10.556 -2.938) 15.571 22.648 ( 1.388 15.060 8.636) 17.416 23.329 ( 2.886 12.771 6.380) 14.565 23.513 ( 6.360 18.816 -6.420) 20.874 23.953 ( -1.430 0.560 0.639) 1.664 24.212 ( -1.523 -1.045 4.151) 4.543 24.559 ( -6.257 -9.215 1.886) 11.297 24.633 ( -0.750 -4.341 0.070) 4.406 24.862 ( -12.641 -6.733 -4.135) 14.907 25.481 ( 11.513 3.179 -0.221) 11.946 25.723 ( 4.876 -1.897 0.835) 5.298 26.567 ( 2.519 -0.728 -11.002) 11.310 27.418 ( -4.965 -1.005 5.358) 7.374 28.522 ( 8.227 -14.068 0.049) 16.297 30.907 ( -3.840 3.131 -0.050) 4.955 31.970 ( 6.483 4.752 -0.586) 8.060 32.106 ( -4.385 -4.619 -0.646) 6.402 33.017 ( 2.153 -7.680 -0.643) 8.002 33.181 ( 2.999 -0.288 5.882) 6.609 33.217 ( -2.442 -0.712 4.110) 4.833 33.817 ( -1.789 -3.491 0.837) 4.011 34.072 ( 5.554 -0.815 -1.639) 5.847 34.422 ( -1.615 2.892 -1.621) 3.688 ======================= Grid point 219 (84/146) ======================= q-point: (-0.27 -0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.461 ( 0.000 -45.241 -41.985) 61.721 7.165 ( 0.000 -74.728 -22.344) 77.997 9.911 ( -0.000 5.723 0.373) 5.736 10.984 ( -0.000 7.449 -19.085) 20.487 12.284 ( 0.000 -104.458 -13.166) 105.285 12.490 ( -0.000 41.997 29.117) 51.103 12.717 ( -0.000 28.130 11.371) 30.341 15.125 ( 0.000 -3.738 -2.766) 4.650 15.565 ( 0.000 -0.722 9.705) 9.732 16.112 ( 0.000 -16.239 1.889) 16.348 17.500 ( -0.000 47.441 5.710) 47.784 18.010 ( -0.000 9.638 16.839) 19.402 18.687 ( 0.000 -10.193 19.785) 22.257 18.748 ( 0.000 -15.154 2.040) 15.291 19.096 ( 0.000 -8.529 -20.247) 21.970 19.669 ( 0.000 -4.649 -15.531) 16.212 20.091 ( 0.000 -23.240 -10.538) 25.517 20.971 ( -0.000 31.997 2.853) 32.124 21.328 ( -0.000 23.550 -4.550) 23.986 22.246 ( -0.000 10.242 4.668) 11.256 22.722 ( -0.000 10.017 17.330) 20.017 22.920 ( -0.000 29.463 -4.521) 29.808 23.610 ( -0.000 12.617 -3.845) 13.190 24.055 ( -0.000 4.066 1.773) 4.436 24.188 ( -0.000 1.234 1.959) 2.316 24.460 ( -0.000 0.891 -0.835) 1.221 24.838 ( 0.000 -15.928 6.848) 17.338 24.962 ( -0.000 6.004 6.657) 8.965 25.338 ( -0.000 3.382 -1.944) 3.901 25.636 ( 0.000 -10.439 -11.598) 15.604 26.455 ( -0.000 0.452 -6.556) 6.572 27.543 ( 0.000 -4.216 3.316) 5.364 28.347 ( 0.000 -15.543 0.052) 15.543 31.027 ( -0.000 2.956 0.950) 3.105 31.802 ( -0.000 4.249 -2.544) 4.953 32.192 ( 0.000 -3.474 0.227) 3.481 32.975 ( 0.000 -9.056 -1.192) 9.134 33.116 ( 0.000 -1.152 8.993) 9.066 33.286 ( 0.000 -1.727 5.179) 5.460 33.846 ( -0.000 0.074 -3.262) 3.262 33.955 ( 0.000 -4.429 1.316) 4.620 34.452 ( -0.000 2.749 -2.132) 3.479 ======================= Grid point 220 (85/146) ======================= q-point: (-0.18 -0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.748 ( 11.251 -50.106 -45.104) 68.349 6.511 ( 28.385 -74.544 -21.155) 82.523 9.713 ( 3.115 -44.886 -10.068) 46.107 10.869 ( -11.988 24.244 -12.277) 29.702 11.455 ( 10.748 -66.246 -5.025) 67.300 13.158 ( 12.596 38.971 4.782) 41.234 13.356 ( 20.832 26.716 35.326) 48.945 14.592 ( -45.214 -2.761 1.601) 45.327 15.536 ( -7.046 -0.247 11.392) 13.398 16.344 ( 29.268 -18.654 -0.494) 34.711 17.601 ( -19.955 11.866 -6.327) 24.063 18.311 ( 7.639 -8.786 4.549) 12.500 18.613 ( 1.861 12.846 -1.063) 13.024 18.782 ( 5.658 -12.748 15.870) 21.128 19.028 ( 11.740 -2.599 -9.470) 15.305 19.367 ( -16.904 -5.938 -2.342) 18.069 19.909 ( 7.271 -16.058 -8.697) 19.656 21.332 ( -2.138 30.988 -2.617) 31.172 21.365 ( -17.904 34.621 0.466) 38.979 22.275 ( -10.752 12.414 3.408) 16.773 22.868 ( -3.611 13.941 8.621) 16.784 23.392 ( 18.437 24.427 1.894) 30.663 23.616 ( -9.483 10.393 -3.613) 14.526 24.032 ( -3.810 2.358 0.402) 4.499 24.259 ( 1.087 0.246 5.747) 5.854 24.501 ( 4.398 0.803 -1.643) 4.763 24.647 ( -7.624 -17.383 3.344) 19.274 24.937 ( -7.573 -4.376 -3.947) 9.596 25.385 ( -0.956 -1.689 -5.566) 5.894 25.604 ( 11.376 7.710 2.962) 14.058 26.453 ( 3.288 1.049 -6.757) 7.588 27.486 ( -2.832 -5.576 3.325) 7.083 28.224 ( 6.220 -19.973 -0.659) 20.930 31.018 ( -4.703 3.644 0.421) 5.964 31.889 ( 6.631 4.752 -2.426) 8.511 32.133 ( -3.369 -3.853 0.664) 5.162 32.883 ( 1.954 -10.842 -0.883) 11.052 33.177 ( 1.612 -2.125 6.730) 7.239 33.296 ( -2.351 -1.668 9.001) 9.451 33.818 ( -0.787 -1.576 -0.375) 1.801 33.959 ( 4.232 -2.336 -1.074) 4.952 34.456 ( -0.799 2.635 -2.160) 3.499 ======================= Grid point 231 (86/146) ======================= q-point: (-0.18 -0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.779 ( 0.000 -57.021 -47.379) 74.136 5.325 ( 0.000 -80.668 -19.656) 83.028 8.659 ( 0.000 -113.110 -23.933) 115.614 10.984 ( -0.000 8.161 -6.124) 10.203 11.224 ( -0.000 7.896 -1.931) 8.129 13.438 ( -0.000 35.433 5.352) 35.835 13.786 ( -0.000 33.780 40.370) 52.639 15.027 ( 0.000 -2.214 -3.278) 3.956 15.715 ( 0.000 -2.774 16.260) 16.495 15.831 ( 0.000 -15.467 3.183) 15.791 17.864 ( 0.000 -11.388 -3.972) 12.061 17.976 ( 0.000 -9.210 -15.767) 18.260 18.513 ( 0.000 -14.481 -16.100) 21.654 18.648 ( 0.000 -20.460 -5.318) 21.140 18.906 ( -0.000 13.272 5.481) 14.359 19.563 ( 0.000 -4.558 -5.554) 7.185 19.815 ( -0.000 13.141 31.891) 34.493 21.537 ( -0.000 29.289 -9.149) 30.684 21.941 ( -0.000 36.731 -3.193) 36.870 22.501 ( -0.000 8.474 6.949) 10.959 23.153 ( -0.000 11.448 13.230) 17.496 23.383 ( -0.000 25.025 -8.444) 26.412 23.828 ( -0.000 9.928 1.266) 10.009 24.090 ( -0.000 1.735 -4.006) 4.366 24.265 ( -0.000 3.252 2.846) 4.322 24.443 ( -0.000 -0.366 -3.026) 3.048 24.552 ( 0.000 -17.215 4.159) 17.711 24.990 ( 0.000 -2.490 -4.377) 5.036 25.273 ( 0.000 -7.321 -10.032) 12.419 25.695 ( -0.000 19.744 11.502) 22.850 26.387 ( -0.000 0.045 -3.684) 3.684 27.458 ( 0.000 -8.404 1.851) 8.606 27.937 ( 0.000 -24.819 -1.833) 24.887 31.110 ( -0.000 4.238 0.701) 4.296 31.841 ( -0.000 3.613 -3.209) 4.832 32.142 ( 0.000 -2.527 1.416) 2.896 32.740 ( 0.000 -12.810 -0.843) 12.838 33.182 ( 0.000 -3.413 5.291) 6.296 33.388 ( 0.000 -2.453 14.859) 15.060 33.802 ( -0.000 0.495 -3.185) 3.223 33.891 ( 0.000 -3.933 1.322) 4.149 34.470 ( -0.000 2.322 -2.148) 3.163 ======================= Grid point 268 (87/146) ======================= q-point: ( 0.18 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.518 ( 0.000 -0.000 75.931) 75.931 3.518 ( 0.000 -0.000 75.931) 75.931 5.450 ( 0.000 -0.000 101.925) 101.925 10.894 ( -0.000 0.000 -7.475) 7.475 13.190 ( 0.000 -0.000 42.401) 42.401 13.602 ( -0.000 0.000 -60.463) 60.463 13.602 ( -0.000 0.000 -60.463) 60.463 14.038 ( -0.000 0.000 -38.968) 38.968 15.329 ( -0.000 -0.000 0.137) 0.137 15.329 ( 0.000 0.000 0.137) 0.137 18.126 ( 0.000 -0.000 20.733) 20.733 18.126 ( 0.000 -0.000 20.733) 20.733 18.348 ( 0.000 -0.000 38.326) 38.326 18.458 ( 0.000 -0.000 17.423) 17.423 18.458 ( 0.000 -0.000 17.423) 17.423 19.740 ( -0.000 0.000 -35.553) 35.553 19.740 ( -0.000 0.000 -35.553) 35.553 22.051 ( -0.000 0.000 -11.024) 11.024 22.944 ( -0.000 -0.000 2.817) 2.817 22.944 ( 0.000 -0.000 2.817) 2.817 23.404 ( -0.000 0.000 -11.655) 11.655 23.739 ( -0.000 0.000 -16.119) 16.119 24.264 ( 0.000 -0.000 3.920) 3.920 24.274 ( 0.000 -0.000 6.375) 6.375 24.274 ( 0.000 -0.000 6.375) 6.375 24.734 ( -0.000 -0.000 2.270) 2.270 24.734 ( 0.000 -0.000 2.270) 2.270 25.321 ( 0.000 -0.000 -1.033) 1.033 25.321 ( 0.000 0.000 -1.033) 1.033 26.256 ( 0.000 -0.000 0.969) 0.969 26.589 ( -0.000 0.000 8.906) 8.906 26.589 ( -0.000 0.000 8.906) 8.906 26.771 ( -0.000 0.000 -9.272) 9.272 31.330 ( -0.000 0.000 -0.323) 0.323 31.934 ( 0.000 -0.000 3.201) 3.201 31.934 ( 0.000 -0.000 3.201) 3.201 32.184 ( 0.000 -0.000 2.058) 2.058 32.184 ( 0.000 0.000 2.058) 2.058 32.843 ( -0.000 0.000 -9.072) 9.072 33.854 ( 0.000 -0.000 2.629) 2.629 33.854 ( 0.000 -0.000 2.629) 2.629 34.643 ( 0.000 -0.000 4.795) 4.795 ======================= Grid point 269 (88/146) ======================= q-point: ( 0.27 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.517 ( 32.451 18.736 67.923) 77.574 4.633 ( 47.546 27.451 61.949) 82.776 6.416 ( 23.376 13.496 84.543) 88.748 10.813 ( -2.595 -1.498 -6.924) 7.544 12.594 ( -28.412 -16.404 -23.671) 40.455 13.212 ( -1.063 -0.614 -60.433) 60.446 13.821 ( 13.709 7.915 14.554) 21.503 13.914 ( 12.646 7.301 -42.237) 44.690 15.077 ( -15.876 -9.166 4.417) 18.857 15.502 ( 9.304 5.372 1.607) 10.863 18.138 ( -7.283 -4.205 25.965) 27.292 18.311 ( 2.808 1.621 3.497) 4.768 18.422 ( -8.906 -5.142 29.398) 31.145 18.649 ( 3.099 1.789 -2.553) 4.395 18.847 ( 16.403 9.471 3.119) 19.196 19.326 ( -5.834 -3.368 3.903) 7.785 19.744 ( 9.361 5.405 -20.518) 23.191 21.887 ( -7.833 -4.523 -11.653) 14.751 22.861 ( -5.581 -3.222 1.134) 6.544 23.019 ( 3.590 2.073 -5.627) 6.989 23.268 ( -1.692 -0.977 -13.238) 13.381 23.585 ( -2.070 -1.195 -16.987) 17.155 24.011 ( -23.117 -13.346 -3.627) 26.938 24.281 ( -1.951 -1.127 3.765) 4.388 24.286 ( -8.445 -4.876 7.738) 12.449 24.572 ( -3.260 -1.882 -4.609) 5.951 24.888 ( -15.496 -8.946 -2.663) 18.090 24.977 ( 7.681 4.435 9.959) 13.336 25.472 ( -5.224 -3.016 9.677) 11.403 26.244 ( -3.939 -2.274 -0.759) 4.612 26.707 ( 19.917 11.499 5.286) 23.598 26.758 ( 3.471 2.004 -6.929) 8.005 26.915 ( 9.602 5.544 7.620) 13.453 31.282 ( -3.693 -2.132 -0.033) 4.264 31.915 ( -1.897 -1.095 2.702) 3.479 32.168 ( 13.283 7.669 -1.546) 15.415 32.242 ( 1.384 0.799 2.701) 3.139 32.285 ( 10.174 5.874 0.470) 11.757 32.804 ( 2.600 1.501 -9.708) 10.162 33.838 ( -1.930 -1.114 2.685) 3.489 33.927 ( 3.429 1.980 2.679) 4.781 34.663 ( -1.389 -0.802 4.700) 4.966 ======================= Grid point 270 (89/146) ======================= q-point: ( 0.36 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.871 ( 44.775 25.851 56.687) 76.723 6.125 ( 41.579 24.006 49.734) 69.127 7.775 ( 50.358 29.074 54.577) 79.749 10.673 ( -5.483 -3.166 -4.173) 7.583 11.872 ( -19.397 -11.199 -21.698) 31.184 12.763 ( -0.201 -0.116 -54.340) 54.340 13.716 ( -10.042 -5.798 -36.484) 38.282 14.170 ( 7.752 4.475 15.674) 18.049 14.898 ( 5.138 2.966 -2.269) 6.352 15.786 ( 11.444 6.607 10.117) 16.643 18.093 ( -10.608 -6.124 -28.263) 30.803 18.185 ( -6.620 -3.822 28.455) 29.464 18.433 ( -8.984 -5.187 28.314) 30.154 18.742 ( 8.331 4.810 10.280) 14.079 19.075 ( 12.777 7.377 -32.729) 35.900 19.562 ( 6.190 3.574 26.899) 27.833 19.896 ( 7.429 4.289 7.987) 11.722 21.542 ( -15.573 -8.991 -7.431) 19.457 22.734 ( -5.942 -3.430 1.406) 7.003 22.886 ( -10.939 -6.315 -5.803) 13.900 23.102 ( -26.780 -15.462 -9.689) 32.406 23.351 ( -2.458 -1.419 -21.874) 22.057 23.416 ( -1.596 -0.922 -15.956) 16.062 24.002 ( -15.931 -9.198 -3.575) 18.739 24.249 ( -2.658 -1.535 2.869) 4.201 24.548 ( 0.874 0.505 -0.259) 1.042 24.681 ( -3.346 -1.932 -0.781) 3.941 25.156 ( 2.510 1.449 5.700) 6.395 25.368 ( -11.481 -6.628 19.504) 23.583 26.156 ( -2.129 -1.229 -2.399) 3.435 26.780 ( 1.203 0.694 -3.692) 3.945 27.146 ( 6.549 3.781 6.787) 10.161 27.302 ( 27.012 15.596 2.045) 31.258 31.187 ( -4.307 -2.487 0.036) 4.974 31.884 ( -2.531 -1.461 2.101) 3.599 32.286 ( 0.715 0.413 2.689) 2.812 32.438 ( 11.936 6.891 -0.320) 13.786 32.572 ( 14.113 8.148 -4.415) 16.884 32.816 ( 4.752 2.743 -9.328) 10.822 33.809 ( -2.404 -1.388 2.858) 3.985 34.038 ( 4.681 2.703 1.876) 5.722 34.647 ( -2.875 -1.660 3.950) 5.160 ======================= Grid point 271 (90/146) ======================= q-point: ( 0.45 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.190 ( 26.224 15.140 36.385) 47.337 7.319 ( 48.627 28.075 46.602) 72.969 9.095 ( 23.536 13.589 17.652) 32.407 10.726 ( 18.178 10.495 12.851) 24.612 11.462 ( -0.215 -0.124 -16.613) 16.615 12.372 ( -7.625 -4.402 -38.282) 39.281 12.991 ( -23.557 -13.600 -33.969) 43.518 14.453 ( 11.074 6.394 6.991) 14.574 15.264 ( 28.812 16.634 -12.753) 35.629 16.097 ( 5.295 3.057 14.870) 16.077 17.750 ( -3.208 -1.852 -8.673) 9.431 18.243 ( -8.916 -5.147 32.482) 34.075 18.445 ( -7.000 -4.041 24.762) 26.048 18.986 ( -2.131 -1.231 14.236) 14.447 18.993 ( 6.565 3.790 -43.445) 44.101 19.702 ( -8.950 -5.167 11.943) 15.793 20.095 ( 2.482 1.433 9.905) 10.311 21.165 ( -12.154 -7.017 1.845) 14.155 22.173 ( -32.437 -18.727 -8.502) 38.408 22.619 ( -6.960 -4.018 3.641) 8.823 22.666 ( -7.295 -4.212 -9.534) 12.722 23.299 ( 1.284 0.741 -12.810) 12.896 23.304 ( 5.351 3.089 -25.372) 26.113 23.583 ( -14.386 -8.306 -12.709) 20.915 24.217 ( -2.027 -1.170 2.546) 3.458 24.565 ( 0.124 0.071 0.966) 0.977 24.665 ( 2.446 1.412 -2.084) 3.511 25.191 ( -0.451 -0.260 -0.091) 0.528 25.286 ( -10.405 -6.008 25.882) 28.535 26.115 ( 0.159 0.092 -2.776) 2.782 26.729 ( -4.512 -2.605 -1.424) 5.401 27.325 ( 5.237 3.024 5.926) 8.467 27.888 ( 23.369 13.492 0.508) 26.989 31.098 ( -3.428 -1.979 -0.165) 3.962 31.830 ( -3.355 -1.937 1.391) 4.116 32.314 ( 0.096 0.055 2.243) 2.246 32.696 ( 10.464 6.042 0.293) 12.087 32.819 ( 10.214 5.897 -3.763) 12.380 32.887 ( 7.589 4.381 -7.772) 11.713 33.775 ( -2.434 -1.405 3.094) 4.180 34.153 ( 4.441 2.564 0.696) 5.176 34.591 ( -4.267 -2.463 2.632) 5.586 ======================= Grid point 272 (91/146) ======================= q-point: ( 0.55 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.911 ( 20.431 11.796 15.109) 28.016 8.699 ( 43.873 25.330 37.197) 62.849 8.945 ( -28.653 -16.543 6.717) 33.761 10.983 ( -5.006 -2.890 0.054) 5.781 11.563 ( -43.320 -25.011 -13.009) 51.686 12.330 ( 68.623 39.620 6.991) 79.547 12.567 ( 11.829 6.830 -47.521) 49.445 14.805 ( 17.583 10.152 0.667) 20.314 15.893 ( 33.486 19.333 -13.897) 41.087 16.153 ( -5.528 -3.191 3.278) 7.175 17.919 ( 6.863 3.962 28.989) 30.052 18.227 ( -13.896 -8.023 30.586) 34.539 18.293 ( -61.353 -35.422 9.544) 71.485 18.506 ( -1.472 -0.850 18.805) 18.881 18.790 ( 1.154 0.666 -30.065) 30.094 19.736 ( 10.556 6.095 -1.205) 12.249 20.134 ( -0.514 -0.297 -3.732) 3.779 21.048 ( -5.298 -3.059 4.531) 7.613 21.599 ( -13.158 -7.597 -7.412) 16.905 22.371 ( -17.879 -10.323 -0.520) 20.652 22.506 ( -0.879 -0.507 -6.465) 6.544 23.202 ( 2.033 1.174 -20.261) 20.397 23.213 ( -2.902 -1.675 -18.829) 19.125 23.356 ( 5.454 3.149 -2.938) 6.950 24.184 ( -2.356 -1.360 1.925) 3.333 24.563 ( -1.103 -0.637 1.362) 1.865 24.753 ( 8.514 4.915 -8.204) 12.804 25.164 ( -0.939 -0.542 -1.727) 2.039 25.277 ( -8.460 -4.884 28.291) 29.930 26.120 ( 1.761 1.017 -1.870) 2.762 26.543 ( -11.061 -6.386 -1.870) 12.909 27.469 ( 3.879 2.239 4.750) 6.529 28.338 ( 15.990 9.232 -0.467) 18.470 31.033 ( -2.046 -1.181 -0.390) 2.395 31.759 ( -3.392 -1.958 0.817) 4.001 32.322 ( -0.637 -0.368 1.493) 1.664 32.894 ( 7.327 4.230 -1.054) 8.526 32.989 ( 6.971 4.025 -0.119) 8.050 33.037 ( 8.736 5.044 -5.287) 11.389 33.748 ( -1.988 -1.148 3.325) 4.041 34.243 ( 3.432 1.981 -0.500) 3.994 34.495 ( -5.392 -3.113 1.034) 6.311 ======================= Grid point 273 (92/146) ======================= q-point: (-0.36 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.849 ( -34.509 -19.924 -10.638) 41.244 8.764 ( 12.722 7.345 24.701) 28.739 9.427 ( -19.854 -11.463 15.593) 27.726 10.837 ( 6.649 3.839 3.523) 8.447 10.848 ( -5.032 -2.905 -2.295) 6.247 12.645 ( 22.810 13.169 -41.258) 48.949 13.873 ( 55.517 32.053 6.822) 64.467 15.209 ( 16.024 9.251 -2.563) 18.680 16.062 ( 2.200 1.270 -0.362) 2.566 16.444 ( 20.562 11.871 -12.751) 26.950 16.529 ( -85.856 -49.569 8.024) 99.463 18.085 ( -11.672 -6.739 14.700) 19.943 18.591 ( 17.833 10.296 39.876) 44.879 18.656 ( -3.606 -2.082 1.595) 4.459 18.676 ( 6.768 3.907 13.003) 15.171 19.943 ( 7.065 4.079 -4.315) 9.228 20.047 ( 0.373 0.215 -18.072) 18.077 20.854 ( -11.701 -6.756 -0.142) 13.512 21.439 ( 1.090 0.630 -2.448) 2.753 21.846 ( -22.741 -13.129 -9.374) 27.882 22.521 ( 4.883 2.819 -5.269) 7.717 23.075 ( 2.188 1.263 -16.760) 16.949 23.174 ( 7.133 4.118 -11.069) 13.797 23.550 ( 9.384 5.418 3.837) 11.495 24.152 ( -1.144 -0.661 1.170) 1.765 24.537 ( -1.986 -1.146 1.372) 2.672 24.910 ( 12.401 7.160 -14.248) 20.200 25.133 ( -1.202 -0.694 0.025) 1.389 25.308 ( -7.277 -4.201 26.685) 27.977 26.166 ( 2.813 1.624 0.265) 3.258 26.200 ( -17.177 -9.917 -4.345) 20.305 27.567 ( 2.088 1.206 3.449) 4.208 28.584 ( 5.965 3.444 -0.999) 6.960 31.002 ( -0.441 -0.255 -0.503) 0.716 31.702 ( -1.819 -1.050 0.627) 2.192 32.306 ( -1.469 -0.848 0.601) 1.799 33.022 ( 4.263 2.461 -0.473) 4.945 33.129 ( 4.632 2.674 2.026) 5.719 33.179 ( 6.923 3.997 -4.006) 8.942 33.737 ( -1.218 -0.703 3.486) 3.759 34.295 ( 1.359 0.785 -2.899) 3.297 34.373 ( -4.970 -2.869 0.881) 5.806 ======================= Grid point 274 (93/146) ======================= q-point: (-0.27 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.809 ( -50.587 -29.206 3.034) 58.491 8.325 ( -64.638 -37.319 2.495) 74.679 9.357 ( 23.379 13.498 13.889) 30.359 10.728 ( -5.016 -2.896 -0.151) 5.794 11.651 ( 41.904 24.194 11.142) 49.653 12.951 ( 28.790 16.622 -35.242) 48.447 14.008 ( -75.300 -43.475 7.686) 87.288 15.233 ( -8.367 -4.831 -0.230) 9.665 15.417 ( 10.269 5.929 1.895) 12.009 16.524 ( -4.825 -2.786 -11.047) 12.372 16.574 ( 40.629 23.457 -0.193) 46.915 18.002 ( -4.607 -2.660 12.302) 13.403 18.617 ( -7.462 -4.308 19.505) 21.324 19.002 ( 13.709 7.915 4.251) 16.390 19.090 ( 0.804 0.464 16.481) 16.507 19.887 ( 0.421 0.243 -26.720) 26.725 19.977 ( -4.571 -2.639 9.822) 11.151 20.664 ( 0.262 0.151 -3.265) 3.279 21.344 ( -10.808 -6.240 -12.428) 17.613 21.632 ( 15.129 8.735 8.412) 19.389 22.621 ( 8.278 4.779 -6.640) 11.639 23.040 ( 4.807 2.775 -14.745) 15.755 23.356 ( 12.742 7.356 -4.789) 15.472 23.789 ( 7.551 4.359 7.034) 11.202 24.159 ( 1.108 0.640 1.019) 1.636 24.497 ( -2.126 -1.227 0.617) 2.531 25.049 ( 4.792 2.767 -10.499) 11.868 25.151 ( 7.213 4.165 -4.767) 9.597 25.331 ( -6.828 -3.942 22.113) 23.476 25.716 ( -21.274 -12.283 -7.069) 25.562 26.245 ( 2.998 1.731 2.852) 4.485 27.610 ( -0.230 -0.133 2.050) 2.067 28.585 ( -5.185 -2.994 -0.965) 6.064 31.006 ( 1.157 0.668 -0.539) 1.441 31.696 ( 0.853 0.493 0.959) 1.375 32.265 ( -2.205 -1.273 -0.246) 2.558 33.052 ( -2.084 -1.203 0.930) 2.580 33.224 ( 2.675 1.544 0.409) 3.116 33.303 ( 6.461 3.730 -2.680) 7.927 33.745 ( -0.392 -0.226 3.522) 3.551 34.188 ( -5.731 -3.309 -4.577) 8.046 34.367 ( 1.475 0.852 0.879) 1.917 ======================= Grid point 275 (94/146) ======================= q-point: (-0.18 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.705 ( -53.634 -30.966 21.451) 65.541 6.820 ( -70.244 -40.555 7.681) 81.473 9.832 ( -1.712 -0.988 7.346) 7.607 10.639 ( -1.810 -1.045 10.982) 11.179 12.080 ( -78.327 -45.222 4.310) 90.547 12.636 ( 39.195 22.629 3.716) 45.411 13.381 ( 30.977 17.884 -34.401) 49.627 15.100 ( -5.428 -3.134 0.266) 6.273 15.696 ( 8.955 5.170 -1.944) 10.521 16.200 ( -15.021 -8.672 -6.895) 18.665 17.552 ( 37.754 21.797 -0.001) 43.594 18.005 ( -5.026 -2.902 15.020) 16.103 18.587 ( -10.506 -6.065 26.519) 29.162 18.899 ( -11.149 -6.437 -8.432) 15.390 19.075 ( -9.266 -5.350 -11.625) 15.799 19.775 ( 9.295 5.366 -25.556) 27.718 19.814 ( -17.680 -10.207 14.420) 24.994 20.944 ( 21.055 12.156 4.700) 24.762 21.341 ( 17.914 10.343 -6.229) 21.603 22.172 ( 21.169 12.222 10.081) 26.441 22.846 ( 16.372 9.452 -0.365) 18.908 23.067 ( 6.826 3.941 -13.446) 15.586 23.614 ( 11.860 6.847 -3.184) 14.060 23.979 ( 4.243 2.450 7.885) 9.283 24.210 ( 2.705 1.561 0.023) 3.123 24.456 ( -1.469 -0.848 -0.035) 1.697 25.000 ( -6.312 -3.644 -4.807) 8.731 25.099 ( -16.314 -9.419 -4.982) 19.485 25.322 ( -6.623 -3.824 16.220) 17.932 25.424 ( 12.518 7.227 -11.724) 18.612 26.332 ( 2.005 1.158 4.273) 4.860 27.581 ( -3.294 -1.902 0.337) 3.819 28.349 ( -14.910 -8.608 -0.116) 17.217 31.044 ( 2.556 1.476 -0.584) 3.009 31.751 ( 2.867 1.655 1.833) 3.784 32.206 ( -2.570 -1.484 -0.916) 3.105 32.947 ( -7.622 -4.400 1.242) 8.888 33.246 ( -0.193 -0.111 -2.202) 2.213 33.412 ( 4.800 2.771 -4.826) 7.349 33.770 ( 0.217 0.126 3.411) 3.420 34.021 ( -5.618 -3.244 -4.590) 7.947 34.413 ( 1.907 1.101 1.169) 2.493 ======================= Grid point 280 (95/146) ======================= q-point: ( 0.27 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.802 ( -0.000 24.227 66.827) 71.083 5.261 ( -0.000 50.981 63.616) 81.523 7.047 ( -0.000 29.204 73.245) 78.853 10.771 ( -0.000 -1.360 -6.901) 7.034 12.501 ( -0.000 -8.797 -58.319) 58.978 12.536 ( 0.000 -19.119 -41.360) 45.566 13.549 ( -0.000 4.299 -35.103) 35.365 14.138 ( -0.000 19.631 31.157) 36.825 15.289 ( 0.000 -2.091 6.738) 7.055 15.343 ( 0.000 -4.068 0.465) 4.095 18.248 ( 0.000 -4.246 -8.433) 9.441 18.395 ( 0.000 -4.023 23.470) 23.812 18.514 ( 0.000 -12.448 -5.251) 13.510 18.557 ( -0.000 7.576 -17.499) 19.068 18.955 ( -0.000 8.860 34.893) 36.001 19.520 ( -0.000 1.386 -2.658) 2.997 19.538 ( -0.000 9.657 19.256) 21.542 21.872 ( -0.000 5.360 -17.518) 18.319 22.856 ( 0.000 -5.347 -10.149) 11.471 22.874 ( 0.000 -7.220 -2.387) 7.604 23.177 ( -0.000 -2.118 -13.369) 13.536 23.399 ( 0.000 -10.707 -17.616) 20.614 24.066 ( 0.000 -16.399 -0.816) 16.419 24.264 ( 0.000 -8.316 3.646) 9.080 24.341 ( 0.000 -17.149 -1.067) 17.182 24.523 ( -0.000 4.148 -1.177) 4.311 24.916 ( 0.000 -15.091 -2.504) 15.297 25.117 ( -0.000 14.740 12.790) 19.515 25.539 ( 0.000 -0.799 2.238) 2.376 26.323 ( -0.000 4.649 0.521) 4.678 26.390 ( 0.000 -18.811 10.999) 21.791 26.770 ( -0.000 13.731 -6.948) 15.389 27.119 ( -0.000 22.792 6.783) 23.780 31.277 ( 0.000 -4.863 0.115) 4.865 32.027 ( -0.000 2.452 2.092) 3.223 32.101 ( -0.000 13.327 0.121) 13.327 32.159 ( 0.000 -3.798 3.703) 5.304 32.371 ( -0.000 11.375 1.150) 11.433 32.734 ( -0.000 3.812 -10.143) 10.836 33.887 ( 0.000 0.416 2.817) 2.847 33.915 ( 0.000 0.580 2.785) 2.844 34.698 ( 0.000 -1.748 4.638) 4.957 ======================= Grid point 281 (96/146) ======================= q-point: ( 0.36 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.849 ( 32.422 28.770 57.236) 71.797 6.343 ( 17.211 40.844 54.008) 69.866 8.032 ( 16.883 48.005 52.208) 72.906 10.685 ( -2.281 -1.561 -6.006) 6.611 11.794 ( -13.988 -13.163 -36.449) 41.200 12.253 ( 9.938 -2.975 -54.050) 55.036 13.398 ( 5.831 -1.096 -30.956) 31.520 14.492 ( -6.480 15.248 25.698) 30.576 14.928 ( -17.068 -13.910 4.351) 22.444 15.709 ( 19.057 8.341 10.846) 23.460 17.922 ( -5.340 -11.067 -29.901) 32.327 18.422 ( 5.682 -6.037 -6.416) 10.483 18.453 ( 2.618 -4.114 7.631) 9.056 18.706 ( 5.541 2.752 9.935) 11.704 19.095 ( -16.151 8.902 23.004) 29.484 19.706 ( 7.781 6.424 21.867) 24.083 19.896 ( 7.984 9.593 17.884) 21.808 21.690 ( -12.490 5.811 -16.829) 21.748 22.669 ( -1.301 -14.415 -4.821) 15.255 22.813 ( 3.693 -9.551 -9.696) 14.102 23.052 ( -2.606 -5.599 -15.103) 16.317 23.110 ( -1.280 -16.841 -14.829) 22.475 23.676 ( -24.020 -7.054 -7.974) 26.273 23.950 ( -5.534 -29.357 -8.773) 31.135 24.276 ( -0.731 -3.209 2.074) 3.890 24.557 ( -2.111 3.944 1.052) 4.595 24.732 ( -3.411 -3.117 -1.988) 5.030 25.309 ( -4.473 12.275 8.367) 15.514 25.552 ( 0.931 -6.400 9.913) 11.836 26.100 ( -6.287 -11.586 4.568) 13.951 26.686 ( 15.612 -3.584 2.244) 16.175 26.919 ( 8.102 12.856 -1.305) 15.251 27.405 ( 3.192 23.723 4.246) 24.311 31.202 ( -2.462 -5.603 0.254) 6.125 31.986 ( -5.463 2.751 0.890) 6.181 32.211 ( 5.339 -3.723 4.105) 7.695 32.350 ( 9.508 12.209 -0.398) 15.479 32.515 ( 3.722 11.897 -0.601) 12.481 32.726 ( 2.177 5.690 -9.548) 11.326 33.868 ( -3.019 -0.265 2.988) 4.256 33.996 ( 4.351 1.340 2.114) 5.020 34.695 ( -1.640 -2.733 3.978) 5.098 ======================= Grid point 282 (97/146) ======================= q-point: ( 0.45 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.149 ( 37.766 28.184 41.289) 62.653 7.303 ( 20.003 23.202 43.451) 53.164 9.184 ( 17.259 43.537 25.832) 53.485 10.705 ( 9.586 14.893 4.204) 18.203 11.270 ( -5.332 -14.648 -22.705) 27.541 12.053 ( 7.868 10.244 -48.620) 50.307 13.092 ( -17.345 -6.632 -26.989) 32.760 14.399 ( -7.764 -14.099 10.666) 19.308 14.941 ( 13.035 7.964 1.885) 15.392 16.192 ( 11.225 13.425 13.163) 21.897 17.645 ( 3.861 -5.923 -8.141) 10.782 18.396 ( 15.775 -8.020 -31.807) 36.399 18.551 ( -1.436 -0.247 20.270) 20.322 18.803 ( -10.560 -4.786 25.464) 27.980 19.158 ( -3.799 13.685 15.396) 20.947 19.959 ( -6.627 1.971 16.360) 17.761 20.168 ( 1.376 4.068 11.280) 12.069 21.365 ( -16.744 0.498 -6.948) 18.136 22.319 ( -22.300 -38.088 -7.218) 44.723 22.509 ( -4.457 -20.683 -2.724) 21.332 22.673 ( -1.676 -6.865 -9.006) 11.447 23.051 ( 7.389 3.797 -24.663) 26.025 23.314 ( -8.448 8.874 -14.075) 18.661 23.487 ( -5.871 -23.919 -15.091) 28.885 24.245 ( -1.147 -2.343 2.174) 3.395 24.560 ( -2.263 1.238 0.851) 2.716 24.695 ( 0.242 1.897 -1.128) 2.220 25.332 ( -8.655 9.769 1.570) 13.146 25.571 ( -6.655 -4.851 22.002) 23.493 25.994 ( 4.005 -10.767 0.445) 11.496 26.776 ( -1.411 1.697 -1.401) 2.614 27.199 ( 12.916 -0.209 2.828) 13.224 27.787 ( 11.600 23.163 1.818) 25.969 31.105 ( -2.449 -5.508 0.208) 6.032 31.921 ( -5.326 1.646 0.468) 5.594 32.283 ( 3.478 -3.285 3.380) 5.857 32.621 ( 8.791 10.957 0.319) 14.051 32.712 ( 7.890 9.215 -2.524) 12.391 32.778 ( 4.342 6.831 -7.415) 10.977 33.835 ( -2.964 -0.573 3.190) 4.392 34.100 ( 4.726 1.497 0.868) 5.033 34.647 ( -3.307 -3.637 2.838) 5.677 ======================= Grid point 283 (98/146) ======================= q-point: ( 0.55 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.862 ( 12.787 13.760 15.170) 24.145 8.484 ( 38.078 22.343 36.358) 57.193 9.425 ( -19.755 8.073 11.814) 24.393 10.890 ( -1.305 -18.008 -7.982) 19.741 11.771 ( 46.264 44.237 11.857) 65.099 11.936 ( -8.773 12.829 -27.848) 31.892 12.366 ( -21.831 5.357 -31.065) 38.345 14.409 ( 21.561 -20.043 1.529) 29.478 15.284 ( 21.665 0.262 -6.412) 22.596 16.492 ( -1.749 27.022 -0.344) 27.080 17.881 ( 18.137 -2.850 23.881) 30.122 18.310 ( 12.235 -9.086 -33.027) 36.374 18.691 ( -5.099 3.818 23.968) 24.800 18.729 ( -13.498 -4.540 28.441) 31.807 19.147 ( -41.227 -6.845 17.287) 45.226 19.717 ( -8.512 3.624 -1.888) 9.442 20.161 ( -6.619 -4.743 1.525) 8.284 21.135 ( -4.775 -6.821 4.240) 9.344 21.593 ( -13.882 -21.352 -11.558) 27.968 22.249 ( -0.566 -29.992 -2.891) 30.137 22.490 ( -2.642 -7.169 -9.099) 11.881 22.983 ( 6.819 -3.954 -24.565) 25.799 23.154 ( -4.261 5.784 -20.474) 21.698 23.318 ( 3.592 10.508 -3.829) 11.746 24.221 ( -1.558 -1.590 1.798) 2.861 24.504 ( -2.551 -2.461 -0.370) 3.564 24.755 ( 3.016 5.670 -1.975) 6.719 25.260 ( -9.639 7.301 -0.227) 12.094 25.568 ( -8.116 -6.223 26.091) 28.024 26.007 ( 7.051 -6.390 -1.246) 9.597 26.677 ( -9.736 -0.032 -2.114) 9.963 27.384 ( 9.149 -2.672 2.145) 9.770 28.216 ( 13.165 17.256 0.247) 21.706 31.021 ( -1.212 -5.050 -0.052) 5.194 31.847 ( -5.435 1.545 0.211) 5.654 32.314 ( 1.245 -2.720 2.275) 3.759 32.835 ( 5.209 8.105 -1.390) 9.734 32.900 ( 9.213 6.281 -4.476) 12.015 32.920 ( 7.007 6.901 -0.500) 9.848 33.808 ( -2.643 -0.224 3.404) 4.316 34.190 ( 4.092 1.133 -0.550) 4.282 34.555 ( -4.750 -4.344 1.509) 6.612 ======================= Grid point 284 (99/146) ======================= q-point: ( 0.64 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.056 ( -11.320 -1.614 -5.043) 12.497 8.910 ( -3.662 -3.967 21.385) 22.056 9.801 ( 6.462 29.757 28.307) 41.575 10.673 ( 5.803 -22.358 -7.055) 24.152 11.092 ( -39.403 -7.108 -3.850) 40.223 12.254 ( 13.088 28.729 -38.455) 49.754 13.396 ( 53.978 48.787 11.665) 73.687 14.661 ( 32.390 -24.271 -4.955) 40.777 15.539 ( 22.602 -10.006 -7.614) 25.864 16.772 ( -5.228 43.243 -3.312) 43.683 17.646 ( -82.801 -37.297 7.999) 91.165 18.074 ( 2.911 -11.688 -14.276) 18.678 18.482 ( 12.192 -4.589 21.522) 25.157 18.751 ( -0.287 -0.206 16.242) 16.246 19.035 ( -3.430 20.987 34.947) 40.909 19.821 ( 3.124 3.337 -2.915) 5.422 19.957 ( -3.714 -6.828 -4.450) 8.956 21.039 ( -6.608 -3.270 0.888) 7.426 21.213 ( 1.417 -20.882 -7.875) 22.363 21.790 ( -6.232 -36.709 -8.965) 38.298 22.411 ( 4.549 2.389 -12.309) 13.338 22.948 ( 7.598 1.327 -11.822) 14.116 23.055 ( -1.453 11.820 -19.297) 22.676 23.542 ( 6.927 14.610 1.806) 16.269 24.182 ( -2.418 -1.004 1.314) 2.929 24.458 ( 2.170 -4.707 -1.275) 5.338 24.859 ( 3.046 9.607 -4.599) 11.078 25.165 ( -6.740 2.146 0.478) 7.089 25.555 ( -6.876 -8.555 23.266) 25.725 26.066 ( 5.590 -4.816 -0.039) 7.379 26.428 ( -16.122 0.129 -2.695) 16.346 27.502 ( 6.877 -3.118 0.914) 7.606 28.533 ( 7.413 10.715 -0.663) 13.046 30.967 ( 0.500 -4.475 -0.276) 4.512 31.780 ( -4.763 2.750 0.234) 5.504 32.308 ( -0.230 -2.781 1.183) 3.030 32.975 ( 4.916 5.860 -1.391) 7.775 33.068 ( 7.216 4.605 -3.285) 9.169 33.087 ( 5.554 3.864 1.378) 6.905 33.795 ( -2.146 0.730 3.565) 4.225 34.247 ( 2.615 0.557 -2.369) 3.572 34.431 ( -5.235 -4.511 0.879) 6.966 ======================= Grid point 285 (100/146) ======================= q-point: (-0.27 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.411 ( -43.180 -18.129 5.760) 47.184 9.153 ( -21.959 -4.783 9.904) 24.559 9.356 ( -31.443 3.102 10.425) 33.271 10.557 ( 9.757 -21.744 -2.927) 24.012 11.382 ( 31.249 31.866 11.337) 46.049 12.557 ( 16.686 32.903 -30.775) 48.043 14.393 ( 14.205 -11.676 3.240) 18.671 14.970 ( 27.664 -8.153 -0.035) 28.841 15.774 ( -73.091 -31.923 5.947) 79.979 15.975 ( 28.790 6.443 -4.878) 29.903 16.970 ( -20.193 33.726 -1.517) 39.338 17.986 ( 9.341 -2.261 -9.946) 13.830 18.696 ( 4.001 -8.626 16.442) 18.994 18.967 ( 7.550 10.009 8.573) 15.188 19.358 ( -9.171 9.663 12.280) 18.119 19.647 ( -2.906 -14.541 -6.839) 16.329 20.050 ( 4.851 6.747 12.717) 15.191 20.804 ( -12.328 0.725 -4.769) 13.238 21.065 ( 6.975 -32.856 -6.943) 34.298 21.467 ( 12.659 -11.557 2.710) 17.354 22.464 ( 8.017 6.675 -14.403) 17.784 23.002 ( -0.925 14.976 -14.729) 21.026 23.124 ( 13.009 1.741 -3.720) 13.642 23.802 ( 5.461 11.278 2.426) 12.763 24.174 ( 0.312 2.253 1.499) 2.724 24.452 ( 2.975 -4.342 -1.362) 5.437 24.970 ( 2.239 11.616 -6.811) 13.651 25.089 ( -1.339 -4.772 1.459) 5.167 25.498 ( -5.800 -11.271 14.694) 19.406 25.930 ( -14.849 -6.882 -3.670) 16.772 26.280 ( -2.381 5.201 4.863) 7.508 27.568 ( 4.339 -3.399 -0.405) 5.527 28.648 ( -2.082 4.320 -0.986) 4.896 30.948 ( 2.377 -3.892 -0.382) 4.576 31.755 ( -2.761 4.912 0.635) 5.671 32.271 ( -1.223 -3.252 0.258) 3.484 33.072 ( 0.993 2.395 0.306) 2.611 33.180 ( 4.162 2.542 -2.502) 5.481 33.207 ( 5.577 1.843 -0.279) 5.880 33.802 ( -1.672 1.939 3.493) 4.331 34.207 ( -3.933 -2.682 -4.625) 6.637 34.360 ( 0.227 -1.191 1.713) 2.099 ======================= Grid point 286 (101/146) ======================= q-point: (-0.18 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.519 ( -50.696 -19.377 24.100) 59.383 7.880 ( -77.582 -17.227 10.535) 80.167 9.767 ( 16.216 11.816 4.829) 20.637 10.546 ( 12.365 -16.938 5.012) 21.562 12.306 ( 30.593 30.017 3.300) 42.986 12.944 ( 7.163 23.241 -20.217) 31.625 13.319 ( -83.186 -27.272 1.069) 87.549 14.733 ( 10.754 -40.258 -3.287) 41.799 15.472 ( 13.442 -0.927 -1.181) 13.526 16.619 ( -10.890 18.541 -2.667) 21.667 17.025 ( 27.428 16.150 3.312) 32.002 18.160 ( 8.310 13.997 -4.748) 16.956 18.701 ( -2.141 -13.152 5.322) 14.348 19.118 ( -9.932 2.451 2.176) 10.459 19.162 ( -14.529 3.712 -11.451) 18.868 19.436 ( 2.704 -15.063 1.527) 15.380 20.149 ( -12.609 -4.517 14.832) 19.984 20.831 ( 13.858 13.397 -1.860) 19.364 20.903 ( 19.228 -16.252 -7.117) 26.163 21.893 ( 26.718 -1.915 13.550) 30.018 22.617 ( 13.220 7.987 -10.107) 18.459 23.073 ( 1.705 21.185 -11.311) 24.075 23.370 ( 15.388 -0.817 0.702) 15.426 23.961 ( 4.399 2.255 1.048) 5.053 24.245 ( 0.905 6.238 -0.796) 6.354 24.455 ( 1.113 -0.166 0.355) 1.180 24.994 ( -1.791 -3.383 1.040) 3.967 25.033 ( -2.185 -12.193 -4.000) 13.017 25.348 ( -3.220 0.643 -5.731) 6.605 25.637 ( -13.789 0.964 7.836) 15.889 26.368 ( 0.649 3.398 7.062) 7.864 27.570 ( 0.962 -4.056 -1.828) 4.552 28.533 ( -12.250 -1.048 -0.585) 12.308 30.966 ( 4.133 -3.224 -0.412) 5.258 31.795 ( -0.420 6.982 1.379) 7.130 32.209 ( -1.751 -3.941 -0.353) 4.327 33.040 ( -5.546 -1.660 1.090) 5.891 33.221 ( 1.059 1.158 -3.647) 3.971 33.303 ( 5.242 0.044 -3.255) 6.171 33.822 ( -1.383 2.213 2.602) 3.685 34.057 ( -5.682 -2.588 -3.358) 7.089 34.395 ( 2.250 0.339 1.418) 2.681 ======================= Grid point 292 (102/146) ======================= q-point: ( 0.36 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.321 ( -0.000 37.336 54.191) 65.807 6.975 ( -0.000 32.072 49.826) 59.256 8.784 ( -0.000 62.606 37.488) 72.972 10.623 ( -0.000 -1.766 -8.769) 8.945 11.606 ( -0.000 -0.785 -47.766) 47.772 11.697 ( -0.000 -4.588 -33.396) 33.710 13.114 ( -0.000 -4.413 -25.669) 26.046 14.807 ( 0.000 4.281 20.497) 20.939 15.281 ( -0.000 1.752 -2.756) 3.266 15.499 ( 0.000 1.007 24.023) 24.045 17.599 ( 0.000 -13.527 -32.795) 35.475 18.050 ( 0.000 -9.431 -23.250) 25.090 18.515 ( 0.000 -6.953 16.952) 18.322 18.904 ( -0.000 8.228 24.681) 26.016 19.634 ( -0.000 9.807 30.022) 31.583 19.721 ( -0.000 8.599 10.322) 13.434 20.105 ( -0.000 9.857 21.296) 23.467 21.759 ( -0.000 14.333 -24.049) 27.997 22.486 ( 0.000 -10.454 -17.597) 20.468 22.524 ( 0.000 -26.755 -0.515) 26.760 22.824 ( 0.000 -26.012 -5.684) 26.625 22.944 ( -0.000 -3.184 -16.493) 16.798 23.589 ( 0.000 -29.697 -16.077) 33.769 23.769 ( 0.000 -7.970 -6.611) 10.355 24.261 ( 0.000 -3.094 2.056) 3.715 24.667 ( -0.000 5.823 0.656) 5.860 24.675 ( 0.000 -6.449 -2.771) 7.019 25.385 ( 0.000 -11.696 -1.256) 11.763 25.568 ( -0.000 12.082 10.525) 16.023 26.240 ( 0.000 -17.560 16.515) 24.106 26.441 ( -0.000 6.251 0.807) 6.303 27.022 ( -0.000 15.801 -2.046) 15.933 27.618 ( -0.000 21.328 1.968) 21.418 31.169 ( 0.000 -5.834 0.116) 5.835 32.031 ( 0.000 -2.441 -1.289) 2.760 32.197 ( 0.000 -0.443 6.375) 6.391 32.395 ( -0.000 15.618 -0.629) 15.631 32.595 ( -0.000 10.725 -0.713) 10.749 32.713 ( -0.000 8.840 -8.302) 12.127 33.946 ( -0.000 1.086 2.879) 3.077 33.954 ( 0.000 -0.280 1.988) 2.008 34.705 ( 0.000 -3.799 3.456) 5.136 ======================= Grid point 293 (103/146) ======================= q-point: ( 0.45 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.270 ( 21.043 37.309 44.202) 61.552 7.609 ( 6.426 19.281 38.142) 43.219 9.615 ( 3.993 39.339 12.210) 41.384 10.707 ( 11.394 28.930 -0.802) 31.104 11.158 ( -11.414 -3.177 -22.716) 25.620 11.648 ( 12.655 11.660 -36.339) 40.207 12.912 ( 4.484 -10.917 -21.505) 24.531 14.685 ( -32.043 -13.383 1.386) 34.753 15.030 ( -5.965 9.945 11.516) 16.343 16.083 ( 25.917 8.116 11.796) 29.610 17.350 ( 10.689 -9.735 -17.534) 22.726 17.891 ( 7.325 -9.654 -13.448) 18.103 18.615 ( 4.645 -5.576 16.736) 18.242 19.143 ( -4.628 5.478 28.279) 29.174 19.621 ( -16.598 13.752 16.122) 26.917 20.105 ( 6.400 5.652 13.942) 16.349 20.308 ( -0.869 4.102 12.391) 13.081 21.596 ( -13.688 11.607 -19.600) 26.575 22.097 ( -5.728 -38.758 -5.069) 39.505 22.402 ( -1.120 -26.304 -3.608) 26.574 22.454 ( -1.180 -15.644 -7.306) 17.306 22.721 ( 1.321 -17.386 -21.340) 27.558 23.241 ( -1.209 -7.948 -17.521) 19.277 23.492 ( -13.702 3.299 -12.587) 18.896 24.245 ( -0.249 -3.105 2.116) 3.765 24.598 ( 0.594 -0.842 -0.144) 1.041 24.710 ( -1.833 2.501 -1.522) 3.454 25.395 ( 10.904 -7.279 -1.273) 13.172 25.705 ( -3.280 6.500 9.107) 11.660 26.036 ( -12.722 -11.334 15.696) 23.166 26.681 ( 12.741 0.337 1.395) 12.822 27.137 ( -0.428 9.689 -0.772) 9.729 27.877 ( 5.646 20.828 0.648) 21.589 31.092 ( -2.283 -5.560 0.233) 6.015 31.983 ( -1.357 -2.098 -1.436) 2.882 32.244 ( 1.048 -0.856 5.290) 5.461 32.592 ( 6.777 11.607 -1.782) 13.558 32.713 ( 2.326 10.853 -1.021) 11.146 32.770 ( 1.385 10.518 -5.383) 11.896 33.908 ( -3.317 -0.159 2.665) 4.258 34.040 ( 4.363 0.660 1.356) 4.616 34.670 ( -1.817 -4.719 2.511) 5.645 ======================= Grid point 294 (104/146) ======================= q-point: ( 0.55 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.982 ( 4.818 16.405 17.391) 24.388 8.433 ( 27.281 27.065 35.658) 52.423 9.737 ( -1.823 0.938 -4.382) 4.838 10.768 ( -13.270 -8.823 -5.601) 16.891 11.692 ( 26.613 50.838 -10.363) 58.310 11.832 ( 19.759 39.820 -9.323) 45.420 12.643 ( -12.458 -6.339 -19.372) 23.888 14.012 ( -16.171 -27.961 1.153) 32.321 15.112 ( 1.297 4.083 -0.338) 4.297 16.618 ( 16.365 22.833 -0.908) 28.107 17.479 ( 22.731 -9.693 -15.173) 28.998 17.953 ( 11.420 -6.847 15.874) 20.719 18.802 ( 6.487 -3.454 16.684) 18.231 19.221 ( -14.390 0.798 30.896) 34.092 19.688 ( -8.624 18.408 14.431) 24.929 20.093 ( -20.527 -0.871 0.944) 20.567 20.278 ( -10.686 -3.563 1.752) 11.399 21.193 ( -24.326 -24.982 1.398) 34.897 21.463 ( -5.916 -33.641 -12.453) 36.356 21.924 ( -7.290 -29.237 -5.604) 30.649 22.349 ( -0.848 -9.057 -13.678) 16.427 22.536 ( 16.511 -6.251 -21.275) 27.646 23.127 ( -0.755 7.894 -17.178) 18.919 23.380 ( -0.012 14.384 -6.775) 15.900 24.227 ( -0.309 -2.526 1.918) 3.187 24.613 ( -6.160 3.035 0.340) 6.875 24.677 ( 4.253 -1.640 -1.626) 4.839 25.487 ( -0.079 4.702 -2.188) 5.186 25.760 ( 2.370 -3.937 9.382) 10.447 25.860 ( -8.745 -11.577 15.791) 21.445 26.807 ( -1.594 3.394 -0.086) 3.750 27.204 ( 5.502 -0.776 -1.697) 5.810 28.211 ( 9.486 18.527 0.267) 20.816 30.999 ( -2.373 -5.235 0.247) 5.753 31.927 ( -2.554 -0.383 -1.251) 2.869 32.283 ( 1.140 -2.248 3.637) 4.426 32.789 ( 7.581 7.401 -4.074) 11.351 32.864 ( 2.345 11.529 -0.366) 11.771 32.887 ( 4.794 8.362 -1.221) 9.716 33.877 ( -2.654 0.102 2.918) 3.946 34.124 ( 4.160 0.454 -0.044) 4.185 34.589 ( -3.534 -5.361 1.409) 6.574 ======================= Grid point 295 (105/146) ======================= q-point: ( 0.64 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.220 ( -4.362 10.710 4.776) 12.512 9.027 ( 2.480 -0.316 13.837) 14.062 9.961 ( 22.346 7.655 -0.543) 23.627 10.503 ( -9.595 3.869 14.590) 17.886 11.830 ( -45.400 -0.353 -4.279) 45.603 12.084 ( 9.697 26.960 -29.709) 41.274 13.162 ( 39.918 44.296 8.384) 60.215 13.802 ( 26.450 -20.686 -5.724) 34.063 15.184 ( 8.703 -1.051 -3.590) 9.473 17.104 ( 10.755 30.222 -1.878) 32.133 17.574 ( 14.054 -3.766 -24.032) 28.093 18.287 ( 8.567 -12.689 28.956) 32.754 18.892 ( -3.888 -5.611 13.607) 15.223 18.934 ( -60.491 -12.640 12.922) 63.133 19.549 ( -11.886 11.113 25.201) 29.998 19.913 ( -8.556 -1.189 4.373) 9.682 19.986 ( -6.171 3.657 3.237) 7.870 20.700 ( 5.243 -33.245 -6.084) 34.201 21.034 ( 3.967 -39.736 -9.969) 41.159 21.487 ( -11.727 -16.610 -7.487) 21.667 22.237 ( 5.276 6.130 -23.337) 24.699 22.683 ( 14.717 -0.950 -4.812) 15.513 23.073 ( -1.473 12.746 -18.566) 22.568 23.600 ( 6.978 17.999 0.319) 19.307 24.210 ( -0.825 -1.753 1.217) 2.288 24.488 ( -7.955 0.112 0.475) 7.970 24.767 ( 7.371 -1.553 -1.237) 7.634 25.422 ( -12.392 8.363 -0.479) 14.958 25.724 ( -7.691 -12.820 16.960) 22.609 25.872 ( 10.182 -7.772 2.590) 13.069 26.707 ( -13.959 5.831 0.636) 15.142 27.296 ( 10.464 -5.502 -2.948) 12.184 28.524 ( 7.839 13.739 -0.190) 15.819 30.921 ( -1.044 -4.828 0.078) 4.940 31.877 ( -3.114 1.932 -0.769) 3.744 32.287 ( 0.083 -3.253 2.040) 3.841 32.940 ( 5.651 7.172 -3.667) 9.839 33.003 ( 4.034 6.449 -0.034) 7.607 33.048 ( 5.037 5.526 0.542) 7.497 33.866 ( -1.975 1.060 3.118) 3.840 34.185 ( 3.270 0.240 -1.606) 3.651 34.472 ( -4.619 -5.499 0.703) 7.216 ======================= Grid point 296 (106/146) ======================= q-point: (-0.27 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.989 ( -31.520 -3.542 8.445) 32.824 9.188 ( 9.704 6.761 5.206) 12.922 10.034 ( 13.062 -26.014 -7.367) 30.027 10.463 ( -61.500 6.875 11.092) 62.870 11.405 ( 13.380 31.693 12.092) 36.464 12.451 ( 16.266 30.211 -18.911) 39.178 13.599 ( 31.395 -41.610 -11.741) 53.431 14.674 ( 30.978 38.638 9.551) 50.435 15.425 ( 27.464 6.701 -4.798) 28.674 17.032 ( -80.391 -24.970 -0.174) 84.180 17.508 ( 13.730 14.300 -2.524) 19.984 17.733 ( -21.305 8.781 -4.920) 23.563 18.657 ( 4.640 -9.838 18.632) 21.574 18.978 ( 7.400 11.135 2.384) 13.581 19.575 ( -8.860 -16.098 0.445) 18.380 19.673 ( -7.766 0.881 6.657) 10.267 20.198 ( 1.255 -2.805 10.831) 11.258 20.377 ( 7.779 -35.166 -11.347) 37.761 20.951 ( 18.877 -10.675 11.930) 24.751 21.124 ( -8.509 -9.156 -2.404) 12.728 22.267 ( 8.862 11.202 -24.407) 28.279 22.915 ( 12.352 1.689 3.225) 12.877 23.063 ( -0.071 15.806 -17.511) 23.589 23.877 ( 2.763 15.124 1.017) 15.408 24.197 ( 0.365 1.018 1.022) 1.488 24.399 ( -1.706 -1.898 1.684) 3.057 24.854 ( 7.461 -4.752 -2.221) 9.120 25.267 ( -12.717 2.631 2.264) 13.182 25.578 ( -7.238 -10.608 8.251) 15.264 25.930 ( 3.014 -6.418 -1.931) 7.348 26.541 ( -13.726 6.951 6.907) 16.865 27.388 ( 9.479 -5.639 -3.982) 11.726 28.712 ( 1.439 8.176 -0.565) 8.321 30.874 ( 0.851 -4.255 -0.057) 4.339 31.857 ( -2.525 4.757 -0.113) 5.387 32.254 ( -0.895 -4.248 0.793) 4.413 33.066 ( 3.838 5.342 -1.735) 6.803 33.118 ( 3.836 3.878 -1.145) 5.573 33.154 ( 3.149 1.124 0.744) 3.425 33.874 ( -1.521 1.763 2.845) 3.676 34.198 ( -0.481 -0.505 -3.481) 3.550 34.364 ( -2.155 -3.764 1.450) 4.574 ======================= Grid point 297 (107/146) ======================= q-point: (-0.18 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.373 ( -44.472 -7.434 22.787) 50.520 9.120 ( -58.912 -2.726 3.900) 59.104 9.683 ( -2.341 6.936 2.971) 7.900 10.065 ( 19.816 -19.392 3.026) 27.890 12.225 ( 23.589 39.986 4.245) 46.619 12.903 ( 17.029 22.766 -9.258) 29.899 13.526 ( 16.129 -35.824 -16.588) 42.646 14.998 ( -46.980 -14.501 7.799) 49.782 15.385 ( -37.930 -12.874 2.152) 40.113 16.289 ( 42.950 25.363 -0.699) 49.884 17.469 ( -25.329 11.799 5.093) 28.403 17.879 ( 23.799 9.231 -10.377) 27.555 18.657 ( -4.269 -10.055 3.301) 11.411 19.158 ( -8.617 5.872 -16.209) 19.273 19.393 ( 2.014 -15.221 14.680) 21.242 19.493 ( -12.835 1.191 5.032) 13.838 19.995 ( 26.065 -33.433 -10.314) 43.630 20.369 ( 1.628 -9.104 3.007) 9.725 20.920 ( -3.063 11.479 -5.514) 13.097 21.540 ( 24.733 -1.736 24.789) 35.060 22.404 ( 12.443 12.537 -17.141) 24.614 23.136 ( 4.977 15.109 -11.357) 19.545 23.176 ( 10.343 6.278 3.949) 12.728 23.956 ( -1.910 3.462 0.122) 3.956 24.242 ( 0.921 1.062 -2.529) 2.894 24.455 ( 3.999 5.288 3.577) 7.533 24.863 ( 4.065 -12.073 -3.594) 13.236 25.051 ( -9.941 -14.394 5.036) 18.203 25.444 ( -6.456 8.472 -3.504) 11.213 25.832 ( -6.113 -2.898 -0.356) 6.775 26.511 ( -5.550 4.272 11.642) 13.586 27.437 ( 6.225 -5.178 -4.880) 9.454 28.713 ( -7.513 3.259 -0.562) 8.209 30.868 ( 2.853 -3.308 -0.054) 4.369 31.888 ( -0.890 7.239 0.542) 7.314 32.189 ( -1.481 -5.353 0.138) 5.556 33.110 ( -2.413 0.670 0.389) 2.534 33.186 ( 2.051 3.173 -3.854) 5.397 33.208 ( 3.447 -1.022 -0.443) 3.622 33.875 ( -1.790 -0.037 0.942) 2.023 34.115 ( -4.596 0.241 -1.678) 4.899 34.364 ( 2.334 -0.709 1.334) 2.780 ======================= Grid point 304 (108/146) ======================= q-point: ( 0.45 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.818 ( -0.000 41.764 42.614) 59.667 7.962 ( -0.000 13.144 26.998) 30.028 9.742 ( 0.000 -4.397 -11.349) 12.171 11.093 ( -0.000 8.359 -31.049) 32.155 11.162 ( -0.000 71.938 8.289) 72.414 11.469 ( -0.000 15.651 -10.878) 19.060 12.538 ( 0.000 -23.381 -17.595) 29.261 14.966 ( 0.000 -0.677 1.795) 1.918 15.391 ( -0.000 18.201 -7.738) 19.778 15.777 ( 0.000 -9.339 14.739) 17.449 17.003 ( 0.000 -7.328 -16.173) 17.756 17.755 ( 0.000 -8.381 12.520) 15.066 18.615 ( 0.000 -8.025 15.446) 17.406 19.456 ( 0.000 5.338 28.603) 29.097 20.050 ( -0.000 14.571 2.164) 14.731 20.157 ( -0.000 4.347 18.106) 18.620 20.387 ( 0.000 -3.695 5.171) 6.356 21.653 ( 0.000 -32.887 -21.683) 39.392 21.729 ( 0.000 -5.348 -12.130) 13.256 22.009 ( 0.000 -11.106 -11.440) 15.944 22.374 ( 0.000 -22.453 9.080) 24.219 22.403 ( 0.000 -18.802 -16.017) 24.700 23.105 ( -0.000 4.382 -17.647) 18.183 23.551 ( -0.000 0.523 -11.913) 11.925 24.229 ( 0.000 -3.213 2.018) 3.794 24.558 ( 0.000 -3.151 -0.889) 3.274 24.724 ( -0.000 1.351 -3.036) 3.323 25.168 ( 0.000 -8.707 1.268) 8.799 25.871 ( -0.000 6.787 5.356) 8.646 26.164 ( 0.000 -16.560 17.040) 23.761 26.568 ( -0.000 5.748 -0.902) 5.818 27.261 ( -0.000 9.516 0.483) 9.528 28.015 ( -0.000 18.675 -0.743) 18.690 31.066 ( 0.000 -4.697 0.154) 4.699 31.939 ( 0.000 -4.426 -1.285) 4.609 32.279 ( 0.000 -0.025 4.542) 4.542 32.621 ( -0.000 10.173 -2.884) 10.573 32.796 ( -0.000 10.346 -0.737) 10.372 32.847 ( -0.000 13.333 -3.005) 13.667 33.961 ( 0.000 -0.939 0.576) 1.102 34.009 ( -0.000 0.906 2.955) 3.090 34.651 ( 0.000 -5.547 1.775) 5.824 ======================= Grid point 305 (109/146) ======================= q-point: ( 0.55 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.227 ( 0.426 12.836 13.970) 18.977 8.645 ( 12.661 35.623 34.470) 51.162 9.545 ( 2.247 -13.554 -12.504) 18.577 10.944 ( -7.391 5.329 -9.552) 13.201 11.515 ( 9.945 17.579 -21.515) 29.510 12.219 ( 13.347 61.803 4.820) 63.411 12.254 ( 11.948 -6.680 -11.741) 18.034 14.500 ( -46.731 -3.862 -1.897) 46.929 15.216 ( -9.608 2.566 -1.603) 10.073 16.348 ( 36.867 15.509 -1.481) 40.024 16.983 ( 11.921 -4.144 -9.235) 15.639 17.885 ( 7.540 -12.113 30.477) 33.651 18.716 ( 8.087 -8.488 14.732) 18.827 19.613 ( -6.656 -3.436 24.471) 25.592 20.105 ( -7.309 15.032 8.669) 18.829 20.253 ( -5.322 -1.426 -1.382) 5.680 20.334 ( 0.032 -6.094 -3.165) 6.867 20.949 ( -5.985 -56.628 -11.124) 58.020 21.542 ( -25.279 0.457 -10.243) 27.279 21.898 ( -11.779 -19.100 1.303) 22.478 22.097 ( 4.902 -5.317 -14.548) 16.246 22.170 ( 4.215 -7.357 -7.411) 11.261 23.079 ( 2.127 8.854 -14.759) 17.342 23.464 ( -1.269 10.688 -8.503) 13.717 24.216 ( 0.176 -2.969 1.918) 3.539 24.561 ( 3.698 -2.623 -0.213) 4.539 24.724 ( -0.561 2.275 -2.831) 3.674 25.231 ( 13.835 -7.779 1.006) 15.904 25.897 ( -6.534 3.735 3.534) 8.315 26.036 ( -8.570 -14.605 16.043) 23.327 26.713 ( 10.611 2.225 -2.298) 11.083 27.275 ( -7.516 5.635 0.262) 9.398 28.244 ( 6.575 16.608 -0.456) 17.868 31.001 ( -2.575 -3.999 0.281) 4.765 31.900 ( 1.264 -3.574 -1.471) 4.067 32.297 ( -0.837 -0.795 3.448) 3.636 32.736 ( 4.557 8.434 -2.336) 9.867 32.901 ( 2.334 8.561 -1.289) 8.967 32.963 ( -0.068 12.439 -0.813) 12.466 33.932 ( -1.821 -0.478 1.159) 2.211 34.068 ( 2.936 0.262 1.549) 3.330 34.588 ( -1.873 -5.970 0.867) 6.316 ======================= Grid point 306 (110/146) ======================= q-point: ( 0.64 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.446 ( 1.167 14.179 5.463) 15.240 9.052 ( -2.829 -5.038 2.255) 6.203 9.653 ( 13.472 7.211 6.326) 16.538 10.868 ( -3.790 13.247 8.949) 16.430 11.750 ( 19.711 2.035 -16.863) 26.019 12.148 ( 14.021 -6.666 -19.500) 24.925 13.228 ( -14.269 34.566 7.672) 38.174 13.727 ( -11.308 29.190 -1.291) 31.330 15.124 ( -2.201 0.916 -1.552) 2.845 16.962 ( 12.731 1.191 -0.940) 12.821 17.250 ( 28.024 23.609 -9.363) 37.821 18.152 ( 13.712 -21.244 30.019) 39.249 18.862 ( 6.854 -12.040 9.985) 17.078 19.628 ( -8.810 1.366 17.210) 19.382 19.898 ( -12.202 -23.128 -14.751) 30.023 20.105 ( -11.446 -6.583 -1.357) 13.273 20.273 ( -2.982 -31.222 -7.073) 32.152 20.328 ( -21.206 5.271 9.339) 23.763 20.676 ( -29.607 -26.306 13.226) 41.756 21.559 ( -11.254 -8.424 -5.128) 14.964 22.004 ( 5.933 10.973 -33.879) 36.103 22.425 ( 16.644 2.135 7.949) 18.568 23.076 ( -0.330 10.779 -15.393) 18.795 23.638 ( 8.087 16.210 -1.347) 18.166 24.205 ( 0.012 -2.265 1.474) 2.702 24.580 ( 1.769 -3.917 -3.100) 5.299 24.695 ( -4.175 3.407 1.674) 5.643 25.432 ( 15.338 -5.790 -1.165) 16.436 25.805 ( -9.133 1.755 2.335) 9.589 25.849 ( -8.306 -16.721 14.271) 23.500 26.891 ( 8.291 3.249 -2.054) 9.138 27.148 ( -9.152 0.336 -1.011) 9.214 28.519 ( 8.108 12.814 -0.031) 15.164 30.916 ( -2.994 -3.500 0.236) 4.612 31.889 ( 1.304 -1.027 -1.290) 2.102 32.286 ( -1.278 -2.197 2.222) 3.376 32.888 ( 5.615 7.122 -1.475) 9.188 33.016 ( 3.100 6.602 -0.826) 7.340 33.065 ( 0.464 7.983 0.065) 7.996 33.918 ( -0.981 0.280 1.567) 1.870 34.126 ( 2.903 0.028 0.131) 2.907 34.488 ( -3.387 -5.757 0.161) 6.681 ======================= Grid point 307 (111/146) ======================= q-point: (-0.27 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.534 ( -17.833 10.602 10.622) 23.308 8.940 ( 11.801 -13.282 -12.121) 21.508 9.727 ( -1.870 -7.572 2.945) 8.337 11.353 ( 7.572 34.599 12.828) 37.670 11.770 ( -10.885 -6.257 -1.116) 12.605 12.124 ( -2.621 -8.515 -9.375) 12.933 12.822 ( 11.268 -1.970 -9.108) 14.622 14.739 ( 27.831 62.000 5.850) 68.212 15.129 ( 6.499 -0.317 -2.513) 6.975 17.075 ( 10.457 -6.622 -3.093) 12.758 17.823 ( 2.984 20.434 -3.708) 20.981 18.232 ( -5.460 -25.980 11.527) 28.942 18.890 ( -47.814 -14.206 13.199) 51.597 18.960 ( 4.919 5.199 3.210) 7.844 19.302 ( -5.493 -42.816 -13.799) 45.319 19.810 ( -7.845 -18.421 -10.448) 22.584 19.941 ( -11.583 3.294 8.650) 14.827 20.114 ( 10.721 -18.898 -7.601) 23.018 20.855 ( 9.459 7.474 35.548) 37.536 21.277 ( -11.860 -0.065 -1.373) 11.939 22.021 ( 9.928 15.525 -31.730) 36.693 22.783 ( 12.788 5.135 10.084) 17.076 23.072 ( 0.345 12.723 -15.414) 19.990 23.950 ( 8.488 14.990 0.564) 17.236 24.198 ( 0.360 -0.468 0.810) 1.003 24.480 ( -6.480 -2.476 -0.405) 6.948 24.696 ( 2.064 -3.423 0.304) 4.008 25.446 ( -8.502 -11.983 2.171) 14.852 25.699 ( -8.099 -0.024 4.498) 9.264 25.740 ( 8.076 -8.145 0.772) 11.496 26.917 ( -15.407 6.945 7.024) 18.301 27.096 ( 12.747 -5.515 -7.699) 15.880 28.737 ( 4.923 7.996 -0.072) 9.390 30.845 ( -1.605 -2.912 0.070) 3.326 31.906 ( 0.904 2.358 -0.611) 2.598 32.242 ( -1.896 -3.823 0.952) 4.372 33.032 ( 4.689 5.904 -1.013) 7.608 33.112 ( 2.116 4.315 0.060) 4.807 33.134 ( 1.351 2.658 0.082) 2.983 33.920 ( -0.731 0.143 1.427) 1.610 34.168 ( 1.935 0.577 -1.078) 2.289 34.378 ( -3.310 -4.395 0.257) 5.508 ======================= Grid point 308 (112/146) ======================= q-point: (-0.18 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.205 ( -37.409 2.590 20.495) 42.734 8.979 ( 21.256 -19.392 -18.619) 34.271 9.781 ( 9.178 3.788 4.212) 10.785 10.727 ( -73.297 5.385 12.741) 74.590 12.092 ( 39.088 -55.070 -9.222) 68.159 12.285 ( 21.603 40.655 2.833) 46.126 13.240 ( 15.116 34.374 -8.253) 38.447 15.060 ( 0.080 -5.834 1.761) 6.094 15.898 ( 31.086 35.432 -2.388) 47.196 16.678 ( -75.098 -4.220 0.046) 75.216 17.465 ( 8.313 -6.796 6.203) 12.401 17.930 ( -5.393 -16.726 7.045) 18.933 18.669 ( -0.836 -12.082 -2.493) 12.365 18.844 ( 10.137 -37.755 -6.474) 39.625 19.293 ( -6.377 14.224 -11.465) 19.351 19.460 ( 8.337 -6.574 6.539) 12.469 19.760 ( -8.198 3.680 2.404) 9.302 20.137 ( 9.507 -12.312 -4.544) 16.206 21.029 ( -4.101 2.478 -3.422) 5.888 21.472 ( 11.269 8.918 21.056) 25.492 22.206 ( 13.046 17.801 -13.277) 25.756 23.086 ( 6.922 7.417 2.713) 10.502 23.146 ( 6.793 13.748 -5.432) 16.268 24.079 ( -4.659 3.779 0.435) 6.015 24.245 ( -2.187 2.934 -1.171) 3.842 24.416 ( 6.182 -3.064 2.879) 7.476 24.679 ( 2.041 -5.353 -2.275) 6.164 25.093 ( -12.474 -21.008 1.868) 24.504 25.635 ( -6.166 8.386 1.046) 10.461 25.799 ( 3.871 -2.862 -3.154) 5.755 26.775 ( -10.921 -0.138 9.474) 14.458 27.211 ( 9.687 -1.474 -6.349) 11.676 28.824 ( -1.543 3.530 -0.221) 3.859 30.813 ( 0.620 -1.826 0.034) 1.929 31.957 ( 0.752 5.478 0.040) 5.529 32.164 ( -2.109 -5.627 0.189) 6.012 33.133 ( 1.680 3.539 -0.792) 3.997 33.158 ( 0.804 -0.625 -0.188) 1.035 33.174 ( 1.314 2.575 -0.362) 2.914 33.897 ( -1.892 -2.361 0.132) 3.028 34.177 ( -1.541 2.303 -0.615) 2.838 34.328 ( 1.043 -1.703 0.712) 2.121 ======================= Grid point 316 (113/146) ======================= q-point: ( 0.55 0.55 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.359 ( -0.000 6.643 -0.657) 6.676 9.210 ( -0.000 41.358 35.759) 54.674 9.316 ( 0.000 -15.352 -3.808) 15.817 10.935 ( -0.000 2.482 -15.588) 15.784 11.424 ( -0.000 5.854 -15.201) 16.289 11.704 ( 0.000 -27.702 -17.421) 32.725 13.021 ( -0.000 88.082 3.467) 88.150 14.938 ( -0.000 2.821 -4.673) 5.459 15.666 ( 0.000 -9.777 4.195) 10.639 15.751 ( -0.000 28.526 -7.192) 29.419 16.899 ( -0.000 4.264 6.308) 7.613 17.862 ( 0.000 -30.687 32.425) 44.644 18.652 ( 0.000 -9.796 13.562) 16.730 19.623 ( 0.000 -27.048 2.719) 27.184 20.134 ( 0.000 -14.242 -8.045) 16.358 20.241 ( 0.000 -7.148 -5.582) 9.070 20.270 ( 0.000 -9.918 5.036) 11.124 20.678 ( -0.000 0.432 -0.614) 0.751 21.690 ( -0.000 10.628 -19.518) 22.224 21.896 ( 0.000 0.934 10.270) 10.312 21.931 ( 0.000 -3.972 -13.267) 13.849 22.090 ( 0.000 -23.149 7.483) 24.328 23.036 ( -0.000 10.570 -13.136) 16.861 23.503 ( -0.000 10.080 -7.134) 12.349 24.195 ( 0.000 -2.901 1.512) 3.272 24.511 ( 0.000 -2.011 0.933) 2.217 24.649 ( 0.000 -1.903 -4.002) 4.432 25.099 ( 0.000 -2.504 2.954) 3.872 26.007 ( -0.000 2.101 1.754) 2.737 26.064 ( 0.000 -18.194 14.490) 23.259 26.597 ( -0.000 2.649 -7.172) 7.645 27.420 ( -0.000 5.110 2.271) 5.592 28.330 ( -0.000 14.177 -0.400) 14.182 30.996 ( 0.000 -2.773 0.413) 2.804 31.834 ( 0.000 -3.978 -1.390) 4.214 32.320 ( 0.000 -1.113 2.369) 2.617 32.771 ( -0.000 8.514 -0.465) 8.527 32.953 ( -0.000 7.854 -1.162) 7.939 33.076 ( -0.000 10.819 -0.925) 10.859 33.936 ( 0.000 -1.210 -1.055) 1.605 34.067 ( 0.000 0.199 3.371) 3.377 34.549 ( 0.000 -5.980 0.104) 5.981 ======================= Grid point 317 (114/146) ======================= q-point: (-0.36 -0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.383 ( 6.892 -3.155 -13.113) 15.146 9.138 ( -7.715 -4.569 5.780) 10.668 9.863 ( -0.809 27.815 27.061) 38.815 10.808 ( 13.698 -21.294 -12.822) 28.381 11.265 ( 1.147 -11.292 -12.297) 16.735 11.725 ( 21.842 15.610 -14.667) 30.592 13.922 ( 4.217 76.756 -2.749) 76.921 14.501 ( -48.864 6.918 0.303) 49.352 15.239 ( -10.773 5.000 1.933) 12.033 16.691 ( 44.228 17.457 0.669) 47.553 17.015 ( 0.654 3.687 9.950) 10.631 17.725 ( 14.610 -58.017 16.856) 62.158 18.700 ( 4.622 -9.868 11.150) 15.590 19.404 ( 6.452 -23.159 -1.925) 24.118 19.825 ( -9.366 -11.014 -17.189) 22.461 20.024 ( -4.971 -10.228 -5.142) 12.481 20.240 ( 0.256 -6.157 7.134) 9.427 20.770 ( -6.959 10.843 10.559) 16.658 21.324 ( -44.855 -13.855 -1.032) 46.958 21.610 ( -7.354 -7.216 1.353) 10.391 21.851 ( -2.667 9.772 -20.012) 22.429 22.271 ( 16.850 8.573 10.372) 21.564 23.074 ( 0.749 10.830 -11.663) 15.934 23.636 ( 6.476 13.181 -2.344) 14.872 24.188 ( 0.674 -2.160 1.295) 2.607 24.487 ( 0.611 -2.949 -1.424) 3.331 24.745 ( 8.017 3.072 -0.423) 8.596 25.135 ( 6.649 -4.811 2.272) 8.516 25.905 ( -7.602 -19.056 10.885) 23.225 25.971 ( -5.848 0.171 1.033) 5.941 26.650 ( 10.504 -0.130 -9.291) 14.024 27.395 ( -9.675 4.186 3.177) 11.010 28.508 ( 6.052 10.125 0.282) 11.799 30.948 ( -3.139 -1.953 0.445) 3.724 31.817 ( 3.008 -2.361 -1.364) 4.060 32.307 ( -1.427 -1.915 1.473) 2.806 32.882 ( 3.083 7.457 1.106) 8.145 33.031 ( 1.677 6.262 -0.753) 6.526 33.149 ( -1.144 7.238 -0.859) 7.378 33.919 ( 0.551 -0.832 -1.184) 1.548 34.101 ( 1.110 -0.546 2.915) 3.167 34.477 ( -1.738 -5.114 -0.593) 5.434 ======================= Grid point 318 (115/146) ======================= q-point: (-0.27 -0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.322 ( 14.008 -20.480 -19.598) 31.619 9.074 ( -11.311 9.159 11.817) 18.748 9.920 ( -17.024 2.922 6.297) 18.385 10.766 ( 30.696 -49.512 -17.034) 60.695 11.507 ( 21.070 29.319 4.238) 36.352 12.298 ( 23.555 28.390 -5.866) 37.353 13.388 ( -63.765 -0.320 7.017) 64.151 14.911 ( 17.506 51.519 -10.273) 55.373 15.250 ( -5.778 21.867 10.183) 24.805 16.861 ( 5.975 -40.897 11.958) 43.026 17.542 ( 13.193 -18.442 -4.526) 23.122 17.685 ( 39.251 -2.158 0.004) 39.311 18.827 ( 6.606 -1.129 10.415) 12.385 19.070 ( -10.495 -14.591 -14.318) 22.979 19.690 ( 3.012 -5.095 -4.380) 7.363 19.768 ( -7.797 -10.575 -6.885) 14.833 20.058 ( -62.736 -20.317 6.726) 66.286 20.255 ( -7.484 4.028 9.022) 12.395 20.939 ( 2.317 -7.653 12.407) 14.760 21.507 ( -8.438 11.894 -4.857) 15.371 21.865 ( 4.424 19.269 -12.200) 23.232 22.719 ( 14.196 9.656 12.821) 21.428 23.089 ( -0.886 11.072 -11.527) 16.008 23.894 ( 10.524 9.155 -0.424) 13.955 24.194 ( 0.598 -0.171 1.175) 1.329 24.461 ( 0.879 -1.810 -3.391) 3.943 24.796 ( -7.390 3.050 2.832) 8.481 25.291 ( 13.230 -6.993 -0.700) 14.981 25.626 ( -7.345 -18.358 4.686) 20.320 25.869 ( -6.798 -0.323 2.663) 7.308 26.761 ( 12.329 -3.918 -10.939) 16.941 27.270 ( -12.807 5.279 5.805) 15.019 28.701 ( 6.831 5.038 0.440) 8.499 30.872 ( -3.746 -1.367 0.179) 3.992 31.865 ( 4.447 0.480 -0.831) 4.550 32.256 ( -2.706 -3.056 0.611) 4.127 33.020 ( 3.712 6.025 1.752) 7.290 33.112 ( 2.192 3.792 -0.236) 4.386 33.169 ( -1.623 3.140 -0.475) 3.566 33.918 ( 0.802 -0.919 -0.792) 1.455 34.135 ( 1.866 -0.947 1.805) 2.764 34.391 ( -2.719 -2.959 -0.895) 4.117 ======================= Grid point 328 (116/146) ======================= q-point: (-0.36 -0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.084 ( 0.000 -19.634 -18.788) 27.175 9.249 ( -0.000 6.556 4.594) 8.005 10.015 ( 0.000 -58.256 -4.545) 58.433 10.578 ( -0.000 41.867 19.427) 46.155 11.161 ( -0.000 -4.003 -18.981) 19.399 11.583 ( -0.000 25.418 -5.723) 26.055 14.531 ( -0.000 62.962 -14.396) 64.587 15.059 ( -0.000 15.188 2.823) 15.448 15.680 ( -0.000 4.137 12.107) 12.795 16.192 ( -0.000 19.156 -1.067) 19.185 16.823 ( 0.000 -94.649 -0.427) 94.650 17.302 ( -0.000 13.336 21.649) 25.427 18.693 ( 0.000 -3.936 13.350) 13.918 19.240 ( 0.000 -9.104 8.331) 12.341 19.651 ( 0.000 -11.599 -22.322) 25.155 19.920 ( 0.000 -10.725 -7.751) 13.233 20.209 ( -0.000 3.043 -0.036) 3.043 20.873 ( 0.000 -5.772 -2.219) 6.184 21.633 ( 0.000 -25.391 -1.680) 25.446 21.673 ( -0.000 11.578 2.898) 11.935 21.944 ( -0.000 20.517 -11.719) 23.628 22.236 ( -0.000 7.286 19.163) 20.501 23.115 ( -0.000 13.234 -7.796) 15.359 23.690 ( -0.000 13.159 -1.349) 13.228 24.166 ( 0.000 -1.440 0.672) 1.589 24.495 ( 0.000 -1.914 1.777) 2.612 24.610 ( -0.000 2.929 -0.336) 2.949 25.114 ( 0.000 -1.124 2.693) 2.918 25.867 ( 0.000 -21.158 10.619) 23.673 25.995 ( 0.000 -3.703 -2.692) 4.578 26.475 ( -0.000 1.491 -12.459) 12.548 27.537 ( -0.000 2.595 3.252) 4.161 28.537 ( -0.000 5.965 0.858) 6.027 30.971 ( 0.000 -0.639 0.715) 0.959 31.754 ( 0.000 -1.657 -1.593) 2.299 32.308 ( 0.000 -2.361 0.759) 2.480 32.945 ( -0.000 6.965 3.279) 7.698 33.068 ( -0.000 4.701 -0.407) 4.718 33.214 ( -0.000 5.112 -1.219) 5.256 33.886 ( 0.000 -1.050 -2.526) 2.735 34.107 ( 0.000 -2.213 4.054) 4.618 34.442 ( 0.000 -3.404 -1.282) 3.637 ======================= Grid point 329 (117/146) ======================= q-point: (-0.27 -0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.729 ( 6.669 -33.541 -21.317) 40.298 9.290 ( -0.693 -12.237 -0.357) 12.262 9.565 ( 19.995 -37.701 -8.712) 43.556 10.563 ( -31.065 6.275 -2.494) 31.791 11.478 ( 20.391 35.469 3.623) 41.073 12.111 ( 26.102 28.584 5.636) 39.117 14.425 ( -47.226 -5.354 0.591) 47.532 15.092 ( -4.602 28.031 -9.272) 29.882 15.781 ( -6.290 45.528 10.709) 47.192 15.923 ( 10.135 -94.254 -5.659) 94.966 16.946 ( 46.120 1.859 0.563) 46.161 17.600 ( -1.529 15.938 19.598) 25.306 18.837 ( 5.715 3.876 14.808) 16.339 19.047 ( -13.471 -13.910 -7.836) 20.890 19.474 ( 8.216 -6.996 -9.429) 14.331 19.724 ( -5.308 -9.579 -8.575) 13.909 20.339 ( 5.084 10.750 -2.561) 12.164 20.716 ( -7.654 -14.884 0.926) 16.762 20.991 ( -33.390 -16.359 -0.572) 37.187 21.729 ( -10.633 17.039 -13.276) 24.076 22.075 ( -1.822 19.058 12.655) 22.949 22.654 ( 16.828 10.718 13.970) 24.357 23.168 ( -3.118 12.619 -6.363) 14.472 23.838 ( 4.223 8.984 -0.802) 9.960 24.185 ( 1.919 0.771 0.725) 2.192 24.443 ( -1.982 0.240 -0.588) 2.081 24.852 ( 13.254 6.201 3.309) 15.002 25.086 ( -1.340 -3.805 1.724) 4.387 25.620 ( -9.740 -20.701 4.013) 23.228 25.911 ( -0.653 -6.833 -2.050) 7.164 26.477 ( 7.741 0.381 -11.643) 13.987 27.515 ( -7.147 2.141 3.804) 8.374 28.625 ( 5.241 0.372 0.952) 5.339 30.938 ( -3.956 0.113 0.525) 3.993 31.777 ( 4.683 0.459 -1.335) 4.891 32.270 ( -1.840 -2.996 0.316) 3.530 33.051 ( 1.758 5.272 3.462) 6.548 33.112 ( 1.243 2.000 0.718) 2.462 33.228 ( -2.026 3.021 -0.796) 3.723 33.872 ( 1.682 -0.793 -2.594) 3.192 34.111 ( 0.676 -4.005 3.679) 5.480 34.398 ( -1.323 -0.759 -1.569) 2.188 ======================= Grid point 340 (118/146) ======================= q-point: (-0.27 -0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.120 ( 0.000 -45.414 -23.477) 51.124 8.503 ( 0.000 -74.068 -13.010) 75.202 9.562 ( -0.000 21.773 -3.093) 21.992 10.844 ( 0.000 -2.973 -12.123) 12.482 11.745 ( -0.000 45.646 9.560) 46.637 12.249 ( -0.000 32.946 19.940) 38.510 14.269 ( 0.000 -89.522 -13.482) 90.531 15.251 ( 0.000 -18.975 -2.326) 19.117 15.447 ( -0.000 14.759 -1.029) 14.795 16.357 ( 0.000 -4.603 3.859) 6.007 16.488 ( -0.000 53.016 7.574) 53.554 17.919 ( -0.000 12.771 18.576) 22.542 18.933 ( 0.000 2.270 14.777) 14.950 19.084 ( 0.000 -6.941 -22.998) 24.023 19.130 ( 0.000 -16.508 6.507) 17.744 19.644 ( 0.000 -5.895 -7.369) 9.436 20.339 ( -0.000 2.602 -15.705) 15.919 20.579 ( 0.000 -1.574 4.819) 5.069 21.197 ( 0.000 -11.988 -0.097) 11.989 21.925 ( -0.000 20.647 -13.959) 24.923 22.388 ( -0.000 20.112 9.739) 22.346 22.673 ( -0.000 8.216 18.001) 19.788 23.317 ( -0.000 14.659 -1.908) 14.782 23.903 ( -0.000 10.377 -2.620) 10.702 24.169 ( -0.000 1.028 0.203) 1.048 24.482 ( 0.000 -2.020 1.419) 2.469 24.799 ( -0.000 10.703 7.884) 13.293 25.117 ( 0.000 -2.321 2.515) 3.422 25.561 ( 0.000 -22.608 6.527) 23.531 25.739 ( 0.000 -9.593 -13.334) 16.427 26.363 ( -0.000 3.131 -8.065) 8.651 27.605 ( 0.000 -0.240 2.219) 2.232 28.562 ( 0.000 -5.406 1.080) 5.513 30.990 ( -0.000 1.356 0.824) 1.587 31.728 ( -0.000 1.487 -1.789) 2.326 32.259 ( 0.000 -3.125 0.301) 3.140 33.073 ( 0.000 -1.187 -0.691) 1.373 33.149 ( -0.000 3.149 5.961) 6.742 33.277 ( -0.000 3.665 0.131) 3.668 33.825 ( -0.000 -0.527 -3.442) 3.482 34.086 ( 0.000 -6.049 4.173) 7.349 34.398 ( -0.000 1.095 -1.687) 2.012 ======================= Grid point 401 (119/146) ======================= q-point: ( 0.27 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.142 ( 0.000 -0.000 69.644) 69.644 5.142 ( 0.000 -0.000 69.644) 69.644 7.338 ( 0.000 -0.000 66.948) 66.948 10.734 ( -0.000 0.000 -6.762) 6.762 12.193 ( -0.000 0.000 -64.338) 64.338 12.193 ( -0.000 0.000 -64.338) 64.338 13.214 ( -0.000 0.000 -34.024) 34.024 14.396 ( 0.000 -0.000 65.722) 65.722 15.378 ( 0.000 -0.000 3.307) 3.307 15.378 ( 0.000 -0.000 3.307) 3.307 18.236 ( -0.000 0.000 -27.420) 27.420 18.236 ( -0.000 0.000 -27.420) 27.420 18.623 ( 0.000 -0.000 15.137) 15.137 18.623 ( 0.000 -0.000 15.137) 15.137 19.192 ( 0.000 -0.000 37.097) 37.097 19.535 ( 0.000 -0.000 16.214) 16.214 19.535 ( 0.000 -0.000 16.214) 16.214 21.672 ( -0.000 0.000 -24.476) 24.476 22.836 ( -0.000 0.000 -11.084) 11.084 22.836 ( -0.000 0.000 -11.084) 11.084 23.137 ( -0.000 0.000 -11.441) 11.441 23.315 ( -0.000 0.000 -21.606) 21.606 24.335 ( 0.000 -0.000 2.340) 2.340 24.355 ( 0.000 -0.000 1.998) 1.998 24.355 ( 0.000 0.000 1.998) 1.998 24.796 ( 0.000 -0.000 0.891) 0.891 24.796 ( 0.000 -0.000 0.891) 0.891 25.362 ( 0.000 -0.000 4.977) 4.977 25.362 ( 0.000 0.000 4.977) 4.977 26.277 ( 0.000 -0.000 0.859) 0.859 26.564 ( -0.000 0.000 -8.604) 8.604 26.795 ( 0.000 -0.000 9.169) 9.169 26.795 ( 0.000 0.000 9.169) 9.169 31.337 ( 0.000 -0.000 0.950) 0.950 31.999 ( 0.000 -0.000 2.390) 2.390 31.999 ( 0.000 -0.000 2.390) 2.390 32.248 ( 0.000 -0.000 3.613) 3.613 32.248 ( 0.000 -0.000 3.613) 3.613 32.619 ( -0.000 0.000 -10.652) 10.652 33.916 ( 0.000 -0.000 2.839) 2.839 33.916 ( 0.000 -0.000 2.839) 2.839 34.750 ( 0.000 -0.000 4.629) 4.629 ======================= Grid point 402 (120/146) ======================= q-point: ( 0.36 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.989 ( 24.405 14.090 63.519) 69.489 5.991 ( 31.991 18.470 59.129) 69.719 7.935 ( 13.648 7.880 51.477) 53.835 10.670 ( -1.509 -0.871 -5.896) 6.148 11.600 ( -6.121 -3.534 -52.207) 52.683 11.810 ( 4.242 2.449 -63.686) 63.874 13.081 ( 8.493 4.904 -32.264) 33.722 14.738 ( -11.862 -6.849 49.397) 51.261 15.186 ( -14.574 -8.414 5.019) 17.562 15.658 ( 16.021 9.250 16.611) 24.863 17.847 ( -6.531 -3.771 -29.983) 30.917 18.182 ( 9.111 5.260 -35.617) 37.138 18.677 ( -4.265 -2.463 21.788) 22.337 18.788 ( 3.685 2.127 14.264) 14.885 19.276 ( -12.626 -7.289 31.508) 34.717 19.802 ( 6.759 3.902 25.155) 26.338 19.845 ( 12.269 7.083 18.659) 23.428 21.471 ( -1.115 -0.644 -27.240) 27.270 22.741 ( -1.396 -0.806 -10.662) 10.783 22.759 ( 3.372 1.947 -16.759) 17.205 22.982 ( -6.038 -3.486 -10.650) 12.730 23.149 ( 0.096 0.055 -21.492) 21.493 23.982 ( -29.371 -16.957 0.690) 33.922 24.340 ( -1.926 -1.112 1.712) 2.807 24.400 ( -19.329 -11.159 0.791) 22.333 24.495 ( 3.030 1.750 -0.679) 3.564 24.778 ( -9.237 -5.333 -5.241) 11.884 25.220 ( 0.366 0.211 9.380) 9.390 25.661 ( 5.039 2.909 6.355) 8.617 26.257 ( -4.856 -2.804 1.783) 5.884 26.606 ( 6.591 3.805 -5.371) 9.315 26.856 ( 13.804 7.970 7.943) 17.809 27.083 ( 8.316 4.801 6.239) 11.451 31.291 ( -4.068 -2.348 0.863) 4.775 31.971 ( -2.223 -1.283 2.222) 3.395 32.168 ( 10.541 6.086 0.744) 12.194 32.309 ( 1.109 0.640 3.211) 3.457 32.331 ( 6.584 3.801 3.136) 8.224 32.578 ( 3.182 1.837 -10.102) 10.749 33.903 ( -1.872 -1.081 2.982) 3.683 33.982 ( 2.869 1.656 2.186) 3.968 34.763 ( -1.826 -1.054 4.051) 4.567 ======================= Grid point 403 (121/146) ======================= q-point: ( 0.45 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.115 ( 35.430 20.455 53.862) 67.637 7.123 ( 28.511 16.461 40.242) 51.992 8.755 ( 31.400 18.129 31.978) 48.344 10.608 ( 1.296 0.748 -1.703) 2.268 11.209 ( -0.616 -0.356 -31.998) 32.006 11.494 ( 8.496 4.905 -57.980) 58.804 12.973 ( -2.857 -1.650 -28.217) 28.410 14.689 ( -12.323 -7.115 22.709) 26.799 14.933 ( -5.947 -3.434 3.751) 7.825 16.152 ( 9.610 5.549 18.447) 21.528 17.648 ( 4.092 2.363 -2.544) 5.366 18.124 ( 10.142 5.856 -39.123) 40.839 18.749 ( -3.750 -2.165 21.423) 21.857 19.030 ( 8.397 4.848 13.497) 16.618 19.190 ( -14.711 -8.493 30.797) 35.171 20.071 ( -0.579 -0.334 16.767) 16.780 20.189 ( 5.458 3.151 14.070) 15.417 21.247 ( -1.595 -0.921 -20.093) 20.177 22.651 ( 0.119 0.069 -8.344) 8.345 22.713 ( -4.652 -2.686 -9.392) 10.820 22.744 ( 0.609 0.351 -21.295) 21.307 23.023 ( 2.390 1.380 -18.270) 18.477 23.048 ( -46.767 -27.001 -4.028) 54.152 23.891 ( -23.256 -13.427 -5.607) 27.433 24.298 ( -2.403 -1.388 1.698) 3.253 24.551 ( 1.581 0.913 0.227) 1.839 24.648 ( -1.670 -0.964 -1.942) 2.737 25.245 ( -2.448 -1.413 2.655) 3.878 25.760 ( -1.184 -0.684 13.251) 13.321 26.141 ( -5.409 -3.123 2.124) 6.597 26.707 ( 3.385 1.954 -2.186) 4.479 27.278 ( 5.964 3.443 3.913) 7.921 27.365 ( 23.906 13.802 3.634) 27.842 31.191 ( -4.731 -2.732 0.309) 5.472 31.927 ( -3.073 -1.774 1.695) 3.932 32.346 ( 0.280 0.161 2.591) 2.611 32.441 ( 12.504 7.219 0.746) 14.457 32.543 ( 10.063 5.810 -0.020) 11.619 32.615 ( 6.277 3.624 -7.652) 10.540 33.878 ( -2.299 -1.327 3.163) 4.129 34.070 ( 3.712 2.143 0.904) 4.380 34.727 ( -3.708 -2.141 3.038) 5.250 ======================= Grid point 404 (122/146) ======================= q-point: ( 0.55 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.775 ( 12.483 7.207 18.071) 23.116 8.336 ( 39.884 23.027 43.240) 63.172 9.416 ( 1.763 1.018 10.539) 10.734 11.011 ( 8.507 4.912 0.145) 9.824 11.145 ( 37.747 21.793 2.224) 43.643 11.359 ( 15.154 8.749 -49.429) 52.435 12.400 ( -31.612 -18.251 -18.816) 41.066 14.641 ( -0.400 -0.231 8.342) 8.355 15.109 ( 20.266 11.701 -2.384) 23.522 16.235 ( -3.999 -2.309 -5.175) 6.935 18.050 ( 8.905 5.141 -39.593) 40.906 18.072 ( 18.046 10.419 39.093) 44.300 18.815 ( -3.491 -2.016 17.691) 18.145 19.088 ( -14.508 -8.376 32.195) 36.293 19.319 ( 5.223 3.015 13.602) 14.878 19.819 ( -28.510 -16.460 -1.884) 32.974 20.261 ( -5.112 -2.952 5.286) 7.924 21.160 ( 0.963 0.556 -4.700) 4.830 21.965 ( -36.107 -20.846 -9.246) 42.705 22.468 ( -7.458 -4.306 -9.691) 12.964 22.596 ( -1.896 -1.095 -6.842) 7.184 22.741 ( 7.593 4.384 -20.568) 22.359 23.003 ( 3.206 1.851 -12.384) 12.926 23.324 ( -17.376 -10.032 -9.033) 22.004 24.261 ( -2.127 -1.228 1.460) 2.857 24.573 ( 0.438 0.253 -0.238) 0.558 24.610 ( -0.633 -0.365 -2.168) 2.287 25.189 ( -2.489 -1.437 0.064) 2.875 25.830 ( -4.132 -2.386 21.261) 21.790 26.067 ( -1.132 -0.654 -1.083) 1.698 26.685 ( -4.342 -2.507 -2.223) 5.484 27.420 ( 4.865 2.809 1.841) 5.911 27.907 ( 21.617 12.481 1.155) 24.988 31.094 ( -3.769 -2.176 -0.226) 4.357 31.858 ( -3.858 -2.227 1.163) 4.604 32.360 ( -0.492 -0.284 1.777) 1.866 32.686 ( 8.458 4.883 -3.004) 10.218 32.748 ( 11.016 6.360 -2.315) 12.929 32.789 ( 9.997 5.772 0.036) 11.544 33.849 ( -2.312 -1.335 3.338) 4.274 34.154 ( 3.471 2.004 -0.654) 4.061 34.642 ( -5.355 -3.091 1.869) 6.459 ======================= Grid point 405 (123/146) ======================= q-point: ( 0.64 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.029 ( 2.276 1.314 2.295) 3.489 9.229 ( -16.135 -9.316 12.238) 22.291 9.495 ( 35.253 20.353 32.449) 52.057 10.944 ( -3.988 -2.303 0.056) 4.606 11.363 ( -34.948 -20.177 -4.050) 40.557 11.479 ( 13.668 7.891 -47.962) 50.493 12.623 ( 67.304 38.858 16.815) 79.515 14.818 ( 12.428 7.175 0.570) 14.362 15.687 ( 30.206 17.439 -5.126) 35.254 16.043 ( -5.730 -3.308 -10.114) 12.086 17.939 ( 5.940 3.429 -34.520) 35.195 18.529 ( -73.509 -42.440 8.892) 85.345 18.844 ( -2.771 -1.600 9.812) 10.321 18.847 ( 17.818 10.287 48.518) 52.700 19.038 ( -10.890 -6.288 32.245) 34.610 19.651 ( 10.291 5.941 -4.832) 12.827 20.087 ( -10.546 -6.089 -0.576) 12.191 21.095 ( -6.451 -3.724 -1.881) 7.682 21.412 ( -7.249 -4.185 -8.088) 11.640 22.288 ( 0.227 0.131 -16.268) 16.270 22.304 ( -23.135 -13.357 -4.348) 27.065 22.760 ( -1.493 -0.862 -21.487) 21.556 22.815 ( 9.301 5.370 -9.031) 14.032 23.339 ( 11.698 6.754 1.037) 13.547 24.213 ( -2.723 -1.572 0.717) 3.225 24.567 ( -0.649 -0.375 -0.744) 1.056 24.604 ( 2.571 1.484 -4.044) 5.017 25.152 ( -0.814 -0.470 -0.080) 0.943 25.858 ( -7.817 -4.513 21.701) 23.503 26.097 ( 3.913 2.259 0.987) 4.625 26.470 ( -12.392 -7.155 -4.638) 15.042 27.526 ( 3.832 2.212 0.163) 4.427 28.329 ( 15.010 8.666 -0.355) 17.336 31.023 ( -2.204 -1.273 -0.562) 2.606 31.778 ( -3.643 -2.103 0.954) 4.313 32.350 ( -1.303 -0.752 0.875) 1.740 32.850 ( 8.412 4.857 -2.911) 10.140 32.954 ( 8.135 4.697 -1.796) 9.564 33.012 ( 8.509 4.913 1.652) 9.963 33.826 ( -1.888 -1.090 3.469) 4.097 34.211 ( 2.366 1.366 -2.386) 3.627 34.519 ( -6.211 -3.586 1.120) 7.259 ======================= Grid point 406 (124/146) ======================= q-point: (-0.27 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.787 ( -25.972 -14.995 5.912) 30.567 9.186 ( 6.322 3.650 11.497) 13.619 9.749 ( -46.406 -26.793 13.965) 55.375 10.865 ( -4.676 -2.700 6.164) 8.195 10.938 ( 27.337 15.783 -0.390) 31.568 11.777 ( 28.386 16.389 -30.434) 44.728 14.159 ( 51.346 29.645 16.929) 61.659 15.138 ( 14.914 8.611 -3.686) 17.611 15.935 ( 6.750 3.897 -9.678) 12.426 16.240 ( 18.618 10.749 -5.603) 22.217 16.710 ( -88.555 -51.127 7.832) 102.554 17.852 ( 7.395 4.270 -24.753) 26.184 18.877 ( 3.465 2.001 -0.505) 4.033 19.055 ( -8.053 -4.650 28.237) 29.729 19.331 ( -0.820 -0.474 12.583) 12.619 19.828 ( -10.925 -6.307 -1.057) 12.659 19.937 ( 15.331 8.852 12.258) 21.533 20.850 ( -13.300 -7.679 -0.028) 15.358 21.460 ( 11.205 6.469 6.409) 14.438 21.667 ( -26.051 -15.041 -5.278) 30.541 22.241 ( 7.721 4.457 -19.670) 21.596 22.672 ( 5.076 2.931 -19.290) 20.161 23.027 ( 12.007 6.932 -0.590) 13.877 23.638 ( 12.056 6.961 3.422) 14.336 24.169 ( -1.176 -0.679 0.377) 1.409 24.533 ( -1.615 -0.932 -1.302) 2.274 24.670 ( 6.605 3.814 -6.458) 9.994 25.141 ( -0.359 -0.207 -0.059) 0.419 25.815 ( -8.100 -4.676 16.245) 18.745 26.069 ( -18.660 -10.773 -7.458) 22.801 26.226 ( 4.169 2.407 6.807) 8.337 27.593 ( 2.234 1.290 -1.099) 2.804 28.560 ( 5.672 3.275 -1.131) 6.647 30.988 ( -0.465 -0.269 -0.720) 0.898 31.722 ( -1.728 -0.998 1.193) 2.325 32.315 ( -2.091 -1.207 0.106) 2.417 33.008 ( 6.332 3.656 -1.448) 7.454 33.090 ( 5.393 3.113 -2.987) 6.906 33.177 ( 4.968 2.868 1.999) 6.075 33.817 ( -1.185 -0.684 3.515) 3.772 34.206 ( -1.337 -0.772 -4.550) 4.805 34.407 ( -3.565 -2.058 1.728) 4.464 ======================= Grid point 413 (125/146) ======================= q-point: ( 0.36 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.229 ( -0.000 15.571 60.763) 62.726 6.622 ( -0.000 38.866 57.973) 69.795 8.305 ( -0.000 17.900 40.059) 43.877 10.620 ( 0.000 -2.410 -7.181) 7.574 11.224 ( -0.000 0.106 -55.273) 55.273 11.334 ( -0.000 4.910 -56.420) 56.633 12.843 ( -0.000 7.253 -27.207) 28.158 15.113 ( 0.000 -13.101 29.479) 32.259 15.374 ( 0.000 -7.177 1.700) 7.375 15.664 ( 0.000 6.235 42.001) 42.461 17.591 ( 0.000 -9.906 -31.459) 32.982 17.894 ( -0.000 4.847 -28.905) 29.309 18.785 ( 0.000 -6.766 15.860) 17.243 18.927 ( -0.000 5.789 19.726) 20.558 19.723 ( 0.000 3.911 32.673) 32.907 19.762 ( 0.000 -1.633 17.525) 17.601 20.059 ( -0.000 11.420 22.658) 25.373 21.293 ( -0.000 8.721 -35.711) 36.761 22.536 ( 0.000 -7.404 -16.745) 18.309 22.699 ( -0.000 1.840 -12.550) 12.684 22.912 ( 0.000 -6.658 -9.096) 11.272 22.965 ( -0.000 -2.745 -20.754) 20.934 24.092 ( 0.000 -20.276 2.595) 20.442 24.249 ( 0.000 -36.243 -4.547) 36.527 24.329 ( 0.000 -2.422 1.724) 2.973 24.549 ( -0.000 6.070 1.577) 6.272 24.791 ( 0.000 -8.167 -6.215) 10.262 25.422 ( -0.000 9.679 12.007) 15.422 25.545 ( 0.000 -4.504 -0.970) 4.607 26.335 ( -0.000 4.541 0.492) 4.567 26.604 ( -0.000 1.696 -0.639) 1.813 26.719 ( 0.000 1.806 9.939) 10.101 27.236 ( -0.000 18.925 3.577) 19.260 31.292 ( 0.000 -5.700 1.128) 5.811 32.045 ( -0.000 0.053 0.097) 0.111 32.129 ( -0.000 10.907 1.768) 11.050 32.268 ( 0.000 -1.840 5.216) 5.531 32.408 ( -0.000 7.988 1.751) 8.178 32.511 ( -0.000 4.916 -9.239) 10.466 33.950 ( 0.000 0.429 2.734) 2.767 33.970 ( 0.000 0.241 2.035) 2.049 34.791 ( 0.000 -2.219 3.585) 4.217 ======================= Grid point 414 (126/146) ======================= q-point: ( 0.45 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.064 ( 24.014 19.577 51.120) 59.776 7.466 ( 9.148 29.144 46.415) 55.565 8.882 ( 11.800 34.045 23.407) 42.967 10.528 ( 2.678 -3.741 -10.722) 11.668 10.915 ( 4.322 3.862 -38.003) 38.442 11.075 ( 3.104 14.392 -46.038) 48.335 12.776 ( 4.027 5.075 -22.907) 23.806 15.022 ( -18.754 -16.228 4.099) 25.137 15.084 ( -12.209 -4.348 17.359) 21.663 16.159 ( 11.302 -1.255 23.483) 26.091 17.406 ( 14.226 -8.456 -15.190) 22.464 17.824 ( 4.253 6.913 -12.235) 14.683 18.859 ( 2.106 -6.105 16.337) 17.567 19.146 ( 0.112 10.698 17.408) 20.433 19.645 ( -16.987 -0.849 24.812) 30.082 20.147 ( 7.324 1.998 17.076) 18.687 20.304 ( -0.038 6.367 14.799) 16.111 21.121 ( -0.197 12.561 -34.480) 36.697 22.381 ( 5.827 -9.340 -16.423) 19.771 22.614 ( 0.539 -2.994 -10.523) 10.954 22.733 ( -5.399 -5.952 -9.814) 12.684 22.804 ( 0.653 -5.461 -13.940) 14.986 23.557 ( -34.097 -21.401 -2.838) 40.357 23.772 ( -5.635 -42.238 -6.496) 43.104 24.317 ( -0.710 -2.673 1.535) 3.163 24.570 ( -1.783 3.155 0.102) 3.625 24.675 ( -1.299 -0.388 -2.776) 3.090 25.403 ( -6.178 4.432 1.354) 7.723 25.726 ( 9.903 -1.484 5.766) 11.555 26.251 ( -9.776 -2.572 6.977) 12.283 26.689 ( 5.073 3.556 -1.009) 6.277 26.985 ( 14.342 3.511 5.998) 15.937 27.469 ( 3.746 20.790 1.394) 21.171 31.213 ( -2.705 -6.067 0.691) 6.678 31.997 ( -3.694 -0.115 0.235) 3.703 32.300 ( 3.953 0.505 3.353) 5.208 32.369 ( 7.829 8.672 1.669) 11.802 32.504 ( 2.564 7.919 -3.890) 9.188 32.550 ( 3.047 8.551 -2.771) 9.491 33.933 ( -2.596 -0.372 2.654) 3.731 34.033 ( 3.378 1.022 1.155) 3.713 34.770 ( -2.019 -3.378 2.720) 4.784 ======================= Grid point 415 (127/146) ======================= q-point: ( 0.55 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.853 ( 7.369 11.254 24.052) 27.558 8.265 ( 28.582 20.395 40.263) 53.423 9.529 ( 6.350 20.317 3.576) 21.584 10.703 ( 18.958 12.688 -17.720) 28.886 10.873 ( 13.875 13.588 -5.319) 20.136 11.086 ( 10.513 25.525 -27.361) 38.868 12.593 ( -14.476 -2.565 -16.366) 22.000 14.585 ( -7.471 -25.183 5.797) 26.900 15.035 ( -2.265 4.131 4.888) 6.789 16.302 ( 0.053 6.652 -4.093) 7.810 17.512 ( 18.478 -7.995 -26.671) 33.417 18.153 ( 16.161 5.994 37.290) 41.081 18.968 ( 1.152 -1.661 14.836) 14.974 19.394 ( 0.653 12.623 15.374) 19.903 19.530 ( -15.456 -2.015 23.961) 28.584 20.129 ( -16.847 -2.821 -2.669) 17.289 20.364 ( -5.193 -2.290 5.942) 8.217 21.086 ( 4.725 11.766 -19.162) 22.977 22.147 ( -20.702 -36.487 -8.280) 42.760 22.329 ( -7.801 -14.629 -9.994) 19.358 22.509 ( 1.878 -6.825 -5.006) 8.670 22.659 ( -2.712 -1.765 -9.742) 10.265 22.971 ( -9.237 3.281 -15.095) 17.999 23.231 ( -3.903 -26.988 -7.354) 28.243 24.286 ( -1.301 -2.076 1.433) 2.838 24.568 ( -2.901 1.435 0.131) 3.239 24.661 ( 0.886 2.179 -1.650) 2.873 25.341 ( -8.809 7.125 -0.034) 11.330 25.884 ( 7.515 -2.532 4.217) 8.981 26.131 ( -8.172 -5.101 12.348) 15.661 26.742 ( -2.729 3.031 -1.412) 4.317 27.241 ( 12.840 -3.734 0.489) 13.381 27.821 ( 11.282 21.310 1.227) 24.144 31.109 ( -2.943 -5.444 0.129) 6.189 31.929 ( -4.209 -0.473 0.335) 4.249 32.351 ( 1.475 -2.136 2.405) 3.538 32.606 ( 6.258 7.509 -5.475) 11.203 32.640 ( 8.786 10.786 1.210) 13.964 32.715 ( 6.651 8.352 -0.002) 10.677 33.904 ( -2.501 -0.644 2.809) 3.816 34.106 ( 3.449 1.183 -0.309) 3.659 34.698 ( -3.918 -4.364 1.710) 6.109 ======================= Grid point 416 (128/146) ======================= q-point: ( 0.64 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.089 ( -0.206 6.962 8.870) 11.277 9.165 ( 19.465 1.534 21.019) 28.689 9.644 ( 5.985 17.761 3.768) 19.118 10.682 ( 4.154 -8.661 -8.593) 12.889 11.254 ( 10.603 28.945 -22.866) 38.381 11.915 ( -37.002 -7.147 -3.654) 37.862 12.164 ( 47.794 49.937 11.150) 70.016 14.443 ( 18.270 -29.802 1.409) 34.984 15.163 ( 13.342 -1.360 -3.744) 13.924 16.400 ( -4.091 31.924 -5.085) 32.585 17.498 ( 13.583 -4.857 -29.935) 33.230 18.740 ( 14.291 -9.279 32.023) 36.274 19.046 ( -5.900 -4.181 8.715) 11.325 19.374 ( -37.688 -13.609 21.325) 45.392 19.555 ( -21.157 3.120 9.959) 23.591 19.665 ( -1.752 17.109 16.900) 24.112 20.179 ( -10.167 -10.094 1.019) 14.363 21.119 ( 0.444 5.132 -11.454) 12.559 21.310 ( -12.359 -28.991 -10.362) 33.176 22.070 ( 0.383 -18.172 -12.836) 22.251 22.251 ( -6.083 -33.860 -9.669) 35.735 22.654 ( 7.126 5.556 -7.777) 11.922 22.708 ( -2.866 3.998 -13.930) 14.773 23.279 ( 8.647 13.363 0.175) 15.918 24.249 ( -2.087 -1.499 0.626) 2.645 24.505 ( -3.533 -1.694 0.769) 3.993 24.711 ( 1.000 6.005 -1.765) 6.339 25.251 ( -9.356 6.861 -0.293) 11.606 25.983 ( 4.543 -5.588 -0.757) 7.241 26.075 ( -3.610 -5.387 17.577) 18.735 26.623 ( -11.683 1.619 -2.332) 12.023 27.383 ( 10.274 -4.816 -2.072) 11.534 28.222 ( 12.101 16.423 0.318) 20.402 31.018 ( -1.702 -4.713 -0.274) 5.018 31.854 ( -4.663 0.127 0.499) 4.691 32.353 ( -0.104 -2.154 1.023) 2.387 32.758 ( 6.855 8.040 -3.615) 11.167 32.873 ( 7.000 6.707 0.330) 9.700 32.929 ( 8.834 6.984 0.884) 11.296 33.881 ( -2.221 -0.245 2.959) 3.708 34.162 ( 2.700 0.871 -1.916) 3.423 34.583 ( -5.221 -4.944 0.975) 7.256 ======================= Grid point 417 (129/146) ======================= q-point: (-0.27 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.094 ( -13.850 -0.502 8.950) 16.498 9.204 ( -0.012 -4.588 3.735) 5.916 10.281 ( 21.022 13.511 5.081) 25.500 10.530 ( -19.646 -18.093 0.232) 26.709 11.090 ( -22.114 3.350 3.132) 22.585 11.622 ( 10.012 35.123 -11.531) 38.299 13.713 ( 55.806 43.797 14.297) 72.366 14.556 ( 31.185 -33.671 -4.113) 46.078 15.356 ( 19.375 -5.320 -7.793) 21.551 16.711 ( -6.487 48.812 -1.763) 49.273 17.430 ( 3.307 -10.044 -24.151) 26.365 17.880 ( -75.571 -27.242 1.101) 80.338 18.865 ( -1.388 -0.059 -1.107) 1.776 19.155 ( -1.995 -18.423 25.257) 31.326 19.560 ( -8.241 6.206 3.399) 10.862 19.920 ( -8.849 -11.143 3.077) 14.558 20.051 ( 2.436 18.192 24.117) 30.307 20.994 ( -7.561 -4.276 -7.492) 11.470 21.135 ( 16.391 -18.829 5.934) 25.660 21.621 ( -2.987 -38.844 -5.174) 39.301 21.976 ( 6.772 -0.703 -21.431) 22.486 22.621 ( -2.087 15.498 -18.405) 24.152 22.889 ( 11.254 4.085 4.264) 12.709 23.588 ( 8.778 14.290 2.121) 16.905 24.200 ( -2.331 -0.406 0.234) 2.378 24.453 ( -0.371 -3.152 0.991) 3.325 24.775 ( -1.019 10.535 -2.789) 10.946 25.164 ( -5.872 2.480 -0.477) 6.392 25.916 ( -4.482 -10.981 6.825) 13.684 26.070 ( -1.191 -10.528 -1.481) 10.699 26.437 ( -12.071 8.074 6.233) 15.803 27.473 ( 8.153 -4.856 -3.069) 9.973 28.518 ( 6.569 10.615 -0.609) 12.498 30.959 ( 0.138 -4.034 -0.465) 4.063 31.792 ( -4.045 1.853 0.859) 4.531 32.323 ( -1.093 -2.522 0.060) 2.750 32.927 ( 6.711 6.650 -2.616) 9.803 33.027 ( 4.908 4.600 -0.509) 6.746 33.122 ( 6.400 3.217 1.515) 7.322 33.870 ( -1.841 0.629 2.992) 3.569 34.177 ( 0.514 0.043 -3.621) 3.658 34.456 ( -4.461 -4.348 1.169) 6.338 ======================= Grid point 425 (130/146) ======================= q-point: ( 0.45 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.478 ( -0.000 27.528 49.182) 56.362 7.943 ( -0.000 14.837 35.979) 38.918 9.283 ( -0.000 42.178 5.214) 42.499 10.401 ( -0.000 6.997 -9.106) 11.483 10.618 ( -0.000 11.421 -40.707) 42.279 10.999 ( -0.000 19.842 -23.085) 30.440 12.624 ( -0.000 1.054 -17.052) 17.085 15.119 ( 0.000 -10.016 7.347) 12.422 15.225 ( 0.000 -4.750 -2.867) 5.548 16.129 ( 0.000 -14.798 18.216) 23.469 17.034 ( 0.000 -7.858 -16.069) 17.887 17.886 ( -0.000 6.865 19.391) 20.570 18.883 ( 0.000 -7.003 14.940) 16.500 19.414 ( -0.000 16.087 17.690) 23.911 19.965 ( 0.000 -1.159 11.752) 11.809 20.227 ( 0.000 3.408 21.534) 21.802 20.445 ( -0.000 1.769 7.568) 7.772 20.983 ( -0.000 20.413 -44.439) 48.903 22.125 ( 0.000 -9.715 -11.910) 15.370 22.462 ( 0.000 -15.264 -5.226) 16.134 22.658 ( 0.000 -6.847 -8.660) 11.039 22.675 ( 0.000 -3.302 -7.125) 7.853 23.267 ( 0.000 -45.480 -11.839) 46.996 23.680 ( 0.000 -21.180 -1.420) 21.227 24.303 ( 0.000 -2.803 1.653) 3.254 24.607 ( 0.000 -3.447 -2.768) 4.421 24.650 ( -0.000 3.983 -1.743) 4.347 25.351 ( 0.000 -9.752 -1.483) 9.865 25.763 ( -0.000 8.874 6.758) 11.154 26.445 ( -0.000 5.886 -0.699) 5.927 26.543 ( 0.000 -10.398 9.218) 13.896 27.048 ( -0.000 13.131 4.730) 13.957 27.625 ( -0.000 19.602 -1.312) 19.646 31.179 ( 0.000 -6.512 0.699) 6.549 32.004 ( 0.000 -3.067 -1.092) 3.255 32.321 ( 0.000 -0.679 4.532) 4.582 32.390 ( -0.000 11.828 -0.438) 11.836 32.547 ( -0.000 12.317 -3.963) 12.938 32.608 ( -0.000 9.435 -0.473) 9.447 33.983 ( 0.000 -0.849 0.611) 1.046 34.007 ( -0.000 1.270 2.540) 2.840 34.767 ( 0.000 -4.563 2.018) 4.989 ======================= Grid point 426 (131/146) ======================= q-point: ( 0.55 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.114 ( -0.585 14.501 25.690) 29.506 8.351 ( 16.251 18.292 32.227) 40.464 9.551 ( 1.328 8.076 -13.696) 15.955 10.633 ( 16.037 17.463 -24.752) 34.276 10.723 ( 4.748 43.449 0.016) 43.708 11.098 ( 5.619 30.128 -9.414) 32.061 12.521 ( 3.551 -7.957 -12.364) 15.126 14.701 ( -28.616 -17.127 -0.231) 33.351 15.178 ( -5.301 -0.881 1.590) 5.604 16.203 ( 13.842 -1.240 -0.761) 13.918 17.009 ( 11.856 -5.795 -11.025) 17.196 18.243 ( 9.667 0.682 40.018) 41.174 18.964 ( 5.073 -5.821 13.188) 15.283 19.712 ( -1.820 21.626 17.095) 27.627 19.896 ( -12.069 -2.893 10.853) 16.488 20.296 ( -8.528 -0.448 -1.060) 8.605 20.428 ( -1.795 -4.662 -0.446) 5.015 20.931 ( 6.972 18.588 -36.282) 41.358 21.941 ( -4.298 -23.549 -4.650) 24.385 22.290 ( 6.468 -20.785 0.136) 21.768 22.397 ( -7.740 -18.016 -4.604) 20.141 22.498 ( -12.148 -27.777 -0.154) 30.318 22.878 ( 0.155 -6.840 -13.478) 15.115 23.257 ( -16.289 -1.806 -7.964) 18.221 24.286 ( -0.328 -2.806 1.444) 3.172 24.591 ( 2.769 -0.439 -0.421) 2.835 24.660 ( -1.612 2.029 -2.295) 3.462 25.362 ( 9.069 -5.252 -1.239) 10.553 25.848 ( -2.585 3.777 4.203) 6.214 26.325 ( -9.181 -3.969 8.182) 12.922 26.695 ( 10.595 -1.406 0.342) 10.693 27.156 ( -2.711 6.519 2.243) 7.408 27.873 ( 7.239 20.161 -0.914) 21.440 31.101 ( -2.379 -5.818 0.439) 6.301 31.956 ( -0.851 -2.982 -0.998) 3.257 32.340 ( -0.046 -0.901 3.160) 3.286 32.543 ( 5.764 8.954 -2.304) 10.895 32.684 ( 2.376 14.631 -0.851) 14.848 32.721 ( 2.837 9.136 -0.377) 9.574 33.954 ( -1.911 -0.776 1.153) 2.363 34.065 ( 2.487 1.016 1.018) 2.873 34.711 ( -2.043 -5.523 1.167) 6.003 ======================= Grid point 427 (132/146) ======================= q-point: ( 0.64 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.269 ( -1.420 8.402 7.997) 11.686 9.090 ( 12.456 9.708 21.294) 26.511 9.503 ( 10.462 5.833 -12.952) 17.642 10.752 ( -4.773 5.546 1.703) 7.513 11.137 ( 16.604 30.876 -17.456) 39.163 12.025 ( 34.803 65.635 6.650) 74.588 12.340 ( -9.129 -9.032 -7.128) 14.688 14.018 ( -17.979 -32.044 -0.212) 36.744 15.094 ( -2.094 0.020 -0.640) 2.190 16.574 ( 15.115 25.184 -1.026) 29.389 17.066 ( 10.128 -3.229 -12.711) 16.571 18.673 ( 10.690 -9.660 32.408) 35.467 19.083 ( 0.955 -5.247 4.131) 6.746 19.746 ( -7.274 -2.115 9.623) 12.247 19.963 ( -13.731 12.950 -2.614) 19.055 20.102 ( -6.144 7.647 19.610) 21.927 20.260 ( -8.665 -9.506 -1.112) 12.911 20.969 ( 8.688 7.009 -26.399) 28.663 21.252 ( -27.784 -48.082 -2.034) 55.569 21.748 ( -17.437 -39.960 -5.794) 43.982 22.012 ( -6.312 -19.290 -6.720) 21.380 22.475 ( 13.891 -1.265 6.803) 15.519 22.756 ( -4.508 9.765 -14.937) 18.406 23.289 ( 7.227 16.829 -1.855) 18.409 24.259 ( -0.900 -2.323 0.797) 2.615 24.603 ( -4.602 0.437 -0.685) 4.673 24.657 ( 4.204 0.821 -0.272) 4.292 25.450 ( 1.162 3.356 -0.900) 3.664 25.837 ( 0.209 -3.465 1.377) 3.734 26.197 ( -6.840 -9.232 9.005) 14.598 26.806 ( -0.656 4.601 0.160) 4.650 27.157 ( 2.661 -2.718 -1.913) 4.257 28.213 ( 9.913 17.949 -0.010) 20.505 31.004 ( -2.678 -5.127 0.114) 5.786 31.907 ( -1.595 -1.472 -0.459) 2.219 32.342 ( -0.340 -1.904 1.442) 2.413 32.714 ( 5.952 8.927 -1.977) 10.910 32.864 ( 3.778 8.891 0.278) 9.664 32.881 ( 5.907 9.855 -0.053) 11.490 33.929 ( -1.422 -0.340 1.406) 2.029 34.117 ( 2.152 0.833 -0.372) 2.337 34.611 ( -3.701 -6.073 0.491) 7.129 ======================= Grid point 428 (133/146) ======================= q-point: (-0.27 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.387 ( -4.649 10.516 8.838) 14.502 9.107 ( 0.565 -11.368 -4.312) 12.171 9.852 ( 14.586 2.197 -6.778) 16.234 10.863 ( 3.416 19.242 10.866) 22.360 11.616 ( 1.666 27.344 -8.490) 28.680 11.848 ( -28.184 3.387 6.907) 29.215 13.302 ( 36.918 14.409 1.749) 39.669 13.721 ( 28.541 -1.677 -1.158) 28.614 15.118 ( 4.892 0.470 -1.522) 5.145 17.077 ( 8.559 4.411 -5.199) 10.942 17.147 ( 8.264 34.815 -6.619) 36.390 18.693 ( -35.372 -15.657 -10.898) 40.188 18.882 ( 2.070 -1.382 6.160) 6.644 19.427 ( -37.328 -20.883 24.227) 49.157 19.787 ( -7.312 7.240 1.194) 10.359 19.944 ( -5.962 -15.624 4.243) 17.252 20.311 ( -4.157 -4.086 3.892) 7.009 20.522 ( 5.772 -44.644 -8.069) 45.733 21.053 ( 8.472 3.534 12.169) 15.243 21.218 ( -0.010 -17.286 -12.660) 21.426 21.743 ( -0.301 -7.530 -10.264) 12.734 22.690 ( -2.196 14.267 -14.268) 20.296 22.787 ( 11.127 3.589 9.311) 14.946 23.615 ( 9.229 17.914 0.850) 20.170 24.223 ( -1.382 -1.447 -0.115) 2.005 24.517 ( -5.616 -0.493 2.190) 6.048 24.735 ( 5.527 -0.671 -1.696) 5.820 25.416 ( -11.302 8.933 0.192) 14.407 25.836 ( 4.887 -8.086 -0.352) 9.455 26.005 ( -7.050 -14.927 1.340) 16.563 26.782 ( -11.226 10.254 5.901) 16.309 27.200 ( 11.092 -8.384 -4.702) 14.678 28.520 ( 7.379 13.578 -0.128) 15.454 30.921 ( -1.335 -4.575 -0.123) 4.767 31.871 ( -2.188 1.059 0.269) 2.445 32.312 ( -1.005 -2.841 0.011) 3.014 32.883 ( 5.315 8.140 -1.215) 9.797 33.006 ( 3.840 6.296 0.228) 7.378 33.060 ( 5.818 4.991 0.462) 7.679 33.921 ( -0.976 0.514 1.430) 1.806 34.145 ( 1.013 0.761 -1.638) 2.071 34.485 ( -4.094 -5.833 0.414) 7.138 ======================= Grid point 437 (134/146) ======================= q-point: ( 0.55 0.55 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.288 ( 0.000 -0.267 0.767) 0.812 8.736 ( -0.000 34.492 38.016) 51.332 9.512 ( 0.000 -4.097 -4.360) 5.983 10.463 ( -0.000 21.701 -24.507) 32.734 11.070 ( -0.000 22.957 -10.805) 25.373 11.448 ( -0.000 68.826 3.170) 68.899 12.225 ( 0.000 -24.999 -9.512) 26.747 14.955 ( 0.000 -8.282 -3.745) 9.089 15.228 ( -0.000 15.372 -6.518) 16.697 15.909 ( 0.000 -12.879 2.053) 13.042 16.897 ( 0.000 1.361 7.019) 7.150 18.449 ( 0.000 -5.538 41.960) 42.323 18.931 ( 0.000 -8.388 11.194) 13.988 19.983 ( 0.000 -6.546 -2.205) 6.908 20.077 ( -0.000 24.253 13.172) 27.600 20.290 ( 0.000 -10.313 -14.785) 18.026 20.375 ( 0.000 -7.646 2.294) 7.983 20.712 ( -0.000 12.077 -41.984) 43.686 21.728 ( 0.000 -50.127 2.617) 50.196 21.972 ( 0.000 -1.320 9.101) 9.196 22.203 ( 0.000 -18.435 -4.357) 18.943 22.589 ( 0.000 -13.838 9.549) 16.813 22.761 ( -0.000 6.888 -12.515) 14.285 23.320 ( 0.000 -3.603 -8.111) 8.876 24.267 ( 0.000 -3.157 1.235) 3.390 24.548 ( 0.000 -1.268 0.070) 1.270 24.646 ( -0.000 -0.286 -3.444) 3.455 25.187 ( 0.000 -5.571 0.496) 5.593 25.960 ( -0.000 4.513 2.853) 5.339 26.469 ( 0.000 -12.535 9.990) 16.029 26.489 ( -0.000 2.804 -6.642) 7.210 27.314 ( -0.000 7.811 3.923) 8.740 27.984 ( -0.000 19.698 -1.883) 19.788 31.075 ( 0.000 -4.904 0.546) 4.934 31.909 ( 0.000 -4.485 -1.285) 4.665 32.359 ( 0.000 -0.956 2.418) 2.600 32.575 ( -0.000 10.301 -0.842) 10.336 32.779 ( -0.000 9.410 -0.720) 9.437 32.812 ( -0.000 14.640 -0.819) 14.663 33.956 ( 0.000 -1.581 -1.046) 1.896 34.073 ( -0.000 1.471 2.697) 3.072 34.676 ( 0.000 -6.382 0.458) 6.399 ======================= Grid point 438 (135/146) ======================= q-point: ( 0.64 0.55 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.292 ( 4.359 1.890 -6.904) 8.381 9.302 ( -8.732 1.120 13.584) 16.187 9.448 ( 7.620 24.894 11.332) 28.394 10.682 ( 12.336 13.624 -11.101) 21.471 11.153 ( 4.375 17.543 -9.139) 20.259 11.956 ( 11.748 -34.492 -8.040) 37.314 12.335 ( 15.463 78.045 -1.563) 79.577 14.469 ( -42.819 -3.463 -1.052) 42.971 15.150 ( -7.434 3.277 -2.493) 8.498 16.331 ( 35.546 14.588 0.828) 38.432 17.006 ( -1.457 4.443 12.393) 13.246 18.666 ( 4.100 -17.345 32.191) 36.795 18.989 ( 5.777 -10.094 7.528) 13.854 19.780 ( -3.383 -8.148 -9.567) 13.014 19.975 ( -3.820 -19.399 -25.877) 32.566 20.207 ( -3.393 -11.114 -5.695) 12.941 20.321 ( 5.605 5.695 -10.633) 13.301 20.686 ( 6.163 4.369 6.746) 10.128 21.227 ( -17.138 -16.012 -4.090) 23.808 21.908 ( -11.280 -16.398 1.463) 19.957 22.073 ( -35.258 -26.293 7.083) 44.549 22.287 ( 16.013 0.862 13.664) 21.068 22.796 ( -0.268 8.581 -10.110) 13.263 23.325 ( 4.471 14.823 -4.021) 15.996 24.247 ( 0.077 -2.858 0.785) 2.965 24.538 ( 1.562 -3.199 -1.770) 3.976 24.688 ( 3.360 2.827 -0.030) 4.391 25.244 ( 11.126 -5.392 0.355) 12.368 25.955 ( -6.380 2.430 1.784) 7.056 26.268 ( -8.302 -10.311 2.421) 13.458 26.625 ( 12.949 -3.936 -3.820) 14.063 27.316 ( -9.749 6.077 3.135) 11.908 28.232 ( 7.446 17.447 -0.533) 18.977 31.010 ( -2.771 -4.008 0.429) 4.891 31.871 ( 1.474 -3.757 -1.053) 4.171 32.351 ( -1.110 -1.435 1.270) 2.214 32.712 ( 3.892 9.884 0.387) 10.630 32.883 ( 2.463 8.297 -0.492) 8.669 32.948 ( 0.818 12.245 -0.767) 12.297 33.931 ( 0.170 -1.358 -1.321) 1.902 34.112 ( 0.516 1.292 2.302) 2.690 34.596 ( -1.869 -6.772 -0.155) 7.027 ======================= Grid point 449 (136/146) ======================= q-point: (-0.36 -0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.172 ( -0.000 -2.144 -10.571) 10.787 9.342 ( 0.000 -11.078 1.414) 11.168 9.888 ( -0.000 40.744 11.187) 42.252 10.700 ( -0.000 10.376 7.787) 12.973 11.086 ( -0.000 0.782 -12.576) 12.600 11.409 ( 0.000 -34.067 -8.136) 35.024 12.950 ( -0.000 80.737 -10.198) 81.378 14.850 ( -0.000 6.849 -2.785) 7.393 15.650 ( -0.000 31.190 -1.562) 31.230 15.810 ( 0.000 -6.542 9.247) 11.328 17.256 ( -0.000 9.114 24.816) 26.437 18.481 ( 0.000 -61.475 17.178) 63.830 18.888 ( 0.000 -7.798 5.645) 9.627 19.509 ( 0.000 -18.308 -7.026) 19.610 19.716 ( 0.000 -13.526 -27.023) 30.219 19.990 ( -0.000 11.099 -35.681) 37.368 20.122 ( 0.000 -13.321 -3.819) 13.858 20.876 ( -0.000 8.705 16.816) 18.936 21.338 ( -0.000 3.357 -4.082) 5.285 21.931 ( 0.000 -8.433 9.745) 12.888 22.203 ( 0.000 -19.099 5.899) 19.989 22.284 ( 0.000 -7.438 19.401) 20.778 22.817 ( -0.000 11.831 -6.268) 13.388 23.389 ( -0.000 14.781 -3.406) 15.168 24.217 ( 0.000 -3.111 0.387) 3.135 24.539 ( 0.000 -1.151 1.480) 1.875 24.581 ( 0.000 -0.451 -1.556) 1.620 25.142 ( 0.000 -1.095 1.041) 1.510 26.031 ( 0.000 -0.613 0.282) 0.674 26.325 ( 0.000 -16.836 8.833) 19.013 26.346 ( -0.000 0.605 -15.105) 15.117 27.487 ( -0.000 4.790 3.105) 5.708 28.325 ( -0.000 15.743 -0.031) 15.743 31.009 ( 0.000 -2.708 0.657) 2.787 31.803 ( 0.000 -4.128 -1.284) 4.323 32.354 ( 0.000 -1.769 0.626) 1.876 32.789 ( -0.000 10.353 2.010) 10.546 32.940 ( -0.000 7.870 -0.091) 7.870 33.049 ( -0.000 10.585 -1.515) 10.693 33.895 ( 0.000 -1.770 -2.555) 3.108 34.144 ( -0.000 1.118 3.402) 3.581 34.541 ( 0.000 -6.853 -0.756) 6.894 ======================= Grid point 534 (137/146) ======================= q-point: ( 0.36 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.591 ( 0.000 -0.000 59.984) 59.984 6.591 ( 0.000 -0.000 59.984) 59.984 8.453 ( 0.000 -0.000 34.831) 34.831 10.595 ( -0.000 0.000 -5.607) 5.607 10.809 ( -0.000 0.000 -58.713) 58.713 10.809 ( -0.000 0.000 -58.713) 58.713 12.567 ( -0.000 0.000 -23.317) 23.317 15.452 ( 0.000 -0.000 3.039) 3.039 15.452 ( 0.000 -0.000 3.039) 3.039 16.033 ( 0.000 -0.000 78.475) 78.475 17.524 ( -0.000 0.000 -29.526) 29.526 17.524 ( -0.000 0.000 -29.526) 29.526 18.977 ( 0.000 -0.000 13.924) 13.924 18.977 ( 0.000 -0.000 13.924) 13.924 19.973 ( 0.000 -0.000 32.257) 32.257 20.005 ( 0.000 -0.000 21.594) 21.594 20.005 ( 0.000 -0.000 21.594) 21.594 20.913 ( -0.000 0.000 -43.970) 43.970 22.519 ( -0.000 0.000 -15.847) 15.847 22.519 ( -0.000 0.000 -15.847) 15.847 22.805 ( -0.000 0.000 -23.363) 23.363 22.931 ( -0.000 0.000 -6.717) 6.717 24.370 ( 0.000 -0.000 0.889) 0.889 24.390 ( 0.000 0.000 1.247) 1.247 24.390 ( 0.000 0.000 1.247) 1.247 24.765 ( -0.000 -0.000 -2.592) 2.592 24.765 ( 0.000 0.000 -2.592) 2.592 25.495 ( 0.000 -0.000 5.680) 5.680 25.495 ( 0.000 -0.000 5.680) 5.680 26.293 ( 0.000 -0.000 0.552) 0.552 26.410 ( -0.000 0.000 -5.058) 5.058 26.978 ( 0.000 -0.000 6.883) 6.883 26.978 ( 0.000 -0.000 6.883) 6.883 31.369 ( 0.000 -0.000 1.815) 1.815 32.037 ( 0.000 -0.000 1.081) 1.081 32.037 ( 0.000 0.000 1.081) 1.081 32.334 ( 0.000 -0.000 3.709) 3.709 32.334 ( 0.000 -0.000 3.709) 3.709 32.393 ( -0.000 0.000 -9.024) 9.024 33.973 ( 0.000 -0.000 2.146) 2.146 33.973 ( 0.000 -0.000 2.146) 2.146 34.839 ( 0.000 -0.000 3.194) 3.194 ======================= Grid point 535 (138/146) ======================= q-point: ( 0.45 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.230 ( 20.148 11.632 51.773) 56.760 7.297 ( 19.298 11.142 52.573) 57.100 8.725 ( 6.393 3.691 19.716) 21.053 10.458 ( 5.995 3.461 -55.951) 56.377 10.507 ( 9.322 5.382 -42.440) 43.783 10.555 ( 0.704 0.406 -4.961) 5.027 12.505 ( 7.282 4.204 -18.938) 20.720 15.291 ( -13.218 -7.631 4.278) 15.851 15.347 ( -13.595 -7.849 8.685) 17.940 16.445 ( -9.056 -5.228 33.012) 34.628 17.433 ( 5.467 3.156 -28.539) 29.229 17.504 ( 16.425 9.483 14.903) 24.120 19.068 ( -1.570 -0.906 12.452) 12.584 19.088 ( 2.982 1.722 11.152) 11.672 19.928 ( -11.704 -6.757 26.036) 29.335 20.252 ( 1.542 0.890 9.566) 9.730 20.308 ( 5.557 3.208 20.507) 21.488 20.666 ( 8.519 4.919 -40.364) 41.545 22.378 ( 0.938 0.542 -14.919) 14.958 22.446 ( 1.451 0.838 -14.514) 14.610 22.669 ( 2.963 1.710 -20.243) 20.530 22.810 ( -6.592 -3.806 -5.054) 9.136 24.019 ( -32.351 -18.678 2.272) 37.425 24.340 ( -18.164 -10.487 -4.057) 21.363 24.364 ( -1.601 -0.925 0.581) 1.938 24.532 ( -1.136 -0.656 2.260) 2.613 24.672 ( -5.382 -3.107 -4.050) 7.418 25.380 ( -4.853 -2.802 5.224) 7.661 25.745 ( 8.359 4.826 1.412) 9.755 26.303 ( -1.229 -0.710 1.942) 2.405 26.531 ( 9.317 5.379 -1.611) 10.879 27.043 ( 9.916 5.725 8.329) 14.159 27.172 ( 6.310 3.643 1.448) 7.428 31.315 ( -4.959 -2.863 1.141) 5.838 32.010 ( -2.132 -1.231 1.287) 2.778 32.184 ( 10.317 5.957 0.557) 11.926 32.367 ( 3.511 2.027 -5.693) 6.988 32.375 ( 0.482 0.278 2.409) 2.472 32.416 ( 5.271 3.043 1.476) 6.263 33.963 ( -1.490 -0.860 2.272) 2.850 34.019 ( 2.067 1.194 1.060) 2.612 34.836 ( -2.160 -1.247 2.422) 3.476 ======================= Grid point 536 (139/146) ======================= q-point: ( 0.55 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.919 ( 7.000 4.042 31.239) 32.267 8.188 ( 28.301 16.340 39.199) 51.035 9.178 ( 25.743 14.863 6.107) 30.346 10.286 ( 13.219 7.632 -46.689) 49.121 10.561 ( 14.453 8.344 -8.380) 18.675 10.660 ( 13.880 8.014 -9.252) 18.506 12.507 ( -0.208 -0.120 -13.141) 13.143 15.032 ( -8.798 -5.080 4.836) 11.252 15.044 ( -17.308 -9.993 10.263) 22.466 16.276 ( -9.467 -5.466 -4.573) 11.850 17.353 ( 6.108 3.527 -28.165) 29.035 18.290 ( 23.772 13.725 53.571) 60.193 19.095 ( -3.192 -1.843 8.746) 9.491 19.255 ( 5.804 3.351 3.253) 7.450 19.855 ( -12.390 -7.153 27.699) 31.175 20.121 ( -5.944 -3.432 -17.995) 19.260 20.460 ( -2.665 -1.539 9.262) 9.760 20.744 ( 12.527 7.232 -18.081) 23.155 22.345 ( 3.425 1.977 -10.022) 10.774 22.378 ( 1.969 1.137 -15.481) 15.647 22.581 ( -10.159 -5.866 -3.586) 12.267 22.680 ( 8.855 5.112 -10.683) 14.787 23.019 ( -51.584 -29.782 0.685) 59.568 23.775 ( -26.483 -15.290 -4.600) 30.924 24.326 ( -2.057 -1.188 0.836) 2.518 24.553 ( 0.758 0.437 0.084) 0.879 24.610 ( -0.419 -0.242 -1.081) 1.184 25.289 ( -5.303 -3.061 1.586) 6.325 25.900 ( 5.370 3.100 0.934) 6.270 26.269 ( -4.091 -2.362 7.440) 8.813 26.679 ( 2.939 1.697 -0.698) 3.464 27.300 ( 5.578 3.220 -2.053) 6.760 27.461 ( 20.049 11.575 4.804) 23.644 31.197 ( -5.414 -3.126 0.124) 6.253 31.958 ( -3.273 -1.890 1.166) 3.955 32.392 ( -0.215 -0.124 1.208) 1.234 32.440 ( 7.783 4.493 -4.153) 9.900 32.471 ( 12.462 7.195 0.289) 14.393 32.586 ( 8.185 4.726 1.256) 9.535 33.941 ( -1.900 -1.097 2.389) 3.244 34.076 ( 2.623 1.514 -0.369) 3.051 34.778 ( -4.223 -2.438 1.514) 5.106 ======================= Grid point 537 (140/146) ======================= q-point: ( 0.64 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.103 ( -0.425 -0.245 12.954) 12.963 9.100 ( 32.768 18.918 17.201) 41.563 9.523 ( -0.945 -0.545 -0.720) 1.307 10.386 ( 20.642 11.918 -28.966) 37.512 10.913 ( 10.293 5.943 1.383) 11.965 11.393 ( 56.885 32.843 8.659) 66.254 12.152 ( -26.481 -15.289 -3.584) 30.787 14.816 ( -7.206 -4.160 7.567) 11.247 15.120 ( 14.850 8.574 2.940) 17.398 16.031 ( -7.480 -4.319 -9.196) 12.616 17.291 ( 6.589 3.804 -27.250) 28.293 19.042 ( -5.358 -3.094 2.342) 6.615 19.164 ( 7.928 4.577 25.968) 27.534 19.336 ( 10.743 6.203 6.846) 14.169 19.782 ( -12.520 -7.228 28.693) 32.129 19.833 ( -16.576 -9.570 9.272) 21.268 20.349 ( -9.790 -5.652 3.005) 11.697 20.841 ( 9.446 5.454 -23.076) 25.524 21.816 ( -42.154 -24.338 -4.695) 48.901 22.211 ( -9.979 -5.761 -7.129) 13.549 22.304 ( 2.455 1.417 -17.182) 17.415 22.583 ( 6.096 3.519 2.681) 7.532 22.785 ( -4.533 -2.617 -8.296) 9.809 23.222 ( -10.576 -6.106 0.133) 12.213 24.280 ( -2.529 -1.460 0.143) 2.924 24.559 ( -0.007 -0.004 -0.797) 0.797 24.593 ( -1.177 -0.679 0.909) 1.635 25.192 ( -3.389 -1.956 0.050) 3.913 26.006 ( 3.604 2.081 -1.274) 4.352 26.260 ( -3.021 -1.744 13.879) 14.310 26.619 ( -6.726 -3.883 -4.213) 8.836 27.402 ( 5.240 3.025 -3.089) 6.793 27.940 ( 19.245 11.111 1.857) 22.299 31.086 ( -4.121 -2.379 -0.454) 4.780 31.883 ( -4.012 -2.316 1.112) 4.764 32.384 ( -0.896 -0.517 0.125) 1.042 32.598 ( 9.038 5.218 -2.946) 10.844 32.757 ( 9.823 5.671 1.218) 11.408 32.799 ( 11.002 6.352 0.545) 12.715 33.916 ( -1.915 -1.106 2.494) 3.333 34.125 ( 2.283 1.318 -1.906) 3.253 34.672 ( -5.772 -3.332 0.812) 6.714 ======================= Grid point 546 (141/146) ======================= q-point: ( 0.45 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.469 ( 0.000 11.117 49.267) 50.506 7.800 ( -0.000 29.786 46.577) 55.287 8.825 ( -0.000 3.652 4.428) 5.739 10.094 ( -0.000 8.554 -44.559) 45.373 10.154 ( -0.000 11.444 -35.005) 36.828 10.558 ( -0.000 6.291 -6.952) 9.376 12.381 ( -0.000 8.107 -13.557) 15.796 15.374 ( 0.000 -9.250 4.787) 10.415 15.397 ( 0.000 -9.797 0.049) 9.797 16.647 ( 0.000 -24.993 15.086) 29.193 17.061 ( 0.000 -6.116 -14.346) 15.595 17.765 ( -0.000 25.585 35.013) 43.364 19.089 ( 0.000 -4.172 10.358) 11.167 19.237 ( -0.000 8.890 7.292) 11.498 20.130 ( 0.000 -4.597 -1.304) 4.778 20.337 ( 0.000 1.581 18.980) 19.046 20.339 ( -0.000 10.363 -32.858) 34.453 20.460 ( -0.000 3.341 13.013) 13.436 22.204 ( 0.000 -6.576 -10.539) 12.423 22.388 ( -0.000 5.393 -13.406) 14.451 22.529 ( -0.000 4.665 -16.395) 17.046 22.778 ( 0.000 -7.711 -3.435) 8.441 24.154 ( 0.000 -38.966 -3.872) 39.158 24.163 ( 0.000 -20.907 3.602) 21.215 24.358 ( 0.000 -1.780 0.882) 1.987 24.574 ( -0.000 1.519 0.917) 1.775 24.668 ( 0.000 -6.101 -4.633) 7.661 25.514 ( 0.000 -7.777 -1.715) 7.964 25.631 ( -0.000 9.056 6.821) 11.338 26.342 ( -0.000 4.071 0.055) 4.072 26.549 ( -0.000 12.542 -2.004) 12.701 26.976 ( 0.000 -1.384 10.107) 10.201 27.269 ( -0.000 14.847 -0.786) 14.868 31.319 ( 0.000 -6.503 1.124) 6.600 32.042 ( 0.000 -1.339 -0.331) 1.380 32.164 ( -0.000 10.790 1.348) 10.874 32.331 ( -0.000 5.532 -5.563) 7.845 32.366 ( 0.000 -0.769 3.233) 3.323 32.453 ( -0.000 6.303 1.166) 6.410 34.001 ( 0.000 -0.378 0.702) 0.797 34.002 ( -0.000 0.784 1.803) 1.966 34.852 ( 0.000 -2.549 1.755) 3.095 ======================= Grid point 547 (142/146) ======================= q-point: ( 0.55 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.075 ( 11.380 12.063 36.804) 40.368 8.339 ( 2.373 10.644 28.042) 30.088 9.008 ( 15.896 26.028 -12.143) 32.827 9.943 ( 6.124 17.407 -28.223) 33.720 10.310 ( 16.193 16.318 -12.941) 26.381 10.600 ( 2.053 12.271 -4.693) 13.298 12.425 ( 3.764 6.635 -8.098) 11.125 15.087 ( -14.250 -18.990 1.600) 23.796 15.290 ( -7.450 -6.861 3.672) 10.773 16.347 ( -8.329 -13.250 -1.047) 15.685 17.032 ( 8.162 -4.999 -12.418) 15.679 18.459 ( 16.376 13.082 52.025) 56.088 19.129 ( 1.043 -3.413 6.694) 7.586 19.360 ( -2.841 15.881 -1.220) 16.179 19.950 ( -0.679 3.689 -30.242) 30.474 20.219 ( -10.196 1.301 13.430) 16.912 20.528 ( 2.526 -1.393 -3.684) 4.679 20.541 ( 4.609 1.477 2.039) 5.252 22.133 ( 4.134 -6.401 -3.797) 8.514 22.341 ( -0.267 4.760 -10.734) 11.745 22.549 ( 5.087 7.911 -6.703) 11.549 22.620 ( -5.624 -9.450 -2.193) 11.214 23.527 ( -32.054 -35.712 -0.395) 47.989 23.673 ( -12.689 -41.228 -2.311) 43.198 24.342 ( -0.845 -1.966 0.659) 2.239 24.569 ( -0.297 1.657 -0.022) 1.683 24.624 ( -0.024 0.573 -1.480) 1.587 25.413 ( -3.206 -1.158 0.032) 3.408 25.811 ( 5.433 2.915 1.866) 6.441 26.359 ( -2.313 2.018 2.418) 3.907 26.672 ( 3.569 6.018 -0.369) 7.006 27.114 ( 6.171 -0.236 4.047) 7.384 27.473 ( 7.106 19.116 -0.541) 20.401 31.227 ( -3.359 -6.378 0.395) 7.219 32.000 ( -2.141 -1.864 0.027) 2.839 32.349 ( 5.773 5.582 1.262) 8.129 32.383 ( 2.657 5.358 -2.161) 6.359 32.417 ( 3.721 7.738 0.056) 8.587 32.556 ( 3.603 7.440 0.578) 8.287 33.978 ( -1.580 -0.760 1.162) 2.104 34.047 ( 1.957 1.172 0.237) 2.294 34.812 ( -2.203 -3.764 0.953) 4.464 ======================= Grid point 548 (143/146) ======================= q-point: ( 0.64 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.254 ( -4.399 -0.188 10.021) 10.946 8.893 ( 21.778 22.420 3.927) 31.501 9.346 ( 11.215 -0.341 -8.453) 14.048 10.308 ( 6.482 35.436 -2.729) 36.128 10.707 ( 23.015 10.266 -1.325) 25.235 11.026 ( 30.760 36.192 2.203) 47.549 12.395 ( -10.695 -1.027 -1.414) 10.837 14.672 ( -3.992 -30.563 2.381) 30.915 15.138 ( -5.597 -2.226 4.093) 7.282 16.200 ( -5.177 9.505 -2.409) 11.088 17.020 ( 5.382 -1.324 -12.904) 14.044 18.982 ( 2.093 -5.810 2.329) 6.600 19.154 ( -0.637 -0.489 -3.283) 3.380 19.559 ( 5.786 22.690 22.913) 32.761 19.864 ( 5.363 -0.784 -3.538) 6.472 20.181 ( -10.732 1.359 20.963) 23.589 20.428 ( -4.869 -7.904 -2.329) 9.571 20.602 ( 6.736 5.868 -17.259) 19.434 21.970 ( -13.675 -23.367 -5.727) 27.674 22.290 ( -16.985 -16.177 4.025) 23.799 22.398 ( -3.811 1.905 -7.373) 8.516 22.513 ( -12.160 -13.916 -1.707) 18.559 22.749 ( -6.524 -7.634 -3.143) 10.523 23.158 ( 0.313 -21.276 0.703) 21.290 24.303 ( -1.805 -1.818 0.026) 2.562 24.577 ( -2.501 1.745 0.711) 3.132 24.636 ( 1.691 1.451 -0.287) 2.247 25.344 ( -8.346 5.452 0.414) 9.978 25.904 ( 5.460 -1.889 -1.022) 5.867 26.354 ( -1.771 -2.332 5.413) 6.154 26.713 ( -5.128 4.206 -1.212) 6.742 27.216 ( 9.010 -3.824 -2.484) 10.098 27.847 ( 12.554 18.904 1.228) 22.726 31.108 ( -3.542 -5.291 -0.197) 6.370 31.939 ( -3.173 -1.723 0.565) 3.655 32.378 ( 0.018 -1.267 -0.162) 1.278 32.526 ( 5.774 8.565 -1.339) 10.416 32.668 ( 10.214 10.436 1.011) 14.637 32.718 ( 6.420 7.269 0.074) 9.698 33.952 ( -1.486 -0.941 1.271) 2.170 34.089 ( 1.768 1.342 -1.079) 2.468 34.721 ( -4.054 -4.684 0.311) 6.202 ======================= Grid point 558 (144/146) ======================= q-point: ( 0.55 0.55 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.395 ( 0.000 -11.254 -3.093) 11.671 8.413 ( -0.000 24.509 27.248) 36.649 9.169 ( -0.000 38.981 -2.485) 39.060 9.877 ( -0.000 19.099 -18.484) 26.578 10.361 ( -0.000 29.317 4.605) 29.677 10.695 ( -0.000 19.155 -6.707) 20.295 12.395 ( -0.000 1.690 -2.959) 3.408 15.140 ( 0.000 -9.219 -4.651) 10.326 15.180 ( 0.000 -14.971 -1.792) 15.078 16.214 ( 0.000 -18.521 -0.893) 18.543 16.940 ( 0.000 0.146 7.833) 7.834 18.783 ( 0.000 5.476 45.258) 45.588 19.125 ( 0.000 -4.908 5.650) 7.484 19.511 ( -0.000 26.142 -30.437) 40.122 19.811 ( -0.000 10.510 -16.324) 19.415 20.350 ( 0.000 -7.429 -14.379) 16.185 20.433 ( -0.000 2.876 11.382) 11.739 20.537 ( 0.000 -5.833 3.751) 6.935 22.075 ( 0.000 -2.380 8.110) 8.452 22.317 ( -0.000 0.191 -5.489) 5.493 22.556 ( 0.000 -10.649 -1.265) 10.724 22.572 ( -0.000 11.565 -0.681) 11.585 23.080 ( 0.000 -57.933 -5.184) 58.165 23.694 ( 0.000 -29.249 2.406) 29.348 24.330 ( 0.000 -2.447 0.596) 2.519 24.564 ( 0.000 -0.929 -1.102) 1.441 24.612 ( -0.000 1.587 -1.195) 1.986 25.321 ( 0.000 -8.006 -1.315) 8.113 25.871 ( -0.000 6.910 3.116) 7.581 26.398 ( -0.000 2.419 -3.825) 4.526 26.655 ( 0.000 -0.656 2.076) 2.177 27.195 ( -0.000 7.466 6.825) 10.115 27.563 ( -0.000 20.018 -4.045) 20.422 31.194 ( 0.000 -6.743 0.458) 6.759 31.982 ( 0.000 -3.590 -0.983) 3.722 32.381 ( -0.000 9.032 0.572) 9.050 32.390 ( 0.000 -0.612 1.532) 1.649 32.493 ( -0.000 15.467 -1.292) 15.521 32.605 ( -0.000 8.589 -0.363) 8.596 33.979 ( 0.000 -1.545 -0.969) 1.824 34.054 ( -0.000 1.935 1.606) 2.515 34.792 ( 0.000 -4.963 0.257) 4.970 ======================= Grid point 668 (145/146) ======================= q-point: ( 0.45 0.45 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.737 ( 0.000 -0.000 38.039) 38.039 7.737 ( 0.000 -0.000 38.039) 38.039 8.951 ( 0.000 -0.000 10.905) 10.905 9.676 ( -0.000 0.000 -37.847) 37.847 9.676 ( -0.000 0.000 -37.847) 37.847 10.499 ( -0.000 0.000 -2.551) 2.551 12.209 ( -0.000 0.000 -8.328) 8.328 15.501 ( 0.000 -0.000 1.187) 1.187 15.501 ( 0.000 -0.000 1.187) 1.187 17.051 ( -0.000 0.000 -11.462) 11.462 17.051 ( -0.000 0.000 -11.462) 11.462 17.699 ( 0.000 -0.000 63.188) 63.188 19.196 ( 0.000 -0.000 5.206) 5.206 19.196 ( 0.000 -0.000 5.206) 5.206 19.795 ( -0.000 0.000 -50.128) 50.128 20.389 ( 0.000 -0.000 10.581) 10.581 20.389 ( 0.000 -0.000 10.581) 10.581 20.551 ( 0.000 -0.000 16.560) 16.560 22.217 ( -0.000 0.000 -8.809) 8.809 22.217 ( -0.000 0.000 -8.809) 8.809 22.356 ( -0.000 0.000 -13.680) 13.680 22.836 ( -0.000 0.000 -2.005) 2.005 24.380 ( 0.000 -0.000 0.188) 0.188 24.409 ( 0.000 -0.000 0.442) 0.442 24.409 ( 0.000 0.000 0.442) 0.442 24.717 ( -0.000 0.000 -1.322) 1.322 24.717 ( 0.000 0.000 -1.322) 1.322 25.584 ( 0.000 -0.000 2.078) 2.078 25.584 ( 0.000 0.000 2.078) 2.078 26.301 ( 0.000 -0.000 0.187) 0.187 26.338 ( -0.000 0.000 -1.509) 1.509 27.085 ( 0.000 -0.000 2.537) 2.537 27.085 ( 0.000 0.000 2.537) 2.537 31.405 ( 0.000 -0.000 1.045) 1.045 32.051 ( 0.000 -0.000 0.287) 0.287 32.051 ( 0.000 0.000 0.287) 0.287 32.245 ( -0.000 0.000 -3.712) 3.712 32.395 ( 0.000 -0.000 1.544) 1.544 32.395 ( 0.000 -0.000 1.544) 1.544 34.007 ( 0.000 -0.000 0.796) 0.796 34.007 ( 0.000 -0.000 0.796) 0.796 34.888 ( 0.000 -0.000 1.124) 1.124 ======================= Grid point 669 (146/146) ======================= q-point: ( 0.55 0.45 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.112 ( 13.137 7.585 7.314) 16.840 8.235 ( 21.648 12.498 31.977) 40.588 8.752 ( -8.619 -4.976 -14.744) 17.789 9.554 ( 8.143 4.701 -11.706) 15.014 9.869 ( 24.182 13.961 -9.850) 29.609 10.496 ( 1.652 0.954 -0.330) 1.935 12.260 ( 7.173 4.141 -2.810) 8.746 15.369 ( -11.099 -6.408 2.551) 13.067 15.426 ( -7.891 -4.556 0.120) 9.112 16.638 ( -21.934 -12.664 1.710) 25.385 17.000 ( 0.251 0.145 -9.049) 9.053 18.464 ( 27.024 15.602 30.340) 43.523 19.182 ( -2.267 -1.309 -3.680) 4.516 19.209 ( -1.537 -0.887 0.157) 1.781 19.601 ( 8.409 4.855 -20.427) 22.618 20.378 ( -4.866 -2.809 12.279) 13.504 20.472 ( 1.594 0.920 -4.138) 4.529 20.620 ( -1.575 -0.909 3.796) 4.209 22.170 ( -0.752 -0.434 -7.774) 7.823 22.203 ( 3.277 1.892 0.870) 3.883 22.364 ( 6.988 4.034 -3.944) 8.981 22.748 ( -6.672 -3.852 -0.674) 7.733 24.078 ( -33.824 -19.528 3.010) 39.172 24.249 ( -17.858 -10.311 -4.044) 21.014 24.369 ( -1.164 -0.672 -0.110) 1.348 24.586 ( -3.690 -2.130 2.832) 5.116 24.604 ( -2.253 -1.301 -2.090) 3.337 25.466 ( -7.163 -4.136 2.776) 8.725 25.732 ( 8.111 4.683 -2.467) 9.685 26.334 ( 2.119 1.223 0.811) 2.578 26.522 ( 10.915 6.302 0.516) 12.614 27.140 ( 2.968 1.714 -4.423) 5.596 27.200 ( 10.148 5.859 5.318) 12.868 31.332 ( -5.726 -3.306 0.145) 6.614 32.031 ( -1.788 -1.032 0.661) 2.167 32.188 ( 10.270 5.930 -0.486) 11.869 32.273 ( 4.306 2.486 -0.922) 5.057 32.403 ( -0.108 -0.062 -0.105) 0.163 32.458 ( 4.739 2.736 0.950) 5.554 33.999 ( -0.936 -0.540 0.880) 1.394 34.027 ( 1.273 0.735 -0.392) 1.521 34.867 ( -2.296 -1.326 0.362) 2.676 =================== 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 3/55902 10.0 86.222 86.222 187.114 0.000 -0.000 -0.000 3/55902 20.0 1785.593 1785.593 3394.734 0.000 -0.000 -0.000 3/55902 30.0 3894.250 3894.250 6658.309 0.000 -0.000 -0.000 3/55902 40.0 4887.980 4887.980 7339.780 0.000 -0.000 -0.000 3/55902 50.0 4836.105 4836.105 6111.816 0.000 -0.000 -0.000 3/55902 60.0 4325.510 4325.510 4655.730 0.000 -0.000 -0.000 3/55902 70.0 3667.689 3667.689 3550.205 0.000 -0.000 -0.000 3/55902 80.0 3033.381 3033.381 2773.129 0.000 -0.000 -0.000 3/55902 90.0 2489.370 2489.370 2215.806 0.000 -0.000 -0.000 3/55902 100.0 2041.675 2041.675 1798.784 0.000 -0.000 -0.000 3/55902 110.0 1678.016 1678.016 1475.433 0.000 -0.000 -0.000 3/55902 120.0 1384.537 1384.537 1219.325 0.000 -0.000 -0.000 3/55902 130.0 1149.112 1149.112 1014.532 0.000 -0.000 -0.000 3/55902 140.0 961.165 961.165 850.246 0.000 -0.000 -0.000 3/55902 150.0 811.422 811.422 718.283 0.000 -0.000 -0.000 3/55902 160.0 691.947 691.947 612.087 0.000 -0.000 -0.000 3/55902 170.0 596.194 596.194 526.341 0.000 -0.000 -0.000 3/55902 180.0 518.936 518.936 456.767 0.000 -0.000 -0.000 3/55902 190.0 456.091 456.091 399.965 0.000 -0.000 -0.000 3/55902 200.0 404.515 404.515 353.263 0.000 -0.000 -0.000 3/55902 210.0 361.798 361.798 314.574 0.000 -0.000 -0.000 3/55902 220.0 326.097 326.097 282.273 0.000 -0.000 -0.000 3/55902 230.0 295.997 295.997 255.094 0.000 -0.000 -0.000 3/55902 240.0 270.404 270.404 232.049 0.000 -0.000 -0.000 3/55902 250.0 248.471 248.471 212.363 0.000 -0.000 -0.000 3/55902 260.0 229.534 229.534 195.427 0.000 -0.000 -0.000 3/55902 270.0 213.067 213.067 180.758 0.000 -0.000 -0.000 3/55902 280.0 198.655 198.655 167.969 0.000 -0.000 -0.000 3/55902 290.0 185.964 185.964 156.752 0.000 -0.000 -0.000 3/55902 300.0 174.725 174.725 146.857 0.000 -0.000 -0.000 3/55902 310.0 164.717 164.717 138.081 0.000 -0.000 -0.000 3/55902 320.0 155.762 155.762 130.257 0.000 -0.000 -0.000 3/55902 330.0 147.711 147.711 123.249 0.000 -0.000 -0.000 3/55902 340.0 140.442 140.442 116.943 0.000 -0.000 -0.000 3/55902 350.0 133.851 133.851 111.245 0.000 -0.000 -0.000 3/55902 360.0 127.853 127.853 106.076 0.000 -0.000 -0.000 3/55902 370.0 122.373 122.373 101.368 0.000 -0.000 -0.000 3/55902 380.0 117.351 117.351 97.066 0.000 -0.000 -0.000 3/55902 390.0 112.733 112.733 93.121 0.000 -0.000 -0.000 3/55902 400.0 108.475 108.475 89.493 0.000 -0.000 -0.000 3/55902 410.0 104.536 104.536 86.146 0.000 -0.000 -0.000 3/55902 420.0 100.884 100.884 83.049 0.000 -0.000 -0.000 3/55902 430.0 97.488 97.488 80.176 0.000 -0.000 -0.000 3/55902 440.0 94.324 94.324 77.505 0.000 -0.000 -0.000 3/55902 450.0 91.368 91.368 75.015 0.000 -0.000 -0.000 3/55902 460.0 88.601 88.601 72.688 0.000 -0.000 -0.000 3/55902 470.0 86.007 86.007 70.510 0.000 -0.000 -0.000 3/55902 480.0 83.568 83.568 68.467 0.000 -0.000 -0.000 3/55902 490.0 81.272 81.272 66.546 0.000 -0.000 -0.000 3/55902 500.0 79.107 79.107 64.738 0.000 -0.000 -0.000 3/55902 510.0 77.061 77.061 63.032 0.000 -0.000 -0.000 3/55902 520.0 75.126 75.126 61.420 0.000 -0.000 -0.000 3/55902 530.0 73.292 73.292 59.894 0.000 -0.000 -0.000 3/55902 540.0 71.552 71.552 58.448 0.000 -0.000 -0.000 3/55902 550.0 69.898 69.898 57.076 0.000 -0.000 -0.000 3/55902 560.0 68.324 68.324 55.772 0.000 -0.000 -0.000 3/55902 570.0 66.825 66.825 54.530 0.000 -0.000 -0.000 3/55902 580.0 65.395 65.395 53.348 0.000 -0.000 -0.000 3/55902 590.0 64.029 64.029 52.219 0.000 -0.000 -0.000 3/55902 600.0 62.724 62.724 51.142 0.000 -0.000 -0.000 3/55902 610.0 61.474 61.474 50.111 0.000 -0.000 -0.000 3/55902 620.0 60.278 60.278 49.125 0.000 -0.000 -0.000 3/55902 630.0 59.130 59.130 48.180 0.000 -0.000 -0.000 3/55902 640.0 58.029 58.029 47.274 0.000 -0.000 -0.000 3/55902 650.0 56.971 56.971 46.404 0.000 -0.000 -0.000 3/55902 660.0 55.954 55.954 45.568 0.000 -0.000 -0.000 3/55902 670.0 54.975 54.975 44.764 0.000 -0.000 -0.000 3/55902 680.0 54.033 54.033 43.991 0.000 -0.000 -0.000 3/55902 690.0 53.124 53.124 43.246 0.000 -0.000 -0.000 3/55902 700.0 52.249 52.249 42.528 0.000 -0.000 -0.000 3/55902 710.0 51.403 51.403 41.835 0.000 -0.000 -0.000 3/55902 720.0 50.587 50.587 41.167 0.000 -0.000 -0.000 3/55902 730.0 49.798 49.798 40.521 0.000 -0.000 -0.000 3/55902 740.0 49.035 49.035 39.897 0.000 -0.000 -0.000 3/55902 750.0 48.297 48.297 39.293 0.000 -0.000 -0.000 3/55902 760.0 47.582 47.582 38.709 0.000 -0.000 -0.000 3/55902 770.0 46.890 46.890 38.143 0.000 -0.000 -0.000 3/55902 780.0 46.219 46.219 37.595 0.000 -0.000 -0.000 3/55902 790.0 45.568 45.568 37.064 0.000 -0.000 -0.000 3/55902 800.0 44.937 44.937 36.549 0.000 -0.000 -0.000 3/55902 810.0 44.324 44.324 36.049 0.000 -0.000 -0.000 3/55902 820.0 43.729 43.729 35.564 0.000 -0.000 -0.000 3/55902 830.0 43.151 43.151 35.092 0.000 -0.000 -0.000 3/55902 840.0 42.588 42.588 34.634 0.000 -0.000 -0.000 3/55902 850.0 42.042 42.042 34.188 0.000 -0.000 -0.000 3/55902 860.0 41.510 41.510 33.755 0.000 -0.000 -0.000 3/55902 870.0 40.992 40.992 33.333 0.000 -0.000 -0.000 3/55902 880.0 40.488 40.488 32.923 0.000 -0.000 -0.000 3/55902 890.0 39.997 39.997 32.523 0.000 -0.000 -0.000 3/55902 900.0 39.518 39.518 32.133 0.000 -0.000 -0.000 3/55902 910.0 39.052 39.052 31.754 0.000 -0.000 -0.000 3/55902 920.0 38.597 38.597 31.384 0.000 -0.000 -0.000 3/55902 930.0 38.153 38.153 31.023 0.000 -0.000 -0.000 3/55902 940.0 37.720 37.720 30.670 0.000 -0.000 -0.000 3/55902 950.0 37.297 37.297 30.327 0.000 -0.000 -0.000 3/55902 960.0 36.884 36.884 29.991 0.000 -0.000 -0.000 3/55902 970.0 36.481 36.481 29.663 0.000 -0.000 -0.000 3/55902 980.0 36.087 36.087 29.343 0.000 -0.000 -0.000 3/55902 990.0 35.702 35.702 29.030 0.000 -0.000 -0.000 3/55902 1000.0 35.326 35.326 28.724 0.000 -0.000 -0.000 3/55902 Thermal conductivity related properties were written into "kappa-m111111.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 18:51:07]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|