----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:00:18]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.774222630000037 0.000000000000000 0.000000000000000 b 0.000000000000000 5.853895529999999 0.000000000000000 c -5.742070453163258 0.000000000000000 8.196218406325023 Atomic positions (fractional): *1 O 0.69138695255425 0.47498674181187 0.77091495411889 15.999 2 O 0.30861304744575 0.97498674181187 0.72908504588111 15.999 3 O 0.30861304744575 0.52501325818813 0.22908504588111 15.999 4 O 0.69138695255425 0.02501325818813 0.27091495411889 15.999 *5 O 0.85668854157668 0.23232682376534 0.04569912003236 15.999 6 O 0.14331145842332 0.73232682376533 0.45430087996764 15.999 7 O 0.14331145842332 0.76767317623467 0.95430087996764 15.999 8 O 0.85668854157668 0.26767317623467 0.54569912003236 15.999 *9 O 0.77180127330012 0.80662327487448 0.53918831804171 15.999 10 O 0.22819872669988 0.30662327487448 0.96081168195829 15.999 11 O 0.22819872669988 0.19337672512552 0.46081168195829 15.999 12 O 0.77180127330012 0.69337672512552 0.03918831804171 15.999 *13 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 14 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 *15 Sr 0.75888178653028 0.46146314368147 0.24962271753136 87.620 16 Sr 0.24111821346972 0.96146314368147 0.25037728246864 87.620 17 Sr 0.75888178653028 0.03853685631853 0.74962271753136 87.620 18 Sr 0.24111821346972 0.53853685631853 0.75037728246864 87.620 *19 Te 0.00000000000000 0.00000000000000 0.50000000000000 127.600 20 Te 0.00000000000000 0.50000000000000 0.00000000000000 127.600 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.774222630000037 0.000000000000000 0.000000000000000 b 0.000000000000000 5.853895529999999 0.000000000000000 c -5.742070453163258 0.000000000000000 8.196218406325023 Atomic positions (fractional): *1 O 0.69138695255425 0.47498674181187 0.77091495411889 15.999 > 1 2 O 0.30861304744575 0.97498674181187 0.72908504588111 15.999 > 2 3 O 0.30861304744575 0.52501325818813 0.22908504588111 15.999 > 3 4 O 0.69138695255425 0.02501325818813 0.27091495411889 15.999 > 4 *5 O 0.85668854157668 0.23232682376534 0.04569912003236 15.999 > 5 6 O 0.14331145842332 0.73232682376533 0.45430087996764 15.999 > 6 7 O 0.14331145842332 0.76767317623467 0.95430087996764 15.999 > 7 8 O 0.85668854157668 0.26767317623467 0.54569912003236 15.999 > 8 *9 O 0.77180127330012 0.80662327487448 0.53918831804171 15.999 > 9 10 O 0.22819872669988 0.30662327487448 0.96081168195829 15.999 > 10 11 O 0.22819872669988 0.19337672512552 0.46081168195829 15.999 > 11 12 O 0.77180127330012 0.69337672512552 0.03918831804171 15.999 > 12 *13 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 13 14 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 > 14 *15 Sr 0.75888178653028 0.46146314368147 0.24962271753136 87.620 > 15 16 Sr 0.24111821346972 0.96146314368147 0.25037728246864 87.620 > 16 17 Sr 0.75888178653028 0.03853685631853 0.74962271753136 87.620 > 17 18 Sr 0.24111821346972 0.53853685631853 0.75037728246864 87.620 > 18 *19 Te 0.00000000000000 0.00000000000000 0.50000000000000 127.600 > 19 20 Te 0.00000000000000 0.50000000000000 0.00000000000000 127.600 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.548445260000074 0.000000000000000 0.000000000000000 b 0.000000000000000 11.707791059999998 0.000000000000000 c -5.742070453163258 0.000000000000000 8.196218406325023 Atomic positions (fractional): *1 O 0.34569347627712 0.23749337090594 0.77091495411889 15.999 > 1 2 O 0.84569347627712 0.23749337090594 0.77091495411889 15.999 > 1 3 O 0.34569347627712 0.73749337090594 0.77091495411889 15.999 > 1 4 O 0.84569347627712 0.73749337090594 0.77091495411889 15.999 > 1 5 O 0.15430652372288 0.48749337090594 0.72908504588111 15.999 > 2 6 O 0.65430652372288 0.48749337090594 0.72908504588111 15.999 > 2 7 O 0.15430652372288 0.98749337090594 0.72908504588111 15.999 > 2 8 O 0.65430652372288 0.98749337090594 0.72908504588111 15.999 > 2 9 O 0.15430652372288 0.26250662909406 0.22908504588111 15.999 > 3 10 O 0.65430652372288 0.26250662909406 0.22908504588111 15.999 > 3 11 O 0.15430652372288 0.76250662909406 0.22908504588111 15.999 > 3 12 O 0.65430652372288 0.76250662909406 0.22908504588111 15.999 > 3 13 O 0.34569347627712 0.01250662909406 0.27091495411889 15.999 > 4 14 O 0.84569347627712 0.01250662909406 0.27091495411889 15.999 > 4 15 O 0.34569347627712 0.51250662909406 0.27091495411889 15.999 > 4 16 O 0.84569347627712 0.51250662909406 0.27091495411889 15.999 > 4 *17 O 0.42834427078834 0.11616341188267 0.04569912003236 15.999 > 5 18 O 0.92834427078834 0.11616341188267 0.04569912003236 15.999 > 5 19 O 0.42834427078834 0.61616341188267 0.04569912003236 15.999 > 5 20 O 0.92834427078834 0.61616341188267 0.04569912003236 15.999 > 5 21 O 0.07165572921166 0.36616341188267 0.45430087996764 15.999 > 6 22 O 0.57165572921166 0.36616341188267 0.45430087996764 15.999 > 6 23 O 0.07165572921166 0.86616341188267 0.45430087996764 15.999 > 6 24 O 0.57165572921166 0.86616341188267 0.45430087996764 15.999 > 6 25 O 0.07165572921166 0.38383658811733 0.95430087996764 15.999 > 7 26 O 0.57165572921166 0.38383658811733 0.95430087996764 15.999 > 7 27 O 0.07165572921166 0.88383658811733 0.95430087996764 15.999 > 7 28 O 0.57165572921166 0.88383658811733 0.95430087996764 15.999 > 7 29 O 0.42834427078834 0.13383658811733 0.54569912003236 15.999 > 8 30 O 0.92834427078834 0.13383658811733 0.54569912003236 15.999 > 8 31 O 0.42834427078834 0.63383658811733 0.54569912003236 15.999 > 8 32 O 0.92834427078834 0.63383658811733 0.54569912003236 15.999 > 8 *33 O 0.38590063665006 0.40331163743724 0.53918831804171 15.999 > 9 34 O 0.88590063665006 0.40331163743724 0.53918831804171 15.999 > 9 35 O 0.38590063665006 0.90331163743724 0.53918831804171 15.999 > 9 36 O 0.88590063665006 0.90331163743724 0.53918831804171 15.999 > 9 37 O 0.11409936334994 0.15331163743724 0.96081168195829 15.999 > 10 38 O 0.61409936334994 0.15331163743724 0.96081168195829 15.999 > 10 39 O 0.11409936334994 0.65331163743724 0.96081168195829 15.999 > 10 40 O 0.61409936334994 0.65331163743724 0.96081168195829 15.999 > 10 41 O 0.11409936334994 0.09668836256276 0.46081168195829 15.999 > 11 42 O 0.61409936334994 0.09668836256276 0.46081168195829 15.999 > 11 43 O 0.11409936334994 0.59668836256276 0.46081168195829 15.999 > 11 44 O 0.61409936334994 0.59668836256276 0.46081168195829 15.999 > 11 45 O 0.38590063665006 0.34668836256276 0.03918831804171 15.999 > 12 46 O 0.88590063665006 0.34668836256276 0.03918831804171 15.999 > 12 47 O 0.38590063665006 0.84668836256276 0.03918831804171 15.999 > 12 48 O 0.88590063665006 0.84668836256276 0.03918831804171 15.999 > 12 *49 Ca 0.25000000000000 0.00000000000000 0.00000000000000 40.078 > 13 50 Ca 0.75000000000000 0.00000000000000 0.00000000000000 40.078 > 13 51 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 13 52 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 13 53 Ca 0.25000000000000 0.25000000000000 0.50000000000000 40.078 > 14 54 Ca 0.75000000000000 0.25000000000000 0.50000000000000 40.078 > 14 55 Ca 0.25000000000000 0.75000000000000 0.50000000000000 40.078 > 14 56 Ca 0.75000000000000 0.75000000000000 0.50000000000000 40.078 > 14 *57 Sr 0.37944089326514 0.23073157184073 0.24962271753136 87.620 > 15 58 Sr 0.87944089326514 0.23073157184073 0.24962271753136 87.620 > 15 59 Sr 0.37944089326514 0.73073157184073 0.24962271753136 87.620 > 15 60 Sr 0.87944089326514 0.73073157184073 0.24962271753136 87.620 > 15 61 Sr 0.12055910673486 0.48073157184073 0.25037728246864 87.620 > 16 62 Sr 0.62055910673486 0.48073157184073 0.25037728246864 87.620 > 16 63 Sr 0.12055910673486 0.98073157184073 0.25037728246864 87.620 > 16 64 Sr 0.62055910673486 0.98073157184073 0.25037728246864 87.620 > 16 65 Sr 0.37944089326514 0.01926842815927 0.74962271753136 87.620 > 17 66 Sr 0.87944089326514 0.01926842815927 0.74962271753136 87.620 > 17 67 Sr 0.37944089326514 0.51926842815927 0.74962271753136 87.620 > 17 68 Sr 0.87944089326514 0.51926842815927 0.74962271753136 87.620 > 17 69 Sr 0.12055910673486 0.26926842815927 0.75037728246864 87.620 > 18 70 Sr 0.62055910673486 0.26926842815927 0.75037728246864 87.620 > 18 71 Sr 0.12055910673486 0.76926842815927 0.75037728246864 87.620 > 18 72 Sr 0.62055910673486 0.76926842815927 0.75037728246864 87.620 > 18 *73 Te 0.00000000000000 0.00000000000000 0.50000000000000 127.600 > 19 74 Te 0.50000000000000 0.00000000000000 0.50000000000000 127.600 > 19 75 Te 0.00000000000000 0.50000000000000 0.50000000000000 127.600 > 19 76 Te 0.50000000000000 0.50000000000000 0.50000000000000 127.600 > 19 77 Te 0.00000000000000 0.25000000000000 0.00000000000000 127.600 > 20 78 Te 0.50000000000000 0.25000000000000 0.00000000000000 127.600 > 20 79 Te 0.00000000000000 0.75000000000000 0.00000000000000 127.600 > 20 80 Te 0.50000000000000 0.75000000000000 0.00000000000000 127.600 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7498763 0.0000000 -0.0117132 0.0000000 3.7510719 0.0000000 -0.0121300 0.0000000 3.7091601 -------------------------- Born effective charges -------------------------- 1 O -1.8433207 0.0708771 -0.1932660 0.0904172 -1.6888420 -0.0855921 -0.1657601 -0.0577387 -2.7387461 2 O -1.8433207 -0.0708771 -0.1932660 -0.0904172 -1.6888420 0.0855921 -0.1657601 0.0577387 -2.7387461 3 O -1.8433207 0.0708771 -0.1932660 0.0904172 -1.6888420 -0.0855921 -0.1657601 -0.0577387 -2.7387461 4 O -1.8433207 -0.0708771 -0.1932660 -0.0904172 -1.6888420 0.0855921 -0.1657601 0.0577387 -2.7387461 5 O -2.1035259 -0.4710075 0.1350761 -0.5169351 -2.4079565 0.1521885 0.1381169 0.1700948 -1.7325145 6 O -2.1035259 0.4710075 0.1350761 0.5169351 -2.4079565 -0.1521885 0.1381169 -0.1700948 -1.7325145 7 O -2.1035259 -0.4710075 0.1350761 -0.5169351 -2.4079565 0.1521885 0.1381169 0.1700948 -1.7325145 8 O -2.1035259 0.4710075 0.1350761 0.5169351 -2.4079565 -0.1521885 0.1381169 -0.1700948 -1.7325145 9 O -2.3521615 -0.4984578 0.0586000 -0.4807753 -2.1772106 0.0316133 0.0876453 0.0456278 -1.7457472 10 O -2.3521615 0.4984578 0.0586000 0.4807753 -2.1772106 -0.0316133 0.0876453 -0.0456278 -1.7457472 11 O -2.3521615 -0.4984578 0.0586000 -0.4807753 -2.1772106 0.0316133 0.0876453 0.0456278 -1.7457472 12 O -2.3521615 0.4984578 0.0586000 0.4807753 -2.1772106 -0.0316133 0.0876453 -0.0456278 -1.7457472 13 Ca 2.6890326 -0.1805735 0.2711271 0.1118862 2.7234543 0.0454944 -0.1982930 0.1021925 2.6949430 14 Ca 2.6890326 0.1805735 0.2711271 -0.1118862 2.7234543 -0.0454944 -0.1982930 -0.1021925 2.6949430 15 Sr 2.5400394 0.1008827 -0.0571236 0.1145371 2.4888024 -0.0263296 0.0231133 -0.0674704 2.4402212 16 Sr 2.5400394 -0.1008827 -0.0571236 -0.1145371 2.4888024 0.0263296 0.0231133 0.0674704 2.4402212 17 Sr 2.5400394 -0.1008827 -0.0571236 -0.1145371 2.4888024 0.0263296 0.0231133 0.0674704 2.4402212 18 Sr 2.5400394 0.1008827 -0.0571236 0.1145371 2.4888024 -0.0263296 0.0231133 -0.0674704 2.4402212 19 Te 4.8289048 -0.1035151 -0.1577001 -0.0180592 4.8469593 -0.0759971 0.0320621 -0.0537127 4.8586302 20 Te 4.8289048 0.1035151 -0.1577001 0.0180592 4.8469593 0.0759971 0.0320621 0.0537127 4.8586302 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.212 Solver_block: 200 / 640 - Time: 2.220 Solver_block: 300 / 640 - Time: 2.213 Solver_block: 400 / 640 - Time: 2.213 Solver_block: 500 / 640 - Time: 2.215 Solver_block: 600 / 640 - Time: 2.216 Solver_block: 640 / 640 - Time: 0.948 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.284 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 00:00:52]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:00:52]------------------------- 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): [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.774222630000037 0.000000000000000 0.000000000000000 b 0.000000000000000 5.853895529999999 0.000000000000000 c -5.742070453163258 0.000000000000000 8.196218406325023 Atomic positions (fractional): 1 O 0.69138695255425 0.47498674181187 0.77091495411889 15.999 2 O 0.30861304744575 0.97498674181187 0.72908504588111 15.999 3 O 0.30861304744575 0.52501325818813 0.22908504588111 15.999 4 O 0.69138695255425 0.02501325818813 0.27091495411889 15.999 5 O 0.85668854157668 0.23232682376534 0.04569912003236 15.999 6 O 0.14331145842332 0.73232682376533 0.45430087996764 15.999 7 O 0.14331145842332 0.76767317623467 0.95430087996764 15.999 8 O 0.85668854157668 0.26767317623467 0.54569912003236 15.999 9 O 0.77180127330012 0.80662327487448 0.53918831804171 15.999 10 O 0.22819872669988 0.30662327487448 0.96081168195829 15.999 11 O 0.22819872669988 0.19337672512552 0.46081168195829 15.999 12 O 0.77180127330012 0.69337672512552 0.03918831804171 15.999 13 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 14 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 15 Sr 0.75888178653028 0.46146314368147 0.24962271753136 87.620 16 Sr 0.24111821346972 0.96146314368147 0.25037728246864 87.620 17 Sr 0.75888178653028 0.03853685631853 0.74962271753136 87.620 18 Sr 0.24111821346972 0.53853685631853 0.75037728246864 87.620 19 Te 0.00000000000000 0.00000000000000 0.50000000000000 127.600 20 Te 0.00000000000000 0.50000000000000 0.00000000000000 127.600 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.548445260000074 0.000000000000000 0.000000000000000 b 0.000000000000000 11.707791059999998 0.000000000000000 c -5.742070453163258 0.000000000000000 8.196218406325023 Atomic positions (fractional): 1 O 0.34569347627712 0.23749337090594 0.77091495411889 15.999 > 1 2 O 0.84569347627712 0.23749337090594 0.77091495411889 15.999 > 1 3 O 0.34569347627712 0.73749337090594 0.77091495411889 15.999 > 1 4 O 0.84569347627712 0.73749337090594 0.77091495411889 15.999 > 1 5 O 0.15430652372288 0.48749337090594 0.72908504588111 15.999 > 5 6 O 0.65430652372288 0.48749337090594 0.72908504588111 15.999 > 5 7 O 0.15430652372288 0.98749337090594 0.72908504588111 15.999 > 5 8 O 0.65430652372288 0.98749337090594 0.72908504588111 15.999 > 5 9 O 0.15430652372288 0.26250662909406 0.22908504588111 15.999 > 9 10 O 0.65430652372288 0.26250662909406 0.22908504588111 15.999 > 9 11 O 0.15430652372288 0.76250662909406 0.22908504588111 15.999 > 9 12 O 0.65430652372288 0.76250662909406 0.22908504588111 15.999 > 9 13 O 0.34569347627712 0.01250662909406 0.27091495411889 15.999 > 13 14 O 0.84569347627712 0.01250662909406 0.27091495411889 15.999 > 13 15 O 0.34569347627712 0.51250662909406 0.27091495411889 15.999 > 13 16 O 0.84569347627712 0.51250662909406 0.27091495411889 15.999 > 13 17 O 0.42834427078834 0.11616341188267 0.04569912003236 15.999 > 17 18 O 0.92834427078834 0.11616341188267 0.04569912003236 15.999 > 17 19 O 0.42834427078834 0.61616341188267 0.04569912003236 15.999 > 17 20 O 0.92834427078834 0.61616341188267 0.04569912003236 15.999 > 17 21 O 0.07165572921166 0.36616341188267 0.45430087996764 15.999 > 21 22 O 0.57165572921166 0.36616341188267 0.45430087996764 15.999 > 21 23 O 0.07165572921166 0.86616341188267 0.45430087996764 15.999 > 21 24 O 0.57165572921166 0.86616341188267 0.45430087996764 15.999 > 21 25 O 0.07165572921166 0.38383658811733 0.95430087996764 15.999 > 25 26 O 0.57165572921166 0.38383658811733 0.95430087996764 15.999 > 25 27 O 0.07165572921166 0.88383658811733 0.95430087996764 15.999 > 25 28 O 0.57165572921166 0.88383658811733 0.95430087996764 15.999 > 25 29 O 0.42834427078834 0.13383658811733 0.54569912003236 15.999 > 29 30 O 0.92834427078834 0.13383658811733 0.54569912003236 15.999 > 29 31 O 0.42834427078834 0.63383658811733 0.54569912003236 15.999 > 29 32 O 0.92834427078834 0.63383658811733 0.54569912003236 15.999 > 29 33 O 0.38590063665006 0.40331163743724 0.53918831804171 15.999 > 33 34 O 0.88590063665006 0.40331163743724 0.53918831804171 15.999 > 33 35 O 0.38590063665006 0.90331163743724 0.53918831804171 15.999 > 33 36 O 0.88590063665006 0.90331163743724 0.53918831804171 15.999 > 33 37 O 0.11409936334994 0.15331163743724 0.96081168195829 15.999 > 37 38 O 0.61409936334994 0.15331163743724 0.96081168195829 15.999 > 37 39 O 0.11409936334994 0.65331163743724 0.96081168195829 15.999 > 37 40 O 0.61409936334994 0.65331163743724 0.96081168195829 15.999 > 37 41 O 0.11409936334994 0.09668836256276 0.46081168195829 15.999 > 41 42 O 0.61409936334994 0.09668836256276 0.46081168195829 15.999 > 41 43 O 0.11409936334994 0.59668836256276 0.46081168195829 15.999 > 41 44 O 0.61409936334994 0.59668836256276 0.46081168195829 15.999 > 41 45 O 0.38590063665006 0.34668836256276 0.03918831804171 15.999 > 45 46 O 0.88590063665006 0.34668836256276 0.03918831804171 15.999 > 45 47 O 0.38590063665006 0.84668836256276 0.03918831804171 15.999 > 45 48 O 0.88590063665006 0.84668836256276 0.03918831804171 15.999 > 45 49 Ca 0.25000000000000 0.00000000000000 0.00000000000000 40.078 > 49 50 Ca 0.75000000000000 0.00000000000000 0.00000000000000 40.078 > 49 51 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 49 52 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 49 53 Ca 0.25000000000000 0.25000000000000 0.50000000000000 40.078 > 53 54 Ca 0.75000000000000 0.25000000000000 0.50000000000000 40.078 > 53 55 Ca 0.25000000000000 0.75000000000000 0.50000000000000 40.078 > 53 56 Ca 0.75000000000000 0.75000000000000 0.50000000000000 40.078 > 53 57 Sr 0.37944089326514 0.23073157184073 0.24962271753136 87.620 > 57 58 Sr 0.87944089326514 0.23073157184073 0.24962271753136 87.620 > 57 59 Sr 0.37944089326514 0.73073157184073 0.24962271753136 87.620 > 57 60 Sr 0.87944089326514 0.73073157184073 0.24962271753136 87.620 > 57 61 Sr 0.12055910673486 0.48073157184073 0.25037728246864 87.620 > 61 62 Sr 0.62055910673486 0.48073157184073 0.25037728246864 87.620 > 61 63 Sr 0.12055910673486 0.98073157184073 0.25037728246864 87.620 > 61 64 Sr 0.62055910673486 0.98073157184073 0.25037728246864 87.620 > 61 65 Sr 0.37944089326514 0.01926842815927 0.74962271753136 87.620 > 65 66 Sr 0.87944089326514 0.01926842815927 0.74962271753136 87.620 > 65 67 Sr 0.37944089326514 0.51926842815927 0.74962271753136 87.620 > 65 68 Sr 0.87944089326514 0.51926842815927 0.74962271753136 87.620 > 65 69 Sr 0.12055910673486 0.26926842815927 0.75037728246864 87.620 > 69 70 Sr 0.62055910673486 0.26926842815927 0.75037728246864 87.620 > 69 71 Sr 0.12055910673486 0.76926842815927 0.75037728246864 87.620 > 69 72 Sr 0.62055910673486 0.76926842815927 0.75037728246864 87.620 > 69 73 Te 0.00000000000000 0.00000000000000 0.50000000000000 127.600 > 73 74 Te 0.50000000000000 0.00000000000000 0.50000000000000 127.600 > 73 75 Te 0.00000000000000 0.50000000000000 0.50000000000000 127.600 > 73 76 Te 0.50000000000000 0.50000000000000 0.50000000000000 127.600 > 73 77 Te 0.00000000000000 0.25000000000000 0.00000000000000 127.600 > 77 78 Te 0.50000000000000 0.25000000000000 0.00000000000000 127.600 > 77 79 Te 0.00000000000000 0.75000000000000 0.00000000000000 127.600 > 77 80 Te 0.50000000000000 0.75000000000000 0.00000000000000 127.600 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7498763 0.0000000 -0.0117132 0.0000000 3.7510719 0.0000000 -0.0121300 0.0000000 3.7091601 -------------------------- Born effective charges -------------------------- 1 O -1.8433207 0.0708771 -0.1932660 0.0904172 -1.6888420 -0.0855921 -0.1657601 -0.0577387 -2.7387461 2 O -1.8433207 -0.0708771 -0.1932660 -0.0904172 -1.6888420 0.0855921 -0.1657601 0.0577387 -2.7387461 3 O -1.8433207 0.0708771 -0.1932660 0.0904172 -1.6888420 -0.0855921 -0.1657601 -0.0577387 -2.7387461 4 O -1.8433207 -0.0708771 -0.1932660 -0.0904172 -1.6888420 0.0855921 -0.1657601 0.0577387 -2.7387461 5 O -2.1035259 -0.4710075 0.1350761 -0.5169351 -2.4079565 0.1521885 0.1381169 0.1700948 -1.7325145 6 O -2.1035259 0.4710075 0.1350761 0.5169351 -2.4079565 -0.1521885 0.1381169 -0.1700948 -1.7325145 7 O -2.1035259 -0.4710075 0.1350761 -0.5169351 -2.4079565 0.1521885 0.1381169 0.1700948 -1.7325145 8 O -2.1035259 0.4710075 0.1350761 0.5169351 -2.4079565 -0.1521885 0.1381169 -0.1700948 -1.7325145 9 O -2.3521615 -0.4984578 0.0586000 -0.4807753 -2.1772106 0.0316133 0.0876453 0.0456278 -1.7457472 10 O -2.3521615 0.4984578 0.0586000 0.4807753 -2.1772106 -0.0316133 0.0876453 -0.0456278 -1.7457472 11 O -2.3521615 -0.4984578 0.0586000 -0.4807753 -2.1772106 0.0316133 0.0876453 0.0456278 -1.7457472 12 O -2.3521615 0.4984578 0.0586000 0.4807753 -2.1772106 -0.0316133 0.0876453 -0.0456278 -1.7457472 13 Ca 2.6890326 -0.1805735 0.2711271 0.1118862 2.7234543 0.0454944 -0.1982930 0.1021925 2.6949430 14 Ca 2.6890326 0.1805735 0.2711271 -0.1118862 2.7234543 -0.0454944 -0.1982930 -0.1021925 2.6949430 15 Sr 2.5400394 0.1008827 -0.0571236 0.1145371 2.4888024 -0.0263296 0.0231133 -0.0674704 2.4402212 16 Sr 2.5400394 -0.1008827 -0.0571236 -0.1145371 2.4888024 0.0263296 0.0231133 0.0674704 2.4402212 17 Sr 2.5400394 -0.1008827 -0.0571236 -0.1145371 2.4888024 0.0263296 0.0231133 0.0674704 2.4402212 18 Sr 2.5400394 0.1008827 -0.0571236 0.1145371 2.4888024 -0.0263296 0.0231133 -0.0674704 2.4402212 19 Te 4.8289048 -0.1035151 -0.1577001 -0.0180592 4.8469593 -0.0759971 0.0320621 -0.0537127 4.8586302 20 Te 4.8289048 0.1035151 -0.1577001 0.0180592 4.8469593 0.0759971 0.0320621 0.0537127 4.8586302 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000003 (zzz) -0.00000003 (zzz) -0.00000003 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000013 (yx) 0.00000013 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:01:08]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:01:08]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.774222630000037 0.000000000000000 0.000000000000000 b 0.000000000000000 5.853895529999999 0.000000000000000 c -5.742070453163258 0.000000000000000 8.196218406325023 Atomic positions (fractional): 1 O 0.69138695255425 0.47498674181187 0.77091495411889 15.999 2 O 0.30861304744575 0.97498674181187 0.72908504588111 15.999 3 O 0.30861304744575 0.52501325818813 0.22908504588111 15.999 4 O 0.69138695255425 0.02501325818813 0.27091495411889 15.999 5 O 0.85668854157668 0.23232682376534 0.04569912003236 15.999 6 O 0.14331145842332 0.73232682376533 0.45430087996764 15.999 7 O 0.14331145842332 0.76767317623467 0.95430087996764 15.999 8 O 0.85668854157668 0.26767317623467 0.54569912003236 15.999 9 O 0.77180127330012 0.80662327487448 0.53918831804171 15.999 10 O 0.22819872669988 0.30662327487448 0.96081168195829 15.999 11 O 0.22819872669988 0.19337672512552 0.46081168195829 15.999 12 O 0.77180127330012 0.69337672512552 0.03918831804171 15.999 13 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 14 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 15 Sr 0.75888178653028 0.46146314368147 0.24962271753136 87.620 16 Sr 0.24111821346972 0.96146314368147 0.25037728246864 87.620 17 Sr 0.75888178653028 0.03853685631853 0.74962271753136 87.620 18 Sr 0.24111821346972 0.53853685631853 0.75037728246864 87.620 19 Te 0.00000000000000 0.00000000000000 0.50000000000000 127.600 20 Te 0.00000000000000 0.50000000000000 0.00000000000000 127.600 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.548445260000074 0.000000000000000 0.000000000000000 b 0.000000000000000 11.707791059999998 0.000000000000000 c -5.742070453163258 0.000000000000000 8.196218406325023 Atomic positions (fractional): 1 O 0.34569347627712 0.23749337090594 0.77091495411889 15.999 > 1 2 O 0.84569347627712 0.23749337090594 0.77091495411889 15.999 > 1 3 O 0.34569347627712 0.73749337090594 0.77091495411889 15.999 > 1 4 O 0.84569347627712 0.73749337090594 0.77091495411889 15.999 > 1 5 O 0.15430652372288 0.48749337090594 0.72908504588111 15.999 > 5 6 O 0.65430652372288 0.48749337090594 0.72908504588111 15.999 > 5 7 O 0.15430652372288 0.98749337090594 0.72908504588111 15.999 > 5 8 O 0.65430652372288 0.98749337090594 0.72908504588111 15.999 > 5 9 O 0.15430652372288 0.26250662909406 0.22908504588111 15.999 > 9 10 O 0.65430652372288 0.26250662909406 0.22908504588111 15.999 > 9 11 O 0.15430652372288 0.76250662909406 0.22908504588111 15.999 > 9 12 O 0.65430652372288 0.76250662909406 0.22908504588111 15.999 > 9 13 O 0.34569347627712 0.01250662909406 0.27091495411889 15.999 > 13 14 O 0.84569347627712 0.01250662909406 0.27091495411889 15.999 > 13 15 O 0.34569347627712 0.51250662909406 0.27091495411889 15.999 > 13 16 O 0.84569347627712 0.51250662909406 0.27091495411889 15.999 > 13 17 O 0.42834427078834 0.11616341188267 0.04569912003236 15.999 > 17 18 O 0.92834427078834 0.11616341188267 0.04569912003236 15.999 > 17 19 O 0.42834427078834 0.61616341188267 0.04569912003236 15.999 > 17 20 O 0.92834427078834 0.61616341188267 0.04569912003236 15.999 > 17 21 O 0.07165572921166 0.36616341188267 0.45430087996764 15.999 > 21 22 O 0.57165572921166 0.36616341188267 0.45430087996764 15.999 > 21 23 O 0.07165572921166 0.86616341188267 0.45430087996764 15.999 > 21 24 O 0.57165572921166 0.86616341188267 0.45430087996764 15.999 > 21 25 O 0.07165572921166 0.38383658811733 0.95430087996764 15.999 > 25 26 O 0.57165572921166 0.38383658811733 0.95430087996764 15.999 > 25 27 O 0.07165572921166 0.88383658811733 0.95430087996764 15.999 > 25 28 O 0.57165572921166 0.88383658811733 0.95430087996764 15.999 > 25 29 O 0.42834427078834 0.13383658811733 0.54569912003236 15.999 > 29 30 O 0.92834427078834 0.13383658811733 0.54569912003236 15.999 > 29 31 O 0.42834427078834 0.63383658811733 0.54569912003236 15.999 > 29 32 O 0.92834427078834 0.63383658811733 0.54569912003236 15.999 > 29 33 O 0.38590063665006 0.40331163743724 0.53918831804171 15.999 > 33 34 O 0.88590063665006 0.40331163743724 0.53918831804171 15.999 > 33 35 O 0.38590063665006 0.90331163743724 0.53918831804171 15.999 > 33 36 O 0.88590063665006 0.90331163743724 0.53918831804171 15.999 > 33 37 O 0.11409936334994 0.15331163743724 0.96081168195829 15.999 > 37 38 O 0.61409936334994 0.15331163743724 0.96081168195829 15.999 > 37 39 O 0.11409936334994 0.65331163743724 0.96081168195829 15.999 > 37 40 O 0.61409936334994 0.65331163743724 0.96081168195829 15.999 > 37 41 O 0.11409936334994 0.09668836256276 0.46081168195829 15.999 > 41 42 O 0.61409936334994 0.09668836256276 0.46081168195829 15.999 > 41 43 O 0.11409936334994 0.59668836256276 0.46081168195829 15.999 > 41 44 O 0.61409936334994 0.59668836256276 0.46081168195829 15.999 > 41 45 O 0.38590063665006 0.34668836256276 0.03918831804171 15.999 > 45 46 O 0.88590063665006 0.34668836256276 0.03918831804171 15.999 > 45 47 O 0.38590063665006 0.84668836256276 0.03918831804171 15.999 > 45 48 O 0.88590063665006 0.84668836256276 0.03918831804171 15.999 > 45 49 Ca 0.25000000000000 0.00000000000000 0.00000000000000 40.078 > 49 50 Ca 0.75000000000000 0.00000000000000 0.00000000000000 40.078 > 49 51 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 49 52 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 49 53 Ca 0.25000000000000 0.25000000000000 0.50000000000000 40.078 > 53 54 Ca 0.75000000000000 0.25000000000000 0.50000000000000 40.078 > 53 55 Ca 0.25000000000000 0.75000000000000 0.50000000000000 40.078 > 53 56 Ca 0.75000000000000 0.75000000000000 0.50000000000000 40.078 > 53 57 Sr 0.37944089326514 0.23073157184073 0.24962271753136 87.620 > 57 58 Sr 0.87944089326514 0.23073157184073 0.24962271753136 87.620 > 57 59 Sr 0.37944089326514 0.73073157184073 0.24962271753136 87.620 > 57 60 Sr 0.87944089326514 0.73073157184073 0.24962271753136 87.620 > 57 61 Sr 0.12055910673486 0.48073157184073 0.25037728246864 87.620 > 61 62 Sr 0.62055910673486 0.48073157184073 0.25037728246864 87.620 > 61 63 Sr 0.12055910673486 0.98073157184073 0.25037728246864 87.620 > 61 64 Sr 0.62055910673486 0.98073157184073 0.25037728246864 87.620 > 61 65 Sr 0.37944089326514 0.01926842815927 0.74962271753136 87.620 > 65 66 Sr 0.87944089326514 0.01926842815927 0.74962271753136 87.620 > 65 67 Sr 0.37944089326514 0.51926842815927 0.74962271753136 87.620 > 65 68 Sr 0.87944089326514 0.51926842815927 0.74962271753136 87.620 > 65 69 Sr 0.12055910673486 0.26926842815927 0.75037728246864 87.620 > 69 70 Sr 0.62055910673486 0.26926842815927 0.75037728246864 87.620 > 69 71 Sr 0.12055910673486 0.76926842815927 0.75037728246864 87.620 > 69 72 Sr 0.62055910673486 0.76926842815927 0.75037728246864 87.620 > 69 73 Te 0.00000000000000 0.00000000000000 0.50000000000000 127.600 > 73 74 Te 0.50000000000000 0.00000000000000 0.50000000000000 127.600 > 73 75 Te 0.00000000000000 0.50000000000000 0.50000000000000 127.600 > 73 76 Te 0.50000000000000 0.50000000000000 0.50000000000000 127.600 > 73 77 Te 0.00000000000000 0.25000000000000 0.00000000000000 127.600 > 77 78 Te 0.50000000000000 0.25000000000000 0.00000000000000 127.600 > 77 79 Te 0.00000000000000 0.75000000000000 0.00000000000000 127.600 > 77 80 Te 0.50000000000000 0.75000000000000 0.00000000000000 127.600 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.7498763 0.0000000 -0.0117132 0.0000000 3.7510719 0.0000000 -0.0121300 0.0000000 3.7091601 -------------------------- Born effective charges -------------------------- 1 O -1.8433207 0.0708771 -0.1932660 0.0904172 -1.6888420 -0.0855921 -0.1657601 -0.0577387 -2.7387461 2 O -1.8433207 -0.0708771 -0.1932660 -0.0904172 -1.6888420 0.0855921 -0.1657601 0.0577387 -2.7387461 3 O -1.8433207 0.0708771 -0.1932660 0.0904172 -1.6888420 -0.0855921 -0.1657601 -0.0577387 -2.7387461 4 O -1.8433207 -0.0708771 -0.1932660 -0.0904172 -1.6888420 0.0855921 -0.1657601 0.0577387 -2.7387461 5 O -2.1035259 -0.4710075 0.1350761 -0.5169351 -2.4079565 0.1521885 0.1381169 0.1700948 -1.7325145 6 O -2.1035259 0.4710075 0.1350761 0.5169351 -2.4079565 -0.1521885 0.1381169 -0.1700948 -1.7325145 7 O -2.1035259 -0.4710075 0.1350761 -0.5169351 -2.4079565 0.1521885 0.1381169 0.1700948 -1.7325145 8 O -2.1035259 0.4710075 0.1350761 0.5169351 -2.4079565 -0.1521885 0.1381169 -0.1700948 -1.7325145 9 O -2.3521615 -0.4984578 0.0586000 -0.4807753 -2.1772106 0.0316133 0.0876453 0.0456278 -1.7457472 10 O -2.3521615 0.4984578 0.0586000 0.4807753 -2.1772106 -0.0316133 0.0876453 -0.0456278 -1.7457472 11 O -2.3521615 -0.4984578 0.0586000 -0.4807753 -2.1772106 0.0316133 0.0876453 0.0456278 -1.7457472 12 O -2.3521615 0.4984578 0.0586000 0.4807753 -2.1772106 -0.0316133 0.0876453 -0.0456278 -1.7457472 13 Ca 2.6890326 -0.1805735 0.2711271 0.1118862 2.7234543 0.0454944 -0.1982930 0.1021925 2.6949430 14 Ca 2.6890326 0.1805735 0.2711271 -0.1118862 2.7234543 -0.0454944 -0.1982930 -0.1021925 2.6949430 15 Sr 2.5400394 0.1008827 -0.0571236 0.1145371 2.4888024 -0.0263296 0.0231133 -0.0674704 2.4402212 16 Sr 2.5400394 -0.1008827 -0.0571236 -0.1145371 2.4888024 0.0263296 0.0231133 0.0674704 2.4402212 17 Sr 2.5400394 -0.1008827 -0.0571236 -0.1145371 2.4888024 0.0263296 0.0231133 0.0674704 2.4402212 18 Sr 2.5400394 0.1008827 -0.0571236 0.1145371 2.4888024 -0.0263296 0.0231133 -0.0674704 2.4402212 19 Te 4.8289048 -0.1035151 -0.1577001 -0.0180592 4.8469593 -0.0759971 0.0320621 -0.0537127 4.8586302 20 Te 4.8289048 0.1035151 -0.1577001 0.0180592 4.8469593 0.0759971 0.0320621 0.0537127 4.8586302 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000003 (zzz) -0.00000003 (zzz) -0.00000003 (zzz) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 9 6 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.64, Number of G-points: 319, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/170) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.646 ( 0.000 0.000 0.000) 0.000 2.960 ( 0.000 0.000 0.000) 0.000 3.230 ( 0.000 0.000 0.000) 0.000 3.248 ( 0.000 0.000 0.000) 0.000 3.332 ( 0.000 0.000 0.000) 0.000 3.356 ( 0.000 0.000 0.000) 0.000 3.615 ( 0.000 0.000 0.000) 0.000 3.676 ( 0.000 0.000 0.000) 0.000 4.041 ( 0.000 0.000 0.000) 0.000 4.063 ( 0.000 0.000 0.000) 0.000 4.235 ( 0.000 0.000 0.000) 0.000 4.286 ( 0.000 0.000 0.000) 0.000 4.438 ( 0.000 0.000 0.000) 0.000 4.487 ( 0.000 0.000 0.000) 0.000 4.641 ( 0.000 0.000 0.000) 0.000 4.849 ( 0.000 0.000 0.000) 0.000 4.902 ( 0.000 0.000 0.000) 0.000 5.112 ( 0.000 0.000 0.000) 0.000 5.650 ( 0.000 0.000 0.000) 0.000 6.869 ( 0.000 0.000 0.000) 0.000 6.974 ( 0.000 0.000 0.000) 0.000 7.087 ( 0.000 0.000 0.000) 0.000 7.346 ( 0.000 0.000 0.000) 0.000 7.380 ( 0.000 0.000 0.000) 0.000 7.612 ( 0.000 0.000 0.000) 0.000 7.794 ( 0.000 0.000 0.000) 0.000 7.830 ( 0.000 0.000 0.000) 0.000 8.131 ( 0.000 0.000 0.000) 0.000 8.356 ( 0.000 0.000 0.000) 0.000 8.519 ( 0.000 0.000 0.000) 0.000 8.690 ( 0.000 0.000 0.000) 0.000 9.429 ( 0.000 0.000 0.000) 0.000 9.896 ( 0.000 0.000 0.000) 0.000 10.898 ( 0.000 0.000 0.000) 0.000 10.984 ( 0.000 0.000 0.000) 0.000 11.248 ( 0.000 0.000 0.000) 0.000 11.539 ( 0.000 0.000 0.000) 0.000 11.580 ( 0.000 0.000 0.000) 0.000 12.050 ( 0.000 0.000 0.000) 0.000 12.059 ( 0.000 0.000 0.000) 0.000 12.197 ( 0.000 0.000 0.000) 0.000 12.274 ( 0.000 0.000 0.000) 0.000 12.296 ( 0.000 0.000 0.000) 0.000 12.975 ( 0.000 0.000 0.000) 0.000 13.880 ( 0.000 0.000 0.000) 0.000 17.487 ( 0.000 0.000 0.000) 0.000 17.694 ( 0.000 0.000 0.000) 0.000 17.708 ( 0.000 0.000 0.000) 0.000 18.587 ( 0.000 0.000 0.000) 0.000 18.641 ( 0.000 0.000 0.000) 0.000 18.893 ( 0.000 0.000 0.000) 0.000 18.955 ( 0.000 0.000 0.000) 0.000 19.065 ( 0.000 0.000 0.000) 0.000 19.198 ( 0.000 0.000 0.000) 0.000 20.295 ( 0.000 0.000 0.000) 0.000 21.200 ( 0.000 0.000 0.000) 0.000 21.377 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/170) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.628 ( 22.738 0.000 23.349) 32.592 0.696 ( 27.969 0.000 22.073) 35.629 1.146 ( 49.336 0.000 30.568) 58.039 2.683 ( 5.384 0.000 -2.395) 5.893 2.920 ( 0.406 0.000 -7.145) 7.157 3.114 ( -7.456 0.000 -8.825) 11.553 3.243 ( -1.203 0.000 -0.056) 1.205 3.320 ( -4.896 0.000 -0.657) 4.940 3.342 ( 0.701 0.000 0.617) 0.934 3.631 ( -4.286 0.000 0.559) 4.322 3.760 ( -13.813 0.000 0.248) 13.815 3.867 ( 5.649 0.000 6.916) 8.929 4.188 ( -0.758 0.000 2.299) 2.421 4.315 ( 1.171 0.000 -2.975) 3.197 4.416 ( -9.748 0.000 17.945) 20.421 4.478 ( 2.601 0.000 5.366) 5.964 4.539 ( 7.566 0.000 3.301) 8.255 4.840 ( -2.619 0.000 4.602) 5.295 4.975 ( -13.057 0.000 -5.761) 14.271 4.998 ( 6.197 0.000 5.877) 8.540 5.219 ( -0.128 0.000 -12.544) 12.545 5.575 ( -4.963 0.000 -5.793) 7.628 6.892 ( 7.304 0.000 -7.053) 10.153 6.976 ( 1.118 0.000 -1.006) 1.504 7.015 ( -6.543 0.000 1.996) 6.840 7.359 ( -0.488 0.000 2.165) 2.220 7.481 ( 7.923 0.000 2.010) 8.174 7.704 ( 5.865 0.000 -3.662) 6.914 7.888 ( 5.769 0.000 2.195) 6.172 8.180 ( 1.770 0.000 4.926) 5.235 8.327 ( -2.412 0.000 -0.725) 2.518 8.486 ( -8.074 0.000 9.951) 12.814 8.592 ( 0.792 0.000 0.886) 1.188 8.990 ( 5.907 0.000 -10.121) 11.719 9.453 ( 2.243 0.000 0.678) 2.343 9.844 ( -4.222 0.000 -2.815) 5.075 10.910 ( 1.505 0.000 -0.124) 1.511 10.963 ( -2.063 0.000 -0.486) 2.119 11.336 ( -8.862 0.000 10.744) 13.928 11.560 ( -1.504 0.000 -1.312) 1.995 11.959 ( -3.986 0.000 -1.830) 4.386 11.999 ( -7.791 0.000 0.758) 7.827 12.217 ( 0.231 0.000 1.741) 1.756 12.242 ( -5.462 0.000 -0.527) 5.487 12.342 ( 7.649 0.000 1.600) 7.815 13.051 ( 10.711 0.000 -3.476) 11.261 13.787 ( 14.613 0.000 -20.704) 25.342 13.853 ( -1.952 0.000 -1.861) 2.697 17.493 ( -0.139 0.000 1.281) 1.289 17.686 ( -0.611 0.000 -0.501) 0.791 17.714 ( -0.722 0.000 2.090) 2.211 18.594 ( 0.426 0.000 0.528) 0.678 18.635 ( -1.070 0.000 -0.063) 1.072 18.946 ( -5.282 0.000 2.142) 5.700 19.011 ( -5.829 0.000 -15.956) 16.987 19.030 ( -3.258 0.000 3.999) 5.158 20.475 ( 10.293 0.000 12.738) 16.377 21.215 ( 1.230 0.000 0.787) 1.460 21.379 ( 0.536 0.000 -0.441) 0.694 21.509 ( -0.569 0.000 -0.736) 0.930 ======================= Grid point 2 (3/170) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.217 ( 20.588 0.000 20.941) 29.367 1.355 ( 25.411 0.000 20.493) 32.645 2.173 ( 39.412 0.000 23.937) 46.112 2.668 ( -0.436 0.000 -14.810) 14.817 2.840 ( 3.447 0.000 -10.484) 11.036 2.929 ( -4.088 0.000 1.974) 4.540 3.177 ( -10.615 0.000 -3.062) 11.048 3.223 ( -0.871 0.000 -0.525) 1.017 3.363 ( 1.128 0.000 0.369) 1.187 3.560 ( -6.002 0.000 0.963) 6.079 3.637 ( -6.624 0.000 4.240) 7.865 4.048 ( 6.707 0.000 5.783) 8.856 4.170 ( -1.732 0.000 -3.171) 3.613 4.251 ( -2.663 0.000 -1.410) 3.013 4.474 ( -4.427 0.000 11.114) 11.963 4.496 ( -7.960 0.000 9.104) 12.093 4.642 ( -14.186 0.000 -8.310) 16.440 4.769 ( 15.232 0.000 -1.299) 15.287 4.881 ( 0.092 0.000 6.433) 6.433 5.050 ( -6.893 0.000 -6.794) 9.679 5.189 ( 7.183 0.000 7.836) 10.630 5.390 ( -7.574 0.000 -8.439) 11.339 6.888 ( 0.659 0.000 -5.111) 5.153 6.986 ( 0.986 0.000 -0.502) 1.106 7.034 ( 5.062 0.000 3.812) 6.337 7.371 ( -0.488 0.000 1.115) 1.218 7.612 ( 6.801 0.000 0.065) 6.801 7.771 ( 4.854 0.000 -0.082) 4.854 8.044 ( 7.986 0.000 3.826) 8.855 8.198 ( -2.931 0.000 -0.817) 3.043 8.357 ( 2.215 0.000 8.357) 8.645 8.442 ( -5.292 0.000 1.162) 5.418 8.625 ( 1.760 0.000 1.122) 2.087 8.940 ( 0.426 0.000 -8.704) 8.714 9.497 ( 2.103 0.000 -0.031) 2.103 9.731 ( -4.670 0.000 -3.824) 6.036 10.925 ( -1.558 0.000 -0.051) 1.559 10.937 ( 2.444 0.000 -0.804) 2.573 11.310 ( -4.902 0.000 4.477) 6.639 11.511 ( -1.738 0.000 -2.342) 2.916 11.854 ( -7.110 0.000 -0.891) 7.165 11.858 ( -10.659 0.000 1.375) 10.747 12.141 ( -5.784 0.000 -1.184) 5.904 12.229 ( -0.277 0.000 0.402) 0.488 12.537 ( 11.837 0.000 4.904) 12.812 13.187 ( 12.484 0.000 -6.601) 14.122 13.786 ( 6.286 0.000 -9.596) 11.472 13.786 ( -3.204 0.000 -2.223) 3.900 17.511 ( -0.021 0.000 2.163) 2.163 17.665 ( -1.044 0.000 -0.872) 1.360 17.732 ( -1.071 0.000 3.788) 3.936 18.532 ( -11.646 0.000 -8.260) 14.278 18.610 ( 0.824 0.000 0.497) 0.963 18.714 ( -3.238 0.000 -6.299) 7.082 18.957 ( 1.038 0.000 -2.288) 2.512 19.018 ( -1.338 0.000 0.469) 1.418 20.806 ( 10.724 0.000 14.925) 18.378 21.253 ( 2.096 0.000 1.259) 2.445 21.384 ( 0.810 0.000 -0.717) 1.082 21.485 ( -0.668 0.000 -1.848) 1.965 ======================= Grid point 3 (4/170) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 15.733 0.000 17.063) 23.209 1.932 ( 20.814 0.000 17.120) 26.950 2.453 ( -1.910 0.000 -12.639) 12.783 2.617 ( 3.746 0.000 -5.739) 6.853 2.885 ( -11.647 0.000 -4.412) 12.455 2.963 ( 14.113 0.000 -0.485) 14.121 3.031 ( -1.453 0.000 6.236) 6.403 3.219 ( 1.304 0.000 0.542) 1.413 3.353 ( -5.422 0.000 -1.634) 5.663 3.479 ( -5.549 0.000 5.034) 7.493 3.580 ( -6.289 0.000 1.457) 6.456 4.053 ( -6.109 0.000 -5.036) 7.917 4.143 ( 3.051 0.000 3.670) 4.772 4.237 ( 1.535 0.000 -0.726) 1.698 4.448 ( -8.702 0.000 6.912) 11.113 4.468 ( 6.719 0.000 -1.980) 7.004 4.584 ( -0.435 0.000 5.579) 5.596 4.906 ( -5.033 0.000 2.501) 5.620 4.971 ( 8.157 0.000 3.240) 8.777 4.987 ( 10.254 0.000 -0.097) 10.255 5.176 ( -7.632 0.000 -7.595) 10.767 5.361 ( 5.332 0.000 4.414) 6.922 6.820 ( -5.803 0.000 -0.872) 5.868 6.988 ( -0.360 0.000 -0.353) 0.504 7.204 ( 9.185 0.000 4.916) 10.418 7.369 ( -0.719 0.000 0.480) 0.865 7.700 ( 5.291 0.000 -1.251) 5.437 7.835 ( 3.427 0.000 -1.098) 3.599 8.065 ( -3.454 0.000 -1.327) 3.700 8.276 ( 6.375 0.000 5.648) 8.517 8.354 ( -4.774 0.000 -1.919) 5.145 8.510 ( 3.451 0.000 10.043) 10.620 8.663 ( 0.899 0.000 1.249) 1.539 8.811 ( -3.612 0.000 -9.162) 9.848 9.492 ( -1.275 0.000 -2.781) 3.060 9.627 ( -3.534 0.000 -3.163) 4.743 10.935 ( 2.184 0.000 1.515) 2.658 10.973 ( 3.930 0.000 -1.535) 4.219 11.283 ( -3.381 0.000 2.421) 4.159 11.465 ( -0.460 0.000 -2.519) 2.561 11.713 ( -9.522 0.000 1.669) 9.667 11.725 ( -8.177 0.000 -0.239) 8.181 12.041 ( -4.692 0.000 -1.672) 4.981 12.217 ( -0.915 0.000 -0.663) 1.130 12.799 ( 12.826 0.000 6.432) 14.349 13.275 ( 9.074 0.000 -8.836) 12.666 13.721 ( -2.554 0.000 -0.744) 2.660 13.768 ( 2.282 0.000 -6.070) 6.484 17.538 ( 0.317 0.000 2.208) 2.230 17.636 ( -1.257 0.000 -1.032) 1.627 17.764 ( -0.975 0.000 4.778) 4.876 18.208 ( -11.334 0.000 -11.637) 16.244 18.628 ( 0.765 0.000 0.457) 0.891 18.672 ( 0.039 0.000 -1.394) 1.395 18.943 ( 0.113 0.000 -2.098) 2.101 18.998 ( -0.830 0.000 -1.083) 1.365 21.112 ( 7.984 0.000 13.066) 15.312 21.303 ( 2.304 0.000 1.270) 2.631 21.388 ( 0.655 0.000 -0.641) 0.917 21.450 ( -0.626 0.000 -2.395) 2.475 ======================= Grid point 4 (5/170) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 5.610 0.000 10.729) 12.107 2.289 ( 8.115 0.000 -1.408) 8.236 2.470 ( 12.714 0.000 6.893) 14.463 2.565 ( 1.715 0.000 -6.262) 6.493 2.624 ( -12.746 0.000 -2.786) 13.047 2.937 ( -5.978 0.000 -8.447) 10.348 3.077 ( -5.632 0.000 5.838) 8.111 3.189 ( -7.325 0.000 -0.771) 7.365 3.231 ( 2.073 0.000 -5.606) 5.977 3.467 ( -5.208 0.000 -2.446) 5.754 3.488 ( -3.180 0.000 6.416) 7.161 3.893 ( -6.062 0.000 -5.710) 8.327 4.265 ( 2.354 0.000 -0.310) 2.374 4.344 ( 11.108 0.000 0.848) 11.140 4.395 ( -5.199 0.000 3.922) 6.513 4.498 ( -3.021 0.000 1.459) 3.355 4.685 ( 7.734 0.000 3.023) 8.303 4.958 ( -5.832 0.000 0.433) 5.848 5.089 ( 9.953 0.000 8.519) 13.100 5.117 ( 3.006 0.000 9.219) 9.696 5.182 ( 16.212 0.000 -5.310) 17.059 5.441 ( 2.141 0.000 -0.858) 2.307 6.674 ( -10.770 0.000 -1.233) 10.840 6.963 ( -1.797 0.000 -1.043) 2.078 7.363 ( -0.684 0.000 0.451) 0.819 7.395 ( 6.388 0.000 5.972) 8.745 7.745 ( 2.230 0.000 -1.646) 2.772 7.839 ( 0.687 0.000 -3.999) 4.058 8.040 ( 1.567 0.000 0.381) 1.612 8.265 ( -3.660 0.000 -2.268) 4.306 8.410 ( 1.471 0.000 7.240) 7.388 8.619 ( -6.602 0.000 -2.018) 6.903 8.666 ( 3.678 0.000 6.737) 7.676 8.716 ( 2.345 0.000 -3.120) 3.903 9.403 ( -3.532 0.000 -5.162) 6.254 9.549 ( -2.562 0.000 -2.331) 3.464 11.026 ( 5.817 0.000 2.963) 6.528 11.031 ( 5.972 0.000 -2.020) 6.304 11.253 ( -3.706 0.000 1.895) 4.162 11.429 ( -1.949 0.000 -2.433) 3.118 11.603 ( -6.818 0.000 0.168) 6.820 11.607 ( -5.481 0.000 1.545) 5.694 11.963 ( -2.689 0.000 -1.660) 3.160 12.190 ( -1.127 0.000 -0.999) 1.506 13.061 ( 10.959 0.000 6.140) 12.562 13.283 ( 4.002 0.000 -7.450) 8.457 13.696 ( -0.501 0.000 0.217) 0.546 13.721 ( -0.820 0.000 -4.587) 4.660 17.566 ( 0.458 0.000 1.454) 1.525 17.604 ( -1.301 0.000 -1.001) 1.642 17.804 ( -0.546 0.000 4.367) 4.401 17.961 ( -6.070 0.000 -7.649) 9.764 18.643 ( 0.499 0.000 0.298) 0.581 18.661 ( -0.052 0.000 -0.698) 0.700 18.915 ( -0.545 0.000 -1.973) 2.047 18.971 ( -0.653 0.000 -1.504) 1.639 21.335 ( 4.648 0.000 8.916) 10.055 21.348 ( 1.758 0.000 0.891) 1.971 21.389 ( -0.073 0.000 -0.128) 0.148 21.417 ( -0.020 0.000 -2.320) 2.320 ======================= Grid point 5 (6/170) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.129 ( -2.193 0.000 2.469) 3.303 2.336 ( 2.588 0.000 -4.125) 4.870 2.496 ( -1.700 0.000 2.040) 2.656 2.559 ( 1.636 0.000 -1.293) 2.086 2.746 ( 9.471 0.000 5.779) 11.094 2.780 ( -2.218 0.000 -4.178) 4.730 2.946 ( -11.809 0.000 -0.363) 11.815 3.124 ( -2.703 0.000 1.742) 3.216 3.191 ( 1.414 0.000 -4.847) 5.049 3.422 ( 0.431 0.000 -0.517) 0.673 3.512 ( -1.097 0.000 3.272) 3.451 3.763 ( -3.018 0.000 -3.113) 4.336 4.293 ( 1.131 0.000 -0.090) 1.134 4.349 ( -0.624 0.000 -3.767) 3.818 4.373 ( -1.541 0.000 1.334) 2.039 4.580 ( 3.288 0.000 4.127) 5.277 4.799 ( 5.285 0.000 -2.196) 5.723 4.842 ( -6.796 0.000 2.003) 7.085 5.259 ( 2.628 0.000 7.009) 7.486 5.344 ( 7.827 0.000 -1.783) 8.028 5.398 ( 9.161 0.000 6.906) 11.472 5.417 ( -0.545 0.000 -4.586) 4.619 6.506 ( -6.748 0.000 -0.717) 6.786 6.920 ( -1.522 0.000 -0.965) 1.802 7.358 ( -0.349 0.000 0.226) 0.416 7.513 ( 2.218 0.000 2.536) 3.369 7.746 ( 0.227 0.000 -0.744) 0.778 7.796 ( -0.368 0.000 -2.528) 2.555 8.088 ( 1.971 0.000 0.790) 2.124 8.190 ( -2.193 0.000 -1.700) 2.775 8.485 ( 0.022 0.000 3.900) 3.900 8.532 ( -2.128 0.000 -0.325) 2.153 8.727 ( 0.881 0.000 -0.594) 1.063 8.751 ( 1.070 0.000 1.849) 2.137 9.309 ( -1.567 0.000 -2.820) 3.226 9.500 ( -1.062 0.000 -0.946) 1.422 11.111 ( 6.684 0.000 -2.102) 7.007 11.167 ( 7.175 0.000 3.219) 7.864 11.202 ( -5.501 0.000 1.980) 5.846 11.326 ( -6.612 0.000 -2.788) 7.175 11.528 ( -2.610 0.000 0.118) 2.612 11.581 ( -0.466 0.000 0.704) 0.844 11.922 ( -0.783 0.000 -0.756) 1.088 12.167 ( -0.524 0.000 -0.474) 0.707 13.252 ( 5.290 0.000 3.259) 6.213 13.261 ( 0.935 0.000 -2.730) 2.886 13.653 ( -1.720 0.000 -2.526) 3.056 13.697 ( 0.134 0.000 0.088) 0.161 17.578 ( -0.673 0.000 -0.511) 0.844 17.582 ( 0.207 0.000 0.474) 0.517 17.835 ( -0.133 0.000 1.839) 1.844 17.848 ( -1.616 0.000 -2.459) 2.943 18.650 ( 0.169 0.000 0.092) 0.192 18.655 ( -0.048 0.000 -0.235) 0.239 18.890 ( -0.373 0.000 -0.872) 0.949 18.950 ( -0.284 0.000 -0.708) 0.763 21.375 ( 0.651 0.000 0.314) 0.723 21.382 ( -0.407 0.000 -0.050) 0.410 21.403 ( 0.346 0.000 -0.889) 0.954 21.450 ( 1.499 0.000 3.170) 3.506 ======================= Grid point 11 (7/170) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.653 ( 0.000 33.862 0.000) 33.862 0.709 ( 0.000 36.556 0.000) 36.556 1.083 ( 0.000 54.052 0.000) 54.052 2.688 ( 0.000 2.146 0.000) 2.146 2.971 ( 0.000 1.037 0.000) 1.037 3.201 ( 0.000 -2.923 0.000) 2.923 3.228 ( 0.000 -4.835 0.000) 4.835 3.335 ( 0.000 0.614 0.000) 0.614 3.407 ( 0.000 -1.971 0.000) 1.971 3.609 ( 0.000 0.134 0.000) 0.134 3.635 ( 0.000 -3.753 0.000) 3.753 3.894 ( 0.000 -10.682 0.000) 10.682 4.093 ( 0.000 4.696 0.000) 4.696 4.095 ( 0.000 -7.410 0.000) 7.410 4.383 ( 0.000 4.516 0.000) 4.516 4.647 ( 0.000 11.212 0.000) 11.212 4.719 ( 0.000 11.384 0.000) 11.384 4.724 ( 0.000 -3.326 0.000) 3.326 4.914 ( 0.000 7.118 0.000) 7.118 5.086 ( 0.000 -5.777 0.000) 5.777 5.131 ( 0.000 -16.087 0.000) 16.087 5.773 ( 0.000 6.898 0.000) 6.898 6.948 ( 0.000 -2.481 0.000) 2.481 7.022 ( 0.000 -6.130 0.000) 6.130 7.111 ( 0.000 3.813 0.000) 3.813 7.376 ( 0.000 2.650 0.000) 2.650 7.466 ( 0.000 4.222 0.000) 4.222 7.614 ( 0.000 0.316 0.000) 0.316 7.827 ( 0.000 3.196 0.000) 3.196 8.054 ( 0.000 4.169 0.000) 4.169 8.218 ( 0.000 2.972 0.000) 2.972 8.501 ( 0.000 -2.344 0.000) 2.344 8.781 ( 0.000 9.162 0.000) 9.162 8.818 ( 0.000 0.252 0.000) 0.252 9.593 ( 0.000 -4.276 0.000) 4.276 9.852 ( 0.000 -4.312 0.000) 4.312 10.909 ( 0.000 1.091 0.000) 1.091 11.231 ( 0.000 -2.138 0.000) 2.138 11.531 ( 0.000 -0.659 0.000) 0.659 11.612 ( 0.000 2.862 0.000) 2.862 11.985 ( 0.000 -5.219 0.000) 5.219 12.111 ( 0.000 5.347 0.000) 5.347 12.182 ( 0.000 -2.161 0.000) 2.161 12.215 ( 0.000 -3.544 0.000) 3.544 12.255 ( 0.000 -2.000 0.000) 2.000 13.048 ( 0.000 6.776 0.000) 6.776 13.197 ( 0.000 0.048 0.000) 0.048 13.903 ( 0.000 -4.695 0.000) 4.695 17.512 ( 0.000 2.473 0.000) 2.473 17.703 ( 0.000 0.955 0.000) 0.955 17.717 ( 0.000 0.942 0.000) 0.942 18.535 ( 0.000 -5.546 0.000) 5.546 18.897 ( 0.000 0.370 0.000) 0.370 18.922 ( 0.000 -0.250 0.000) 0.250 19.010 ( 0.000 -4.804 0.000) 4.804 19.163 ( 0.000 -2.522 0.000) 2.522 20.405 ( 0.000 10.575 0.000) 10.575 21.206 ( 0.000 0.562 0.000) 0.562 21.362 ( 0.000 -1.286 0.000) 1.286 21.440 ( 0.000 0.707 0.000) 0.707 ======================= Grid point 12 (8/170) ======================= q-point: ( 0.09 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.819 ( 14.209 19.874 15.297) 28.825 0.895 ( 15.807 23.419 14.559) 31.785 1.638 ( 35.307 37.707 22.081) 56.178 2.705 ( 4.302 2.109 -2.461) 5.387 2.917 ( -0.985 -0.345 -7.101) 7.177 3.111 ( -6.593 -0.467 -7.766) 10.198 3.199 ( -2.422 -6.131 0.123) 6.593 3.288 ( -2.307 0.106 0.578) 2.381 3.362 ( -3.400 -1.703 -1.835) 4.223 3.598 ( -3.825 -2.339 1.800) 4.832 3.683 ( -0.263 -5.673 1.495) 5.872 3.850 ( -3.615 0.217 6.221) 7.198 4.122 ( -1.118 -8.152 4.160) 9.220 4.272 ( 3.824 -3.306 11.986) 13.009 4.341 ( 0.080 2.811 -3.610) 4.576 4.512 ( -11.329 0.155 6.897) 13.264 4.687 ( 3.773 11.005 0.142) 11.635 4.845 ( 0.347 3.298 3.974) 5.176 4.971 ( -1.899 -0.744 -1.527) 2.548 4.991 ( -1.777 2.774 1.291) 3.538 5.222 ( 8.858 -9.219 -11.850) 17.432 5.683 ( -5.129 9.160 -6.422) 12.307 6.911 ( 3.017 -1.762 -11.113) 11.649 6.961 ( 0.987 -1.668 -0.924) 2.147 7.081 ( -8.128 6.471 7.221) 12.652 7.385 ( -0.791 2.306 1.981) 3.141 7.496 ( 5.358 1.916 0.897) 5.760 7.687 ( 6.332 -1.489 -1.343) 6.642 7.912 ( 6.385 2.777 2.210) 7.305 8.152 ( 2.400 -1.923 5.869) 6.626 8.249 ( -0.639 0.818 4.312) 4.435 8.524 ( 3.798 -2.865 -1.380) 4.953 8.690 ( -7.867 8.474 3.518) 12.086 8.893 ( 3.571 -1.797 -1.226) 4.181 9.507 ( -3.918 0.543 -1.131) 4.113 9.809 ( -3.278 -3.410 -2.487) 5.344 10.880 ( -1.316 0.087 -0.949) 1.625 11.158 ( -1.692 7.177 -7.625) 10.607 11.358 ( -12.173 2.776 6.546) 14.098 11.587 ( -1.835 2.453 -1.562) 3.439 11.906 ( -2.757 -4.097 -2.359) 5.472 12.026 ( -8.685 2.291 -0.310) 8.988 12.171 ( -2.041 -3.931 -0.346) 4.442 12.249 ( -1.572 -0.403 1.437) 2.168 12.334 ( 8.380 -0.038 2.791) 8.832 13.118 ( 10.260 6.222 -3.353) 12.459 13.514 ( 19.381 -13.259 -1.472) 23.529 13.863 ( -1.433 -3.530 -4.299) 5.744 17.507 ( -0.062 2.068 0.296) 2.090 17.702 ( -0.145 0.352 0.240) 0.450 17.735 ( 1.961 2.640 -0.750) 3.373 18.525 ( -1.441 -6.683 -0.440) 6.850 18.767 ( -5.304 7.390 -4.704) 10.241 18.920 ( -5.797 -1.763 1.270) 6.191 18.967 ( 1.937 -1.946 -7.422) 7.913 19.087 ( -3.195 1.303 -4.007) 5.288 20.539 ( 7.024 6.819 11.750) 15.294 21.216 ( 0.815 0.211 0.740) 1.120 21.374 ( 1.166 -1.104 -0.752) 1.773 21.448 ( -2.344 -2.931 3.391) 5.058 ======================= Grid point 13 (9/170) ======================= q-point: ( 0.18 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( 18.138 5.688 22.310) 29.310 1.361 ( 22.045 9.759 14.971) 28.378 2.438 ( 32.106 22.454 19.449) 43.740 2.689 ( 0.179 1.524 -14.003) 14.086 2.832 ( 1.931 -0.164 -6.937) 7.202 2.926 ( -5.019 -0.436 -1.008) 5.137 3.139 ( -7.011 -4.795 -1.031) 8.556 3.205 ( -5.669 -1.721 -1.853) 6.208 3.337 ( 1.776 -2.019 0.860) 2.823 3.546 ( -5.805 -0.934 1.875) 6.171 3.644 ( -4.808 -0.106 3.789) 6.122 3.958 ( 5.020 -5.262 3.936) 8.269 4.138 ( 0.105 -8.534 0.305) 8.540 4.241 ( -2.691 4.781 -3.593) 6.558 4.444 ( -5.047 -3.830 4.599) 7.829 4.458 ( -6.410 -1.290 15.385) 16.717 4.700 ( -11.299 4.111 -2.901) 12.369 4.748 ( 3.846 -0.983 -2.612) 4.751 4.939 ( 2.880 7.629 4.561) 9.344 5.117 ( 1.510 2.453 -11.014) 11.385 5.174 ( 5.696 -0.449 4.571) 7.317 5.520 ( -5.715 10.060 -6.054) 13.058 6.870 ( 1.147 -1.907 -4.483) 5.005 6.958 ( -0.349 -1.504 0.304) 1.574 7.104 ( 3.436 5.503 3.767) 7.502 7.389 ( -0.996 1.565 1.102) 2.157 7.590 ( 4.331 -1.402 1.406) 4.764 7.772 ( 5.277 -0.844 -0.578) 5.376 8.052 ( 6.026 0.707 2.541) 6.578 8.176 ( -2.590 -1.344 0.834) 3.035 8.312 ( 1.522 -1.011 7.330) 7.555 8.533 ( -0.961 4.073 -3.607) 5.524 8.660 ( -1.261 1.164 4.966) 5.254 8.876 ( -1.673 -1.917 -3.501) 4.328 9.499 ( 2.170 0.300 -0.209) 2.200 9.716 ( -3.828 -1.490 -3.293) 5.265 10.868 ( 0.043 -1.599 0.325) 1.632 11.078 ( 0.561 9.078 -4.886) 10.325 11.286 ( -6.278 -2.823 4.365) 8.151 11.531 ( -1.854 2.020 -2.617) 3.790 11.835 ( -4.336 -1.239 -0.644) 4.555 11.865 ( -10.671 0.622 -0.141) 10.690 12.112 ( -3.881 -2.653 -1.415) 4.910 12.233 ( -1.005 -0.144 -0.026) 1.016 12.547 ( 11.533 1.378 6.210) 13.171 13.248 ( 11.878 5.679 -6.458) 14.664 13.674 ( 6.010 -7.430 -3.040) 10.028 13.790 ( 0.012 -2.396 -5.463) 5.965 17.522 ( 0.481 1.680 1.646) 2.401 17.703 ( -0.877 1.298 1.224) 1.988 17.757 ( 1.659 4.195 -0.411) 4.530 18.436 ( -7.009 -7.691 -6.615) 12.330 18.653 ( -4.409 5.081 -1.622) 6.920 18.789 ( -1.206 3.992 -6.523) 7.742 18.953 ( 1.299 -0.307 -2.190) 2.565 19.040 ( -1.231 1.638 -0.291) 2.070 20.814 ( 7.987 1.127 14.382) 16.489 21.245 ( 1.324 -0.791 1.207) 1.959 21.380 ( 0.986 -0.593 -1.105) 1.595 21.434 ( -2.383 -4.264 1.197) 5.029 ======================= Grid point 14 (10/170) ======================= q-point: ( 0.27 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( 13.678 6.579 15.878) 21.966 1.893 ( 20.031 -2.146 16.769) 26.211 2.498 ( -1.441 4.279 -11.878) 12.707 2.705 ( 0.431 5.944 -9.234) 10.990 2.855 ( -10.362 -2.235 -2.200) 10.826 2.958 ( 5.323 -1.130 1.218) 5.577 3.032 ( 2.302 0.341 2.518) 3.428 3.175 ( 2.064 -4.127 0.962) 4.714 3.351 ( -5.535 -0.122 -1.317) 5.691 3.478 ( -5.007 0.392 4.729) 6.899 3.598 ( -5.915 0.563 1.362) 6.096 3.995 ( -3.649 -6.392 -2.215) 7.686 4.123 ( 1.741 -1.639 2.406) 3.392 4.216 ( 4.672 0.505 -1.708) 5.000 4.439 ( -5.295 0.588 9.199) 10.630 4.484 ( 3.776 1.142 1.230) 4.132 4.667 ( -0.959 5.329 8.025) 9.681 4.753 ( 0.507 -7.359 -2.397) 7.756 4.973 ( -0.975 0.582 -1.650) 2.003 5.089 ( 7.735 6.875 -1.051) 10.402 5.279 ( 1.483 6.169 -2.098) 6.683 5.434 ( 0.456 6.822 1.523) 7.004 6.810 ( -5.485 -0.854 -1.145) 5.668 6.966 ( 0.114 -2.052 0.648) 2.155 7.244 ( 7.311 3.570 4.799) 9.445 7.378 ( -1.313 0.793 0.252) 1.555 7.666 ( 3.619 -2.908 1.482) 4.873 7.819 ( 2.257 -2.625 -2.613) 4.338 8.061 ( -3.125 0.169 0.836) 3.239 8.219 ( 1.760 -5.067 3.807) 6.577 8.381 ( -2.164 0.675 -0.555) 2.334 8.488 ( 0.580 -1.181 0.646) 1.466 8.709 ( 0.067 1.434 5.315) 5.506 8.809 ( -0.255 3.777 -3.248) 4.988 9.513 ( 0.507 2.029 -2.775) 3.474 9.628 ( -2.838 0.135 -2.917) 4.072 10.890 ( 1.771 -2.290 1.517) 3.268 11.065 ( 3.294 6.939 -3.570) 8.470 11.245 ( -4.064 -3.715 3.220) 6.379 11.487 ( 0.319 2.212 -2.826) 3.603 11.700 ( -9.670 -0.308 -0.603) 9.694 11.759 ( -5.296 2.383 0.769) 5.858 12.030 ( -3.825 -1.037 -1.907) 4.398 12.215 ( -0.782 -0.384 -0.820) 1.196 12.814 ( 12.212 1.611 7.392) 14.365 13.323 ( 7.678 4.357 -8.447) 12.218 13.681 ( -0.244 -3.685 -1.026) 3.833 13.758 ( 2.630 -0.972 -5.554) 6.222 17.554 ( 1.091 2.261 1.896) 3.146 17.701 ( -1.157 3.872 1.442) 4.291 17.780 ( 0.993 3.612 0.906) 3.854 18.193 ( -8.786 -1.190 -10.609) 13.826 18.615 ( -0.281 0.881 0.208) 0.948 18.740 ( 0.228 4.130 -2.825) 5.009 18.944 ( 0.281 0.210 -1.815) 1.848 19.018 ( -0.981 1.880 -0.927) 2.315 21.077 ( 5.930 -3.435 12.478) 14.236 21.278 ( 0.930 -2.603 1.149) 2.994 21.382 ( 0.509 -0.703 -0.761) 1.154 21.409 ( -1.137 -3.884 -0.289) 4.058 ======================= Grid point 15 (11/170) ======================= q-point: ( 0.36 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 4.616 2.770 9.187) 10.648 2.297 ( 10.826 -0.399 6.976) 12.885 2.461 ( 8.004 2.072 -0.501) 8.283 2.597 ( -7.501 -0.367 -6.363) 9.843 2.646 ( -2.452 3.728 -2.184) 4.968 2.904 ( -5.294 -3.216 -6.670) 9.103 3.080 ( -4.497 0.229 4.767) 6.558 3.158 ( -9.076 -3.656 0.759) 9.814 3.225 ( 3.555 -0.352 -7.075) 7.926 3.425 ( -4.846 -1.765 -0.891) 5.234 3.523 ( -4.861 0.773 3.729) 6.175 3.858 ( -5.743 -4.057 -5.527) 8.943 4.206 ( 4.267 -2.214 1.035) 4.917 4.390 ( 6.984 1.272 0.377) 7.109 4.421 ( -0.982 4.255 2.760) 5.166 4.539 ( -0.422 3.685 1.904) 4.169 4.738 ( 4.663 4.670 0.844) 6.653 4.823 ( 0.677 -9.435 5.670) 11.028 5.019 ( 7.698 -2.572 6.409) 10.342 5.224 ( 6.710 3.743 2.379) 8.043 5.277 ( 4.421 8.139 -1.752) 9.426 5.479 ( 1.283 3.477 0.285) 3.717 6.668 ( -9.847 -0.356 -1.675) 9.995 6.962 ( -1.191 -0.247 0.088) 1.219 7.354 ( -1.648 -0.963 0.988) 2.149 7.408 ( 5.711 1.202 3.845) 6.989 7.735 ( 1.939 -1.043 2.060) 3.015 7.796 ( 0.647 -5.013 -3.893) 6.380 8.051 ( -0.078 1.272 1.452) 1.932 8.247 ( -4.343 -10.132 0.108) 11.024 8.296 ( -1.652 -0.879 0.076) 1.873 8.475 ( -2.710 -6.641 -0.626) 7.200 8.804 ( 1.333 8.088 1.042) 8.263 8.817 ( 4.442 7.100 4.494) 9.504 9.447 ( -2.538 4.095 -5.281) 7.148 9.564 ( -1.783 1.504 -2.110) 3.145 10.962 ( 4.415 -3.394 2.343) 6.042 11.081 ( 2.385 1.089 -2.399) 3.554 11.240 ( -0.586 0.328 2.882) 2.960 11.467 ( -0.308 3.407 -3.639) 4.995 11.562 ( -6.039 -1.062 0.759) 6.178 11.688 ( -4.862 4.987 0.707) 7.001 11.958 ( -2.406 -0.519 -1.989) 3.164 12.191 ( -0.837 -0.010 -1.013) 1.315 13.075 ( 10.283 1.452 6.909) 12.473 13.315 ( 2.684 2.969 -6.413) 7.559 13.678 ( 0.861 -1.576 -0.625) 1.902 13.723 ( 0.093 0.248 -4.904) 4.912 17.594 ( 1.628 3.702 1.366) 4.269 17.696 ( -1.510 6.951 1.219) 7.217 17.808 ( 0.604 1.686 1.724) 2.486 17.976 ( -5.204 1.939 -7.932) 9.683 18.629 ( 1.467 0.354 0.282) 1.535 18.717 ( -0.514 3.605 -1.141) 3.816 18.923 ( -0.467 0.711 -1.628) 1.837 18.988 ( -1.119 1.775 -1.394) 2.519 21.261 ( 3.234 -7.069 6.031) 9.839 21.294 ( -0.375 -5.086 2.374) 5.625 21.382 ( 0.372 -1.057 -0.156) 1.131 21.400 ( 0.427 -2.052 -0.234) 2.109 ======================= Grid point 16 (12/170) ======================= q-point: ( 0.45 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( -1.018 2.306 2.703) 3.696 2.345 ( -2.265 0.814 -4.876) 5.438 2.499 ( 1.343 0.382 3.136) 3.432 2.601 ( 2.612 3.708 -0.160) 4.538 2.730 ( 8.899 -0.809 4.210) 9.877 2.773 ( -1.736 -0.803 -4.036) 4.467 2.950 ( -11.422 0.220 -0.478) 11.434 3.079 ( -3.689 -4.454 1.445) 5.961 3.193 ( 1.154 -0.797 -4.010) 4.248 3.402 ( 2.074 -1.175 -0.983) 2.579 3.510 ( -2.442 -0.773 3.090) 4.013 3.734 ( -2.738 -2.892 -3.105) 5.050 4.272 ( 2.532 -0.307 0.278) 2.566 4.359 ( -2.689 1.538 -0.382) 3.121 4.418 ( -0.095 4.624 -1.504) 4.863 4.652 ( 4.360 5.226 2.732) 7.334 4.791 ( 3.508 -1.472 -4.194) 5.663 4.826 ( -4.186 0.085 5.679) 7.055 5.247 ( 5.825 -5.664 4.044) 9.076 5.320 ( 5.377 1.099 0.690) 5.532 5.368 ( 2.497 -1.764 1.245) 3.301 5.479 ( -0.017 4.418 -0.210) 4.423 6.514 ( -5.707 1.067 -0.896) 5.874 6.939 ( -1.007 1.792 -0.414) 2.097 7.339 ( -0.734 -1.877 0.226) 2.027 7.503 ( 2.195 -1.209 1.495) 2.918 7.758 ( -0.131 -0.643 0.845) 1.070 7.774 ( 0.251 -1.764 -1.869) 2.582 8.081 ( 0.280 -3.200 2.897) 4.326 8.136 ( -2.228 -3.348 -4.646) 6.145 8.339 ( 0.141 -9.325 5.301) 10.727 8.419 ( -1.801 -5.421 -2.596) 6.275 8.820 ( 0.497 7.527 0.169) 7.545 8.922 ( 2.166 10.551 2.404) 11.036 9.358 ( -1.552 4.836 -3.017) 5.907 9.527 ( -0.686 2.449 -0.819) 2.672 11.057 ( 4.590 -4.543 -0.029) 6.458 11.084 ( -0.770 -4.783 1.066) 4.961 11.283 ( 1.940 4.594 2.104) 5.412 11.368 ( -4.447 3.227 -3.403) 6.463 11.555 ( 0.996 2.646 1.626) 3.262 11.620 ( -3.335 4.130 -0.794) 5.368 11.918 ( -0.644 -0.448 -0.837) 1.147 12.172 ( -0.414 0.323 -0.481) 0.712 13.262 ( 4.461 1.256 4.058) 6.160 13.291 ( 0.978 2.845 -2.601) 3.977 13.660 ( -1.420 0.569 -2.305) 2.767 13.688 ( 0.726 -0.720 -0.840) 1.323 17.636 ( 2.075 6.170 0.871) 6.568 17.676 ( -2.156 8.102 0.236) 8.388 17.832 ( 0.699 0.638 0.676) 1.163 17.862 ( -1.880 1.833 -2.774) 3.819 18.658 ( 1.570 1.238 -0.001) 1.999 18.697 ( -1.007 3.511 -0.139) 3.655 18.901 ( -0.365 1.147 -0.681) 1.383 18.960 ( -0.590 1.091 -0.765) 1.457 21.278 ( -0.262 -7.522 -0.188) 7.529 21.354 ( 0.651 -6.088 1.794) 6.380 21.391 ( 0.373 -1.287 0.473) 1.421 21.412 ( 0.406 -2.910 0.662) 3.012 ======================= Grid point 22 (13/170) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( 0.000 31.170 0.000) 31.170 1.373 ( 0.000 33.101 0.000) 33.101 1.972 ( 0.000 36.996 0.000) 36.996 2.732 ( 0.000 1.743 0.000) 1.743 3.007 ( 0.000 3.245 0.000) 3.245 3.018 ( 0.000 -11.317 0.000) 11.317 3.177 ( 0.000 -3.236 0.000) 3.236 3.321 ( 0.000 -5.363 0.000) 5.363 3.381 ( 0.000 2.134 0.000) 2.134 3.511 ( 0.000 -9.132 0.000) 9.132 3.569 ( 0.000 -2.298 0.000) 2.298 3.823 ( 0.000 -3.385 0.000) 3.385 3.958 ( 0.000 -2.878 0.000) 2.878 4.174 ( 0.000 1.956 0.000) 1.956 4.500 ( 0.000 7.938 0.000) 7.938 4.668 ( 0.000 -0.909 0.000) 0.909 4.736 ( 0.000 -17.486 0.000) 17.486 4.792 ( 0.000 7.028 0.000) 7.028 4.985 ( 0.000 12.658 0.000) 12.658 5.058 ( 0.000 -2.404 0.000) 2.404 5.135 ( 0.000 15.182 0.000) 15.182 5.853 ( 0.000 1.583 0.000) 1.583 6.884 ( 0.000 -7.773 0.000) 7.773 6.887 ( 0.000 -3.906 0.000) 3.906 7.205 ( 0.000 5.840 0.000) 5.840 7.428 ( 0.000 2.593 0.000) 2.593 7.566 ( 0.000 5.993 0.000) 5.993 7.627 ( 0.000 1.122 0.000) 1.122 7.903 ( 0.000 4.593 0.000) 4.593 8.087 ( 0.000 -1.048 0.000) 1.048 8.360 ( 0.000 11.731 0.000) 11.731 8.425 ( 0.000 -5.608 0.000) 5.608 8.795 ( 0.000 -3.785 0.000) 3.785 8.991 ( 0.000 11.226 0.000) 11.226 9.510 ( 0.000 -3.321 0.000) 3.321 9.751 ( 0.000 -5.843 0.000) 5.843 10.932 ( 0.000 1.166 0.000) 1.166 11.155 ( 0.000 -5.815 0.000) 5.815 11.522 ( 0.000 -0.107 0.000) 0.107 11.668 ( 0.000 2.911 0.000) 2.911 11.917 ( 0.000 -0.956 0.000) 0.956 12.076 ( 0.000 -8.071 0.000) 8.071 12.165 ( 0.000 -2.349 0.000) 2.349 12.199 ( 0.000 -3.803 0.000) 3.803 12.266 ( 0.000 10.797 0.000) 10.797 13.192 ( 0.000 -0.819 0.000) 0.819 13.192 ( 0.000 7.610 0.000) 7.610 13.781 ( 0.000 -7.848 0.000) 7.848 17.575 ( 0.000 3.964 0.000) 3.964 17.728 ( 0.000 1.545 0.000) 1.545 17.746 ( 0.000 2.149 0.000) 2.149 18.384 ( 0.000 -9.813 0.000) 9.813 18.906 ( 0.000 0.468 0.000) 0.468 18.915 ( 0.000 -0.538 0.000) 0.538 18.923 ( 0.000 -3.712 0.000) 3.712 19.099 ( 0.000 -4.062 0.000) 4.062 20.650 ( 0.000 14.240 0.000) 14.240 21.221 ( 0.000 1.028 0.000) 1.028 21.335 ( 0.000 -1.550 0.000) 1.550 21.445 ( 0.000 -0.413 0.000) 0.413 ======================= Grid point 23 (14/170) ======================= q-point: ( 0.09 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( -0.498 28.554 2.506) 28.668 1.389 ( 8.445 26.898 7.580) 29.193 2.304 ( 21.661 27.770 15.154) 38.340 2.747 ( 2.973 1.582 -2.094) 3.966 2.916 ( -3.629 -0.175 -6.313) 7.284 3.030 ( -0.109 -7.776 -0.930) 7.832 3.089 ( -4.994 -2.094 -5.137) 7.465 3.269 ( -5.387 -6.817 -0.604) 8.709 3.338 ( -2.523 3.877 -1.152) 4.767 3.547 ( 0.686 -8.716 3.197) 9.309 3.560 ( -1.953 -1.870 1.914) 3.313 3.841 ( 1.400 -3.798 -1.061) 4.185 4.004 ( -0.729 -0.858 7.028) 7.118 4.272 ( 1.999 -0.700 11.343) 11.539 4.421 ( -6.142 5.252 -3.683) 8.881 4.538 ( -7.309 4.188 2.503) 8.788 4.743 ( -1.865 -4.484 7.373) 8.829 4.933 ( 5.491 2.525 -7.063) 9.296 4.965 ( -5.598 1.606 -1.164) 5.939 5.065 ( 10.510 2.626 -2.514) 11.121 5.178 ( 2.932 11.115 1.227) 11.561 5.794 ( -2.581 2.437 -6.477) 7.386 6.834 ( 1.025 -5.417 -5.896) 8.072 6.912 ( 1.586 -3.534 0.489) 3.905 7.205 ( -4.338 6.307 5.442) 9.392 7.432 ( -1.864 2.422 1.965) 3.634 7.551 ( 0.297 3.360 0.333) 3.390 7.672 ( 4.288 0.311 0.645) 4.347 7.992 ( 7.512 5.310 0.622) 9.220 8.102 ( -0.740 -3.580 2.649) 4.515 8.372 ( -1.134 10.616 3.161) 11.135 8.399 ( -0.936 -9.111 -0.223) 9.162 8.776 ( -5.167 -0.563 3.500) 6.266 8.983 ( 0.578 8.871 -2.624) 9.269 9.492 ( -0.537 -0.602 -0.315) 0.866 9.728 ( -1.492 -4.718 -1.633) 5.211 10.893 ( -2.067 1.115 -1.864) 2.998 11.161 ( -0.854 -4.584 2.076) 5.104 11.432 ( -8.544 4.063 -2.256) 9.727 11.637 ( -1.385 2.826 -2.226) 3.855 11.857 ( -0.648 -0.315 -3.749) 3.818 12.027 ( -9.064 -4.768 2.300) 10.497 12.110 ( -0.712 -0.715 -4.918) 5.021 12.208 ( 0.453 -3.760 0.371) 3.805 12.384 ( 7.725 6.087 5.438) 11.238 13.246 ( 9.278 5.808 -2.902) 11.324 13.359 ( 13.416 -4.155 1.664) 14.143 13.757 ( -0.471 -6.860 -3.046) 7.520 17.566 ( -0.057 3.787 -0.628) 3.839 17.714 ( -0.301 0.999 -0.223) 1.067 17.796 ( 5.025 3.600 -0.825) 6.236 18.368 ( -1.400 -9.190 -1.415) 9.403 18.860 ( -2.613 2.916 -3.672) 5.368 18.890 ( -1.637 -1.379 -1.984) 2.918 18.935 ( 2.772 -1.350 -2.677) 4.083 19.067 ( -0.244 -2.838 -3.364) 4.409 20.715 ( 1.200 10.891 9.027) 14.197 21.224 ( -0.136 0.588 0.648) 0.885 21.335 ( -0.918 -2.447 1.199) 2.876 21.422 ( -4.084 -0.822 2.352) 4.784 ======================= Grid point 24 (15/170) ======================= q-point: ( 0.18 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( 11.272 13.561 12.936) 21.870 1.665 ( 12.450 18.462 10.629) 24.674 2.692 ( 1.783 -0.661 -8.388) 8.601 2.761 ( 10.109 5.181 2.531) 11.638 2.871 ( 0.801 -0.727 1.542) 1.884 2.961 ( -5.298 4.649 -0.178) 7.051 3.015 ( 3.841 -1.050 -2.225) 4.561 3.125 ( -8.537 -6.444 -2.506) 10.986 3.343 ( 2.822 2.904 0.932) 4.155 3.517 ( -4.406 -2.951 1.364) 5.475 3.601 ( -1.946 -4.728 4.824) 7.029 3.849 ( 2.600 -6.443 -2.803) 7.492 4.062 ( -0.582 2.417 7.086) 7.509 4.312 ( -5.639 1.373 -0.172) 5.806 4.424 ( -2.626 -0.549 14.300) 14.550 4.470 ( -4.702 6.914 1.816) 8.556 4.718 ( -5.665 0.476 -4.517) 7.261 4.800 ( -5.040 2.103 4.702) 7.206 5.027 ( 6.532 2.130 -4.639) 8.290 5.163 ( 6.554 3.887 -6.264) 9.864 5.249 ( 4.022 7.754 5.669) 10.413 5.659 ( -3.612 3.924 -7.571) 9.261 6.817 ( 2.341 -3.463 -2.552) 4.897 6.926 ( -0.938 -2.314 0.102) 2.499 7.221 ( 0.373 6.458 4.964) 8.153 7.414 ( -2.239 0.859 1.226) 2.693 7.579 ( 0.041 0.107 2.696) 2.699 7.741 ( 3.409 -1.507 -0.105) 3.729 8.041 ( -2.832 -3.453 0.459) 4.489 8.131 ( -0.008 -3.905 1.523) 4.191 8.357 ( -0.432 1.769 2.566) 3.146 8.472 ( 3.690 -1.673 3.977) 5.677 8.715 ( -5.591 3.517 2.432) 7.039 8.951 ( -0.429 6.587 -2.641) 7.109 9.516 ( 3.646 1.630 -0.440) 4.018 9.679 ( -1.644 -2.206 -2.270) 3.567 10.858 ( -0.891 0.505 -0.102) 1.029 11.171 ( -2.223 -4.477 3.724) 6.234 11.277 ( -4.124 7.288 -5.197) 9.856 11.583 ( -1.256 3.348 -3.200) 4.799 11.830 ( -0.398 0.840 -1.182) 1.504 11.874 ( -9.790 -0.188 -1.268) 9.874 12.055 ( -1.293 -2.903 -2.830) 4.256 12.206 ( 0.088 -2.841 -1.001) 3.014 12.601 ( 9.970 4.496 8.155) 13.642 13.359 ( 9.309 4.209 -5.514) 11.610 13.541 ( 8.168 -5.517 -1.144) 9.923 13.726 ( 2.895 -3.572 -4.611) 6.512 17.573 ( 1.033 3.290 0.761) 3.531 17.714 ( -0.504 0.630 1.242) 1.481 17.869 ( 6.476 6.684 -2.684) 9.686 18.300 ( -2.690 -6.109 -4.915) 8.289 18.753 ( -4.839 4.626 -3.899) 7.747 18.836 ( 1.070 1.324 -5.926) 6.166 18.948 ( 1.705 -0.280 -1.582) 2.343 19.049 ( 0.917 -1.188 -1.217) 1.932 20.858 ( 0.818 3.481 12.710) 13.203 21.227 ( -1.184 -1.111 1.336) 2.102 21.330 ( -2.056 -4.140 2.246) 5.139 21.384 ( -2.778 -1.143 1.001) 3.166 ======================= Grid point 25 (16/170) ======================= q-point: ( 0.27 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 13.667 2.694 16.151) 21.329 1.972 ( 11.095 10.077 9.393) 17.688 2.589 ( 1.545 4.443 -8.888) 10.057 2.751 ( -2.711 0.350 -6.370) 6.931 2.805 ( -11.871 -3.745 -1.774) 12.573 2.889 ( -0.045 -5.319 -0.429) 5.337 3.041 ( -0.832 -5.098 2.279) 5.646 3.134 ( 7.188 4.015 -5.263) 9.772 3.347 ( -6.192 -0.474 -1.945) 6.507 3.478 ( -2.468 -0.830 1.900) 3.223 3.575 ( -6.126 -3.031 1.922) 7.099 3.833 ( -1.863 -8.849 -2.507) 9.384 4.155 ( 0.692 5.641 4.026) 6.965 4.266 ( 3.393 2.766 5.736) 7.216 4.466 ( -0.917 3.060 6.355) 7.112 4.498 ( -0.959 0.058 7.052) 7.117 4.656 ( -0.913 1.559 0.404) 1.851 4.803 ( -1.089 3.989 3.115) 5.177 5.015 ( 2.161 4.260 -6.499) 8.066 5.204 ( 4.207 4.757 -0.859) 6.409 5.383 ( 4.441 5.119 2.346) 7.172 5.546 ( -1.963 3.819 -3.064) 5.276 6.796 ( -3.667 -0.473 -1.934) 4.173 6.915 ( -0.225 -3.251 1.850) 3.747 7.312 ( 2.105 2.878 4.663) 5.870 7.395 ( -0.562 1.137 0.500) 1.363 7.604 ( -0.753 -3.388 3.768) 5.122 7.760 ( 0.186 -2.729 -1.864) 3.310 8.003 ( -2.777 -7.075 3.256) 8.268 8.075 ( -7.271 -10.797 0.807) 13.042 8.397 ( 0.144 2.420 0.851) 2.569 8.515 ( 0.490 5.737 -4.327) 7.203 8.742 ( 3.259 2.502 8.646) 9.573 8.932 ( 0.743 6.495 -0.913) 6.601 9.559 ( 2.506 2.550 -2.328) 4.266 9.633 ( -0.882 0.347 -2.316) 2.502 10.861 ( 0.275 -0.665 1.529) 1.690 11.127 ( -6.734 -4.327 2.049) 8.263 11.246 ( 5.206 8.048 -3.282) 10.131 11.546 ( 1.532 3.917 -3.403) 5.411 11.703 ( -8.793 0.519 -2.616) 9.189 11.806 ( -1.981 2.346 0.238) 3.079 12.005 ( -1.390 -1.458 -2.682) 3.355 12.195 ( 0.197 -1.854 -1.271) 2.257 12.862 ( 10.489 3.441 9.175) 14.354 13.389 ( 2.335 0.545 -4.888) 5.444 13.618 ( 6.080 -1.290 -3.582) 7.173 13.741 ( 4.764 -0.640 -5.503) 7.307 17.613 ( 1.866 3.159 2.127) 4.241 17.726 ( -0.871 0.314 2.935) 3.078 17.930 ( 5.398 9.992 -3.740) 11.957 18.186 ( -1.989 1.082 -8.398) 8.698 18.661 ( -2.123 3.420 -1.540) 4.310 18.797 ( 1.127 1.917 -4.339) 4.875 18.951 ( 0.592 0.384 -1.260) 1.444 19.051 ( 0.221 0.954 -0.731) 1.222 21.000 ( -0.146 -4.140 11.479) 12.203 21.205 ( -4.046 -5.082 2.163) 6.847 21.330 ( -0.703 -3.668 1.985) 4.230 21.361 ( -0.433 -1.482 -0.744) 1.714 ======================= Grid point 26 (17/170) ======================= q-point: ( 0.36 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 2.494 3.547 6.020) 7.419 2.263 ( 11.168 -2.188 12.706) 17.057 2.570 ( 4.538 6.707 -3.429) 8.794 2.580 ( -10.338 0.915 -4.193) 11.193 2.703 ( 3.277 1.413 -4.016) 5.373 2.823 ( -3.948 -4.878 -3.167) 7.030 3.051 ( -5.939 -5.518 -0.414) 8.117 3.117 ( -1.986 1.713 -0.079) 2.624 3.190 ( -2.476 -2.759 -6.564) 7.539 3.429 ( -4.169 2.013 -1.107) 4.760 3.493 ( -4.953 -3.757 2.947) 6.880 3.752 ( -3.265 -6.198 -3.812) 7.975 4.222 ( 4.103 3.016 2.892) 5.856 4.433 ( 5.752 3.242 1.219) 6.714 4.497 ( -1.614 2.844 4.117) 5.258 4.626 ( -0.393 5.039 -0.322) 5.064 4.650 ( 8.362 -6.670 3.749) 11.334 4.837 ( 0.313 4.347 4.199) 6.052 5.019 ( 1.437 1.921 3.050) 3.881 5.258 ( 1.359 0.212 1.140) 1.787 5.404 ( 0.950 4.525 -3.073) 5.552 5.545 ( 0.631 2.902 1.500) 3.327 6.674 ( -7.226 1.348 -2.724) 7.839 6.946 ( 0.797 -1.504 2.045) 2.661 7.323 ( -3.032 -2.426 1.424) 4.136 7.427 ( 2.108 0.214 -0.000) 2.119 7.659 ( 1.098 -5.075 4.020) 6.566 7.740 ( -0.318 -1.381 0.787) 1.621 7.962 ( -7.004 -12.182 0.665) 14.068 8.024 ( -0.567 -9.278 4.007) 10.123 8.352 ( -2.439 4.707 -3.801) 6.524 8.470 ( -0.857 6.603 -1.940) 6.936 8.920 ( 6.249 4.404 4.175) 8.711 8.956 ( 1.669 6.372 3.766) 7.588 9.530 ( -0.907 4.061 -4.348) 6.018 9.600 ( -0.472 2.118 -2.044) 2.982 10.906 ( 2.438 -2.281 2.610) 4.238 11.051 ( -4.483 -3.275 0.562) 5.580 11.308 ( 5.193 5.979 -1.701) 8.100 11.535 ( -2.192 2.780 -6.311) 7.236 11.567 ( -1.439 2.224 1.565) 3.077 11.779 ( -2.550 4.160 1.072) 4.996 11.947 ( -1.492 -0.324 -3.308) 3.643 12.184 ( 0.003 -0.947 -1.117) 1.464 13.116 ( 8.646 2.776 8.612) 12.515 13.364 ( -0.070 1.283 -1.534) 2.001 13.657 ( 4.422 0.072 -4.433) 6.262 13.731 ( 2.045 0.581 -6.093) 6.454 17.674 ( 2.243 3.385 2.770) 4.915 17.751 ( -1.034 0.204 4.161) 4.292 17.955 ( 3.132 11.738 -3.488) 12.640 18.064 ( -1.150 8.161 -8.812) 12.065 18.654 ( 1.621 1.874 0.067) 2.478 18.775 ( 0.561 2.280 -2.074) 3.132 18.940 ( -0.217 1.054 -0.915) 1.413 19.032 ( -1.357 2.553 -1.003) 3.060 21.096 ( -0.278 -9.578 5.683) 11.141 21.164 ( -4.207 -8.294 3.836) 10.060 21.343 ( 0.039 -3.167 0.732) 3.251 21.351 ( 0.259 -2.437 -0.643) 2.534 ======================= Grid point 27 (18/170) ======================= q-point: ( 0.45 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( 1.700 3.101 3.327) 4.856 2.365 ( -8.940 1.042 -4.219) 9.940 2.482 ( 3.466 -2.577 3.526) 5.576 2.664 ( 7.785 2.634 1.605) 8.374 2.748 ( -1.717 -1.041 -1.042) 2.262 2.779 ( 7.752 5.622 -1.178) 9.648 2.900 ( -8.328 -6.267 -1.275) 10.500 3.024 ( -8.138 0.403 -0.816) 8.189 3.153 ( 1.273 -2.216 -1.657) 3.046 3.397 ( 1.608 0.108 -1.231) 2.028 3.470 ( -2.709 -3.326 2.477) 4.953 3.671 ( -1.637 -3.276 -2.345) 4.349 4.312 ( 2.483 3.870 2.145) 5.074 4.416 ( -2.117 4.021 -1.190) 4.697 4.527 ( 1.524 5.910 -1.517) 6.289 4.690 ( 3.693 -1.162 2.553) 4.638 4.744 ( 1.718 -2.792 -0.745) 3.362 4.895 ( 1.657 5.765 2.406) 6.463 5.107 ( 1.832 -7.742 3.595) 8.730 5.254 ( -0.872 -6.461 -0.034) 6.519 5.387 ( -0.863 1.637 -0.505) 1.918 5.559 ( 0.010 3.488 0.382) 3.509 6.557 ( -3.484 3.772 -1.256) 5.287 6.974 ( 0.581 1.608 0.662) 1.834 7.293 ( -1.363 -2.858 0.213) 3.173 7.448 ( 0.787 -5.223 -0.038) 5.282 7.684 ( 0.594 -3.459 -0.415) 3.535 7.760 ( -1.114 -2.070 2.043) 3.114 7.903 ( -1.693 -10.502 1.177) 10.702 8.053 ( 0.003 -10.848 1.542) 10.957 8.288 ( -1.257 6.413 -1.371) 6.678 8.442 ( -0.449 6.829 -0.930) 6.907 8.971 ( 1.043 7.744 0.403) 7.824 9.070 ( 2.574 4.753 3.122) 6.242 9.468 ( -0.991 5.885 -2.521) 6.479 9.574 ( -0.395 2.152 -0.952) 2.386 10.974 ( 2.635 -3.651 1.050) 4.623 11.004 ( -2.298 -3.451 0.777) 4.219 11.358 ( 2.259 3.217 0.354) 3.947 11.421 ( -2.878 2.152 -3.848) 5.265 11.623 ( 3.602 4.333 2.422) 6.133 11.727 ( -3.921 6.693 -1.589) 7.918 11.906 ( -0.263 -0.744 -1.159) 1.402 12.173 ( -0.107 -0.414 -0.522) 0.675 13.299 ( 3.700 2.517 5.314) 6.947 13.357 ( 0.253 3.728 -0.664) 3.795 13.664 ( 0.443 -0.228 -0.811) 0.951 13.684 ( 0.823 0.481 -4.930) 5.021 17.738 ( 1.914 2.550 2.170) 3.857 17.774 ( -1.138 1.208 2.330) 2.861 17.959 ( 1.105 12.264 -1.602) 12.417 17.969 ( -0.687 11.444 -4.727) 12.401 18.684 ( 1.416 1.153 -0.193) 1.837 18.772 ( 0.432 3.838 -0.164) 3.866 18.932 ( 0.074 2.106 -0.002) 2.107 18.994 ( -1.568 2.481 -0.912) 3.074 21.103 ( -0.906 -10.473 0.130) 10.513 21.179 ( -0.854 -11.517 3.330) 12.019 21.346 ( 0.131 -3.217 -0.051) 3.220 21.352 ( 0.022 -3.352 -0.128) 3.355 ======================= Grid point 33 (19/170) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( 0.000 26.352 0.000) 26.352 1.950 ( 0.000 27.155 0.000) 27.155 2.441 ( 0.000 14.347 0.000) 14.347 2.716 ( 0.000 -4.223 0.000) 4.223 2.881 ( 0.000 -1.536 0.000) 1.536 3.066 ( 0.000 1.057 0.000) 1.057 3.072 ( 0.000 -7.116 0.000) 7.116 3.165 ( 0.000 -10.266 0.000) 10.266 3.361 ( 0.000 -7.132 0.000) 7.132 3.441 ( 0.000 1.545 0.000) 1.545 3.524 ( 0.000 -3.874 0.000) 3.874 3.661 ( 0.000 -8.902 0.000) 8.902 3.988 ( 0.000 1.819 0.000) 1.819 4.139 ( 0.000 -4.623 0.000) 4.623 4.587 ( 0.000 5.731 0.000) 5.731 4.669 ( 0.000 9.173 0.000) 9.173 4.741 ( 0.000 7.505 0.000) 7.505 4.910 ( 0.000 4.728 0.000) 4.728 5.009 ( 0.000 -2.796 0.000) 2.796 5.201 ( 0.000 9.242 0.000) 9.242 5.396 ( 0.000 10.864 0.000) 10.864 5.837 ( 0.000 -3.200 0.000) 3.200 6.746 ( 0.000 -6.146 0.000) 6.146 6.801 ( 0.000 -4.951 0.000) 4.951 7.321 ( 0.000 6.062 0.000) 6.062 7.474 ( 0.000 2.118 0.000) 2.118 7.662 ( 0.000 2.991 0.000) 2.991 7.690 ( 0.000 6.934 0.000) 6.934 8.002 ( 0.000 5.997 0.000) 5.997 8.043 ( 0.000 -2.977 0.000) 2.977 8.291 ( 0.000 -8.342 0.000) 8.342 8.600 ( 0.000 5.802 0.000) 5.802 8.663 ( 0.000 -3.066 0.000) 3.066 9.140 ( 0.000 3.010 0.000) 3.010 9.494 ( 0.000 1.493 0.000) 1.493 9.653 ( 0.000 -4.000 0.000) 4.000 10.949 ( 0.000 0.514 0.000) 0.514 11.037 ( 0.000 -5.588 0.000) 5.588 11.537 ( 0.000 1.962 0.000) 1.962 11.737 ( 0.000 4.701 0.000) 4.701 11.904 ( 0.000 -9.558 0.000) 9.558 11.940 ( 0.000 2.676 0.000) 2.676 12.097 ( 0.000 -5.362 0.000) 5.362 12.127 ( 0.000 -3.233 0.000) 3.233 12.506 ( 0.000 14.004 0.000) 14.004 13.149 ( 0.000 -4.273 0.000) 4.273 13.321 ( 0.000 5.876 0.000) 5.876 13.625 ( 0.000 -7.866 0.000) 7.866 17.654 ( 0.000 4.273 0.000) 4.273 17.756 ( 0.000 1.213 0.000) 1.213 17.799 ( 0.000 3.480 0.000) 3.480 18.187 ( 0.000 -10.347 0.000) 10.347 18.869 ( 0.000 -1.743 0.000) 1.743 18.900 ( 0.000 -1.048 0.000) 1.048 18.920 ( 0.000 0.752 0.000) 0.752 19.021 ( 0.000 -3.838 0.000) 3.838 20.916 ( 0.000 13.240 0.000) 13.240 21.244 ( 0.000 1.429 0.000) 1.429 21.304 ( 0.000 -1.796 0.000) 1.796 21.417 ( 0.000 -2.726 0.000) 2.726 ======================= Grid point 34 (20/170) ======================= q-point: ( 0.09 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.829 ( -5.182 24.660 -4.526) 25.601 1.876 ( 4.447 23.744 2.929) 24.334 2.613 ( 8.100 6.899 7.412) 12.967 2.731 ( 1.836 -4.031 -0.360) 4.444 2.868 ( 0.681 -0.192 -4.556) 4.611 2.943 ( -6.704 -6.045 -4.462) 10.069 3.080 ( -4.765 -6.967 0.363) 8.449 3.117 ( 1.384 -1.041 -0.685) 1.862 3.381 ( 0.288 -5.095 0.269) 5.110 3.431 ( 1.021 0.233 0.084) 1.051 3.496 ( -2.484 -4.141 0.098) 4.830 3.749 ( 4.896 -5.418 1.761) 7.512 4.032 ( -0.630 1.486 7.763) 7.929 4.197 ( -0.600 -5.356 9.635) 11.040 4.560 ( -5.279 10.997 2.982) 12.558 4.640 ( 2.500 6.460 -3.784) 7.893 4.762 ( -2.073 8.001 7.189) 10.954 4.915 ( -4.566 -1.706 -5.785) 7.565 5.031 ( 7.525 2.932 -0.057) 8.076 5.187 ( -0.847 6.667 -0.025) 6.721 5.398 ( 0.181 10.076 -0.058) 10.078 5.790 ( -1.900 -2.565 -5.336) 6.218 6.732 ( 1.137 -4.658 -2.337) 5.334 6.827 ( 1.901 -5.184 1.107) 5.631 7.324 ( -2.803 6.355 4.618) 8.341 7.480 ( -2.350 2.761 2.412) 4.355 7.603 ( -5.205 1.886 1.383) 5.706 7.706 ( 2.106 3.148 0.136) 3.789 8.014 ( -3.364 -4.455 0.656) 5.621 8.097 ( 1.010 1.199 -2.167) 2.675 8.218 ( 0.027 -5.757 2.436) 6.251 8.601 ( -2.195 10.802 2.161) 11.233 8.705 ( 3.883 -4.669 0.192) 6.076 9.106 ( -2.516 2.374 -2.107) 4.051 9.508 ( 2.202 2.089 -0.344) 3.055 9.648 ( 0.398 -3.255 -1.206) 3.494 10.918 ( -1.631 1.357 -1.487) 2.590 11.055 ( -1.736 -5.330 4.497) 7.187 11.503 ( -3.762 3.697 -1.241) 5.418 11.706 ( -1.314 4.372 -2.551) 5.229 11.864 ( 0.540 -2.899 -4.035) 4.998 11.919 ( -3.958 -1.548 1.913) 4.661 12.090 ( -1.706 -2.201 -3.937) 4.822 12.115 ( 1.617 -5.803 -0.662) 6.061 12.562 ( 4.471 11.992 3.697) 13.322 13.226 ( 6.833 -6.532 0.559) 9.469 13.394 ( 9.625 5.022 -1.887) 11.020 13.629 ( 2.631 -5.901 -2.291) 6.855 17.639 ( -0.543 3.756 -1.058) 3.939 17.737 ( -0.458 1.102 -0.803) 1.438 17.870 ( 7.233 4.212 -0.383) 8.379 18.197 ( 1.941 -8.474 -1.358) 8.798 18.862 ( -0.003 -1.011 -1.723) 1.998 18.901 ( 1.096 1.189 -4.571) 4.849 18.913 ( 1.166 -1.070 0.236) 1.600 19.002 ( 0.423 -3.415 -2.889) 4.493 20.927 ( -3.645 10.898 6.766) 13.335 21.239 ( -1.335 0.923 0.618) 1.737 21.290 ( -3.283 -2.294 2.309) 4.623 21.395 ( -3.349 -2.324 1.437) 4.322 ======================= Grid point 35 (21/170) ======================= q-point: ( 0.18 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( 2.785 16.688 3.182) 17.215 2.013 ( 7.117 17.335 4.437) 19.257 2.687 ( -1.288 0.868 -4.206) 4.483 2.755 ( 4.029 -6.164 -2.079) 7.651 2.794 ( -2.599 -7.623 -1.275) 8.154 2.877 ( -2.289 -3.026 -0.247) 3.802 2.948 ( -6.475 -4.981 -2.904) 8.670 3.198 ( 6.330 4.422 -2.670) 8.170 3.375 ( -0.737 -2.341 0.302) 2.473 3.461 ( -2.037 -3.614 0.435) 4.171 3.486 ( 0.940 -2.214 4.930) 5.486 3.774 ( -0.128 -3.220 -3.633) 4.856 4.139 ( -0.005 3.012 13.165) 13.505 4.279 ( -4.523 -3.351 10.036) 11.507 4.518 ( -7.525 10.504 6.654) 14.534 4.646 ( -0.284 9.384 -0.801) 9.422 4.756 ( -3.836 3.107 -2.827) 5.688 4.812 ( -1.394 3.021 3.881) 5.112 5.103 ( 4.205 4.075 -3.357) 6.750 5.212 ( 3.284 0.368 -0.011) 3.305 5.411 ( 1.736 8.300 0.908) 8.528 5.681 ( -2.636 -0.968 -6.716) 7.280 6.752 ( 3.120 -2.937 -0.303) 4.295 6.863 ( 0.700 -4.228 0.120) 4.287 7.343 ( -1.898 6.460 6.067) 9.063 7.430 ( -4.934 1.328 1.044) 5.216 7.578 ( -3.695 -0.719 3.731) 5.300 7.731 ( 1.005 0.138 -0.543) 1.151 7.924 ( -9.162 -8.974 0.683) 12.843 7.971 ( -7.498 -10.116 1.032) 12.634 8.389 ( 9.502 5.291 2.582) 11.178 8.601 ( -0.272 8.975 3.492) 9.634 8.746 ( 1.455 0.246 -1.178) 1.888 9.036 ( -2.300 1.210 -2.216) 3.416 9.555 ( 4.125 2.200 -0.683) 4.724 9.643 ( 0.963 -1.440 -1.704) 2.429 10.884 ( -1.931 2.094 0.543) 2.900 11.065 ( -4.081 -5.198 5.082) 8.337 11.428 ( -0.505 7.497 -3.926) 8.478 11.652 ( -0.584 3.376 -3.586) 4.960 11.844 ( -6.864 -2.118 0.849) 7.233 11.865 ( 1.901 2.358 -2.849) 4.158 12.011 ( -0.458 -1.930 -5.355) 5.711 12.130 ( 2.355 -4.958 -2.069) 5.866 12.719 ( 7.192 7.951 7.564) 13.121 13.304 ( 2.507 -8.802 -0.675) 9.177 13.540 ( 12.287 3.834 -4.667) 13.691 13.674 ( 7.263 -1.832 -4.117) 8.548 17.631 ( 0.383 2.713 0.233) 2.750 17.727 ( -0.356 0.350 0.063) 0.503 17.997 ( 10.479 6.511 -2.607) 12.610 18.213 ( 3.659 -3.125 -3.582) 5.999 18.813 ( -2.100 1.771 -4.411) 5.197 18.857 ( 1.710 1.221 -6.293) 6.635 18.939 ( 2.040 -0.721 -0.768) 2.296 19.000 ( 2.312 -3.423 -0.971) 4.243 20.941 ( -7.032 4.980 10.638) 13.690 21.194 ( -7.801 -2.801 3.792) 9.115 21.273 ( -1.579 -1.203 2.391) 3.107 21.358 ( -2.197 -1.721 0.153) 2.795 ======================= Grid point 36 (22/170) ======================= q-point: ( 0.27 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( 8.128 6.539 9.029) 13.797 2.168 ( 5.522 9.740 3.770) 11.814 2.642 ( 1.530 1.842 -2.833) 3.709 2.698 ( -6.792 -7.894 -1.665) 10.546 2.739 ( -3.121 -5.843 -0.866) 6.681 2.853 ( 0.256 4.719 -3.453) 5.853 2.888 ( 3.676 -7.128 -3.166) 8.622 3.199 ( 2.276 1.048 -7.174) 7.599 3.339 ( -5.962 0.074 0.494) 5.983 3.436 ( -2.549 -4.693 0.734) 5.391 3.514 ( -3.625 -1.909 2.243) 4.671 3.705 ( -1.335 -4.837 -4.933) 7.037 4.251 ( -4.243 2.578 2.995) 5.798 4.321 ( 1.504 3.246 15.100) 15.518 4.505 ( -6.338 2.716 12.119) 13.943 4.602 ( -1.429 9.803 -2.440) 10.203 4.737 ( 0.493 5.428 -0.496) 5.473 4.842 ( 0.062 1.788 4.145) 4.515 5.103 ( 0.833 2.843 -4.380) 5.288 5.248 ( 0.831 -0.856 0.186) 1.207 5.473 ( 3.123 4.363 0.734) 5.415 5.581 ( -1.906 0.421 -3.489) 3.998 6.792 ( 0.841 0.016 -1.804) 1.990 6.852 ( -0.601 -2.934 1.590) 3.391 7.335 ( -5.299 -0.077 1.173) 5.428 7.433 ( 1.295 2.854 3.521) 4.714 7.539 ( -5.363 -3.854 4.930) 8.241 7.714 ( -1.508 -3.304 -1.647) 3.988 7.820 ( -7.278 -9.096 4.974) 12.667 7.892 ( -3.728 -7.267 0.324) 8.174 8.475 ( 0.379 5.666 0.310) 5.687 8.679 ( 2.219 9.832 -1.916) 10.260 8.770 ( 4.336 -0.189 6.200) 7.568 9.010 ( 0.871 1.361 -0.340) 1.652 9.601 ( 2.640 1.789 -1.835) 3.679 9.642 ( 1.455 0.502 -1.909) 2.452 10.868 ( -1.658 1.418 1.888) 2.885 11.036 ( -5.622 -4.339 4.045) 8.173 11.418 ( 4.589 8.891 -4.709) 11.059 11.627 ( 2.683 4.221 -3.950) 6.373 11.711 ( -7.302 0.264 -3.490) 8.098 11.835 ( -2.327 0.365 -0.546) 2.417 11.986 ( 2.556 -0.130 -3.958) 4.713 12.144 ( 2.223 -3.464 -2.079) 4.611 12.941 ( 8.144 4.821 9.912) 13.705 13.316 ( -0.250 -6.778 1.450) 6.936 13.652 ( 10.195 3.459 -7.758) 13.270 13.736 ( 7.071 0.032 -6.413) 9.546 17.658 ( 1.038 1.653 2.360) 3.062 17.728 ( -0.416 -0.268 1.549) 1.626 18.120 ( 9.365 9.522 -4.615) 14.130 18.240 ( 6.979 4.067 -6.537) 10.391 18.726 ( -2.356 3.151 -3.419) 5.213 18.821 ( 1.838 0.745 -5.337) 5.693 18.955 ( 0.999 -0.025 -0.671) 1.203 19.039 ( 2.804 -2.161 -0.233) 3.548 20.938 ( -8.086 -1.935 10.689) 13.542 21.095 ( -10.442 -5.986 5.302) 13.152 21.282 ( -0.302 -1.401 1.349) 1.969 21.328 ( -1.128 -1.858 -0.855) 2.336 ======================= Grid point 37 (23/170) ======================= q-point: ( 0.36 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( 4.003 0.163 6.903) 7.981 2.267 ( 3.253 2.930 5.899) 7.346 2.575 ( -5.507 -0.897 -0.861) 5.646 2.654 ( -1.619 -3.696 -6.545) 7.689 2.700 ( 4.184 -0.833 -0.152) 4.269 2.827 ( 2.828 8.838 -2.929) 9.731 2.909 ( 2.761 -7.003 -4.082) 8.563 3.150 ( -3.757 0.528 -1.947) 4.264 3.204 ( -5.569 4.758 -2.174) 7.641 3.400 ( -4.403 -5.351 2.947) 7.531 3.449 ( -4.178 -1.425 -0.473) 4.440 3.644 ( -0.138 -5.123 -4.184) 6.616 4.280 ( 2.362 2.932 4.713) 6.032 4.481 ( 1.165 -0.862 8.305) 8.431 4.545 ( -2.726 6.145 1.646) 6.921 4.587 ( 2.930 -0.113 3.262) 4.386 4.730 ( 1.144 4.315 -2.566) 5.149 4.895 ( -0.548 2.370 5.365) 5.890 5.044 ( -4.651 -0.847 0.547) 4.759 5.229 ( -3.692 -3.482 -0.427) 5.093 5.461 ( -0.315 2.496 -4.020) 4.743 5.580 ( 0.796 0.662 1.546) 1.861 6.728 ( -2.755 4.337 -3.531) 6.234 6.912 ( 3.721 -1.725 2.508) 4.807 7.266 ( -4.067 -3.065 0.652) 5.134 7.399 ( -4.503 -3.355 -1.210) 5.744 7.602 ( 0.966 -1.510 6.997) 7.223 7.689 ( -0.312 -5.297 1.367) 5.479 7.764 ( -5.692 -5.187 2.601) 8.128 7.861 ( -1.137 -7.415 0.322) 7.508 8.465 ( -1.385 7.324 0.534) 7.473 8.643 ( -0.877 9.118 -2.618) 9.526 8.962 ( 7.374 0.240 6.793) 10.029 9.044 ( 2.098 2.650 1.583) 3.732 9.592 ( 0.041 2.513 -2.970) 3.890 9.636 ( 0.293 1.354 -2.360) 2.736 10.883 ( 0.400 -0.048 2.695) 2.725 10.990 ( -4.563 -2.881 2.533) 5.961 11.430 ( 3.550 6.141 -6.302) 9.488 11.561 ( -4.694 0.706 -5.624) 7.359 11.644 ( 2.663 4.717 -0.205) 5.421 11.826 ( -0.175 0.391 2.596) 2.631 11.961 ( 0.228 2.046 -5.232) 5.623 12.151 ( 1.251 -2.510 -1.592) 3.225 13.175 ( 6.751 3.293 10.240) 12.700 13.351 ( 0.102 -2.293 5.313) 5.788 13.686 ( 6.126 2.472 -9.092) 11.239 13.743 ( 3.977 0.578 -8.107) 9.049 17.709 ( 1.126 0.902 3.444) 3.734 17.750 ( -0.070 -0.297 2.934) 2.950 18.181 ( 5.618 11.471 -5.053) 13.736 18.265 ( 5.931 11.182 -8.697) 15.357 18.688 ( 0.319 1.649 -0.618) 1.789 18.805 ( 2.148 0.937 -2.688) 3.566 18.961 ( 0.495 1.152 0.003) 1.254 19.065 ( 0.663 0.478 -0.498) 0.957 20.925 ( -5.838 -7.679 6.758) 11.778 20.998 ( -8.783 -8.600 5.276) 13.377 21.287 ( -0.288 -2.428 0.311) 2.464 21.304 ( -0.602 -2.380 -0.887) 2.611 ======================= Grid point 38 (24/170) ======================= q-point: ( 0.45 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.262 ( 2.526 2.595 4.815) 6.025 2.357 ( -4.118 -1.612 4.069) 6.010 2.449 ( -1.559 -0.546 -7.686) 7.862 2.630 ( 4.212 -8.027 -2.039) 9.291 2.749 ( 1.318 2.977 2.788) 4.287 2.848 ( -2.398 3.031 -2.732) 4.733 2.917 ( 5.785 7.009 -0.263) 9.092 3.042 ( -5.334 0.824 -1.182) 5.525 3.162 ( -1.087 3.982 0.381) 4.145 3.376 ( -1.158 -2.988 0.973) 3.349 3.395 ( -2.236 -4.213 0.176) 4.772 3.606 ( 0.013 -4.125 -2.148) 4.650 4.382 ( 1.960 2.988 4.914) 6.076 4.494 ( -0.318 4.149 -4.158) 5.882 4.574 ( 3.041 -2.071 3.891) 5.355 4.654 ( -0.223 -3.014 -0.750) 3.114 4.731 ( 1.727 2.659 -1.003) 3.325 4.939 ( 0.816 -2.251 3.528) 4.264 5.006 ( -3.129 -2.653 3.717) 5.536 5.126 ( -5.435 -5.397 -2.712) 8.126 5.423 ( -0.494 2.726 -1.334) 3.075 5.596 ( 0.146 0.184 0.220) 0.322 6.666 ( -1.086 7.654 -1.506) 7.876 6.992 ( 2.773 0.172 1.014) 2.958 7.231 ( -0.861 -3.682 0.046) 3.782 7.325 ( -3.042 -6.618 -0.218) 7.287 7.649 ( 0.267 -0.944 1.049) 1.436 7.712 ( -1.892 -2.202 0.038) 2.903 7.731 ( 0.282 -7.198 3.140) 7.858 7.849 ( -0.525 -9.022 -0.049) 9.037 8.456 ( -0.692 10.020 0.798) 10.075 8.611 ( -0.300 9.152 -1.216) 9.237 9.090 ( 2.610 4.097 0.167) 4.860 9.109 ( 1.846 -0.022 4.061) 4.461 9.558 ( -0.285 3.427 -1.668) 3.822 9.605 ( -0.745 1.052 -1.535) 2.004 10.927 ( 1.527 -1.331 1.483) 2.511 10.955 ( -2.319 -1.759 1.059) 3.098 11.407 ( 0.820 2.041 -1.745) 2.808 11.449 ( -2.216 0.788 -4.391) 4.981 11.710 ( 2.891 4.585 2.445) 5.946 11.853 ( -0.471 4.910 0.590) 4.968 11.895 ( -0.648 0.821 -3.281) 3.443 12.149 ( 0.289 -2.180 -0.728) 2.316 13.353 ( 2.872 3.040 6.676) 7.878 13.416 ( 0.394 2.125 3.614) 4.211 13.666 ( 1.778 0.548 -3.994) 4.406 13.694 ( 1.006 0.313 -6.682) 6.764 17.755 ( 0.489 0.331 1.848) 1.940 17.781 ( 0.136 -0.124 1.829) 1.839 18.196 ( 2.281 12.329 -3.221) 12.945 18.246 ( 1.261 14.531 -3.462) 14.991 18.695 ( 0.542 0.147 -0.327) 0.650 18.825 ( 1.685 1.265 -0.547) 2.177 18.982 ( 1.707 3.190 0.902) 3.728 19.046 ( -1.828 2.629 -0.843) 3.311 20.903 ( -2.062 -9.898 1.096) 10.170 20.950 ( -3.491 -11.583 3.407) 12.569 21.283 ( -0.150 -2.960 -0.175) 2.969 21.292 ( -0.197 -2.874 -0.278) 2.894 ======================= Grid point 44 (25/170) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 0.000 19.364 0.000) 19.364 2.391 ( 0.000 19.163 0.000) 19.163 2.556 ( 0.000 -11.249 0.000) 11.249 2.602 ( 0.000 -0.092 0.000) 0.092 2.932 ( 0.000 -2.308 0.000) 2.308 2.946 ( 0.000 -8.641 0.000) 8.641 2.992 ( 0.000 7.035 0.000) 7.035 3.072 ( 0.000 -0.173 0.000) 0.173 3.216 ( 0.000 -6.325 0.000) 6.325 3.295 ( 0.000 -12.213 0.000) 12.213 3.523 ( 0.000 1.491 0.000) 1.491 3.555 ( 0.000 -2.637 0.000) 2.637 4.005 ( 0.000 0.719 0.000) 0.719 4.044 ( 0.000 -3.924 0.000) 3.924 4.825 ( 0.000 6.821 0.000) 6.821 4.852 ( 0.000 9.343 0.000) 9.343 4.929 ( 0.000 13.455 0.000) 13.455 4.952 ( 0.000 0.020 0.000) 0.020 4.952 ( 0.000 0.179 0.000) 0.179 5.233 ( 0.000 -8.324 0.000) 8.324 5.574 ( 0.000 9.210 0.000) 9.210 5.736 ( 0.000 -7.267 0.000) 7.267 6.675 ( 0.000 -0.849 0.000) 0.849 6.711 ( 0.000 -4.010 0.000) 4.010 7.424 ( 0.000 4.559 0.000) 4.559 7.484 ( 0.000 -1.457 0.000) 1.457 7.754 ( 0.000 5.814 0.000) 5.814 7.802 ( 0.000 2.836 0.000) 2.836 8.008 ( 0.000 1.168 0.000) 1.168 8.119 ( 0.000 -7.421 0.000) 7.421 8.148 ( 0.000 8.312 0.000) 8.312 8.380 ( 0.000 -14.205 0.000) 14.205 8.889 ( 0.000 12.883 0.000) 12.883 9.091 ( 0.000 -7.533 0.000) 7.533 9.543 ( 0.000 3.051 0.000) 3.051 9.596 ( 0.000 -2.528 0.000) 2.528 10.953 ( 0.000 0.116 0.000) 0.116 10.967 ( 0.000 -1.801 0.000) 1.801 11.603 ( 0.000 5.139 0.000) 5.139 11.732 ( 0.000 -8.222 0.000) 8.222 11.846 ( 0.000 6.604 0.000) 6.604 11.977 ( 0.000 -6.890 0.000) 6.890 12.001 ( 0.000 3.463 0.000) 3.463 12.066 ( 0.000 -3.352 0.000) 3.352 12.776 ( 0.000 13.913 0.000) 13.913 13.012 ( 0.000 -10.257 0.000) 10.257 13.416 ( 0.000 4.361 0.000) 4.361 13.502 ( 0.000 -5.126 0.000) 5.126 17.728 ( 0.000 3.179 0.000) 3.179 17.764 ( 0.000 -0.570 0.000) 0.570 17.881 ( 0.000 5.270 0.000) 5.270 18.008 ( 0.000 -8.215 0.000) 8.215 18.855 ( 0.000 0.283 0.000) 0.283 18.875 ( 0.000 -1.492 0.000) 1.492 18.936 ( 0.000 1.019 0.000) 1.019 18.964 ( 0.000 -2.074 0.000) 2.074 21.137 ( 0.000 9.546 0.000) 9.546 21.259 ( 0.000 -3.455 0.000) 3.455 21.277 ( 0.000 2.225 0.000) 2.225 21.343 ( 0.000 -4.578 0.000) 4.578 ======================= Grid point 45 (26/170) ======================= q-point: ( 0.09 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( -2.243 17.980 -10.648) 21.017 2.276 ( -1.282 17.818 0.019) 17.864 2.559 ( 1.952 -10.575 -2.859) 11.128 2.619 ( -2.770 -11.213 1.859) 11.698 2.833 ( -5.803 0.098 -3.644) 6.853 2.911 ( -4.764 -6.619 0.155) 8.157 2.990 ( 2.497 10.737 -1.802) 11.170 3.142 ( 5.227 -0.732 0.771) 5.334 3.279 ( 1.194 -4.635 3.579) 5.977 3.312 ( 0.736 -7.632 3.080) 8.263 3.525 ( 1.397 3.815 -0.385) 4.081 3.621 ( 5.065 -6.549 2.116) 8.545 4.050 ( -0.940 1.057 8.851) 8.964 4.097 ( -0.849 -4.269 9.832) 10.752 4.771 ( -0.869 6.159 -4.091) 7.445 4.856 ( -2.144 -1.944 -3.708) 4.704 4.883 ( -4.631 17.684 4.127) 18.740 4.939 ( -0.290 6.725 3.330) 7.510 5.051 ( 6.026 -0.405 0.981) 6.118 5.196 ( -4.956 -7.588 0.846) 9.103 5.566 ( 0.241 8.341 -1.592) 8.495 5.707 ( -0.816 -6.039 -3.827) 7.196 6.682 ( 1.458 -0.081 -0.166) 1.470 6.729 ( 1.657 -4.535 0.908) 4.913 7.440 ( -1.674 5.410 4.868) 7.467 7.508 ( -0.508 -1.121 4.141) 4.320 7.662 ( -10.508 5.832 0.139) 12.019 7.756 ( -3.085 -0.102 -0.804) 3.190 7.930 ( -6.777 -3.673 -0.331) 7.716 7.957 ( -12.376 -7.212 -0.841) 14.349 8.317 ( 13.892 9.654 0.759) 16.934 8.513 ( 10.302 -10.224 0.460) 14.521 8.867 ( -2.168 11.958 -0.391) 12.159 9.056 ( -3.116 -7.135 -1.379) 7.907 9.557 ( 2.175 2.669 -0.646) 3.503 9.602 ( 1.540 -2.108 -1.079) 2.824 10.944 ( -1.050 1.492 0.572) 1.912 10.980 ( -1.411 -2.620 3.424) 4.536 11.586 ( -2.138 5.221 -0.048) 5.642 11.701 ( -3.028 -6.238 -0.370) 6.944 11.854 ( 1.895 5.915 -0.901) 6.276 11.966 ( 0.864 2.927 -4.281) 5.258 11.988 ( -0.679 -6.387 0.463) 6.440 12.038 ( -0.361 -3.466 -3.957) 5.273 12.810 ( 2.797 13.426 1.642) 13.812 13.051 ( 3.394 -11.473 0.634) 11.981 13.477 ( 8.396 3.703 -1.852) 9.361 13.542 ( 6.366 -3.554 -1.771) 7.503 17.704 ( -1.343 2.926 -1.282) 3.465 17.742 ( -1.096 -0.842 -1.214) 1.840 17.954 ( 8.134 4.711 -0.267) 9.403 18.056 ( 6.125 -6.251 -0.716) 8.781 18.856 ( 0.859 0.504 -1.401) 1.719 18.880 ( 1.176 -1.825 -0.861) 2.335 18.926 ( 0.797 1.155 -2.836) 3.165 18.952 ( 0.811 -1.823 -2.779) 3.422 21.110 ( -7.041 8.044 5.346) 11.953 21.222 ( -7.071 -3.681 3.649) 8.767 21.280 ( -0.175 1.942 0.459) 2.003 21.336 ( -1.238 -3.539 0.640) 3.804 ======================= Grid point 46 (27/170) ======================= q-point: ( 0.18 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( -0.071 16.342 -5.088) 17.116 2.283 ( 2.686 7.614 -3.038) 8.626 2.535 ( -0.071 -11.172 -2.846) 11.529 2.604 ( -0.294 -9.950 0.718) 9.980 2.734 ( -3.839 3.869 -0.618) 5.485 2.820 ( -5.777 -4.538 0.748) 7.384 3.013 ( 3.469 9.136 -3.428) 10.356 3.182 ( 3.809 -6.210 -5.648) 9.218 3.327 ( -0.672 -0.876 3.869) 4.024 3.352 ( -1.379 -3.851 3.772) 5.564 3.558 ( 1.701 5.618 -0.475) 5.889 3.677 ( 0.786 -6.434 -2.556) 6.967 4.165 ( -1.415 1.212 14.836) 14.953 4.211 ( -2.059 -3.512 14.222) 14.793 4.705 ( -5.869 5.303 -1.123) 7.989 4.747 ( -3.905 0.221 -2.370) 4.573 4.882 ( -1.359 13.630 5.194) 14.650 4.978 ( -0.823 10.585 0.653) 10.637 5.103 ( -3.127 -5.715 1.203) 6.625 5.146 ( 0.736 -7.020 1.121) 7.147 5.552 ( 0.994 6.232 -2.489) 6.784 5.640 ( -0.911 -3.225 -5.044) 6.056 6.726 ( 3.446 0.658 0.955) 3.636 6.777 ( 2.757 -4.235 0.737) 5.107 7.459 ( -5.183 4.831 4.616) 8.456 7.493 ( -6.325 6.544 2.307) 9.389 7.539 ( -6.558 -3.241 4.064) 8.369 7.665 ( -7.895 -9.794 1.513) 12.670 7.791 ( -4.803 0.569 0.316) 4.846 7.846 ( -4.733 -4.474 -0.472) 6.530 8.520 ( 9.352 7.426 0.776) 11.967 8.642 ( 5.240 -4.544 0.514) 6.955 8.836 ( -0.396 8.886 -0.350) 8.902 8.987 ( -2.547 -5.976 -1.242) 6.613 9.594 ( 3.425 1.796 -1.008) 3.996 9.621 ( 2.582 -1.111 -1.464) 3.169 10.931 ( -2.732 2.676 2.233) 4.429 10.986 ( -3.349 -3.263 4.081) 6.206 11.557 ( 0.619 6.222 -1.700) 6.480 11.657 ( -0.048 -3.573 -1.994) 4.092 11.851 ( -4.196 3.623 -0.163) 5.546 11.907 ( -2.912 0.430 -2.756) 4.032 11.976 ( 3.824 -0.580 -5.434) 6.670 12.031 ( 5.414 -4.909 -3.979) 8.321 12.897 ( 4.120 10.544 4.647) 12.237 13.107 ( 2.212 -11.160 1.653) 11.496 13.607 ( 11.618 2.798 -4.773) 12.868 13.646 ( 10.069 -1.464 -4.328) 11.057 17.678 ( -0.560 2.301 -0.194) 2.377 17.716 ( -0.832 -1.456 -0.396) 1.723 18.105 ( 12.394 4.598 -2.438) 13.442 18.168 ( 10.037 -2.260 -2.712) 10.640 18.838 ( 0.662 1.392 -4.492) 4.749 18.867 ( 1.847 -0.934 -6.431) 6.756 18.925 ( 1.631 -0.001 0.029) 1.631 18.946 ( 1.629 -1.917 -1.127) 2.756 21.036 ( -12.044 4.919 8.802) 15.708 21.124 ( -12.454 -4.253 6.908) 14.863 21.281 ( -0.536 1.552 0.611) 1.752 21.319 ( -1.380 -2.241 0.092) 2.634 ======================= Grid point 47 (28/170) ======================= q-point: ( 0.27 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( 3.885 10.423 0.796) 11.152 2.288 ( 1.278 -1.136 -1.586) 2.333 2.524 ( 1.032 -4.157 -1.157) 4.437 2.602 ( -0.107 -7.516 -1.225) 7.616 2.695 ( -0.973 3.767 0.860) 3.984 2.775 ( -0.544 -4.369 0.386) 4.420 3.022 ( 3.160 9.545 -4.208) 10.900 3.168 ( 2.434 -4.769 -5.094) 7.390 3.337 ( -2.900 -0.654 2.971) 4.203 3.349 ( -3.535 -2.643 3.072) 5.377 3.518 ( -3.399 2.879 -4.295) 6.187 3.609 ( -1.697 -5.662 -5.914) 8.362 4.292 ( -2.512 2.458 11.499) 12.024 4.336 ( -1.563 -1.530 13.601) 13.776 4.604 ( -6.658 6.667 5.025) 10.678 4.701 ( -1.533 -1.990 -0.485) 2.558 4.892 ( -7.304 10.877 -1.122) 13.149 4.934 ( -0.897 7.584 6.058) 9.748 5.076 ( -2.352 -4.619 -1.721) 5.461 5.155 ( -1.134 -8.628 0.873) 8.746 5.546 ( 1.282 3.019 -2.391) 4.059 5.579 ( -0.473 -0.627 -3.223) 3.317 6.797 ( 4.154 0.683 0.024) 4.210 6.816 ( 2.255 -1.151 -0.395) 2.562 7.344 ( -8.118 2.027 0.226) 8.370 7.426 ( -8.634 -5.800 0.033) 10.401 7.513 ( -1.675 3.960 7.400) 8.558 7.606 ( -4.585 -5.775 4.303) 8.538 7.759 ( -2.092 0.302 1.529) 2.609 7.792 ( -2.423 -3.288 0.374) 4.102 8.599 ( 0.511 6.889 1.313) 7.032 8.716 ( 1.219 -4.800 2.478) 5.538 8.860 ( 4.413 8.213 0.490) 9.336 8.981 ( 2.580 -4.214 0.122) 4.943 9.629 ( 2.506 1.205 -1.664) 3.240 9.645 ( 2.388 -0.321 -1.767) 2.988 10.909 ( -3.276 2.731 2.815) 5.110 10.966 ( -4.391 -3.241 3.755) 6.625 11.566 ( 3.756 6.448 -4.617) 8.775 11.653 ( 3.012 -2.398 -5.390) 6.624 11.746 ( -5.295 3.805 -1.570) 6.707 11.813 ( -4.166 -2.649 -1.419) 5.136 12.009 ( 5.256 2.486 -4.434) 7.312 12.072 ( 4.466 -3.826 -3.423) 6.805 13.045 ( 5.288 6.203 8.492) 11.771 13.176 ( 2.182 -7.423 5.330) 9.396 13.709 ( 9.857 2.209 -8.217) 13.022 13.734 ( 8.788 -0.500 -7.571) 11.610 17.686 ( 0.268 1.440 1.912) 2.409 17.712 ( -0.240 -1.274 1.448) 1.944 18.267 ( 12.273 5.238 -5.042) 14.265 18.303 ( 12.655 1.400 -5.571) 13.897 18.782 ( -0.481 2.814 -5.078) 5.826 18.823 ( 1.750 -0.960 -6.177) 6.492 18.954 ( 1.743 0.361 0.267) 1.800 18.985 ( 3.233 -2.833 0.627) 4.345 20.934 ( -13.626 1.510 9.665) 16.774 20.993 ( -14.234 -4.509 7.946) 16.914 21.274 ( -0.872 0.464 0.154) 1.000 21.295 ( -1.337 -1.565 -0.591) 2.142 ======================= Grid point 48 (29/170) ======================= q-point: ( 0.36 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( 2.968 4.534 4.453) 7.014 2.304 ( -0.232 -1.478 3.899) 4.176 2.510 ( 0.270 -2.740 -4.013) 4.867 2.547 ( -1.233 -4.935 -6.950) 8.613 2.739 ( 3.971 4.043 2.333) 6.128 2.816 ( 4.795 -3.811 0.753) 6.171 3.022 ( 2.378 9.434 -3.671) 10.399 3.143 ( -1.626 -2.532 -1.992) 3.609 3.306 ( -2.782 2.593 0.927) 3.915 3.319 ( -4.395 -1.895 3.397) 5.869 3.404 ( -3.696 1.269 -4.061) 5.635 3.531 ( -0.002 -7.544 -5.336) 9.240 4.354 ( -1.465 4.948 7.513) 9.114 4.439 ( -2.388 -3.363 10.293) 11.089 4.607 ( -2.024 2.702 5.147) 6.156 4.664 ( -2.699 0.159 -1.837) 3.269 4.781 ( -4.668 6.355 0.657) 7.912 4.948 ( -7.000 -6.556 3.289) 10.139 4.992 ( -1.767 5.418 -0.901) 5.770 5.127 ( -2.547 -6.816 -1.140) 7.365 5.518 ( -0.041 3.249 -3.030) 4.443 5.569 ( 0.530 -1.769 -0.565) 1.932 6.822 ( 2.648 4.761 -2.988) 6.214 6.884 ( 5.473 -1.754 -0.007) 5.747 7.235 ( -6.183 0.676 0.934) 6.289 7.304 ( -7.091 -5.716 0.399) 9.117 7.579 ( -0.376 -0.266 6.662) 6.678 7.604 ( -1.752 -2.650 4.084) 5.174 7.734 ( -2.283 0.240 0.114) 2.299 7.762 ( -1.555 -2.977 -0.540) 3.402 8.617 ( -0.792 8.017 3.056) 8.616 8.728 ( -1.281 -1.831 1.377) 2.625 8.981 ( 6.508 3.248 3.505) 8.074 9.048 ( 4.255 -2.246 1.249) 4.971 9.629 ( 0.388 1.458 -2.408) 2.842 9.646 ( 0.459 -0.248 -2.391) 2.448 10.901 ( -1.555 1.763 2.900) 3.733 10.941 ( -3.209 -2.320 2.975) 4.953 11.522 ( -0.041 3.457 -8.562) 9.233 11.562 ( -2.755 -0.834 -7.823) 8.336 11.732 ( 2.078 4.376 1.357) 5.031 11.801 ( 1.316 -2.681 2.275) 3.754 12.019 ( 2.051 3.707 -4.345) 6.068 12.091 ( 2.290 -3.690 -2.740) 5.135 13.237 ( 4.853 3.200 10.744) 12.215 13.297 ( 2.589 -3.135 9.247) 10.102 13.729 ( 5.873 1.729 -10.475) 12.133 13.747 ( 5.249 -0.236 -9.925) 11.230 17.724 ( 0.703 0.779 3.163) 3.332 17.739 ( 0.372 -0.765 2.868) 2.991 18.364 ( 8.186 6.988 -6.453) 12.549 18.413 ( 9.917 2.753 -8.165) 13.138 18.732 ( -0.446 3.507 -1.994) 4.059 18.798 ( 1.892 -2.198 -3.145) 4.278 18.992 ( 2.416 2.389 0.902) 3.515 19.044 ( 3.117 -2.493 0.386) 4.010 20.831 ( -10.995 -1.757 7.312) 13.320 20.863 ( -11.957 -4.934 6.633) 14.537 21.258 ( -0.836 -0.489 -0.367) 1.036 21.267 ( -1.002 -1.350 -0.795) 1.859 ======================= Grid point 49 (30/170) ======================= q-point: ( 0.45 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( 1.005 2.640 6.841) 7.401 2.345 ( -1.261 -0.244 3.631) 3.851 2.434 ( -0.860 -0.725 -8.863) 8.934 2.474 ( 1.392 -6.112 -3.426) 7.144 2.840 ( 3.962 5.357 2.575) 7.144 2.904 ( 3.365 -0.110 1.074) 3.534 3.015 ( 1.152 4.516 -2.577) 5.325 3.064 ( -4.235 0.515 -1.404) 4.491 3.291 ( -2.075 3.669 3.122) 5.246 3.304 ( -0.412 -3.065 0.591) 3.148 3.325 ( -1.476 2.451 -2.705) 3.938 3.492 ( 0.370 -8.200 -2.279) 8.518 4.435 ( 1.086 3.128 7.155) 7.884 4.507 ( -0.685 -4.082 7.604) 8.657 4.559 ( -1.518 2.056 -7.111) 7.557 4.595 ( -3.374 -2.533 -2.678) 4.997 4.769 ( -0.247 2.903 1.773) 3.411 4.882 ( -3.114 -7.638 3.103) 8.813 4.976 ( -1.259 4.971 0.101) 5.129 5.066 ( -1.814 -3.323 -1.925) 4.247 5.494 ( -0.099 4.295 -1.106) 4.437 5.567 ( 0.065 -3.021 -0.383) 3.046 6.831 ( 1.536 8.934 -1.527) 9.193 6.964 ( 4.004 -4.074 -0.457) 5.730 7.177 ( -2.097 -0.853 0.507) 2.320 7.216 ( -4.326 -4.514 0.709) 6.292 7.627 ( -0.608 -1.264 2.678) 3.023 7.633 ( -0.201 -2.456 3.359) 4.166 7.700 ( -0.735 0.477 -1.173) 1.464 7.733 ( -0.641 -3.357 -1.158) 3.608 8.638 ( -0.332 8.245 1.834) 8.453 8.721 ( -0.471 0.813 0.195) 0.960 9.099 ( 3.039 0.391 2.296) 3.829 9.122 ( 2.353 -0.761 1.330) 2.808 9.602 ( -0.355 1.366 -1.466) 2.035 9.614 ( -0.809 -0.044 -1.683) 1.868 10.919 ( 0.190 0.318 1.601) 1.644 10.932 ( -1.250 -0.905 1.330) 2.038 11.437 ( -0.684 1.222 -3.345) 3.626 11.452 ( -1.682 -0.332 -4.304) 4.633 11.790 ( 1.880 3.698 1.639) 4.461 11.847 ( 1.308 -2.265 0.709) 2.710 11.992 ( -0.054 5.856 -2.238) 6.269 12.088 ( 0.500 -4.217 -1.262) 4.430 13.406 ( 2.162 2.270 7.842) 8.445 13.432 ( 1.339 -0.362 7.252) 7.384 13.681 ( 1.776 0.880 -7.164) 7.433 13.693 ( 1.453 -0.350 -7.860) 8.001 17.763 ( 0.383 0.531 1.696) 1.818 17.774 ( 0.312 -0.528 1.671) 1.780 18.390 ( 2.682 7.370 -3.530) 8.601 18.440 ( 2.968 3.698 -4.005) 6.207 18.720 ( 0.063 3.686 -0.223) 3.693 18.805 ( 1.114 -3.432 -0.712) 3.678 19.046 ( 2.604 2.974 0.831) 4.039 19.076 ( 0.373 0.097 -0.187) 0.429 20.763 ( -4.006 -3.904 2.308) 6.051 20.778 ( -5.155 -5.556 3.045) 8.168 21.244 ( -0.341 -0.901 -0.276) 1.002 21.250 ( -0.373 -1.381 -0.343) 1.471 ======================= Grid point 99 (31/170) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.659 ( 0.659 0.000 31.903) 31.910 0.711 ( 3.903 0.000 34.431) 34.652 1.297 ( -6.254 0.000 61.120) 61.439 2.607 ( -1.085 0.000 -5.849) 5.949 2.835 ( -1.234 0.000 -11.951) 12.015 3.090 ( -0.376 0.000 -8.387) 8.396 3.289 ( -3.171 0.000 -2.604) 4.104 3.351 ( -1.390 0.000 2.141) 2.553 3.361 ( -0.405 0.000 -0.839) 0.931 3.649 ( 0.179 0.000 -1.764) 1.773 3.788 ( 7.980 0.000 4.384) 9.105 3.927 ( -8.455 0.000 -5.505) 10.089 4.169 ( 0.015 0.000 -5.283) 5.283 4.226 ( 19.081 0.000 0.303) 19.084 4.306 ( -0.965 0.000 1.564) 1.838 4.602 ( 0.102 0.000 4.366) 4.367 4.623 ( 3.367 0.000 -0.865) 3.476 4.894 ( 2.265 0.000 4.490) 5.029 5.067 ( -3.107 0.000 -3.756) 4.874 5.130 ( -5.859 0.000 19.114) 19.992 5.196 ( -1.142 0.000 3.150) 3.350 5.593 ( -3.112 0.000 -5.193) 6.054 6.715 ( 3.315 0.000 -10.807) 11.304 6.948 ( -0.041 0.000 -2.311) 2.312 7.145 ( -5.334 0.000 3.682) 6.481 7.428 ( 1.418 0.000 3.946) 4.192 7.442 ( -3.280 0.000 0.777) 3.371 7.622 ( -1.585 0.000 0.291) 1.612 7.861 ( 0.691 0.000 3.044) 3.121 8.187 ( 2.869 0.000 4.791) 5.585 8.376 ( -2.750 0.000 2.200) 3.522 8.419 ( 11.737 0.000 -0.213) 11.739 8.629 ( 4.086 0.000 -5.599) 6.931 8.921 ( -14.025 0.000 -5.533) 15.077 9.452 ( -0.368 0.000 2.153) 2.184 9.843 ( -0.596 0.000 -6.371) 6.399 10.907 ( -0.430 0.000 0.746) 0.862 10.976 ( -0.196 0.000 -0.738) 0.763 11.513 ( 5.814 0.000 -1.903) 6.118 11.565 ( -0.785 0.000 -1.446) 1.645 12.017 ( -4.435 0.000 -0.211) 4.440 12.049 ( 1.564 0.000 -0.882) 1.795 12.255 ( 2.899 0.000 5.222) 5.973 12.281 ( -1.938 0.000 0.785) 2.091 12.300 ( -0.632 0.000 0.296) 0.698 12.921 ( -0.881 0.000 -5.085) 5.160 13.469 ( -3.559 0.000 1.858) 4.015 13.842 ( -0.015 0.000 -3.570) 3.570 17.508 ( 0.051 0.000 1.894) 1.895 17.683 ( 0.099 0.000 -1.064) 1.069 17.749 ( 1.605 0.000 4.119) 4.421 18.639 ( -3.327 0.000 0.146) 3.331 18.641 ( 0.295 0.000 -0.073) 0.304 18.851 ( 2.566 0.000 -12.998) 13.249 19.036 ( 6.133 0.000 0.136) 6.135 19.082 ( -7.166 0.000 -4.885) 8.672 20.501 ( 3.696 0.000 16.622) 17.028 21.214 ( 0.097 0.000 1.367) 1.370 21.356 ( 0.041 0.000 -2.037) 2.038 21.505 ( -1.922 0.000 -2.536) 3.182 ======================= Grid point 100 (32/170) ======================= q-point: ( 0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 15.587 0.000 27.403) 31.526 1.253 ( 16.284 0.000 29.621) 33.802 2.027 ( 17.172 0.000 46.405) 49.480 2.501 ( 1.885 0.000 -16.268) 16.377 2.671 ( 1.648 0.000 -16.640) 16.722 3.001 ( -3.051 0.000 -0.063) 3.051 3.212 ( -1.281 0.000 -2.245) 2.584 3.293 ( -6.514 0.000 -1.648) 6.719 3.370 ( -0.415 0.000 2.090) 2.131 3.624 ( -1.971 0.000 0.106) 1.974 3.760 ( -6.336 0.000 -1.655) 6.548 3.960 ( 8.635 0.000 3.971) 9.505 4.118 ( 1.292 0.000 -5.282) 5.438 4.235 ( 1.703 0.000 -8.276) 8.450 4.537 ( 11.017 0.000 1.941) 11.187 4.612 ( -0.692 0.000 0.689) 0.976 4.653 ( -1.129 0.000 6.065) 6.169 4.827 ( -17.892 0.000 -7.676) 19.469 4.991 ( 0.028 0.000 8.988) 8.988 5.166 ( -8.552 0.000 4.584) 9.703 5.229 ( -3.944 0.000 12.666) 13.265 5.437 ( -7.403 0.000 -6.058) 9.566 6.719 ( 8.921 0.000 -5.319) 10.387 6.936 ( 2.103 0.000 -3.144) 3.783 7.109 ( -4.315 0.000 5.647) 7.107 7.401 ( -2.074 0.000 0.908) 2.264 7.534 ( 5.352 0.000 3.090) 6.180 7.697 ( 5.872 0.000 0.952) 5.949 7.961 ( 6.372 0.000 5.156) 8.197 8.251 ( -2.728 0.000 1.016) 2.911 8.399 ( 1.924 0.000 8.135) 8.360 8.503 ( 0.241 0.000 -3.305) 3.313 8.592 ( 1.535 0.000 -5.367) 5.582 8.751 ( 3.275 0.000 -11.118) 11.590 9.484 ( 0.794 0.000 2.345) 2.476 9.745 ( -2.675 0.000 -5.953) 6.526 10.914 ( 0.446 0.000 0.336) 0.558 10.951 ( -1.592 0.000 -0.534) 1.679 11.475 ( -6.755 0.000 2.906) 7.353 11.515 ( -2.153 0.000 -3.038) 3.723 11.931 ( -5.389 0.000 -0.891) 5.463 12.002 ( -6.206 0.000 -0.302) 6.214 12.237 ( -6.534 0.000 0.034) 6.534 12.253 ( -2.048 0.000 1.297) 2.424 12.429 ( 8.954 0.000 7.102) 11.428 12.934 ( 10.068 0.000 -7.670) 12.657 13.577 ( 9.412 0.000 -2.383) 9.709 13.788 ( -0.947 0.000 -4.266) 4.370 17.532 ( 0.005 0.000 2.241) 2.241 17.666 ( -0.432 0.000 -1.429) 1.493 17.818 ( -1.385 0.000 7.741) 7.864 18.590 ( -8.415 0.000 -14.470) 16.739 18.619 ( -0.775 0.000 1.234) 1.457 18.661 ( 1.037 0.000 -6.235) 6.321 18.978 ( -3.652 0.000 1.096) 3.813 19.051 ( -1.568 0.000 -0.106) 1.572 20.801 ( 8.779 0.000 17.161) 19.276 21.243 ( 1.107 0.000 1.996) 2.282 21.345 ( 1.950 0.000 -3.156) 3.710 21.450 ( -0.044 0.000 -4.509) 4.509 ======================= Grid point 101 (33/170) ======================= q-point: ( 0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.681 ( 13.693 0.000 23.152) 26.898 1.819 ( 17.052 0.000 23.604) 29.119 2.321 ( 1.337 0.000 -17.593) 17.644 2.459 ( 4.054 0.000 -12.959) 13.579 2.766 ( 15.771 0.000 15.357) 22.013 2.991 ( -3.607 0.000 1.826) 4.043 3.151 ( -7.969 0.000 2.038) 8.225 3.205 ( 1.711 0.000 -1.050) 2.007 3.389 ( -0.030 0.000 3.433) 3.433 3.599 ( -3.898 0.000 4.054) 5.624 3.673 ( -4.169 0.000 -1.232) 4.347 4.078 ( -0.981 0.000 -4.653) 4.755 4.122 ( 5.133 0.000 1.760) 5.427 4.164 ( 1.775 0.000 -7.370) 7.581 4.457 ( -11.373 0.000 -6.030) 12.873 4.614 ( -0.509 0.000 -0.319) 0.601 4.644 ( -0.774 0.000 -0.187) 0.796 4.684 ( 4.893 0.000 -1.137) 5.024 5.070 ( -2.892 0.000 9.792) 10.210 5.073 ( -8.043 0.000 4.482) 9.207 5.262 ( -9.726 0.000 -0.045) 9.726 5.308 ( 4.190 0.000 1.626) 4.494 6.828 ( 5.032 0.000 0.230) 5.037 6.933 ( 3.179 0.000 -5.241) 6.130 7.161 ( 2.096 0.000 8.218) 8.481 7.384 ( -0.788 0.000 -0.090) 0.794 7.641 ( 4.074 0.000 2.960) 5.036 7.787 ( 3.518 0.000 0.866) 3.623 8.120 ( -0.759 0.000 2.565) 2.675 8.219 ( 4.678 0.000 4.954) 6.814 8.404 ( -4.533 0.000 -4.401) 6.318 8.557 ( 3.043 0.000 10.195) 10.639 8.576 ( 6.562 0.000 -11.190) 12.972 8.704 ( 2.844 0.000 -7.713) 8.221 9.503 ( -1.382 0.000 0.592) 1.504 9.645 ( -2.744 0.000 -3.988) 4.841 10.926 ( 1.089 0.000 -0.341) 1.142 10.935 ( -0.153 0.000 1.025) 1.037 11.405 ( -6.880 0.000 4.165) 8.042 11.445 ( -1.288 0.000 -4.019) 4.220 11.825 ( -6.156 0.000 -1.823) 6.420 11.873 ( -9.265 0.000 0.167) 9.266 12.126 ( -6.922 0.000 -0.270) 6.927 12.231 ( -1.717 0.000 -0.110) 1.720 12.683 ( 11.296 0.000 9.110) 14.512 13.020 ( 11.732 0.000 -9.369) 15.014 13.664 ( 5.024 0.000 -2.399) 5.567 13.733 ( -0.731 0.000 -2.620) 2.720 17.556 ( 0.021 0.000 2.144) 2.144 17.640 ( -0.746 0.000 -1.579) 1.746 17.875 ( -3.673 0.000 9.811) 10.476 18.244 ( -9.663 0.000 -16.391) 19.027 18.629 ( 0.153 0.000 1.196) 1.206 18.655 ( 0.590 0.000 -0.759) 0.961 18.946 ( -1.785 0.000 -0.002) 1.785 19.017 ( -2.228 0.000 -0.232) 2.240 21.112 ( 8.038 0.000 13.809) 15.978 21.290 ( 1.577 0.000 2.449) 2.913 21.345 ( 2.902 0.000 -3.821) 4.798 21.402 ( 0.889 0.000 -5.376) 5.449 ======================= Grid point 102 (34/170) ======================= q-point: ( 0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( 7.933 0.000 15.984) 17.844 2.162 ( 5.812 0.000 -5.234) 7.821 2.339 ( 13.485 0.000 11.010) 17.409 2.376 ( 7.701 0.000 -14.485) 16.405 2.828 ( -13.345 0.000 0.343) 13.350 2.956 ( -0.512 0.000 -0.118) 0.526 3.162 ( -2.690 0.000 -5.147) 5.807 3.178 ( -0.156 0.000 7.162) 7.164 3.345 ( -10.463 0.000 -1.511) 10.572 3.554 ( -7.765 0.000 -4.095) 8.778 3.603 ( -3.539 0.000 7.464) 8.261 3.952 ( -6.867 0.000 -5.052) 8.525 4.159 ( 5.483 0.000 -5.669) 7.887 4.196 ( 7.812 0.000 0.548) 7.831 4.490 ( 8.852 0.000 4.483) 9.922 4.547 ( -8.712 0.000 1.613) 8.860 4.592 ( 0.437 0.000 -1.311) 1.382 4.814 ( 18.000 0.000 -9.619) 20.409 5.045 ( 0.724 0.000 -0.300) 0.783 5.139 ( 2.064 0.000 4.181) 4.663 5.157 ( -9.661 0.000 11.874) 15.308 5.378 ( 3.726 0.000 -1.150) 3.899 6.816 ( -6.588 0.000 0.371) 6.598 6.918 ( 3.191 0.000 -6.288) 7.051 7.328 ( 6.652 0.000 5.513) 8.640 7.374 ( -0.397 0.000 -0.149) 0.424 7.746 ( 3.078 0.000 6.316) 7.026 7.812 ( -0.008 0.000 -1.246) 1.246 8.061 ( -3.877 0.000 1.048) 4.016 8.295 ( -3.355 0.000 -3.952) 5.184 8.430 ( 6.238 0.000 8.762) 10.756 8.533 ( 6.396 0.000 -15.340) 16.620 8.678 ( 0.487 0.000 -0.885) 1.010 8.690 ( 1.165 0.000 7.537) 7.626 9.440 ( -5.251 0.000 -1.851) 5.567 9.572 ( -2.498 0.000 -1.895) 3.135 10.947 ( 2.758 0.000 -0.996) 2.932 10.983 ( 3.452 0.000 3.063) 4.615 11.352 ( -5.462 0.000 3.863) 6.690 11.400 ( 0.953 0.000 -3.448) 3.578 11.702 ( -6.593 0.000 -1.958) 6.878 11.730 ( -8.810 0.000 -0.060) 8.810 12.025 ( -5.499 0.000 0.256) 5.505 12.198 ( -1.509 0.000 -1.088) 1.860 12.965 ( 10.817 0.000 9.591) 14.457 13.085 ( 9.812 0.000 -9.543) 13.688 13.686 ( 0.949 0.000 -1.935) 2.156 13.714 ( -0.297 0.000 0.599) 0.668 17.578 ( -0.039 0.000 1.694) 1.695 17.609 ( -0.876 0.000 -1.596) 1.820 17.915 ( -4.973 0.000 9.583) 10.796 17.969 ( -5.669 0.000 -10.532) 11.961 18.645 ( 0.132 0.000 1.154) 1.162 18.655 ( 0.159 0.000 -0.302) 0.341 18.916 ( -1.294 0.000 -0.969) 1.617 18.980 ( -1.782 0.000 -0.406) 1.828 21.320 ( 3.457 0.000 3.434) 4.873 21.345 ( 3.776 0.000 -6.551) 7.561 21.361 ( 2.760 0.000 7.546) 8.035 21.368 ( 1.055 0.000 -2.560) 2.769 ======================= Grid point 103 (35/170) ======================= q-point: ( 0.36 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 8.494 0.000 -2.867) 8.965 2.226 ( -0.886 0.000 2.191) 2.363 2.403 ( 6.986 0.000 -6.098) 9.273 2.561 ( -0.398 0.000 2.795) 2.823 2.741 ( -1.457 0.000 9.934) 10.041 2.843 ( -7.514 0.000 0.806) 7.557 3.093 ( 2.103 0.000 -5.300) 5.702 3.142 ( -12.722 0.000 -0.714) 12.742 3.193 ( -4.513 0.000 -1.530) 4.766 3.423 ( -1.257 0.000 -0.437) 1.331 3.623 ( -4.988 0.000 7.034) 8.623 3.800 ( -5.222 0.000 -3.093) 6.069 4.182 ( 5.593 0.000 -6.678) 8.711 4.270 ( 4.301 0.000 -4.476) 6.207 4.460 ( -4.208 0.000 1.433) 4.446 4.599 ( 0.850 0.000 4.631) 4.709 4.673 ( 6.592 0.000 -1.834) 6.842 5.007 ( -7.763 0.000 4.674) 9.062 5.025 ( 21.347 0.000 -9.800) 23.489 5.209 ( 5.366 0.000 -3.575) 6.448 5.294 ( 9.880 0.000 6.044) 11.582 5.401 ( 0.217 0.000 0.900) 0.925 6.667 ( -11.488 0.000 0.674) 11.508 6.903 ( 1.871 0.000 -3.602) 4.058 7.363 ( -0.562 0.000 -0.611) 0.830 7.441 ( 4.538 0.000 -0.949) 4.636 7.789 ( -0.436 0.000 -0.279) 0.518 7.851 ( -2.814 0.000 10.577) 10.945 8.056 ( 1.727 0.000 0.753) 1.884 8.206 ( -2.576 0.000 -3.242) 4.141 8.465 ( 4.112 0.000 -10.709) 11.471 8.543 ( -1.790 0.000 4.174) 4.541 8.693 ( 2.180 0.000 -0.978) 2.390 8.757 ( 0.488 0.000 2.394) 2.443 9.343 ( -4.317 0.000 0.586) 4.357 9.525 ( -2.154 0.000 0.244) 2.168 10.996 ( 5.225 0.000 -1.272) 5.378 11.098 ( 5.893 0.000 3.581) 6.896 11.312 ( -5.124 0.000 3.500) 6.205 11.375 ( -1.675 0.000 -2.353) 2.888 11.583 ( -5.273 0.000 -2.079) 5.668 11.606 ( -4.927 0.000 -1.625) 5.188 11.968 ( -3.446 0.000 2.296) 4.141 12.166 ( -0.663 0.000 -1.250) 1.415 13.131 ( 8.304 0.000 -7.282) 11.044 13.213 ( 6.998 0.000 8.510) 11.018 13.657 ( -1.526 0.000 -1.650) 2.247 13.728 ( -0.961 0.000 3.189) 3.331 17.579 ( -0.606 0.000 -1.392) 1.518 17.591 ( -0.304 0.000 1.057) 1.100 17.839 ( -1.061 0.000 -3.801) 3.946 17.923 ( -5.753 0.000 6.867) 8.959 18.655 ( -0.017 0.000 0.046) 0.049 18.657 ( -0.244 0.000 1.085) 1.112 18.891 ( -0.533 0.000 -0.568) 0.779 18.957 ( -0.958 0.000 0.340) 1.017 21.325 ( 3.681 0.000 -6.631) 7.584 21.367 ( 1.070 0.000 1.046) 1.496 21.376 ( 1.816 0.000 -1.063) 2.104 21.462 ( 0.799 0.000 3.106) 3.207 ======================= Grid point 104 (36/170) ======================= q-point: ( 0.45 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( -6.794 0.000 1.919) 7.059 2.336 ( 6.228 0.000 2.551) 6.730 2.447 ( 9.924 0.000 -7.698) 12.560 2.566 ( -5.216 0.000 6.004) 7.953 2.803 ( 2.976 0.000 -1.353) 3.269 2.826 ( -1.598 0.000 5.811) 6.026 2.883 ( -12.988 0.000 -4.222) 13.657 3.093 ( 1.986 0.000 -1.374) 2.415 3.173 ( 3.053 0.000 0.105) 3.054 3.439 ( -0.160 0.000 1.679) 1.686 3.578 ( -7.802 0.000 2.907) 8.326 3.760 ( 0.944 0.000 2.649) 2.812 4.180 ( 5.231 0.000 -9.334) 10.700 4.307 ( 5.343 0.000 -0.649) 5.383 4.429 ( -3.114 0.000 2.388) 3.924 4.631 ( -3.577 0.000 0.918) 3.693 4.711 ( 4.059 0.000 -3.445) 5.324 4.936 ( -6.161 0.000 3.999) 7.345 5.148 ( 6.060 0.000 -13.688) 14.969 5.279 ( 11.716 0.000 -3.450) 12.213 5.416 ( 0.839 0.000 -4.281) 4.363 5.434 ( 1.236 0.000 2.529) 2.815 6.526 ( -6.836 0.000 2.634) 7.326 6.899 ( 0.913 0.000 -0.995) 1.351 7.346 ( 0.096 0.000 -1.412) 1.415 7.459 ( 1.701 0.000 -4.664) 4.965 7.820 ( 1.171 0.000 4.764) 4.906 7.888 ( -6.982 0.000 11.015) 13.041 8.088 ( 1.143 0.000 -0.898) 1.454 8.172 ( 1.233 0.000 0.053) 1.235 8.434 ( 4.964 0.000 -7.866) 9.301 8.483 ( -4.353 0.000 -3.665) 5.691 8.711 ( 2.166 0.000 -2.107) 3.021 8.757 ( -1.491 0.000 -1.568) 2.163 9.342 ( -0.713 0.000 5.739) 5.783 9.514 ( -0.865 0.000 2.170) 2.336 11.081 ( 6.676 0.000 -0.748) 6.718 11.235 ( 6.120 0.000 3.063) 6.844 11.255 ( -6.908 0.000 3.008) 7.535 11.271 ( -6.922 0.000 -2.314) 7.298 11.505 ( -1.182 0.000 -2.219) 2.514 11.551 ( 0.516 0.000 -3.256) 3.297 11.961 ( -2.253 0.000 4.047) 4.632 12.155 ( 0.728 0.000 -0.698) 1.008 13.198 ( 7.714 0.000 -3.006) 8.279 13.322 ( -3.316 0.000 3.329) 4.698 13.646 ( 1.758 0.000 1.745) 2.477 13.743 ( -2.483 0.000 3.979) 4.690 17.568 ( 0.619 0.000 -0.432) 0.755 17.590 ( -0.811 0.000 0.327) 0.875 17.835 ( 2.012 0.000 0.980) 2.238 17.885 ( -5.771 0.000 2.876) 6.448 18.657 ( 0.070 0.000 0.355) 0.362 18.661 ( -0.646 0.000 0.852) 1.069 18.894 ( 0.499 0.000 1.376) 1.464 18.960 ( -0.180 0.000 1.796) 1.805 21.322 ( 4.197 0.000 -5.204) 6.685 21.382 ( -0.264 0.000 0.356) 0.444 21.395 ( 1.547 0.000 -0.330) 1.582 21.450 ( -2.123 0.000 -2.997) 3.673 ======================= Grid point 105 (37/170) ======================= q-point: (-0.45 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( -6.472 0.000 -0.239) 6.476 2.440 ( -5.437 0.000 -4.242) 6.897 2.509 ( 0.516 0.000 11.111) 11.123 2.529 ( 7.497 0.000 -2.673) 7.960 2.634 ( -11.944 0.000 -3.028) 12.322 2.901 ( 10.172 0.000 -3.542) 10.771 2.917 ( 6.318 0.000 5.602) 8.444 3.126 ( 0.506 0.000 3.903) 3.936 3.255 ( 6.751 0.000 -1.519) 6.920 3.446 ( 0.234 0.000 0.838) 0.870 3.468 ( -7.163 0.000 0.358) 7.172 3.862 ( 4.867 0.000 5.471) 7.322 4.146 ( 5.891 0.000 -12.119) 13.475 4.403 ( 4.695 0.000 -4.278) 6.352 4.404 ( -3.187 0.000 2.072) 3.802 4.514 ( -8.194 0.000 2.685) 8.623 4.685 ( -1.029 0.000 -7.302) 7.374 4.962 ( 1.447 0.000 7.876) 8.007 5.047 ( 0.438 0.000 -11.085) 11.093 5.218 ( -14.739 0.000 -7.604) 16.585 5.350 ( -1.210 0.000 -0.996) 1.567 5.459 ( -0.104 0.000 -1.241) 1.246 6.552 ( 5.434 0.000 3.602) 6.519 6.910 ( 2.860 0.000 -2.419) 3.746 7.341 ( 1.138 0.000 -1.227) 1.673 7.394 ( -2.026 0.000 -6.136) 6.462 7.886 ( -7.701 0.000 9.542) 12.262 7.901 ( -0.400 0.000 6.806) 6.818 8.073 ( -1.695 0.000 0.255) 1.714 8.230 ( 3.157 0.000 1.916) 3.693 8.371 ( -2.339 0.000 -6.038) 6.475 8.473 ( 9.615 0.000 -4.146) 10.471 8.667 ( -4.202 0.000 -6.621) 7.842 8.717 ( 2.248 0.000 -2.800) 3.591 9.423 ( 1.260 0.000 7.067) 7.179 9.544 ( 0.953 0.000 2.893) 3.046 11.116 ( -8.338 0.000 -1.665) 8.503 11.158 ( -4.852 0.000 2.268) 5.356 11.186 ( 2.411 0.000 0.685) 2.506 11.372 ( 6.787 0.000 1.434) 6.937 11.502 ( 3.930 0.000 -2.275) 4.541 11.530 ( 1.824 0.000 -3.682) 4.109 11.979 ( -1.120 0.000 3.977) 4.132 12.172 ( 1.776 0.000 -0.111) 1.779 13.200 ( -11.287 0.000 -1.676) 11.410 13.308 ( 6.518 0.000 2.192) 6.876 13.733 ( -3.658 0.000 2.864) 4.646 13.736 ( 3.203 0.000 5.013) 5.949 17.571 ( -1.449 0.000 -0.567) 1.556 17.587 ( 1.623 0.000 0.378) 1.666 17.817 ( -4.519 0.000 0.126) 4.520 17.922 ( 5.731 0.000 4.152) 7.077 18.655 ( -0.936 0.000 0.484) 1.054 18.665 ( 0.266 0.000 0.634) 0.687 18.932 ( 0.670 0.000 3.336) 3.403 18.985 ( -0.007 0.000 2.585) 2.585 21.328 ( -4.607 0.000 -7.570) 8.862 21.341 ( 4.248 0.000 -3.676) 5.618 21.374 ( -1.902 0.000 -0.358) 1.936 21.416 ( 1.151 0.000 0.239) 1.175 ======================= Grid point 106 (38/170) ======================= q-point: (-0.36 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( -17.353 0.000 -5.059) 18.075 2.129 ( -20.012 0.000 -11.225) 22.945 2.528 ( -0.563 0.000 7.003) 7.026 2.633 ( 5.786 0.000 1.104) 5.890 2.755 ( 10.435 0.000 8.489) 13.452 2.958 ( 2.561 0.000 -4.539) 5.211 3.100 ( 3.267 0.000 4.709) 5.731 3.194 ( 4.381 0.000 1.961) 4.800 3.316 ( 6.767 0.000 -6.626) 9.471 3.385 ( -6.698 0.000 4.262) 7.938 3.483 ( 4.029 0.000 -1.360) 4.252 3.987 ( 6.439 0.000 -1.287) 6.566 4.127 ( 7.086 0.000 -7.400) 10.245 4.196 ( -10.073 0.000 -9.576) 13.898 4.382 ( -1.782 0.000 1.437) 2.289 4.535 ( -3.346 0.000 -5.405) 6.357 4.595 ( -1.844 0.000 3.165) 3.663 4.917 ( -8.873 0.000 0.433) 8.884 4.937 ( -1.472 0.000 -7.154) 7.304 5.141 ( 6.366 0.000 8.350) 10.500 5.237 ( -10.901 0.000 -0.530) 10.914 5.392 ( -4.312 0.000 -4.102) 5.951 6.715 ( 8.559 0.000 2.817) 9.010 6.933 ( 4.053 0.000 -3.401) 5.291 7.278 ( -4.929 0.000 -4.065) 6.389 7.350 ( 1.151 0.000 -0.688) 1.341 7.844 ( -8.441 0.000 5.785) 10.233 7.921 ( -4.377 0.000 3.336) 5.503 8.068 ( -1.338 0.000 3.749) 3.980 8.287 ( -1.153 0.000 -4.313) 4.464 8.302 ( 3.858 0.000 1.684) 4.210 8.489 ( -5.834 0.000 -10.339) 11.872 8.602 ( 6.875 0.000 -2.115) 7.193 8.750 ( 6.989 0.000 -1.228) 7.096 9.513 ( 0.869 0.000 4.993) 5.068 9.602 ( 2.622 0.000 2.424) 3.570 10.986 ( -5.891 0.000 -1.061) 5.985 11.076 ( -6.580 0.000 2.460) 7.025 11.246 ( 1.708 0.000 1.092) 2.027 11.461 ( 2.515 0.000 0.599) 2.585 11.556 ( 7.180 0.000 -3.017) 7.788 11.579 ( 8.660 0.000 -1.981) 8.883 12.017 ( 1.117 0.000 3.126) 3.320 12.201 ( 1.764 0.000 -0.062) 1.765 12.968 ( -14.137 0.000 -3.026) 14.457 13.428 ( 1.025 0.000 6.645) 6.723 13.700 ( -1.570 0.000 0.033) 1.570 13.832 ( 1.341 0.000 5.691) 5.847 17.535 ( -1.594 0.000 -1.330) 2.076 17.620 ( 1.698 0.000 0.559) 1.787 17.757 ( -2.727 0.000 -0.269) 2.740 18.112 ( 11.030 0.000 6.088) 12.598 18.643 ( -1.110 0.000 0.277) 1.144 18.679 ( 0.463 0.000 0.908) 1.019 18.979 ( -0.243 0.000 4.257) 4.264 19.009 ( -0.337 0.000 1.839) 1.870 21.126 ( -7.873 0.000 -10.365) 13.016 21.335 ( -2.649 0.000 -0.445) 2.686 21.368 ( 3.094 0.000 -2.128) 3.755 21.437 ( 1.340 0.000 0.088) 1.343 ======================= Grid point 107 (39/170) ======================= q-point: (-0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( -26.056 0.000 -5.658) 26.663 1.629 ( -26.806 0.000 -11.311) 29.094 2.590 ( -20.726 0.000 -3.805) 21.072 2.708 ( 9.812 0.000 10.471) 14.349 2.886 ( -1.842 0.000 -2.921) 3.453 2.993 ( -11.018 0.000 1.392) 11.106 3.035 ( 11.068 0.000 5.279) 12.262 3.217 ( -0.706 0.000 0.920) 1.159 3.318 ( 4.188 0.000 -7.072) 8.219 3.456 ( 6.121 0.000 3.643) 7.123 3.505 ( 3.738 0.000 -5.652) 6.776 4.033 ( 9.910 0.000 -11.314) 15.040 4.040 ( -1.330 0.000 -6.351) 6.488 4.207 ( 4.251 0.000 2.461) 4.912 4.390 ( 0.803 0.000 1.992) 2.148 4.410 ( -3.200 0.000 -6.550) 7.290 4.574 ( 0.252 0.000 7.007) 7.012 4.845 ( -2.285 0.000 -4.271) 4.844 4.992 ( 8.543 0.000 5.224) 10.014 5.022 ( -13.841 0.000 -2.179) 14.011 5.247 ( -7.452 0.000 -4.553) 8.733 5.350 ( 7.462 0.000 8.453) 11.275 6.845 ( 5.071 0.000 1.137) 5.197 6.961 ( 3.196 0.000 -2.038) 3.790 7.159 ( -7.411 0.000 0.479) 7.427 7.358 ( 0.528 0.000 -0.393) 0.658 7.756 ( -9.203 0.000 3.461) 9.832 7.864 ( -5.430 0.000 1.997) 5.786 8.092 ( -0.980 0.000 0.286) 1.021 8.213 ( -5.018 0.000 -2.075) 5.430 8.313 ( -1.067 0.000 -6.226) 6.317 8.371 ( 2.760 0.000 -0.094) 2.762 8.611 ( 0.831 0.000 -3.990) 4.075 8.893 ( 9.269 0.000 -0.200) 9.271 9.543 ( -2.091 0.000 2.066) 2.939 9.681 ( 4.550 0.000 1.769) 4.882 10.920 ( -1.406 0.000 -0.114) 1.411 11.012 ( -5.065 0.000 2.300) 5.563 11.266 ( -0.092 0.000 0.622) 0.629 11.496 ( 2.059 0.000 0.592) 2.142 11.670 ( 10.349 0.000 -2.333) 10.609 11.715 ( 10.102 0.000 -1.056) 10.157 12.083 ( 3.439 0.000 2.267) 4.119 12.219 ( 0.835 0.000 -0.595) 1.025 12.709 ( -14.273 0.000 -2.479) 14.487 13.426 ( -10.065 0.000 5.474) 11.457 13.728 ( 5.186 0.000 -0.236) 5.191 13.906 ( 0.013 0.000 6.107) 6.107 17.500 ( -0.881 0.000 -1.020) 1.348 17.650 ( 1.489 0.000 0.373) 1.535 17.726 ( -1.562 0.000 0.597) 1.672 18.383 ( 14.440 0.000 4.751) 15.202 18.629 ( -1.206 0.000 0.515) 1.311 18.704 ( 1.626 0.000 1.304) 2.085 19.010 ( -0.639 0.000 -0.463) 0.789 19.018 ( -1.005 0.000 5.049) 5.148 20.862 ( -11.092 0.000 -9.989) 14.927 21.285 ( -2.896 0.000 -0.541) 2.946 21.386 ( 0.998 0.000 -0.575) 1.151 21.460 ( 2.080 0.000 -0.812) 2.233 ======================= Grid point 108 (40/170) ======================= q-point: (-0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.984 ( -30.804 0.000 2.869) 30.938 1.064 ( -31.583 0.000 -5.883) 32.126 1.901 ( -53.807 0.000 0.800) 53.813 2.795 ( -6.277 0.000 0.433) 6.292 2.971 ( -0.193 0.000 1.958) 1.968 3.008 ( 13.307 0.000 4.280) 13.979 3.218 ( 1.546 0.000 -2.056) 2.572 3.240 ( 7.662 0.000 3.280) 8.335 3.313 ( 2.373 0.000 -3.072) 3.882 3.536 ( 10.873 0.000 -4.420) 11.737 3.560 ( 3.631 0.000 1.791) 4.048 3.892 ( -6.923 0.000 -7.791) 10.423 4.065 ( 7.815 0.000 -8.879) 11.829 4.265 ( 3.728 0.000 -3.775) 5.305 4.314 ( -2.310 0.000 -1.256) 2.629 4.458 ( 0.379 0.000 7.718) 7.727 4.719 ( -11.834 0.000 -4.864) 12.794 4.801 ( 14.086 0.000 6.285) 15.425 4.823 ( -4.100 0.000 -0.742) 4.166 5.089 ( -7.369 0.000 -0.854) 7.418 5.189 ( 10.538 0.000 0.752) 10.565 5.536 ( 6.124 0.000 4.686) 7.711 6.895 ( 2.342 0.000 -4.474) 5.050 6.983 ( 1.099 0.000 -0.406) 1.171 7.082 ( -5.896 0.000 6.970) 9.130 7.361 ( -0.081 0.000 0.834) 0.838 7.626 ( -10.651 0.000 1.177) 10.716 7.823 ( -4.004 0.000 5.071) 6.461 7.978 ( -7.590 0.000 -2.982) 8.155 8.150 ( 0.286 0.000 -3.898) 3.908 8.321 ( 0.874 0.000 3.981) 4.075 8.357 ( -1.451 0.000 -5.307) 5.501 8.581 ( 1.150 0.000 -3.107) 3.313 9.005 ( 5.906 0.000 -0.719) 5.950 9.505 ( -3.944 0.000 0.698) 4.005 9.781 ( 5.865 0.000 0.972) 5.945 10.931 ( 1.982 0.000 0.321) 2.008 10.963 ( -3.941 0.000 1.480) 4.209 11.263 ( -0.834 0.000 0.593) 1.023 11.539 ( 2.307 0.000 0.515) 2.364 11.822 ( 11.651 0.000 -1.981) 11.819 11.860 ( 8.956 0.000 -0.132) 8.957 12.170 ( 4.671 0.000 1.536) 4.917 12.212 ( -0.231 0.000 -1.353) 1.373 12.485 ( -11.653 0.000 -0.346) 11.658 13.271 ( -13.245 0.000 1.306) 13.310 13.812 ( 4.484 0.000 0.133) 4.486 13.969 ( 0.476 0.000 4.019) 4.047 17.488 ( -0.209 0.000 0.179) 0.275 17.674 ( 1.182 0.000 -0.034) 1.182 17.719 ( -0.924 0.000 1.457) 1.725 18.589 ( 6.396 0.000 -0.007) 6.396 18.623 ( -0.914 0.000 2.001) 2.200 18.790 ( 8.508 0.000 -0.547) 8.526 18.972 ( -1.025 0.000 -4.315) 4.435 19.078 ( 1.330 0.000 6.610) 6.743 20.578 ( -13.040 0.000 -5.325) 14.085 21.238 ( -2.315 0.000 -0.184) 2.323 21.389 ( -0.382 0.000 0.396) 0.550 21.483 ( 2.089 0.000 -0.916) 2.281 ======================= Grid point 109 (41/170) ======================= q-point: (-0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.595 ( -28.093 0.000 15.133) 31.910 0.642 ( -27.888 0.000 20.561) 34.648 1.169 ( -52.349 0.000 34.330) 62.602 2.695 ( -5.969 0.000 -0.425) 5.984 2.951 ( -1.268 0.000 -4.597) 4.768 3.142 ( 5.966 0.000 -6.951) 9.160 3.256 ( 5.955 0.000 0.459) 5.972 3.338 ( 3.036 0.000 0.559) 3.087 3.341 ( 1.466 0.000 3.822) 4.094 3.628 ( 2.500 0.000 3.282) 4.126 3.706 ( -6.570 0.000 -3.135) 7.279 3.817 ( 21.608 0.000 5.172) 22.218 4.061 ( 1.032 0.000 -5.716) 5.809 4.252 ( 3.708 0.000 -9.481) 10.181 4.365 ( 4.660 0.000 13.344) 14.134 4.432 ( -14.140 0.000 -0.825) 14.164 4.554 ( -0.486 0.000 4.725) 4.750 4.825 ( 1.336 0.000 2.545) 2.874 5.034 ( 9.339 0.000 -0.294) 9.344 5.038 ( -4.831 0.000 9.936) 11.048 5.270 ( 4.992 0.000 -12.364) 13.334 5.626 ( 2.492 0.000 -0.739) 2.600 6.817 ( -0.797 0.000 -9.271) 9.305 6.978 ( -0.759 0.000 -1.088) 1.326 7.130 ( -0.474 0.000 7.094) 7.110 7.395 ( 2.064 0.000 3.489) 4.054 7.467 ( -9.429 0.000 1.153) 9.499 7.816 ( -5.105 0.000 -3.085) 5.965 7.868 ( -3.901 0.000 0.257) 3.909 8.130 ( 0.397 0.000 0.502) 0.640 8.251 ( -2.739 0.000 2.825) 3.935 8.372 ( -0.298 0.000 3.253) 3.266 8.594 ( 3.126 0.000 -0.712) 3.206 9.083 ( 3.822 0.000 -1.325) 4.046 9.458 ( -2.749 0.000 1.146) 2.978 9.866 ( 4.489 0.000 -1.814) 4.842 10.921 ( -2.521 0.000 0.549) 2.581 10.967 ( 1.875 0.000 -0.128) 1.879 11.296 ( 4.024 0.000 7.328) 8.360 11.570 ( 1.151 0.000 -0.201) 1.169 11.973 ( 9.226 0.000 -1.570) 9.359 11.989 ( 6.802 0.000 0.617) 6.829 12.195 ( 0.382 0.000 -0.582) 0.696 12.256 ( 4.308 0.000 0.820) 4.385 12.344 ( -7.382 0.000 1.884) 7.619 13.067 ( -11.137 0.000 -1.982) 11.312 13.856 ( 2.008 0.000 -1.572) 2.550 13.891 ( -10.837 0.000 -18.391) 21.347 17.493 ( -0.131 0.000 1.010) 1.019 17.685 ( 0.696 0.000 -0.557) 0.891 17.716 ( -0.818 0.000 0.313) 0.876 18.633 ( 1.231 0.000 -0.390) 1.291 18.669 ( 2.209 0.000 3.460) 4.105 18.875 ( 5.810 0.000 -5.544) 8.030 18.894 ( -0.693 0.000 -0.903) 1.138 19.172 ( 2.584 0.000 -0.702) 2.677 20.396 ( -8.177 0.000 6.463) 10.423 21.212 ( -1.173 0.000 0.545) 1.294 21.382 ( -0.777 0.000 -0.453) 0.900 21.516 ( 1.763 0.000 1.388) 2.243 ======================= Grid point 110 (42/170) ======================= q-point: ( 0.00 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.931 ( -6.832 25.201 19.842) 32.794 1.011 ( -0.129 22.568 25.846) 34.313 1.652 ( 0.711 32.948 45.171) 55.915 2.633 ( -0.916 2.346 -6.441) 6.915 2.846 ( -1.130 1.066 -10.686) 10.798 3.082 ( -0.176 -0.842 -8.288) 8.333 3.248 ( -2.296 -8.272 1.428) 8.702 3.306 ( 0.222 0.323 -1.586) 1.633 3.368 ( 0.512 -0.477 -2.926) 3.009 3.607 ( 1.811 -4.688 -0.922) 5.109 3.665 ( 1.491 -5.316 2.255) 5.964 3.931 ( -2.416 -3.685 -2.816) 5.229 4.206 ( 14.187 -4.236 8.543) 17.094 4.266 ( -0.175 6.393 -6.756) 9.303 4.306 ( -1.751 0.423 10.640) 10.792 4.588 ( 4.547 4.542 -3.451) 7.295 4.688 ( -1.638 6.784 -1.953) 7.247 4.921 ( -1.399 -10.803 7.994) 13.511 4.950 ( 1.812 4.382 1.729) 5.048 5.054 ( -4.575 -4.329 5.993) 8.694 5.125 ( -2.638 -4.584 4.520) 6.956 5.685 ( -2.563 6.420 -6.424) 9.437 6.738 ( 2.858 0.857 -12.334) 12.690 6.929 ( 0.310 -1.921 -2.236) 2.964 7.259 ( -3.890 6.728 3.692) 8.604 7.432 ( 2.454 0.678 3.755) 4.537 7.483 ( -4.848 4.168 1.800) 6.642 7.628 ( -1.516 0.627 0.593) 1.744 7.880 ( 1.173 1.957 3.838) 4.465 8.154 ( 4.306 -1.704 6.278) 7.801 8.281 ( 2.002 0.302 4.277) 4.731 8.482 ( -1.175 -0.221 -1.003) 1.561 8.720 ( 3.910 8.286 -5.455) 10.663 8.892 ( -4.825 -1.059 1.714) 5.229 9.525 ( -0.105 1.479 -2.977) 3.326 9.804 ( -0.207 -3.788 -5.028) 6.298 10.875 ( -0.112 -0.410 -1.553) 1.610 11.122 ( -1.772 7.703 -5.793) 9.799 11.511 ( 4.727 -0.149 -1.882) 5.090 11.579 ( -1.112 1.188 -1.728) 2.374 11.930 ( -3.851 -6.882 -1.971) 8.129 12.057 ( 1.799 0.174 -3.191) 3.667 12.246 ( -2.547 -3.948 1.541) 4.944 12.256 ( 3.560 -1.162 2.177) 4.332 12.299 ( -1.607 1.888 5.982) 6.475 12.994 ( -0.638 6.755 -4.968) 8.410 13.347 ( -0.778 -6.684 7.766) 10.276 13.832 ( -0.345 -3.035 -5.399) 6.203 17.520 ( -0.481 1.741 1.410) 2.291 17.693 ( -0.974 1.027 -1.010) 1.739 17.744 ( 0.578 0.260 3.198) 3.260 18.533 ( -0.205 -7.904 -1.222) 8.001 18.736 ( 1.605 4.057 -7.594) 8.758 18.858 ( 0.159 0.501 -8.664) 8.680 19.011 ( -1.305 -2.629 0.303) 2.950 19.074 ( -1.763 -0.907 -4.276) 4.713 20.587 ( 2.997 8.548 15.157) 17.657 21.219 ( 0.072 0.511 1.320) 1.417 21.350 ( 0.210 -0.649 -1.570) 1.712 21.495 ( -0.391 -0.512 0.954) 1.151 ======================= Grid point 111 (43/170) ======================= q-point: ( 0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( 12.785 10.312 24.452) 29.457 1.387 ( 7.783 12.469 27.869) 31.508 2.289 ( 16.944 23.448 36.395) 46.492 2.525 ( 1.918 2.084 -15.765) 16.017 2.708 ( 1.152 3.647 -13.686) 14.210 2.985 ( -3.269 -1.593 -1.797) 4.056 3.190 ( -2.478 -3.734 -1.458) 4.713 3.289 ( -5.994 -0.681 -2.642) 6.586 3.330 ( 0.747 -3.322 2.055) 3.977 3.604 ( -1.166 -2.294 0.422) 2.608 3.707 ( -0.007 -4.238 -0.171) 4.241 3.901 ( 3.286 -5.083 0.196) 6.056 4.151 ( -2.815 2.180 -4.475) 5.718 4.261 ( -2.216 3.270 -1.890) 4.379 4.511 ( 5.610 -3.168 4.484) 7.849 4.630 ( 2.637 0.766 1.173) 2.986 4.662 ( -0.765 3.915 3.052) 5.023 4.829 ( -10.993 0.295 -8.301) 13.778 5.048 ( -2.726 2.000 7.951) 8.640 5.059 ( -2.496 -5.636 7.481) 9.694 5.167 ( -0.627 -2.495 7.292) 7.732 5.545 ( -4.878 7.075 -6.604) 10.838 6.720 ( 7.842 -0.160 -5.489) 9.574 6.925 ( 2.487 -1.214 -2.989) 4.073 7.195 ( -6.623 7.298 5.061) 11.079 7.425 ( -2.420 2.358 1.317) 3.626 7.549 ( 4.354 1.649 3.384) 5.756 7.697 ( 5.266 -0.047 1.256) 5.414 7.980 ( 5.652 1.898 4.839) 7.679 8.238 ( -2.017 -1.709 2.419) 3.584 8.358 ( 1.669 -0.473 6.277) 6.512 8.477 ( 2.133 -2.956 -3.438) 5.010 8.690 ( 1.372 9.312 -4.612) 10.482 8.814 ( -1.109 3.405 -6.110) 7.083 9.497 ( -0.799 0.440 0.852) 1.249 9.725 ( -2.091 -2.054 -5.183) 5.954 10.869 ( 0.222 -1.768 0.662) 1.901 11.040 ( -1.202 6.487 -4.353) 7.904 11.468 ( -7.830 -0.983 3.785) 8.753 11.529 ( -1.757 1.261 -3.782) 4.356 11.858 ( -2.325 -6.213 -1.850) 6.887 11.994 ( -5.676 -0.586 -2.219) 6.123 12.185 ( -5.710 -4.119 1.113) 7.128 12.260 ( -1.995 -1.135 0.150) 2.300 12.460 ( 8.190 3.457 8.637) 12.394 13.007 ( 9.519 6.746 -7.308) 13.767 13.508 ( 9.461 -5.664 1.214) 11.094 13.758 ( -0.950 -3.454 -5.454) 6.525 17.538 ( -0.064 1.029 2.423) 2.633 17.685 ( 1.078 1.612 -1.429) 2.409 17.796 ( -0.866 -1.216 6.170) 6.348 18.452 ( -4.425 -9.059 -9.719) 14.004 18.690 ( -1.841 4.079 -2.607) 5.180 18.719 ( -0.396 3.135 -8.142) 8.734 18.966 ( -2.677 -0.957 1.324) 3.136 19.051 ( -0.377 -0.499 -0.787) 1.005 20.845 ( 6.289 4.560 16.188) 17.955 21.244 ( 0.685 0.121 1.952) 2.072 21.341 ( 1.515 -0.397 -2.580) 3.018 21.461 ( -1.708 0.769 -2.544) 3.159 ======================= Grid point 112 (44/170) ======================= q-point: ( 0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( 14.828 5.502 20.798) 26.129 1.832 ( 11.250 3.013 24.953) 27.537 2.366 ( 2.115 4.173 -15.959) 16.631 2.553 ( 2.361 7.638 -16.864) 18.662 2.838 ( 11.188 7.275 13.652) 19.091 2.965 ( -2.118 -2.623 1.917) 3.878 3.119 ( -8.575 -4.353 0.346) 9.623 3.171 ( -0.174 -3.462 -1.854) 3.931 3.391 ( 1.102 0.197 4.906) 5.033 3.583 ( -3.696 -2.112 2.311) 4.844 3.670 ( -2.745 -0.819 -1.229) 3.117 3.986 ( 3.793 -8.052 -1.053) 8.963 4.110 ( 1.819 -1.377 -3.299) 4.011 4.192 ( -2.856 5.568 -0.846) 6.314 4.457 ( -8.517 -0.032 -2.069) 8.764 4.627 ( 2.243 0.589 -2.295) 3.262 4.652 ( -3.201 2.310 -4.340) 5.867 4.733 ( 3.041 4.028 4.349) 6.663 5.024 ( -5.987 -3.004 3.124) 7.391 5.086 ( -4.227 -0.662 8.499) 9.515 5.256 ( 2.098 4.385 2.743) 5.582 5.428 ( -1.326 6.963 -3.278) 7.810 6.814 ( 4.609 -1.468 -0.105) 4.839 6.926 ( 2.783 -0.721 -4.033) 4.953 7.215 ( 1.113 5.098 6.712) 8.501 7.402 ( -1.587 1.604 0.065) 2.257 7.644 ( 3.044 0.390 3.556) 4.697 7.778 ( 2.701 -0.957 0.935) 3.014 8.126 ( 0.785 -0.020 4.564) 4.631 8.209 ( 0.855 -0.277 3.281) 3.402 8.405 ( -3.214 -0.713 -4.626) 5.678 8.465 ( 3.601 -3.958 0.202) 5.355 8.705 ( 4.690 8.690 -2.942) 10.304 8.744 ( 0.400 2.790 -3.470) 4.470 9.501 ( -0.712 0.010 0.394) 0.814 9.639 ( -2.276 -0.594 -3.686) 4.372 10.892 ( 0.478 -1.481 2.364) 2.831 10.997 ( 1.154 4.945 -3.191) 5.997 11.390 ( -8.072 -2.028 5.203) 9.815 11.454 ( -1.077 1.125 -4.515) 4.776 11.794 ( -3.495 -2.390 -2.824) 5.089 11.858 ( -8.042 -1.329 -0.677) 8.179 12.100 ( -5.850 -2.516 0.137) 6.370 12.227 ( -1.800 -0.844 -0.428) 2.034 12.716 ( 10.666 3.368 9.893) 14.933 13.086 ( 11.000 6.218 -9.122) 15.584 13.626 ( 5.321 -3.868 -0.897) 6.640 13.697 ( 0.041 -3.398 -3.634) 4.976 17.565 ( 0.122 1.389 2.152) 2.564 17.690 ( 1.466 4.382 -1.348) 4.813 17.848 ( -2.677 -2.229 8.155) 8.868 18.205 ( -7.282 -3.489 -14.060) 16.213 18.630 ( -1.569 1.530 -0.512) 2.251 18.702 ( 1.497 2.655 -1.637) 3.459 18.946 ( -1.366 0.090 0.337) 1.409 19.031 ( -1.291 1.010 -0.432) 1.695 21.104 ( 5.497 -0.500 12.379) 13.554 21.280 ( 0.734 -0.879 2.445) 2.700 21.340 ( 2.356 -0.502 -2.983) 3.834 21.405 ( -0.619 0.042 -3.736) 3.787 ======================= Grid point 113 (45/170) ======================= q-point: ( 0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( 6.381 3.523 14.536) 16.261 2.221 ( 7.262 4.504 5.735) 10.291 2.323 ( 9.743 1.038 2.478) 10.107 2.438 ( 6.902 4.827 -14.223) 16.530 2.819 ( -12.865 -1.249 0.145) 12.926 2.952 ( -3.003 -0.754 -0.376) 3.119 3.123 ( 1.128 -3.759 1.593) 4.236 3.152 ( 0.742 -3.304 -0.078) 3.387 3.327 ( -11.541 -1.600 -1.976) 11.818 3.504 ( -6.915 -3.180 -3.842) 8.525 3.626 ( -3.598 -0.223 4.156) 5.502 3.913 ( -6.372 -4.655 -5.154) 9.425 4.130 ( 4.999 -0.270 -1.829) 5.330 4.231 ( 7.267 3.864 1.357) 8.342 4.505 ( 2.483 0.900 2.734) 3.801 4.535 ( -0.702 0.822 -1.852) 2.144 4.621 ( 2.258 1.208 -2.643) 3.680 4.854 ( 7.516 4.102 0.730) 8.594 5.001 ( 0.413 -1.501 1.383) 2.082 5.129 ( 0.252 0.506 7.391) 7.413 5.267 ( -0.693 7.193 0.172) 7.229 5.440 ( 2.754 5.111 -0.066) 5.806 6.792 ( -5.878 -1.983 -0.814) 6.257 6.933 ( 2.817 0.876 -3.874) 4.869 7.334 ( 4.463 0.939 2.187) 5.058 7.384 ( -0.410 0.555 1.164) 1.353 7.732 ( 2.870 -2.372 2.296) 4.374 7.803 ( -0.972 0.098 3.909) 4.029 8.101 ( -3.984 3.189 2.430) 5.652 8.279 ( -3.891 -2.092 -6.636) 7.972 8.331 ( 2.248 -7.482 6.487) 10.154 8.468 ( 1.238 -4.369 -6.143) 7.639 8.742 ( 3.438 5.349 -0.679) 6.394 8.791 ( 4.235 7.747 2.563) 9.193 9.458 ( -3.493 1.902 -2.148) 4.520 9.577 ( -1.793 0.549 -1.693) 2.526 10.938 ( 1.686 -0.867 2.684) 3.287 11.008 ( 3.485 2.714 -1.365) 4.623 11.336 ( -5.733 -1.759 5.112) 7.880 11.412 ( 1.564 1.346 -3.957) 4.463 11.668 ( -7.351 -1.910 -2.407) 7.967 11.759 ( -4.685 1.841 -0.668) 5.077 12.013 ( -5.093 -1.268 0.304) 5.257 12.195 ( -1.229 -0.484 -1.041) 1.682 12.995 ( 10.211 3.008 9.966) 14.582 13.140 ( 8.889 5.338 -9.259) 13.901 13.667 ( 1.530 -2.762 -0.416) 3.184 13.682 ( 0.722 -2.384 -1.145) 2.741 17.589 ( 0.640 2.608 1.279) 2.974 17.700 ( 0.988 7.510 -0.501) 7.591 17.883 ( -3.995 -2.866 6.767) 8.364 17.975 ( -4.772 0.704 -8.404) 9.690 18.620 ( 0.202 -0.065 0.164) 0.268 18.710 ( 0.526 2.670 -0.010) 2.722 18.926 ( -1.165 0.894 -0.435) 1.531 19.001 ( -1.696 2.022 -0.568) 2.700 21.246 ( 2.445 -5.375 0.192) 5.908 21.326 ( 0.591 -2.572 3.597) 4.461 21.358 ( 2.266 -0.818 0.568) 2.475 21.373 ( 1.386 -0.245 -2.149) 2.569 ======================= Grid point 114 (46/170) ======================= q-point: ( 0.36 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( 0.176 1.504 3.181) 3.523 2.286 ( 2.879 5.570 -4.271) 7.586 2.446 ( 8.415 4.385 -4.232) 10.390 2.552 ( 1.282 -0.694 2.992) 3.328 2.708 ( -2.987 -3.106 8.216) 9.278 2.838 ( -6.842 -0.656 1.222) 6.981 3.090 ( 1.523 -1.299 -5.641) 5.985 3.126 ( -9.724 -2.370 -0.843) 10.044 3.188 ( -5.682 -0.289 0.649) 5.727 3.362 ( -0.136 -4.187 -2.665) 4.965 3.624 ( -4.863 -1.353 5.725) 7.633 3.765 ( -4.815 -3.210 -3.075) 6.553 4.198 ( 5.164 2.827 -2.191) 6.281 4.321 ( 5.309 4.700 -4.578) 8.440 4.415 ( -3.529 -2.578 -1.304) 4.561 4.637 ( 4.059 1.677 4.210) 6.084 4.683 ( 5.195 0.869 -2.665) 5.903 4.968 ( -3.044 -2.302 5.159) 6.417 5.032 ( 12.411 0.529 -6.164) 13.867 5.235 ( 4.219 1.286 -4.367) 6.207 5.313 ( 6.468 3.192 4.083) 8.288 5.473 ( 0.725 5.641 1.214) 5.816 6.651 ( -10.149 -1.335 0.078) 10.236 6.930 ( 1.444 2.412 -2.276) 3.617 7.341 ( -0.539 -1.957 -1.602) 2.586 7.440 ( 3.716 -0.704 -0.623) 3.833 7.752 ( 0.663 -3.509 -0.037) 3.571 7.866 ( -3.373 0.472 8.927) 9.554 8.087 ( 0.522 3.567 -0.015) 3.605 8.149 ( -4.269 -7.225 -3.622) 9.140 8.394 ( -0.225 -6.746 2.548) 7.215 8.409 ( -1.687 -6.039 -3.729) 7.295 8.770 ( 2.847 6.225 -3.059) 7.497 8.891 ( 4.130 9.371 1.268) 10.319 9.381 ( -3.258 3.804 0.110) 5.010 9.546 ( -1.418 1.821 0.521) 2.366 10.988 ( 3.388 -0.840 -0.954) 3.619 11.075 ( 3.288 -2.066 2.989) 4.900 11.328 ( -2.683 1.326 5.240) 6.034 11.382 ( -1.236 0.952 -4.363) 4.633 11.562 ( -2.297 -0.141 -0.939) 2.485 11.668 ( -4.901 4.353 -2.366) 6.969 11.961 ( -3.211 -0.747 2.423) 4.091 12.168 ( -0.436 0.093 -1.145) 1.229 13.168 ( 7.518 3.665 -7.398) 11.166 13.240 ( 6.177 2.756 8.528) 10.885 13.653 ( -0.755 -0.527 -1.898) 2.109 13.707 ( 0.041 -2.100 3.519) 4.098 17.614 ( 1.364 4.824 0.264) 5.021 17.699 ( -0.923 9.145 -0.593) 9.210 17.837 ( -0.661 -0.109 -2.510) 2.598 17.916 ( -4.737 -0.163 5.810) 7.498 18.635 ( 1.378 0.284 0.244) 1.428 18.715 ( -0.707 3.263 1.115) 3.520 18.905 ( -0.700 1.410 -0.340) 1.610 18.972 ( -1.357 1.607 0.008) 2.103 21.243 ( 2.095 -6.824 -4.525) 8.451 21.350 ( 1.088 -2.889 -0.520) 3.130 21.377 ( 1.207 -0.649 -0.541) 1.474 21.414 ( 0.270 -4.416 1.837) 4.791 ======================= Grid point 115 (47/170) ======================= q-point: ( 0.45 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( -6.869 3.084 1.898) 7.765 2.308 ( 5.732 -2.007 -0.254) 6.079 2.511 ( 5.919 5.351 -5.412) 9.641 2.582 ( -3.013 1.392 5.917) 6.784 2.776 ( 4.934 -2.205 -0.968) 5.491 2.822 ( -1.521 -0.418 6.157) 6.356 2.895 ( -12.631 1.439 -4.000) 13.327 3.057 ( -0.764 -4.072 -1.464) 4.394 3.173 ( 4.106 -0.389 -0.069) 4.125 3.394 ( 2.037 -3.690 0.330) 4.228 3.573 ( -7.666 -1.167 2.832) 8.255 3.732 ( 1.104 -2.650 2.721) 3.956 4.223 ( 3.916 4.838 -5.869) 8.555 4.346 ( 2.883 0.775 -4.960) 5.788 4.379 ( 0.054 0.797 2.650) 2.767 4.712 ( 1.871 2.416 -0.498) 3.097 4.722 ( 0.157 3.221 0.955) 3.363 4.900 ( -5.895 -1.832 0.163) 6.175 5.145 ( 8.033 -2.396 -9.955) 13.014 5.281 ( 9.093 -0.398 -2.402) 9.413 5.380 ( -1.684 -1.600 -2.715) 3.573 5.486 ( -0.428 4.211 0.406) 4.252 6.528 ( -5.334 0.466 2.231) 5.801 6.929 ( 0.198 2.897 -0.513) 2.948 7.315 ( 0.367 -2.844 -2.255) 3.648 7.461 ( 1.985 -0.562 -4.025) 4.523 7.787 ( 0.864 -3.056 3.933) 5.055 7.866 ( -6.072 -3.527 5.920) 9.184 8.053 ( 0.169 -5.407 -3.208) 6.290 8.149 ( 1.410 -1.210 3.713) 4.152 8.315 ( -3.254 -6.314 -5.082) 8.734 8.409 ( 0.707 -4.572 -0.148) 4.629 8.776 ( 3.094 6.952 -4.254) 8.718 8.915 ( -0.121 10.005 -3.212) 10.509 9.385 ( -0.141 4.352 5.321) 6.875 9.544 ( -0.783 2.551 2.241) 3.485 11.030 ( 3.767 -3.951 -1.519) 5.666 11.128 ( -2.736 -6.131 2.178) 7.058 11.308 ( -0.297 3.091 -1.878) 3.629 11.354 ( -1.121 5.111 4.084) 6.637 11.555 ( -0.433 4.828 -1.813) 5.175 11.575 ( -0.145 2.540 -2.764) 3.757 11.959 ( -2.166 -0.225 4.294) 4.814 12.161 ( 0.773 0.440 -0.601) 1.073 13.214 ( 6.713 1.597 -4.174) 8.065 13.335 ( -3.448 1.301 2.623) 4.523 13.654 ( 2.082 0.842 2.347) 3.249 13.743 ( -1.679 0.057 4.897) 5.177 17.636 ( 1.658 6.265 -0.935) 6.548 17.661 ( -1.779 6.218 -1.167) 6.572 17.857 ( 2.139 3.194 2.844) 4.782 17.892 ( -4.994 1.577 3.796) 6.468 18.664 ( 1.580 1.288 0.509) 2.101 18.706 ( -1.985 3.713 0.949) 4.316 18.905 ( 0.339 1.115 1.118) 1.615 18.968 ( -0.219 0.839 1.656) 1.870 21.234 ( 3.124 -7.827 -4.305) 9.463 21.347 ( -0.729 -6.298 -2.434) 6.791 21.382 ( 0.492 -1.046 -0.850) 1.435 21.408 ( -0.400 -3.022 -1.130) 3.251 ======================= Grid point 116 (48/170) ======================= q-point: (-0.45 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( -6.337 3.027 0.448) 7.038 2.403 ( -6.470 -3.590 -6.449) 9.815 2.467 ( 6.803 -1.993 2.953) 7.679 2.593 ( -3.859 4.553 4.019) 7.196 2.676 ( -5.566 4.088 -0.014) 6.906 2.896 ( 6.897 -0.068 0.058) 6.898 2.935 ( 8.473 1.207 3.391) 9.206 3.057 ( 1.247 -6.197 1.574) 6.515 3.263 ( 6.478 -0.182 -0.536) 6.503 3.410 ( 0.511 -2.672 -0.777) 2.829 3.470 ( -5.968 -0.408 0.676) 6.021 3.831 ( 4.471 -3.309 5.234) 7.637 4.195 ( 3.727 4.675 -9.962) 11.619 4.288 ( -1.236 -4.243 -5.553) 7.097 4.478 ( 5.622 4.117 3.553) 7.822 4.622 ( -12.032 5.812 -0.355) 13.367 4.695 ( -1.060 0.691 -6.741) 6.859 4.858 ( -0.019 -3.316 2.065) 3.906 5.121 ( -4.925 -2.629 -3.296) 6.483 5.214 ( -4.893 2.703 -6.812) 8.812 5.363 ( 0.804 1.357 0.412) 1.630 5.476 ( -0.519 2.411 -2.159) 3.278 6.562 ( 5.122 1.272 3.710) 6.452 6.923 ( 1.263 1.200 -2.545) 3.084 7.309 ( 1.754 -2.724 -2.297) 3.972 7.412 ( -1.149 0.966 -5.328) 5.536 7.813 ( -5.920 -5.987 3.035) 8.950 7.852 ( -0.367 -6.403 5.041) 8.157 8.057 ( 1.046 -3.177 1.391) 3.622 8.180 ( -0.986 -11.113 -3.619) 11.729 8.278 ( 3.175 3.008 4.002) 5.928 8.423 ( 2.740 -2.911 -1.674) 4.334 8.770 ( 1.812 7.537 -4.797) 9.116 8.823 ( -3.086 8.047 -6.974) 11.087 9.470 ( 1.605 4.321 6.670) 8.108 9.569 ( 0.368 2.285 2.734) 3.582 11.030 ( -5.749 -5.062 -1.312) 7.771 11.086 ( 2.190 -6.053 0.171) 6.439 11.286 ( -5.150 6.973 2.038) 8.905 11.423 ( 6.618 2.854 1.330) 7.329 11.514 ( -0.281 3.418 -1.560) 3.767 11.597 ( 4.224 5.218 -2.619) 7.206 11.980 ( -1.197 0.158 4.334) 4.499 12.177 ( 1.604 0.438 -0.045) 1.664 13.194 ( -9.872 -0.496 -2.413) 10.174 13.316 ( 5.708 0.471 0.584) 5.757 13.730 ( -0.995 0.805 4.687) 4.859 13.766 ( -0.342 2.282 5.025) 5.529 17.614 ( -2.072 4.267 -0.965) 4.841 17.654 ( 1.602 4.766 -1.429) 5.227 17.851 ( -3.959 4.983 2.298) 6.767 17.957 ( 4.857 4.342 5.286) 8.390 18.664 ( -2.714 1.399 0.434) 3.085 18.709 ( 1.735 3.581 0.813) 4.062 18.938 ( 0.580 0.588 3.098) 3.207 18.994 ( 0.304 1.007 2.492) 2.705 21.245 ( 1.394 -7.909 -4.975) 9.447 21.250 ( -1.751 -8.330 -6.093) 10.468 21.379 ( -0.286 -0.795 -0.746) 1.127 21.400 ( 0.423 -1.887 -0.351) 1.965 ======================= Grid point 117 (49/170) ======================= q-point: (-0.36 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.924 ( -16.287 4.519 -5.171) 17.675 2.087 ( -18.912 -2.752 -9.261) 21.237 2.571 ( -0.071 4.048 6.318) 7.503 2.657 ( 10.416 0.270 0.610) 10.438 2.764 ( 5.657 1.692 7.989) 9.934 2.955 ( 1.625 -0.371 -3.654) 4.016 3.076 ( 0.388 -4.183 6.159) 7.456 3.155 ( 8.363 -2.042 0.611) 8.631 3.327 ( 6.396 1.088 -8.661) 10.822 3.367 ( -5.378 0.075 5.197) 7.479 3.483 ( 5.346 -1.161 -1.385) 5.643 3.948 ( 4.522 -4.157 1.013) 6.226 4.130 ( -0.143 -0.427 -6.516) 6.532 4.198 ( 3.013 0.871 -12.362) 12.754 4.377 ( -12.866 0.142 -0.276) 12.870 4.554 ( -2.966 1.395 -4.318) 5.421 4.615 ( 1.057 0.704 -0.142) 1.278 4.819 ( -8.629 -2.707 -0.173) 9.045 4.997 ( -0.483 3.162 4.153) 5.242 5.188 ( -1.516 3.002 0.650) 3.426 5.352 ( -3.173 7.524 3.818) 9.014 5.408 ( -1.051 3.767 -5.849) 7.036 6.717 ( 7.594 0.336 3.057) 8.193 6.920 ( 2.882 -1.395 -3.626) 4.837 7.283 ( -2.338 0.097 -3.745) 4.416 7.355 ( 0.632 0.641 -1.677) 1.903 7.738 ( -5.327 -8.306 0.443) 9.877 7.894 ( -2.122 -4.968 5.162) 7.472 8.063 ( -3.191 0.209 2.287) 3.931 8.168 ( 4.357 -10.516 -2.115) 11.577 8.351 ( 1.103 1.514 -1.077) 2.161 8.480 ( 2.546 0.901 2.140) 3.446 8.654 ( -1.888 3.436 -8.383) 9.254 8.780 ( 2.711 5.253 -3.798) 7.026 9.553 ( 0.164 3.435 4.601) 5.744 9.613 ( 1.831 1.131 2.205) 3.082 10.927 ( -4.623 -3.622 -1.056) 5.967 11.129 ( 0.712 -1.911 1.973) 2.837 11.224 ( -3.612 3.806 1.214) 5.386 11.501 ( 0.388 2.656 -0.814) 2.804 11.557 ( 8.201 2.507 0.752) 8.608 11.649 ( 6.210 5.026 -2.529) 8.380 12.019 ( 0.779 0.258 3.421) 3.518 12.203 ( 1.516 0.150 0.032) 1.524 12.965 ( -13.573 -0.163 -3.766) 14.087 13.432 ( 3.480 -0.376 5.117) 6.200 13.709 ( -4.077 1.458 1.597) 4.615 13.836 ( -0.072 0.600 5.601) 5.633 17.567 ( -2.296 3.271 -1.068) 4.136 17.662 ( 1.376 2.359 -1.354) 3.048 17.825 ( -2.696 8.213 2.457) 8.987 18.130 ( 8.900 2.408 6.077) 11.042 18.626 ( -1.921 0.199 -0.063) 1.933 18.751 ( 1.674 4.956 1.825) 5.540 18.981 ( -0.369 0.226 4.090) 4.112 19.022 ( 0.010 1.378 1.720) 2.204 21.065 ( -6.286 -6.251 -10.291) 13.583 21.266 ( 2.092 -6.949 -1.932) 7.510 21.360 ( 0.319 -1.524 -1.925) 2.476 21.406 ( 0.174 -2.374 0.273) 2.396 ======================= Grid point 118 (50/170) ======================= q-point: (-0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -23.731 4.559 -8.370) 25.573 1.653 ( -24.947 5.485 -5.184) 26.064 2.730 ( -6.609 9.893 -2.215) 12.102 2.737 ( 8.041 3.082 7.982) 11.741 2.886 ( -2.668 0.088 -2.423) 3.606 2.937 ( -4.448 -5.213 3.494) 7.692 3.051 ( -0.793 2.112 2.479) 3.352 3.172 ( 0.354 -5.300 1.795) 5.607 3.300 ( 3.465 0.519 -7.741) 8.498 3.433 ( 5.310 -1.551 1.255) 5.673 3.527 ( 4.345 0.472 -4.916) 6.578 3.950 ( 1.152 -3.038 -6.107) 6.918 4.120 ( 4.943 -2.426 -2.550) 6.068 4.149 ( 3.265 -0.319 -7.313) 8.015 4.307 ( 0.404 -4.118 3.220) 5.243 4.426 ( -4.746 -0.268 -4.347) 6.441 4.621 ( 0.929 3.793 4.194) 5.731 4.759 ( 0.964 -4.037 -1.625) 4.457 5.012 ( -5.992 6.886 -0.711) 9.156 5.196 ( 1.438 3.539 4.341) 5.782 5.245 ( -6.702 2.080 -1.157) 7.112 5.475 ( 6.286 12.306 4.694) 14.594 6.833 ( 4.500 -0.882 0.774) 4.650 6.936 ( 2.689 -2.496 -1.408) 3.930 7.186 ( -6.005 2.380 -0.574) 6.485 7.364 ( 1.312 0.461 -0.753) 1.581 7.665 ( -4.934 -6.286 0.803) 8.031 7.879 ( -5.578 -1.992 3.227) 6.745 8.066 ( 1.192 -2.661 0.807) 3.026 8.190 ( -2.969 -1.741 -0.250) 3.450 8.281 ( -2.452 0.454 -5.629) 6.157 8.485 ( 3.432 6.663 -4.178) 8.581 8.628 ( -0.010 -3.992 -0.104) 3.994 8.810 ( 5.871 0.114 -2.560) 6.406 9.561 ( -3.533 1.636 1.892) 4.328 9.676 ( 3.663 -0.425 1.457) 3.965 10.872 ( -1.414 -2.345 -0.402) 2.768 11.140 ( -1.944 8.857 3.354) 9.668 11.220 ( 0.820 -4.102 0.763) 4.253 11.514 ( 1.963 2.085 -0.149) 2.868 11.686 ( 9.280 1.676 -2.098) 9.660 11.744 ( 7.592 2.831 -0.212) 8.105 12.079 ( 2.590 -0.396 2.601) 3.692 12.220 ( 0.843 0.046 -0.464) 0.963 12.706 ( -13.963 -0.078 -3.052) 14.293 13.472 ( -8.135 3.851 5.792) 10.703 13.690 ( 2.322 -3.396 -0.463) 4.139 13.877 ( -2.127 -2.355 4.978) 5.903 17.527 ( -1.512 2.860 -0.432) 3.264 17.670 ( 1.236 1.091 -0.843) 1.852 17.815 ( -2.516 8.913 2.813) 9.679 18.349 ( 10.429 -3.213 4.113) 11.662 18.613 ( 0.815 1.891 -0.068) 2.061 18.803 ( 1.973 5.945 2.671) 6.810 19.017 ( -1.222 -0.068 4.986) 5.135 19.029 ( 0.029 1.951 -0.286) 1.972 20.833 ( -8.745 -2.832 -9.804) 13.439 21.259 ( -1.057 -3.066 -0.687) 3.315 21.359 ( 2.620 -4.137 -2.477) 5.488 21.407 ( -0.260 -2.957 -0.007) 2.968 ======================= Grid point 119 (51/170) ======================= q-point: (-0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.063 ( -24.635 11.127 -1.154) 27.056 1.227 ( -26.702 15.590 4.232) 31.208 2.188 ( -43.452 24.998 -2.177) 50.177 2.795 ( -5.144 0.118 -0.208) 5.149 2.940 ( 1.637 -3.360 2.379) 4.430 3.010 ( 11.876 0.067 2.595) 12.156 3.167 ( 3.285 -6.425 2.264) 7.563 3.233 ( 3.845 1.368 0.167) 4.085 3.294 ( 5.280 -2.531 -2.976) 6.568 3.493 ( 5.065 -2.876 -3.773) 6.940 3.563 ( 6.899 -1.164 -1.714) 7.203 3.855 ( -5.349 -0.368 -4.855) 7.233 4.105 ( 0.629 -1.115 -4.896) 5.060 4.166 ( 4.865 -3.619 -3.883) 7.200 4.329 ( -1.018 1.546 -3.634) 4.079 4.398 ( 2.471 -4.526 5.735) 7.712 4.718 ( -0.369 -0.569 0.640) 0.933 4.833 ( 10.125 -0.140 2.515) 10.433 4.878 ( -5.025 11.711 -0.424) 12.751 5.075 ( -6.964 -0.854 -1.769) 7.235 5.334 ( 2.743 1.831 2.424) 4.093 5.633 ( 7.071 11.735 3.406) 14.118 6.882 ( 3.763 -1.189 -4.172) 5.742 6.968 ( 1.006 -2.151 1.077) 2.607 7.105 ( -5.480 2.636 4.443) 7.532 7.372 ( 0.329 1.064 0.005) 1.113 7.594 ( -6.013 -2.156 1.643) 6.595 7.820 ( -6.334 -2.560 4.667) 8.273 8.017 ( -8.038 4.402 -1.539) 9.293 8.121 ( 0.556 -2.663 -3.955) 4.800 8.221 ( -1.827 0.680 -1.699) 2.586 8.535 ( 7.364 3.498 -2.134) 8.427 8.593 ( -3.456 0.275 -0.300) 3.480 8.878 ( 4.703 -3.765 -1.616) 6.238 9.509 ( -3.550 0.491 0.746) 3.661 9.757 ( 4.863 -2.343 0.481) 5.420 10.864 ( 0.485 -1.314 -0.049) 1.402 11.177 ( 2.819 12.592 2.681) 13.179 11.237 ( 0.013 -3.101 0.752) 3.191 11.554 ( 2.990 1.587 -0.196) 3.391 11.810 ( 9.501 -0.900 -2.399) 9.841 11.871 ( 8.579 1.226 0.036) 8.666 12.153 ( 2.972 -1.429 2.253) 3.994 12.217 ( 0.389 0.139 -1.798) 1.844 12.481 ( -11.738 0.023 -0.028) 11.738 13.331 ( -12.928 5.654 1.285) 14.169 13.714 ( -2.690 -9.384 0.576) 9.779 13.885 ( -1.304 -5.664 1.846) 6.098 17.513 ( -0.586 2.793 0.735) 2.947 17.684 ( 1.217 0.746 -0.073) 1.430 17.801 ( -3.024 6.654 2.142) 7.616 18.493 ( 4.093 -8.738 0.452) 9.660 18.669 ( 6.791 6.349 -0.854) 9.336 18.867 ( 2.343 3.452 1.734) 4.518 19.004 ( -0.347 2.147 -2.857) 3.591 19.084 ( 2.109 0.757 5.312) 5.765 20.596 ( -9.852 2.252 -4.871) 11.219 21.231 ( -1.536 -0.722 -0.085) 1.699 21.382 ( 2.502 -3.854 -0.589) 4.633 21.396 ( -0.657 -3.928 -0.803) 4.063 ======================= Grid point 120 (52/170) ======================= q-point: (-0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( -11.098 26.328 14.786) 32.171 0.978 ( -19.509 24.045 18.478) 36.058 1.566 ( -39.056 34.944 18.896) 55.710 2.715 ( -4.312 1.443 -0.947) 4.645 2.945 ( 0.023 -0.214 -4.415) 4.420 3.131 ( 5.528 -0.990 -6.298) 8.438 3.224 ( 1.172 -8.994 2.428) 9.390 3.282 ( 4.733 2.222 -0.124) 5.230 3.360 ( 4.169 -0.522 -2.121) 4.706 3.555 ( 4.478 -5.813 0.066) 7.338 3.663 ( -0.062 -4.542 -0.869) 4.624 3.810 ( 9.301 0.542 5.528) 10.833 4.055 ( -1.024 -1.857 -4.039) 4.562 4.206 ( 0.405 -3.353 6.467) 7.296 4.303 ( 3.382 3.488 -5.155) 7.084 4.508 ( 5.409 -2.136 3.071) 6.577 4.663 ( -3.733 11.411 1.359) 12.083 4.860 ( 2.114 6.680 3.101) 7.662 5.002 ( -5.366 -0.715 6.374) 8.363 5.031 ( 6.160 -1.708 0.535) 6.415 5.248 ( -8.517 -8.972 -10.556) 16.263 5.732 ( 3.555 8.793 -2.431) 9.791 6.844 ( 2.418 0.474 -11.417) 11.680 6.959 ( -1.169 -1.901 -1.339) 2.602 7.170 ( 2.411 2.804 9.691) 10.373 7.381 ( 0.202 0.635 1.336) 1.493 7.521 ( -4.841 3.571 2.287) 6.436 7.783 ( -9.971 -7.237 4.474) 13.108 7.869 ( -5.892 5.088 -1.070) 7.858 8.061 ( -0.496 0.883 0.243) 1.042 8.219 ( 0.730 1.953 2.420) 3.194 8.530 ( -3.452 2.046 -0.564) 4.052 8.655 ( 7.479 5.676 0.364) 9.395 8.912 ( -0.354 -4.560 1.558) 4.831 9.508 ( 3.405 0.445 -0.665) 3.498 9.820 ( 3.356 -4.103 -1.905) 5.633 10.880 ( 1.481 0.132 -0.702) 1.645 11.203 ( 0.447 5.449 -5.472) 7.735 11.334 ( 10.459 6.215 4.676) 13.034 11.590 ( 1.802 1.773 -0.896) 2.683 11.925 ( 6.890 -4.001 -1.168) 8.053 12.003 ( 8.387 0.897 -1.783) 8.621 12.188 ( 0.487 -0.743 -0.226) 0.917 12.228 ( 1.974 -2.467 1.069) 3.336 12.347 ( -7.978 0.482 3.375) 8.676 13.132 ( -10.561 6.112 -2.135) 12.387 13.532 ( -20.418 -16.070 -0.263) 25.985 13.877 ( 0.922 -4.071 -3.387) 5.375 17.517 ( -0.351 2.625 0.877) 2.790 17.707 ( 1.034 0.873 0.981) 1.672 17.753 ( -3.998 2.837 -0.801) 4.968 18.528 ( 1.124 -7.800 0.020) 7.881 18.761 ( 8.108 3.885 -7.120) 11.468 18.900 ( -0.075 0.600 0.192) 0.635 18.973 ( 2.691 4.056 -2.747) 5.589 19.150 ( 1.076 -2.409 -1.845) 3.220 20.472 ( -5.029 8.068 6.392) 11.455 21.215 ( -0.813 0.269 0.547) 1.016 21.370 ( -1.079 -2.028 -0.876) 2.459 21.438 ( 2.577 -3.078 3.621) 5.406 ======================= Grid point 121 (53/170) ======================= q-point: ( 0.00 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( -7.579 25.054 11.232) 28.484 1.463 ( -2.987 26.521 13.706) 30.003 2.298 ( 3.268 29.058 26.929) 39.752 2.674 ( 0.277 1.340 -6.958) 7.091 2.881 ( -0.943 2.611 -8.577) 9.015 2.999 ( 0.696 -10.064 -3.543) 10.692 3.089 ( -0.187 -3.082 -3.732) 4.844 3.307 ( -0.654 -3.712 -2.923) 4.769 3.354 ( -0.581 0.692 -3.128) 3.256 3.502 ( 3.985 -6.267 -1.194) 7.522 3.592 ( -0.026 -2.880 3.127) 4.251 3.805 ( 0.367 -8.055 -3.104) 8.640 4.121 ( 4.128 -3.010 13.849) 14.762 4.347 ( 1.045 1.544 11.805) 11.952 4.415 ( 1.809 9.436 -3.836) 10.345 4.575 ( 4.505 -6.110 -8.864) 11.671 4.773 ( -4.492 4.050 -2.189) 6.432 4.883 ( 1.492 -0.859 12.915) 13.029 4.972 ( -4.003 7.048 -0.913) 8.157 5.050 ( -2.486 1.827 0.655) 3.154 5.184 ( 1.062 10.381 3.992) 11.173 5.770 ( -1.993 2.141 -6.820) 7.421 6.726 ( 1.638 -2.121 -9.386) 9.761 6.875 ( 0.997 -3.800 -2.340) 4.572 7.342 ( -1.966 3.252 8.091) 8.939 7.473 ( 2.158 3.276 3.889) 5.524 7.580 ( -4.045 5.713 1.515) 7.162 7.648 ( -1.137 1.537 1.374) 2.354 7.938 ( 1.077 4.024 3.389) 5.370 8.129 ( 1.127 -2.029 3.746) 4.407 8.355 ( 2.210 3.389 -0.399) 4.065 8.452 ( -2.910 0.893 2.020) 3.653 8.802 ( 4.777 -3.628 -0.923) 6.069 8.956 ( -1.731 9.044 -2.812) 9.628 9.503 ( -0.306 -1.922 -0.251) 1.963 9.715 ( 0.254 -5.176 -3.444) 6.222 10.882 ( -0.103 0.930 -2.667) 2.827 11.198 ( -1.330 0.122 1.292) 1.858 11.511 ( 3.056 0.378 -1.134) 3.282 11.601 ( -1.299 1.374 -4.525) 4.904 11.829 ( -2.885 -2.638 -5.756) 6.958 12.034 ( 3.993 -3.305 -5.008) 7.207 12.154 ( -3.177 -4.906 1.166) 5.960 12.205 ( 0.712 -3.838 0.286) 3.914 12.392 ( -0.905 7.831 9.400) 12.268 13.138 ( -0.378 7.557 -4.591) 8.850 13.262 ( 0.852 -3.106 5.089) 6.022 13.729 ( -0.474 -7.163 -4.673) 8.566 17.573 ( -1.073 3.624 0.289) 3.791 17.719 ( -2.165 1.612 -0.829) 2.824 17.765 ( 0.919 1.796 1.965) 2.817 18.351 ( 0.584 -10.649 -3.827) 11.331 18.783 ( 2.599 1.232 -7.338) 7.881 18.865 ( -1.267 0.195 -5.222) 5.377 18.960 ( -2.125 -2.402 1.106) 3.392 19.036 ( -0.266 -2.974 -3.568) 4.652 20.793 ( 1.575 12.278 12.269) 17.429 21.233 ( 0.059 0.940 1.206) 1.530 21.334 ( 0.462 -0.957 -0.607) 1.224 21.486 ( 0.312 -0.747 2.507) 2.634 ======================= Grid point 122 (54/170) ======================= q-point: ( 0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.529 ( 2.502 17.307 16.466) 24.019 1.682 ( 3.749 17.533 19.198) 26.268 2.564 ( 1.541 2.212 -13.044) 13.319 2.677 ( 7.167 9.671 11.553) 16.684 2.831 ( 4.568 9.292 0.256) 10.357 2.938 ( -1.740 -2.954 -4.528) 5.680 3.050 ( -2.105 -6.967 -0.849) 7.327 3.216 ( -5.802 -7.173 -4.783) 10.392 3.330 ( 0.758 2.413 1.936) 3.185 3.531 ( 1.200 -5.123 -1.566) 5.490 3.640 ( 1.018 -3.938 3.519) 5.379 3.778 ( 1.793 -5.440 -3.539) 6.732 4.197 ( -6.003 3.314 5.784) 8.971 4.375 ( -2.494 6.917 1.847) 7.582 4.508 ( -0.224 3.785 5.094) 6.350 4.581 ( 4.233 -4.526 6.080) 8.681 4.746 ( -2.150 3.759 -4.993) 6.609 4.882 ( -1.146 4.800 -5.397) 7.313 4.984 ( -8.443 -3.100 6.803) 11.277 5.051 ( 4.710 4.336 4.029) 7.564 5.257 ( 1.924 8.101 5.817) 10.157 5.644 ( -3.104 3.106 -7.464) 8.660 6.703 ( 5.982 -1.755 -4.801) 7.868 6.884 ( 3.459 -3.205 -2.948) 5.561 7.334 ( -6.484 6.905 5.983) 11.204 7.479 ( -4.714 3.193 2.212) 6.108 7.600 ( 2.215 3.629 3.733) 5.658 7.701 ( 3.219 0.627 2.041) 3.863 8.030 ( 4.113 3.098 3.457) 6.202 8.167 ( -1.579 -5.273 3.181) 6.357 8.387 ( 0.481 -6.347 -1.152) 6.469 8.444 ( 0.862 8.238 2.879) 8.769 8.817 ( -1.239 -3.331 -2.163) 4.160 8.890 ( -0.062 10.003 -4.713) 11.058 9.493 ( -0.245 -0.235 0.648) 0.732 9.671 ( -0.607 -3.446 -3.672) 5.072 10.863 ( -0.007 1.116 0.195) 1.133 11.169 ( -0.109 5.885 -3.649) 6.925 11.428 ( -11.379 -2.685 3.453) 12.190 11.559 ( -0.104 2.015 -4.615) 5.037 11.762 ( 2.996 -2.850 -4.898) 6.410 11.984 ( -4.099 -0.658 -5.480) 6.875 12.086 ( -4.941 -6.112 2.019) 8.115 12.206 ( -0.733 -4.299 -0.176) 4.365 12.556 ( 6.540 6.488 10.237) 13.772 13.152 ( 8.556 7.664 -6.453) 13.175 13.402 ( 8.250 -5.442 2.621) 10.225 13.662 ( -0.076 -6.113 -5.687) 8.349 17.575 ( 0.132 2.702 1.741) 3.217 17.711 ( 1.649 1.005 -0.296) 1.954 17.804 ( 1.006 2.244 2.215) 3.310 18.278 ( -1.721 -8.879 -7.996) 12.072 18.747 ( 2.208 1.392 -5.387) 5.986 18.764 ( -2.653 2.142 -6.021) 6.920 18.948 ( -0.968 -0.973 1.220) 1.836 19.020 ( 1.140 -2.645 -1.100) 3.083 20.966 ( 1.314 7.765 13.641) 15.751 21.249 ( -0.298 0.422 1.877) 1.946 21.330 ( 0.562 -0.714 -1.345) 1.623 21.468 ( -3.931 -0.189 0.383) 3.955 ======================= Grid point 123 (55/170) ======================= q-point: ( 0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 10.686 6.190 19.691) 23.243 1.968 ( 5.388 10.045 18.088) 21.380 2.455 ( 3.491 4.978 -11.521) 13.027 2.688 ( 0.568 6.016 -11.736) 13.200 2.891 ( -0.055 -5.664 1.041) 5.759 2.951 ( -5.741 -2.914 -1.544) 6.621 3.005 ( 3.229 -3.518 0.656) 4.820 3.077 ( -3.783 -3.968 -2.810) 6.160 3.393 ( 0.119 0.095 3.010) 3.014 3.511 ( -1.267 -4.639 -1.099) 4.932 3.640 ( -2.644 -2.099 -1.262) 3.605 3.812 ( 3.071 -9.255 -0.216) 9.754 4.203 ( -2.110 10.354 1.963) 10.748 4.328 ( -4.300 7.916 4.029) 9.868 4.481 ( -4.261 3.656 1.189) 5.739 4.657 ( 1.324 1.085 -1.300) 2.150 4.664 ( -5.307 0.786 2.917) 6.107 4.861 ( 1.774 8.953 2.103) 9.366 4.953 ( -2.128 -3.844 4.064) 5.985 5.126 ( 2.916 5.138 -0.469) 5.926 5.363 ( 2.330 5.454 4.505) 7.448 5.533 ( -1.113 3.874 -5.005) 6.426 6.775 ( 4.421 -2.525 -0.828) 5.159 6.900 ( 2.662 -2.322 -2.793) 4.503 7.329 ( -0.983 6.412 4.522) 7.907 7.430 ( -3.515 1.225 0.308) 3.735 7.660 ( -0.461 1.297 4.613) 4.814 7.759 ( 0.821 -0.885 2.246) 2.550 8.088 ( -2.793 -4.570 4.386) 6.923 8.161 ( -2.324 -6.430 1.318) 6.963 8.381 ( 0.934 -0.563 -2.312) 2.557 8.480 ( 1.051 6.115 -0.785) 6.254 8.772 ( -0.060 -0.016 0.077) 0.099 8.873 ( 3.160 7.817 -2.754) 8.870 9.512 ( 1.393 1.199 -0.049) 1.838 9.623 ( -0.709 -1.104 -2.851) 3.139 10.882 ( -0.192 0.773 3.178) 3.276 11.127 ( 1.987 8.627 -6.507) 10.987 11.316 ( -9.474 -5.433 7.114) 13.034 11.489 ( -0.319 2.554 -5.309) 5.900 11.767 ( 1.389 -0.201 -4.536) 4.748 11.833 ( -6.682 -1.177 -2.223) 7.140 12.038 ( -3.849 -3.899 0.655) 5.517 12.187 ( -0.690 -3.468 -0.688) 3.603 12.802 ( 9.281 5.456 10.999) 15.391 13.221 ( 9.485 7.152 -8.153) 14.408 13.522 ( 4.733 -6.823 -0.102) 8.304 13.628 ( 3.355 -3.389 -4.380) 6.476 17.610 ( 1.163 3.012 2.443) 4.049 17.757 ( 2.344 0.740 2.418) 3.448 17.841 ( 1.463 3.498 0.812) 3.877 18.138 ( -2.459 -2.977 -9.942) 10.665 18.675 ( -2.074 2.594 -2.857) 4.381 18.735 ( 1.957 0.938 -2.870) 3.599 18.949 ( -0.461 0.046 0.662) 0.808 19.033 ( 1.213 -1.082 -0.451) 1.687 21.108 ( -0.546 1.203 9.909) 9.997 21.261 ( -1.415 -0.988 2.556) 3.084 21.326 ( 1.035 -0.929 -1.387) 1.964 21.397 ( -3.647 -0.944 -1.278) 3.978 ======================= Grid point 124 (56/170) ======================= q-point: ( 0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( 3.031 4.984 11.793) 13.157 2.241 ( 8.441 -1.297 18.520) 20.394 2.443 ( 6.709 9.238 -5.240) 12.562 2.546 ( 1.464 6.576 -13.511) 15.098 2.776 ( -11.006 -3.064 0.199) 11.427 2.880 ( -3.999 -7.521 -0.547) 8.535 3.018 ( 1.594 -10.167 -4.637) 11.287 3.084 ( 4.580 0.388 0.991) 4.702 3.299 ( -11.032 -1.085 -3.256) 11.554 3.468 ( -3.002 -0.419 -2.835) 4.150 3.574 ( -3.210 -4.432 0.178) 5.475 3.787 ( -3.744 -8.175 -2.561) 9.349 4.186 ( 2.521 5.362 1.706) 6.165 4.341 ( 2.212 7.598 -1.026) 7.979 4.545 ( 0.298 3.590 0.553) 3.644 4.575 ( 1.019 2.355 -0.169) 2.572 4.644 ( -1.221 2.461 -0.452) 2.784 4.927 ( -2.308 2.437 7.949) 8.629 5.017 ( 2.455 2.942 2.585) 4.622 5.184 ( 6.472 5.032 0.672) 8.225 5.375 ( -0.464 4.008 -2.668) 4.837 5.532 ( 2.029 3.998 1.094) 4.615 6.754 ( -4.503 -1.859 -2.051) 5.286 6.931 ( 3.015 -1.418 -0.518) 3.372 7.367 ( -0.715 1.745 -2.727) 3.315 7.377 ( -0.298 -0.674 1.391) 1.574 7.685 ( -1.042 -1.551 1.798) 2.593 7.801 ( -0.823 -1.089 6.882) 7.016 8.054 ( -5.648 -9.240 -0.275) 10.833 8.120 ( -4.762 -11.018 4.042) 12.666 8.337 ( -0.738 5.580 -4.428) 7.162 8.473 ( -0.442 6.024 -0.590) 6.069 8.833 ( 6.147 3.712 -0.983) 7.248 8.931 ( 4.734 6.036 2.126) 7.960 9.508 ( -0.525 3.021 -2.253) 3.805 9.592 ( -0.267 0.943 -1.288) 1.618 10.923 ( -0.239 -0.365 4.815) 4.835 11.079 ( 0.012 3.996 -5.108) 6.485 11.296 ( -2.819 -1.595 6.482) 7.246 11.452 ( 2.439 2.694 -5.138) 6.293 11.649 ( -6.165 0.027 -2.905) 6.815 11.794 ( -0.024 1.851 -1.257) 2.238 11.979 ( -3.966 -2.256 0.313) 4.573 12.172 ( -0.124 -2.064 -0.890) 2.251 13.071 ( 8.889 4.764 10.821) 14.792 13.259 ( 7.002 6.439 -8.151) 12.527 13.580 ( 3.423 -5.269 0.870) 6.343 13.645 ( 3.058 -1.962 -3.532) 5.067 17.663 ( 2.128 4.264 2.424) 5.347 17.817 ( -1.313 -1.708 5.109) 5.545 17.874 ( 3.982 8.323 -1.403) 9.332 18.008 ( -1.551 3.300 -6.986) 7.880 18.641 ( 0.062 1.903 -0.567) 1.987 18.742 ( 1.445 0.804 -0.804) 1.839 18.944 ( -0.676 0.955 0.243) 1.195 19.039 ( -0.135 1.293 -0.473) 1.383 21.145 ( -2.053 -4.753 0.584) 5.210 21.260 ( -3.314 -4.241 3.969) 6.687 21.334 ( 1.064 -1.621 -0.529) 2.010 21.348 ( -0.590 -2.050 -1.061) 2.382 ======================= Grid point 125 (57/170) ======================= q-point: ( 0.36 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( -2.928 1.833 4.181) 5.423 2.406 ( -2.238 5.566 -7.092) 9.289 2.531 ( 5.906 0.237 7.673) 9.686 2.549 ( 4.737 2.555 0.176) 5.385 2.661 ( -1.511 0.520 2.254) 2.763 2.806 ( -3.931 -2.865 1.177) 5.005 2.986 ( -0.622 -8.212 -3.446) 8.928 3.098 ( -6.870 -0.814 -2.590) 7.387 3.161 ( -0.435 -1.403 2.276) 2.709 3.347 ( -2.294 2.120 -5.988) 6.753 3.557 ( -3.258 -5.018 3.429) 6.895 3.695 ( -3.371 -4.190 -1.506) 5.585 4.288 ( 4.165 5.163 3.609) 7.551 4.368 ( 4.019 0.557 -6.432) 7.605 4.464 ( 0.392 7.515 -2.942) 8.080 4.651 ( 4.152 0.545 -0.237) 4.194 4.682 ( 3.978 -0.651 0.905) 4.131 4.952 ( -3.321 -0.049 3.243) 4.642 5.055 ( 4.215 1.878 -2.129) 5.082 5.247 ( -0.605 -0.163 -2.683) 2.755 5.382 ( 2.720 3.075 1.027) 4.232 5.567 ( 0.204 3.675 1.539) 3.990 6.635 ( -6.970 0.118 -0.966) 7.037 6.970 ( 1.923 1.134 0.597) 2.311 7.300 ( -1.975 -2.227 -2.954) 4.194 7.399 ( 2.319 -3.253 -2.061) 4.495 7.690 ( -0.325 -2.614 1.755) 3.165 7.838 ( -3.820 -3.300 3.356) 6.062 7.948 ( -4.327 -11.498 -1.677) 12.399 8.094 ( -2.649 -8.905 1.626) 9.432 8.288 ( -1.232 4.882 -1.788) 5.343 8.463 ( -1.319 7.560 1.657) 7.851 8.897 ( 5.402 6.356 -3.891) 9.205 9.037 ( 4.531 5.443 1.242) 7.190 9.472 ( -1.172 5.084 -0.186) 5.221 9.581 ( -0.520 1.735 0.454) 1.868 10.966 ( 0.068 -1.341 1.511) 2.021 11.037 ( -0.860 -1.618 0.100) 1.835 11.353 ( 0.916 1.247 5.509) 5.722 11.408 ( -0.831 1.354 -5.515) 5.740 11.593 ( 1.349 3.542 0.336) 3.805 11.755 ( -2.537 4.604 -2.877) 5.992 11.941 ( -2.508 -1.375 2.746) 3.965 12.163 ( 0.238 -0.859 -0.836) 1.222 13.254 ( 5.797 4.963 -6.042) 9.733 13.309 ( 4.527 4.259 6.525) 9.012 13.637 ( 1.216 -1.093 -1.967) 2.558 13.660 ( 2.455 -2.425 4.207) 5.441 17.721 ( 2.115 4.668 0.980) 5.218 17.805 ( -1.920 -0.580 -1.711) 2.636 17.935 ( 2.488 12.329 0.928) 12.612 17.961 ( -0.620 6.233 3.281) 7.071 18.657 ( 1.882 1.567 0.171) 2.455 18.763 ( 0.905 1.677 1.147) 2.224 18.937 ( -0.463 1.859 0.404) 1.958 19.017 ( -1.789 2.784 -0.492) 3.346 21.094 ( -0.785 -8.369 -4.133) 9.366 21.234 ( -3.272 -8.851 0.335) 9.442 21.342 ( 0.683 -2.852 -0.944) 3.081 21.343 ( 0.155 -2.645 0.534) 2.703 ======================= Grid point 126 (58/170) ======================= q-point: ( 0.45 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( -4.873 0.768 -4.112) 6.422 2.287 ( 1.336 2.301 3.298) 4.238 2.569 ( -6.105 -1.056 2.356) 6.629 2.621 ( 4.945 3.238 -1.184) 6.028 2.776 ( 8.519 2.536 0.863) 8.931 2.823 ( 1.526 1.778 4.961) 5.486 2.887 ( -7.816 -5.213 0.390) 9.403 2.995 ( -6.096 0.674 -1.163) 6.243 3.146 ( 2.184 -1.844 -0.233) 2.868 3.336 ( 4.255 -2.081 -3.479) 5.878 3.518 ( -5.485 -4.458 2.263) 7.422 3.680 ( 0.610 -2.548 2.609) 3.697 4.315 ( 0.094 -0.881 -4.784) 4.866 4.356 ( 2.164 7.871 -3.190) 8.764 4.494 ( 4.273 7.609 -0.794) 8.763 4.723 ( 0.212 -1.317 0.338) 1.376 4.732 ( 2.463 -1.516 1.068) 3.082 4.916 ( 1.572 1.252 -4.982) 5.372 5.060 ( -1.008 -5.021 -3.907) 6.442 5.216 ( 1.252 -5.438 -1.621) 5.811 5.393 ( -0.876 1.994 -0.108) 2.180 5.569 ( -1.196 3.768 0.446) 3.978 6.558 ( -2.079 3.151 1.426) 4.035 6.992 ( -0.940 3.160 0.832) 3.400 7.253 ( 0.708 -3.284 -3.327) 4.728 7.407 ( 2.592 -5.307 -3.530) 6.881 7.702 ( -1.177 -5.729 1.070) 5.946 7.784 ( -2.831 -4.075 0.097) 4.963 7.878 ( -1.772 -9.265 -3.144) 9.943 8.069 ( -2.334 -10.947 0.176) 11.195 8.273 ( 1.276 5.855 0.558) 6.019 8.469 ( -1.351 8.307 2.980) 8.928 8.918 ( 3.794 7.258 -5.189) 9.695 9.062 ( -0.180 5.134 -3.753) 6.362 9.487 ( 0.401 5.629 4.086) 6.968 9.589 ( -0.278 1.925 2.207) 2.942 10.964 ( 1.212 -2.741 -1.812) 3.502 11.025 ( -3.536 -4.483 0.972) 5.792 11.362 ( 1.801 2.429 -1.063) 3.205 11.434 ( 0.127 2.973 5.772) 6.494 11.638 ( 1.441 4.237 -1.369) 4.680 11.677 ( -0.471 7.397 -2.122) 7.710 11.953 ( -1.813 -0.435 4.981) 5.319 12.165 ( 0.880 -0.147 -0.230) 0.922 13.254 ( 4.318 2.486 -6.692) 8.344 13.362 ( -3.316 1.224 -0.504) 3.570 13.678 ( 2.518 1.744 4.793) 5.688 13.750 ( 0.302 0.719 7.089) 7.132 17.734 ( 0.631 2.599 -2.401) 3.594 17.744 ( -1.699 1.753 -3.392) 4.179 18.001 ( 1.802 11.490 6.266) 13.211 18.013 ( -1.131 12.380 5.972) 13.792 18.692 ( 1.583 1.266 0.881) 2.210 18.783 ( -0.790 3.874 1.436) 4.206 18.938 ( -0.258 2.417 0.397) 2.463 18.995 ( -0.447 1.990 1.226) 2.380 21.051 ( 2.110 -10.970 -5.156) 12.304 21.160 ( -2.870 -12.330 -4.853) 13.558 21.343 ( 0.617 -2.683 -0.504) 2.799 21.351 ( -0.066 -3.249 0.298) 3.263 ======================= Grid point 127 (59/170) ======================= q-point: (-0.45 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( -4.306 1.897 0.591) 4.742 2.321 ( -5.612 -3.868 -5.593) 8.817 2.470 ( 2.817 2.948 -0.858) 4.167 2.683 ( -2.303 3.665 5.225) 6.785 2.770 ( -4.195 5.702 2.332) 7.453 2.873 ( -3.959 -5.159 5.335) 8.412 2.910 ( 8.237 -0.902 -0.746) 8.320 3.016 ( 8.965 3.212 -0.402) 9.531 3.218 ( 4.955 -4.457 2.547) 7.134 3.360 ( 4.621 -2.935 -3.853) 6.694 3.449 ( -5.024 -1.600 1.104) 5.387 3.750 ( 2.495 -4.558 4.289) 6.738 4.239 ( -1.901 -0.237 -5.933) 6.234 4.314 ( 3.476 5.840 -12.401) 14.142 4.555 ( 0.709 1.791 1.246) 2.294 4.657 ( -7.570 1.211 -1.104) 7.745 4.699 ( -3.792 -0.495 -5.008) 6.301 4.893 ( -2.864 4.089 2.889) 5.768 5.011 ( -0.389 -7.211 -1.445) 7.365 5.204 ( 2.655 -2.752 -3.733) 5.344 5.428 ( 2.693 3.918 3.089) 5.670 5.540 ( -1.721 3.721 -2.000) 4.562 6.610 ( 4.307 4.003 3.929) 7.072 6.949 ( -2.785 1.378 -2.483) 3.978 7.251 ( 3.044 -3.053 -2.926) 5.211 7.400 ( 2.140 -3.000 -4.387) 5.729 7.650 ( -2.953 -7.820 -3.931) 9.237 7.777 ( -0.394 -3.291 2.073) 3.909 7.849 ( 2.776 -12.592 -2.151) 13.073 8.027 ( -2.455 -8.929 -0.293) 9.265 8.342 ( 2.984 3.912 4.120) 6.417 8.487 ( -0.189 8.698 2.974) 9.194 8.907 ( 2.026 5.958 -6.009) 8.701 8.951 ( -4.633 5.343 -7.284) 10.153 9.557 ( 1.138 4.181 5.082) 6.679 9.617 ( 0.171 2.565 2.729) 3.749 10.947 ( -4.842 -3.775 -1.371) 6.291 10.981 ( 3.088 -4.364 -1.213) 5.482 11.417 ( -2.190 6.301 5.176) 8.443 11.464 ( 2.933 2.572 -0.521) 3.936 11.615 ( -1.344 5.793 2.596) 6.489 11.703 ( 4.060 5.610 -3.257) 7.652 11.988 ( -1.111 0.789 5.429) 5.598 12.183 ( 1.098 -0.023 0.291) 1.136 13.188 ( -7.807 0.001 -4.545) 9.034 13.311 ( 4.143 -1.137 -3.191) 5.351 13.767 ( -1.362 2.984 7.185) 7.899 13.818 ( -1.272 2.989 6.828) 7.561 17.683 ( -2.035 2.002 -2.432) 3.750 17.707 ( 0.443 1.302 -2.942) 3.248 18.042 ( -2.889 13.999 5.380) 15.273 18.118 ( 2.394 12.717 7.888) 15.155 18.698 ( -3.280 1.793 0.998) 3.870 18.785 ( 1.107 4.139 1.022) 4.404 18.952 ( 0.322 0.899 2.345) 2.532 19.025 ( 1.071 2.189 2.119) 3.229 21.042 ( -1.606 -12.926 -7.819) 15.192 21.050 ( 4.265 -12.095 -6.150) 14.224 21.343 ( -0.647 -2.814 -0.500) 2.930 21.352 ( 0.588 -2.730 0.058) 2.793 ======================= Grid point 128 (60/170) ======================= q-point: (-0.36 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( -15.381 1.525 -8.574) 17.675 2.112 ( -12.048 6.313 -1.057) 13.643 2.593 ( 10.408 -2.246 0.024) 10.647 2.710 ( -0.739 6.636 6.977) 9.657 2.773 ( 0.209 -1.676 2.810) 3.279 2.905 ( 0.154 -6.283 3.784) 7.336 2.986 ( 2.820 -1.862 -3.781) 5.071 3.171 ( 8.506 3.222 3.110) 9.613 3.346 ( 6.348 -1.053 1.357) 6.576 3.393 ( -2.213 2.557 1.564) 3.726 3.422 ( 7.023 -4.703 -3.799) 9.267 3.831 ( 1.909 -7.293 3.296) 8.228 4.136 ( -2.354 1.962 -6.996) 7.638 4.221 ( 5.882 0.719 -16.135) 17.189 4.361 ( -12.348 -2.771 -4.829) 13.546 4.574 ( -6.637 1.422 -2.010) 7.079 4.648 ( 1.564 4.434 0.566) 4.736 4.829 ( -7.087 1.427 1.630) 7.410 5.069 ( 2.822 3.634 5.366) 7.069 5.225 ( 2.343 1.142 -0.448) 2.645 5.436 ( -5.043 4.571 -3.943) 7.866 5.540 ( 3.531 5.487 4.861) 8.137 6.739 ( 5.248 2.245 3.546) 6.720 6.882 ( -0.114 -2.420 -4.109) 4.770 7.269 ( 2.556 -1.499 -2.682) 3.997 7.373 ( 0.594 1.034 -4.399) 4.557 7.574 ( -0.697 -8.152 -2.544) 8.568 7.800 ( -0.329 -4.270 2.647) 5.035 7.904 ( 5.940 -14.335 -1.970) 15.642 8.002 ( 0.060 -7.531 0.331) 7.538 8.394 ( -0.811 3.461 0.587) 3.603 8.557 ( 2.202 7.232 6.499) 9.969 8.733 ( -6.779 4.114 -10.708) 13.325 8.906 ( 2.157 6.503 -3.595) 7.737 9.611 ( -0.499 2.275 3.224) 3.978 9.646 ( -0.102 2.274 2.062) 3.072 10.870 ( -2.666 -2.248 -1.057) 3.644 11.031 ( 4.291 -5.506 -0.501) 6.998 11.367 ( -5.905 8.471 2.482) 10.620 11.549 ( 3.858 3.073 0.108) 4.934 11.643 ( 1.507 5.391 3.016) 6.358 11.739 ( 4.484 3.986 -1.502) 6.185 12.030 ( -0.286 1.048 4.032) 4.176 12.202 ( 0.728 -0.406 0.500) 0.971 12.969 ( -11.762 0.630 -5.513) 13.005 13.385 ( 5.322 -4.579 1.457) 7.171 13.769 ( -6.733 4.506 4.925) 9.481 13.859 ( -2.935 1.783 5.756) 6.702 17.627 ( -2.054 2.213 -1.562) 3.399 17.693 ( 0.758 1.317 -1.457) 2.105 18.044 ( -3.914 13.285 4.613) 14.598 18.233 ( 1.477 9.088 6.557) 11.303 18.654 ( -1.123 2.375 0.025) 2.627 18.834 ( 1.340 3.516 3.252) 4.973 18.987 ( -0.559 0.374 3.847) 3.905 19.057 ( 0.348 2.066 1.362) 2.499 20.905 ( -1.588 -9.974 -10.539) 14.598 21.084 ( 6.462 -11.515 -4.917) 14.090 21.317 ( -1.154 -2.482 -1.359) 3.056 21.364 ( 0.424 -2.240 0.442) 2.322 ======================= Grid point 129 (61/170) ======================= q-point: (-0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( -16.881 8.962 -5.892) 20.000 1.861 ( -17.741 14.558 -0.359) 22.952 2.757 ( 3.901 -2.549 5.434) 7.159 2.806 ( 8.817 -2.223 -2.078) 9.328 2.844 ( 3.044 -1.451 3.016) 4.524 2.887 ( -4.808 -0.686 0.506) 4.883 3.017 ( 4.897 -8.567 0.621) 9.887 3.199 ( -10.407 9.827 0.678) 14.330 3.362 ( 1.138 4.690 -6.054) 7.743 3.417 ( 1.790 0.106 2.428) 3.018 3.486 ( 5.762 -4.975 -5.646) 9.478 3.874 ( 1.438 -6.416 -0.271) 6.581 4.025 ( -0.770 -0.947 -4.959) 5.107 4.179 ( 6.309 -2.024 -9.033) 11.203 4.266 ( 2.476 0.892 -0.163) 2.637 4.466 ( -3.858 5.708 -1.285) 7.008 4.678 ( 2.249 2.692 2.768) 4.469 4.759 ( -1.957 2.533 -1.587) 3.572 5.109 ( -2.047 1.859 -0.285) 2.780 5.273 ( -4.365 7.754 -2.439) 9.226 5.295 ( -1.722 2.053 3.635) 4.516 5.674 ( 3.976 6.383 7.500) 10.621 6.821 ( 2.050 -0.673 0.677) 2.261 6.872 ( 3.211 -3.725 -1.914) 5.277 7.233 ( -3.093 2.394 -2.423) 4.601 7.366 ( 2.683 -0.371 -1.383) 3.041 7.562 ( 0.486 -4.393 -0.817) 4.495 7.805 ( -2.701 -4.008 1.633) 5.101 7.971 ( 4.449 -7.591 0.483) 8.812 8.061 ( 6.836 -12.565 -0.984) 14.337 8.351 ( -2.481 5.159 -2.368) 6.195 8.489 ( -7.550 2.921 -8.030) 11.402 8.681 ( 1.462 6.780 5.077) 8.595 8.914 ( 3.607 6.334 -2.726) 7.782 9.596 ( -4.449 1.848 1.305) 4.991 9.670 ( 1.207 -0.091 1.084) 1.625 10.844 ( 0.138 -0.682 -0.378) 0.792 11.095 ( 3.786 -6.484 -0.006) 7.509 11.325 ( -2.558 8.425 3.090) 9.331 11.576 ( 1.408 4.265 -0.379) 4.508 11.726 ( 6.453 2.204 -1.090) 6.906 11.808 ( 4.305 3.475 0.637) 5.569 12.072 ( 0.610 -0.218 3.543) 3.602 12.214 ( 0.185 -0.932 0.173) 0.966 12.720 ( -12.332 1.926 -4.182) 13.163 13.479 ( 1.331 -5.319 4.041) 6.811 13.675 ( -8.944 3.573 1.162) 9.701 13.842 ( -5.667 -0.957 3.666) 6.817 17.590 ( -1.443 3.072 0.022) 3.395 17.695 ( 0.691 1.636 -0.397) 1.820 18.012 ( -6.469 10.853 3.827) 13.202 18.301 ( 1.201 -0.884 2.587) 2.986 18.691 ( 4.797 5.311 0.768) 7.198 18.884 ( 0.095 2.756 3.306) 4.305 19.016 ( -1.866 -0.113 4.565) 4.933 19.067 ( -0.168 1.231 0.725) 1.439 20.769 ( -1.437 -3.408 -9.320) 10.027 21.140 ( 6.642 -8.987 -3.802) 11.804 21.282 ( -0.846 -2.352 -1.805) 3.083 21.374 ( 0.243 -1.561 0.404) 1.631 ======================= Grid point 130 (62/170) ======================= q-point: (-0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( -9.978 21.948 3.327) 24.338 1.597 ( -17.545 21.999 5.337) 28.640 2.623 ( -25.404 14.417 -2.498) 29.316 2.796 ( -3.009 -0.565 -1.887) 3.596 2.881 ( 4.766 -1.403 1.268) 5.127 2.985 ( 8.201 -4.375 2.209) 9.554 3.051 ( 0.586 -1.959 -1.486) 2.528 3.177 ( 6.899 -5.739 2.881) 9.425 3.325 ( 0.280 5.443 -1.545) 5.665 3.463 ( 4.342 -1.208 -6.030) 7.528 3.489 ( 2.916 -5.497 -1.697) 6.449 3.863 ( -0.919 -1.640 -2.071) 2.797 3.989 ( -0.801 -4.505 -1.291) 4.754 4.194 ( 2.948 0.343 -2.289) 3.748 4.339 ( 5.300 0.137 1.403) 5.484 4.428 ( 1.643 8.877 -3.556) 9.702 4.720 ( -1.520 -0.285 0.193) 1.559 4.827 ( 10.131 0.319 3.556) 10.741 5.042 ( -3.837 2.744 -1.038) 4.830 5.151 ( -3.286 10.863 -2.516) 11.625 5.316 ( -6.225 -0.377 3.477) 7.140 5.802 ( 3.256 4.200 3.853) 6.565 6.840 ( 1.482 -3.609 -1.708) 4.259 6.902 ( 1.054 -4.332 -0.652) 4.506 7.174 ( -1.718 4.257 0.767) 4.655 7.396 ( 1.798 1.328 -0.078) 2.237 7.564 ( -0.415 -1.150 1.645) 2.049 7.754 ( -5.225 -2.460 1.206) 5.900 8.046 ( 3.289 -4.508 -0.201) 5.584 8.124 ( -3.606 3.209 2.334) 5.362 8.312 ( 5.097 -12.787 -5.695) 14.897 8.338 ( -1.308 9.732 -2.115) 10.045 8.721 ( -0.889 5.922 1.892) 6.280 8.957 ( 4.280 6.934 -1.787) 8.342 9.529 ( -4.428 1.619 0.709) 4.768 9.705 ( 2.198 -2.762 0.066) 3.530 10.860 ( 2.062 0.501 -0.104) 2.124 11.142 ( 1.400 -6.407 1.199) 6.667 11.364 ( 3.211 7.092 2.225) 8.097 11.602 ( 2.883 3.518 -1.163) 4.695 11.810 ( 6.635 0.920 -2.556) 7.169 11.884 ( 5.635 -0.383 -0.318) 5.657 12.130 ( 1.513 -0.886 3.349) 3.780 12.205 ( -0.395 -1.670 -1.828) 2.508 12.511 ( -10.818 3.925 0.414) 11.516 13.443 ( -11.205 3.728 2.309) 12.032 13.543 ( -8.449 -6.264 -1.055) 10.570 13.787 ( -2.979 -4.564 0.767) 5.504 17.582 ( -0.801 3.885 1.315) 4.179 17.706 ( 0.773 1.646 0.367) 1.855 17.925 ( -8.342 6.298 2.041) 10.650 18.341 ( 2.285 -6.864 -0.339) 7.242 18.779 ( 5.700 4.485 -1.874) 7.491 18.909 ( -0.488 1.640 2.037) 2.660 19.014 ( -2.588 -0.686 1.460) 3.050 19.085 ( 0.450 -1.549 1.650) 2.307 20.672 ( -1.147 5.533 -3.588) 6.694 21.203 ( 3.655 -3.107 -0.501) 4.824 21.265 ( 2.298 -3.828 -1.924) 4.861 21.382 ( 0.605 -0.723 0.244) 0.974 ======================= Grid point 131 (63/170) ======================= q-point: (-0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( -4.527 27.555 8.845) 29.292 1.484 ( -9.184 28.507 13.173) 32.719 2.223 ( -22.560 28.873 9.569) 37.871 2.734 ( -1.968 0.112 -2.310) 3.037 2.954 ( 3.568 0.873 -3.953) 5.396 3.013 ( -0.274 -10.136 -2.176) 10.371 3.107 ( 5.457 -2.180 -4.506) 7.406 3.296 ( 3.847 -4.906 1.756) 6.477 3.353 ( 3.155 3.052 -0.363) 4.404 3.452 ( 4.524 -5.874 -4.491) 8.668 3.547 ( 2.590 -4.248 1.875) 5.317 3.825 ( -0.705 -3.342 -1.084) 3.583 3.969 ( 0.543 -3.111 1.329) 3.426 4.236 ( -1.139 2.730 8.420) 8.924 4.418 ( 3.842 7.099 -5.787) 9.932 4.473 ( 10.453 0.291 -0.821) 10.489 4.746 ( -0.304 -1.786 7.848) 8.055 4.938 ( -0.204 0.472 -3.741) 3.776 5.024 ( 1.273 2.747 1.731) 3.488 5.115 ( -6.515 2.059 3.119) 7.511 5.153 ( -7.435 10.994 -3.127) 13.635 5.838 ( 0.607 2.176 -2.923) 3.694 6.810 ( 1.094 -3.617 -7.711) 8.587 6.896 ( -0.733 -4.919 -0.663) 5.018 7.227 ( 2.686 3.742 6.932) 8.323 7.423 ( 1.083 2.947 1.259) 3.382 7.584 ( -0.483 3.192 2.409) 4.028 7.691 ( -5.276 -2.281 3.249) 6.603 7.989 ( -9.608 6.807 0.013) 11.775 8.079 ( 1.347 -0.482 0.888) 1.684 8.336 ( 1.558 9.825 -0.267) 9.951 8.422 ( 4.959 -9.880 2.182) 11.268 8.733 ( 2.910 1.231 -0.367) 3.181 8.986 ( 1.563 8.061 -2.082) 8.471 9.498 ( -0.174 -0.283 0.372) 0.499 9.729 ( 1.690 -4.963 -1.711) 5.515 10.892 ( 2.293 0.916 -1.512) 2.895 11.177 ( 0.058 -4.803 3.307) 5.832 11.444 ( 6.185 3.793 -1.966) 7.517 11.631 ( 2.466 2.711 -2.322) 4.339 11.873 ( 4.230 -0.892 -2.760) 5.128 11.982 ( 7.660 -3.641 -2.156) 8.751 12.163 ( -0.322 -2.131 -1.627) 2.701 12.183 ( 0.852 -2.407 1.010) 2.746 12.397 ( -8.460 6.015 5.874) 11.927 13.264 ( -9.583 6.905 -2.075) 11.992 13.342 ( -13.984 -5.929 0.864) 15.213 13.768 ( 0.255 -6.975 -2.047) 7.274 17.584 ( -0.784 4.091 0.908) 4.263 17.728 ( 0.875 1.501 1.284) 2.161 17.807 ( -7.092 3.028 -0.367) 7.720 18.361 ( 1.749 -9.411 -1.900) 9.759 18.809 ( 3.785 1.483 -5.858) 7.130 18.912 ( -0.634 0.460 -0.672) 1.032 18.983 ( -2.048 -1.622 0.339) 2.634 19.086 ( -0.203 -3.996 -2.699) 4.826 20.674 ( 0.272 12.162 5.605) 13.394 21.223 ( 0.027 0.625 0.532) 0.821 21.317 ( 2.678 -2.800 0.365) 3.892 21.418 ( 3.344 -0.579 1.685) 3.789 ======================= Grid point 132 (64/170) ======================= q-point: ( 0.00 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -3.503 19.633 3.743) 20.291 1.955 ( -6.395 23.487 4.142) 24.692 2.640 ( 0.619 8.454 12.681) 15.253 2.676 ( 1.476 -1.672 -5.049) 5.520 2.805 ( 0.855 -4.702 -4.465) 6.541 2.949 ( -0.519 -1.760 -7.121) 7.354 3.059 ( 2.201 -0.156 -2.393) 3.255 3.150 ( -2.336 -10.618 -3.052) 11.293 3.362 ( 1.452 -3.919 -1.710) 4.515 3.396 ( 2.791 -1.857 -1.084) 3.523 3.517 ( -1.109 -5.082 -0.098) 5.202 3.676 ( 5.334 -7.015 1.204) 8.895 4.118 ( 2.323 2.970 12.152) 12.724 4.333 ( -2.768 -2.281 13.878) 14.334 4.533 ( 4.263 6.606 -2.010) 8.115 4.658 ( -1.624 12.627 0.540) 12.743 4.852 ( 0.106 3.629 -2.479) 4.396 4.876 ( -1.468 2.407 9.001) 9.432 5.054 ( -3.225 1.091 2.550) 4.254 5.188 ( 0.345 9.446 -1.281) 9.538 5.396 ( 0.253 9.778 0.135) 9.782 5.766 ( -1.632 -2.429 -5.937) 6.619 6.669 ( 0.966 -3.199 -5.719) 6.624 6.787 ( 1.811 -5.338 -2.386) 6.121 7.418 ( -0.306 4.755 7.890) 9.217 7.535 ( 0.748 2.892 5.432) 6.200 7.685 ( -0.989 3.434 1.828) 4.014 7.700 ( -1.363 6.063 0.978) 6.290 8.024 ( 1.666 4.525 2.393) 5.383 8.079 ( -2.932 -2.372 3.152) 4.915 8.276 ( -2.005 -7.731 -1.349) 8.100 8.590 ( 5.319 1.156 -1.610) 5.677 8.675 ( -0.863 -1.043 1.337) 1.902 9.085 ( 0.738 2.637 -5.093) 5.783 9.496 ( -0.591 1.323 0.300) 1.480 9.628 ( 0.095 -3.540 -2.353) 4.252 10.910 ( -0.015 2.146 -0.844) 2.306 11.143 ( -1.102 -4.790 7.139) 8.667 11.534 ( 1.830 2.239 -0.209) 2.899 11.658 ( -0.163 4.889 -7.467) 8.927 11.807 ( -1.115 -1.614 -6.482) 6.772 11.938 ( 2.743 -5.062 -2.742) 6.377 12.075 ( -1.883 -3.772 -1.678) 4.538 12.120 ( -0.628 -4.724 -0.138) 4.768 12.584 ( -1.121 11.853 7.129) 13.877 13.183 ( -0.136 -4.841 2.935) 5.663 13.278 ( 0.838 5.805 -4.150) 7.184 13.585 ( -0.282 -7.389 -3.820) 8.323 17.648 ( -1.493 4.077 -0.449) 4.365 17.749 ( -2.780 1.358 -0.674) 3.166 17.810 ( 1.553 2.958 1.139) 3.530 18.151 ( 0.860 -9.941 -3.600) 10.608 18.796 ( 1.678 0.410 -5.753) 6.006 18.863 ( -0.366 -0.594 -4.470) 4.524 18.925 ( -1.185 -1.171 0.523) 1.747 18.974 ( -0.358 -3.152 -2.586) 4.092 21.026 ( 0.709 11.771 9.553) 15.176 21.254 ( 0.068 1.208 0.949) 1.538 21.314 ( 0.538 -1.105 0.363) 1.282 21.455 ( 0.268 -2.680 3.276) 4.241 ======================= Grid point 133 (65/170) ======================= q-point: ( 0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( -2.492 14.259 6.308) 15.790 2.018 ( 1.193 16.945 9.831) 19.627 2.613 ( 1.890 2.485 -10.824) 11.265 2.712 ( -0.047 -4.619 1.329) 4.806 2.804 ( 0.784 -2.324 -0.574) 2.519 2.864 ( -0.634 -7.531 -4.157) 8.625 3.026 ( -4.082 -4.985 -5.085) 8.208 3.114 ( 1.919 0.890 -1.729) 2.732 3.372 ( 1.470 0.055 1.179) 1.885 3.449 ( 1.478 -1.110 -1.305) 2.263 3.513 ( 1.213 -7.567 3.957) 8.625 3.730 ( 1.055 -3.603 -2.990) 4.800 4.286 ( -0.646 4.577 15.940) 16.596 4.420 ( -3.005 -1.307 7.450) 8.139 4.596 ( 4.489 5.435 -0.024) 7.049 4.661 ( -1.595 13.414 7.267) 15.339 4.805 ( -3.835 1.848 -2.854) 5.125 4.922 ( -5.469 2.991 6.387) 8.924 5.032 ( -1.029 5.239 0.002) 5.339 5.193 ( 1.695 7.776 0.887) 8.008 5.405 ( 0.476 6.959 1.314) 7.098 5.661 ( -2.296 -1.225 -6.480) 6.983 6.661 ( 5.131 -2.205 -3.755) 6.730 6.804 ( 4.250 -5.054 -3.086) 7.289 7.459 ( -4.410 6.590 7.217) 10.722 7.545 ( -7.243 3.707 3.043) 8.687 7.671 ( -2.024 3.090 4.702) 5.979 7.724 ( 1.111 1.856 1.914) 2.888 8.040 ( -5.625 -4.931 1.823) 7.700 8.079 ( -3.278 -3.441 0.262) 4.760 8.271 ( 6.424 -2.572 2.517) 7.363 8.620 ( 1.033 7.245 -1.106) 7.402 8.710 ( 2.546 -4.966 0.354) 5.592 9.019 ( -0.683 2.706 -5.846) 6.479 9.505 ( 1.538 1.525 0.177) 2.173 9.608 ( 0.937 -2.698 -2.499) 3.795 10.910 ( -0.483 3.683 1.711) 4.089 11.190 ( -2.581 -3.760 7.073) 8.416 11.445 ( -7.834 5.081 -4.588) 10.404 11.614 ( 0.891 3.914 -5.290) 6.641 11.742 ( 5.156 -0.193 -6.636) 8.406 11.955 ( 2.672 -3.715 -5.622) 7.249 11.974 ( -7.449 -3.894 0.667) 8.431 12.106 ( -0.860 -5.961 -0.420) 6.037 12.704 ( 4.449 9.032 9.259) 13.678 13.248 ( 4.073 -2.836 0.675) 5.008 13.318 ( 9.015 1.317 -4.415) 10.124 13.552 ( 2.907 -5.020 -4.965) 7.635 17.631 ( -0.060 2.988 0.625) 3.053 17.726 ( 0.317 0.523 -0.255) 0.663 17.866 ( 4.269 3.853 0.149) 5.752 18.126 ( 2.176 -6.914 -5.473) 9.082 18.759 ( 1.759 0.359 -5.442) 5.730 18.794 ( -0.677 0.767 -5.931) 6.019 18.928 ( 0.280 -1.130 0.820) 1.424 18.963 ( 1.285 -2.985 -0.702) 3.325 21.123 ( -3.081 8.337 10.620) 13.849 21.260 ( -1.210 0.706 1.636) 2.153 21.315 ( -0.400 -0.873 -0.035) 0.961 21.448 ( -5.160 -2.069 2.520) 6.104 ======================= Grid point 134 (66/170) ======================= q-point: ( 0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( 4.242 5.423 12.866) 14.592 2.162 ( 2.897 9.516 9.442) 13.715 2.551 ( 4.080 3.996 -7.197) 9.188 2.715 ( -0.432 -10.175 -1.354) 10.274 2.775 ( 0.539 1.987 -5.450) 5.826 2.833 ( -1.859 -9.690 -0.174) 9.868 2.889 ( -5.721 0.300 -3.144) 6.535 3.101 ( 2.436 0.547 -5.503) 6.043 3.394 ( -1.187 -0.396 -0.487) 1.343 3.434 ( 0.723 -3.451 -1.358) 3.778 3.574 ( -1.576 -4.777 1.817) 5.348 3.673 ( -0.865 -5.194 -4.737) 7.083 4.364 ( -7.198 4.595 -0.020) 8.539 4.454 ( -0.058 4.099 14.504) 15.073 4.633 ( -2.953 8.102 0.647) 8.648 4.691 ( -6.444 7.676 4.867) 11.142 4.738 ( -0.147 5.905 0.536) 5.931 4.907 ( -2.713 0.894 6.364) 6.976 5.031 ( 2.817 7.201 -0.815) 7.775 5.233 ( 1.422 4.345 0.432) 4.592 5.447 ( 1.393 3.584 1.381) 4.086 5.574 ( -0.802 0.446 -3.487) 3.605 6.727 ( 5.247 -2.155 -1.688) 5.919 6.836 ( 3.321 -4.227 -2.371) 5.875 7.439 ( -6.483 3.600 1.766) 7.623 7.463 ( -3.427 4.014 1.759) 5.563 7.682 ( -4.753 0.377 6.687) 8.213 7.742 ( -1.646 -1.030 1.790) 2.641 7.962 ( -6.036 -7.498 2.574) 9.964 7.986 ( -7.287 -10.355 0.561) 12.674 8.424 ( 6.554 4.848 0.545) 8.171 8.636 ( 2.519 8.636 -0.673) 9.021 8.749 ( 2.705 -2.053 1.207) 3.604 8.968 ( 1.740 1.732 -3.679) 4.423 9.542 ( 2.772 1.708 -0.563) 3.305 9.603 ( 1.387 -0.846 -1.878) 2.483 10.924 ( -1.945 3.505 3.920) 5.607 11.206 ( -8.243 -5.791 7.857) 12.776 11.306 ( 1.768 9.538 -7.672) 12.367 11.545 ( 0.461 2.848 -6.300) 6.929 11.779 ( 2.993 1.344 -5.223) 6.168 11.817 ( -4.667 -0.358 -2.639) 5.373 11.960 ( -1.522 -3.972 0.582) 4.293 12.097 ( 1.067 -5.829 -0.933) 5.999 12.914 ( 7.637 6.277 10.916) 14.727 13.306 ( 3.233 -1.826 -0.362) 3.731 13.414 ( 9.855 -0.721 -6.011) 11.566 13.574 ( 6.298 -2.452 -5.208) 8.533 17.662 ( 1.381 2.208 2.669) 3.729 17.745 ( 0.642 -0.937 2.005) 2.305 17.946 ( 7.325 6.095 -2.228) 9.786 18.103 ( 3.481 -0.808 -6.444) 7.368 18.716 ( -0.893 1.543 -3.813) 4.209 18.745 ( 1.921 0.259 -3.936) 4.388 18.944 ( 0.598 -0.550 0.629) 1.028 18.993 ( 2.763 -2.799 -0.012) 3.933 21.149 ( -6.780 2.822 7.670) 10.619 21.245 ( -3.998 -0.651 2.530) 4.776 21.308 ( -0.595 -0.892 0.349) 1.127 21.369 ( -5.695 -1.940 0.220) 6.020 ======================= Grid point 135 (67/170) ======================= q-point: ( 0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 4.454 -2.344 13.050) 13.987 2.299 ( 1.886 5.111 9.059) 10.571 2.574 ( 4.863 -0.019 -6.205) 7.884 2.635 ( -2.519 -1.065 -4.172) 4.988 2.723 ( -7.369 -2.233 1.090) 7.777 2.772 ( 1.571 3.389 -2.479) 4.483 2.837 ( 0.983 -5.575 -1.899) 5.971 3.108 ( 4.618 0.814 -2.951) 5.541 3.293 ( -7.688 0.634 -4.755) 9.062 3.445 ( 0.680 -3.267 0.866) 3.447 3.501 ( -4.387 -2.926 -3.785) 6.491 3.616 ( -0.994 -9.028 -2.928) 9.543 4.306 ( -1.086 7.066 3.560) 7.986 4.526 ( -5.455 11.557 -3.384) 13.220 4.590 ( 0.385 0.503 8.239) 8.264 4.648 ( -3.452 5.550 0.742) 6.578 4.712 ( -1.180 3.832 -1.566) 4.304 4.952 ( -1.426 1.263 4.491) 4.878 5.088 ( 0.583 2.955 2.578) 3.965 5.252 ( 0.433 0.080 -0.048) 0.443 5.434 ( -0.198 2.989 -2.551) 3.934 5.580 ( 1.252 0.949 1.351) 2.072 6.732 ( -1.079 -0.169 -3.094) 3.281 6.879 ( 3.580 -3.751 0.582) 5.218 7.346 ( -6.139 -0.831 0.207) 6.198 7.417 ( -1.801 1.922 -3.199) 4.144 7.667 ( -3.626 -0.930 2.282) 4.384 7.750 ( -2.316 -4.992 6.689) 8.662 7.865 ( -6.009 -7.388 -2.409) 9.824 7.924 ( -4.655 -8.748 4.110) 10.728 8.469 ( 0.988 8.053 -0.964) 8.171 8.643 ( -0.570 9.820 -0.430) 9.845 8.868 ( 8.624 -0.259 1.244) 8.717 9.000 ( 4.633 1.062 0.213) 4.758 9.560 ( 1.009 2.377 -1.702) 3.093 9.609 ( 1.100 0.718 -0.951) 1.622 10.935 ( -2.550 1.796 4.954) 5.854 11.108 ( -7.299 -1.436 0.403) 7.450 11.324 ( 3.824 4.614 -1.281) 6.128 11.497 ( 1.790 1.351 -7.459) 7.789 11.676 ( -3.824 3.070 -0.602) 4.940 11.827 ( 2.343 1.409 -0.890) 2.875 11.934 ( -1.835 -2.042 -0.322) 2.764 12.113 ( 1.759 -4.188 -0.844) 4.620 13.165 ( 7.656 4.834 11.369) 14.534 13.352 ( 3.814 2.121 -1.720) 4.691 13.499 ( 7.962 -2.067 -3.111) 8.795 13.606 ( 5.017 -2.113 -5.761) 7.926 17.722 ( 1.559 1.761 3.380) 4.118 17.779 ( -0.268 -1.563 2.889) 3.296 18.046 ( 7.906 8.607 -1.802) 11.825 18.103 ( 5.249 5.948 -5.386) 9.589 18.679 ( -0.045 1.900 -1.207) 2.251 18.747 ( 2.290 -0.093 -1.641) 2.819 18.958 ( 0.333 0.429 0.595) 0.805 19.037 ( 2.473 -1.428 -0.023) 2.856 21.078 ( -8.128 -2.187 1.279) 8.514 21.175 ( -8.534 -4.417 2.923) 10.044 21.301 ( -0.652 -1.684 0.109) 1.809 21.309 ( -1.511 -1.849 -0.602) 2.463 ======================= Grid point 136 (68/170) ======================= q-point: ( 0.36 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( -2.167 2.084 4.787) 5.653 2.425 ( -0.980 -2.875 -1.194) 3.264 2.501 ( -3.243 -2.066 5.483) 6.697 2.571 ( -1.470 -2.158 -0.230) 2.622 2.726 ( 4.047 2.883 2.072) 5.384 2.795 ( 3.364 4.001 -1.763) 5.517 2.867 ( 3.030 -1.622 0.154) 3.440 3.102 ( -6.294 0.880 -3.760) 7.385 3.165 ( 2.357 2.082 -0.887) 3.268 3.379 ( -3.734 0.017 -5.306) 6.488 3.457 ( -2.251 -5.139 1.966) 5.945 3.588 ( 0.457 -7.227 -0.746) 7.279 4.379 ( 1.173 5.527 2.506) 6.181 4.417 ( 1.597 4.785 -4.755) 6.932 4.612 ( -1.607 6.723 1.711) 7.121 4.656 ( -0.004 -0.357 -0.353) 0.502 4.697 ( 1.831 2.488 0.756) 3.180 4.940 ( -1.308 -1.016 -2.967) 3.398 5.075 ( -3.152 -1.047 -0.657) 3.386 5.204 ( -5.641 -4.862 -0.500) 7.464 5.429 ( -0.014 2.621 0.712) 2.716 5.605 ( -0.061 0.201 1.294) 1.311 6.671 ( -1.783 3.911 -1.836) 4.674 6.957 ( 4.331 -2.538 2.048) 5.422 7.255 ( -4.142 -2.095 -1.603) 4.911 7.351 ( -1.970 -1.824 -3.157) 4.145 7.637 ( -1.436 -2.888 -0.940) 3.359 7.752 ( -2.481 -7.456 -2.731) 8.319 7.786 ( -2.986 -2.807 3.697) 5.520 7.894 ( -3.460 -9.320 2.072) 10.155 8.456 ( -0.280 10.350 -2.041) 10.553 8.636 ( -1.626 9.136 2.573) 9.630 8.983 ( 7.384 2.309 -3.512) 8.496 9.095 ( 4.370 0.785 1.385) 4.651 9.553 ( 0.020 3.288 0.070) 3.289 9.608 ( -0.431 1.012 0.017) 1.101 10.951 ( -1.908 -0.015 3.050) 3.598 11.014 ( -3.976 -0.932 -0.551) 4.121 11.376 ( 2.336 1.263 2.463) 3.621 11.423 ( -0.440 0.268 -5.586) 5.609 11.687 ( 2.598 5.779 2.013) 6.648 11.841 ( 0.690 4.388 -2.469) 5.082 11.911 ( -1.612 -1.511 2.708) 3.494 12.129 ( 1.295 -2.852 -0.486) 3.170 13.344 ( 3.985 4.254 -3.413) 6.755 13.386 ( 3.209 3.419 2.087) 5.133 13.613 ( 4.052 -1.294 2.195) 4.787 13.623 ( 4.723 -1.542 1.717) 5.257 17.766 ( 0.249 0.780 1.146) 1.409 17.789 ( -0.484 -0.725 -0.333) 0.933 18.133 ( 4.447 10.506 1.432) 11.498 18.179 ( 6.177 11.809 1.733) 13.439 18.682 ( 0.899 1.052 0.104) 1.388 18.783 ( 2.886 0.370 0.474) 2.948 18.973 ( 0.693 1.887 0.992) 2.242 19.058 ( 0.032 1.101 -0.270) 1.134 20.948 ( -5.605 -6.416 -3.824) 9.338 21.055 ( -7.728 -9.220 -1.194) 12.089 21.292 ( -0.724 -2.432 0.573) 2.602 21.293 ( -0.335 -2.275 -0.223) 2.310 ======================= Grid point 137 (69/170) ======================= q-point: ( 0.45 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( -2.367 -0.218 -6.513) 6.933 2.352 ( -3.721 2.256 2.832) 5.192 2.537 ( -2.731 -1.312 8.890) 9.392 2.659 ( 5.221 -2.406 2.261) 6.177 2.758 ( -4.046 -0.827 -0.636) 4.178 2.825 ( 2.031 1.950 1.617) 3.247 2.926 ( 6.878 6.155 0.630) 9.251 3.033 ( -2.643 1.331 0.561) 3.012 3.148 ( -2.286 3.348 -1.477) 4.315 3.305 ( 2.147 -1.479 -5.227) 5.841 3.424 ( -3.454 -5.080 1.513) 6.327 3.617 ( 1.613 -4.977 2.174) 5.666 4.315 ( 1.242 1.529 -8.538) 8.762 4.492 ( 1.027 5.158 0.405) 5.275 4.599 ( -1.236 -0.166 -2.283) 2.601 4.665 ( 2.693 0.143 2.180) 3.468 4.751 ( 1.334 2.009 2.345) 3.364 4.855 ( 1.261 -5.188 -10.272) 11.577 4.976 ( -4.328 -5.728 -5.625) 9.121 5.131 ( -3.843 -2.994 3.641) 6.081 5.440 ( -0.055 3.224 2.339) 3.984 5.611 ( -0.975 0.440 1.298) 1.682 6.660 ( 1.110 7.617 1.053) 7.769 7.030 ( -0.218 0.507 2.477) 2.538 7.199 ( 0.936 -2.701 -2.921) 4.087 7.289 ( -0.763 -5.897 -3.233) 6.769 7.596 ( 0.547 -4.430 -4.184) 6.119 7.689 ( -0.838 -6.799 -5.355) 8.695 7.766 ( -3.146 -2.135 2.074) 4.331 7.871 ( -1.755 -8.484 1.501) 8.792 8.430 ( 0.411 9.546 -2.043) 9.771 8.644 ( -1.514 8.481 3.270) 9.214 9.020 ( 4.067 2.929 -6.469) 8.183 9.121 ( -0.483 1.594 -2.744) 3.210 9.575 ( 0.363 3.356 3.002) 4.517 9.615 ( 0.276 0.847 2.286) 2.454 10.929 ( -0.656 -0.901 -1.770) 2.091 10.964 ( -3.405 -1.992 0.065) 3.946 11.402 ( 2.452 1.847 0.377) 3.093 11.465 ( 1.772 0.450 6.681) 6.927 11.727 ( -0.547 4.874 -0.583) 4.939 11.821 ( 1.424 7.066 -2.216) 7.541 11.942 ( -0.770 -0.399 6.060) 6.122 12.148 ( 1.129 -1.890 0.506) 2.259 13.301 ( 1.912 2.361 -9.048) 9.544 13.375 ( -2.428 0.086 -5.421) 5.940 13.718 ( 2.789 2.308 8.364) 9.114 13.766 ( 2.076 0.839 9.410) 9.673 17.751 ( -1.258 0.176 -1.919) 2.301 17.759 ( -0.298 0.260 -3.278) 3.302 18.246 ( 3.033 12.668 7.388) 14.976 18.290 ( 1.419 14.974 6.791) 16.503 18.703 ( 0.712 -0.147 1.130) 1.343 18.834 ( 1.492 1.003 1.661) 2.448 18.997 ( -0.011 3.675 0.149) 3.678 19.040 ( -0.755 2.494 0.599) 2.673 20.842 ( 0.104 -10.207 -6.711) 12.216 20.914 ( -4.265 -12.588 -6.559) 14.821 21.290 ( -0.269 -2.761 0.434) 2.807 21.291 ( -0.087 -2.589 0.445) 2.629 ======================= Grid point 138 (70/170) ======================= q-point: (-0.45 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( -0.906 -0.777 -3.101) 3.323 2.297 ( -5.225 0.308 -1.839) 5.548 2.558 ( -1.987 4.314 1.587) 5.007 2.704 ( -0.484 0.195 2.110) 2.174 2.744 ( -0.842 -4.886 3.526) 6.084 2.908 ( 3.844 0.530 3.287) 5.086 2.952 ( -6.965 9.453 2.869) 12.087 3.087 ( 9.377 1.134 4.171) 10.326 3.137 ( 2.786 -0.335 -1.572) 3.216 3.301 ( 3.609 -2.531 -3.836) 5.844 3.403 ( -0.334 -3.493 0.468) 3.540 3.671 ( 1.256 -4.286 3.030) 5.397 4.237 ( 1.206 0.193 -9.151) 9.233 4.416 ( -0.503 3.808 -11.212) 11.852 4.500 ( -7.278 -5.062 -7.237) 11.444 4.677 ( -4.592 -0.180 1.994) 5.010 4.762 ( 1.110 5.897 0.264) 6.007 4.836 ( 0.322 -7.813 -4.753) 9.151 4.941 ( 7.679 -1.752 2.764) 8.347 5.162 ( 3.464 -1.863 0.440) 3.958 5.491 ( 1.447 3.275 4.761) 5.957 5.596 ( -2.265 1.772 0.144) 2.879 6.722 ( 2.560 7.794 4.075) 9.160 6.973 ( -6.436 1.230 -1.560) 6.735 7.197 ( 2.388 -2.843 -2.922) 4.725 7.305 ( 6.317 -5.861 -1.892) 8.823 7.554 ( -1.106 -3.075 -6.689) 7.445 7.613 ( 3.042 -9.744 -6.778) 12.253 7.751 ( -1.989 -1.373 2.519) 3.491 7.865 ( -0.942 -7.302 0.775) 7.403 8.436 ( 1.565 6.158 0.278) 6.360 8.660 ( -0.153 7.290 2.291) 7.644 8.962 ( -1.739 1.059 -8.514) 8.754 9.048 ( -1.860 4.053 -3.896) 5.921 9.619 ( 0.232 2.449 3.534) 4.306 9.657 ( 0.710 1.452 2.885) 3.307 10.890 ( -2.525 -1.860 -1.860) 3.646 10.925 ( 1.152 -1.929 -1.649) 2.787 11.494 ( 5.112 2.901 4.083) 7.156 11.545 ( -1.766 4.273 5.393) 7.104 11.708 ( -1.096 4.093 3.205) 5.313 11.798 ( -0.449 3.894 -3.777) 5.443 12.015 ( 0.060 2.151 6.508) 6.854 12.171 ( 0.483 -1.274 1.204) 1.818 13.194 ( -5.706 0.557 -7.211) 9.212 13.277 ( 1.649 -2.159 -6.870) 7.388 13.832 ( -1.483 3.462 9.208) 9.949 13.871 ( -1.793 2.425 8.747) 9.252 17.700 ( -1.498 0.420 -2.785) 3.190 17.721 ( 0.135 0.146 -2.979) 2.985 18.320 ( -4.535 13.943 7.234) 16.349 18.405 ( 0.849 16.035 10.081) 18.960 18.716 ( -2.193 -0.083 1.914) 2.912 18.854 ( -1.019 2.556 2.156) 3.496 18.973 ( -0.717 1.593 0.536) 1.827 19.070 ( 1.019 2.084 1.554) 2.792 20.789 ( 0.754 -12.634 -10.186) 16.246 20.812 ( 6.383 -12.195 -8.311) 16.079 21.288 ( -0.476 -2.490 0.204) 2.544 21.301 ( 0.644 -2.514 0.460) 2.636 ======================= Grid point 139 (71/170) ======================= q-point: (-0.36 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.039 ( -9.313 4.303 -5.319) 11.555 2.247 ( -3.611 6.131 2.775) 7.638 2.566 ( 4.682 -0.168 -1.135) 4.820 2.717 ( -1.025 -3.327 0.448) 3.510 2.731 ( -2.522 -5.184 2.716) 6.372 2.919 ( -2.416 8.042 4.995) 9.770 2.950 ( -1.743 -2.347 -1.533) 3.302 3.218 ( 7.728 -0.541 -0.253) 7.751 3.281 ( 7.030 -3.716 3.516) 8.695 3.351 ( 1.967 -1.695 5.169) 5.784 3.423 ( 4.257 0.230 -2.135) 4.768 3.721 ( 1.147 -4.126 2.929) 5.188 4.164 ( 2.401 -0.794 -9.004) 9.352 4.233 ( -4.059 0.427 -17.293) 17.768 4.315 ( 0.338 0.774 -7.607) 7.654 4.642 ( -3.027 5.985 2.342) 7.104 4.763 ( -0.634 6.868 -0.647) 6.927 4.810 ( -0.009 -4.243 -0.311) 4.255 5.093 ( 4.836 -1.249 0.761) 5.052 5.235 ( 4.478 -1.488 2.516) 5.347 5.529 ( -4.655 4.727 -0.744) 6.676 5.592 ( 2.653 1.127 6.142) 6.785 6.803 ( 1.369 4.245 3.519) 5.682 6.846 ( -4.219 -0.652 -3.893) 5.778 7.236 ( 5.776 -1.776 -1.731) 6.286 7.385 ( 4.245 -0.094 -4.360) 6.086 7.443 ( 0.151 -5.616 -4.787) 7.381 7.639 ( 6.978 -11.199 -4.624) 13.982 7.756 ( -1.220 -1.770 2.887) 3.600 7.860 ( 0.248 -6.531 -0.252) 6.540 8.466 ( 0.614 4.287 0.674) 4.383 8.702 ( 2.649 4.370 2.057) 5.508 8.796 ( -7.047 4.567 -6.696) 10.740 9.000 ( 0.271 3.115 -3.090) 4.396 9.646 ( -1.009 1.648 2.117) 2.866 9.683 ( -1.066 1.237 1.876) 2.487 10.845 ( -0.656 -0.370 -1.170) 1.392 10.946 ( 3.256 -3.531 -1.396) 5.002 11.518 ( -3.808 7.288 0.701) 8.253 11.624 ( 3.529 4.623 4.416) 7.303 11.731 ( -2.553 3.092 1.227) 4.194 11.788 ( 3.676 1.108 1.740) 4.216 12.062 ( -1.714 2.257 4.321) 5.167 12.186 ( -0.635 -1.303 1.520) 2.100 12.993 ( -8.692 2.083 -7.001) 11.354 13.274 ( 3.255 -6.622 -1.646) 7.560 13.856 ( -6.891 4.202 6.678) 10.475 13.899 ( -5.396 2.154 6.383) 8.631 17.654 ( -0.981 0.976 -1.754) 2.234 17.705 ( 0.882 -0.144 -1.223) 1.515 18.292 ( -6.937 12.355 4.866) 14.981 18.452 ( -9.927 11.981 7.794) 17.402 18.705 ( 2.209 3.207 1.008) 4.023 18.886 ( -0.095 2.094 4.477) 4.944 18.990 ( -0.757 -0.195 3.430) 3.518 19.081 ( -1.600 -0.148 1.209) 2.011 20.720 ( 5.787 -8.526 -11.404) 15.370 20.858 ( 10.733 -11.506 -8.086) 17.691 21.278 ( -0.653 -1.463 -0.467) 1.669 21.320 ( 0.939 -2.292 0.507) 2.528 ======================= Grid point 140 (72/170) ======================= q-point: (-0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.862 ( -7.229 13.980 -0.614) 15.750 2.153 ( -10.874 15.239 2.531) 18.891 2.675 ( 4.497 -4.722 0.378) 6.532 2.743 ( 8.084 -4.455 0.766) 9.262 2.761 ( 1.887 -7.514 2.790) 8.234 2.860 ( -5.335 -4.597 -0.788) 7.087 2.948 ( -0.486 4.165 1.523) 4.461 3.288 ( 1.623 -0.287 -3.254) 3.647 3.363 ( 5.155 -6.491 -4.304) 9.340 3.408 ( -4.703 -2.765 9.336) 10.813 3.454 ( 0.414 5.063 -3.349) 6.085 3.776 ( 2.322 -3.608 1.199) 4.455 4.023 ( 0.696 -1.365 -12.456) 12.550 4.124 ( 3.829 -2.724 -7.496) 8.847 4.335 ( 8.432 7.609 -2.673) 11.668 4.636 ( 0.208 11.330 0.565) 11.346 4.747 ( -0.102 4.292 1.345) 4.499 4.805 ( -1.265 2.347 -0.413) 2.698 5.107 ( 1.570 -2.472 -3.703) 4.721 5.311 ( -2.427 -1.037 4.655) 5.351 5.444 ( -3.461 9.036 -0.892) 9.718 5.714 ( 2.164 -1.132 7.783) 8.158 6.772 ( -1.041 -3.268 -1.978) 3.959 6.837 ( 1.199 -0.785 -1.246) 1.899 7.282 ( 0.802 2.924 -4.284) 5.248 7.353 ( 4.115 -0.587 -1.038) 4.284 7.490 ( 4.587 -3.552 -1.755) 6.061 7.729 ( 9.711 -10.367 -3.379) 14.601 7.773 ( -0.621 -4.338 3.581) 5.659 7.882 ( 3.426 -6.095 -0.325) 7.000 8.457 ( -1.497 6.259 -1.440) 6.595 8.615 ( -6.877 7.063 -4.231) 10.728 8.780 ( 0.656 3.800 4.436) 5.878 8.990 ( 2.815 1.204 -2.433) 3.910 9.626 ( -3.504 1.391 0.589) 3.816 9.675 ( -1.497 0.372 1.161) 1.930 10.845 ( 1.653 0.799 -0.528) 1.910 10.987 ( 3.083 -4.606 -0.503) 5.565 11.470 ( -2.515 7.025 0.733) 7.498 11.663 ( 0.264 4.199 -0.268) 4.216 11.757 ( 3.402 0.956 0.615) 3.587 11.862 ( 2.695 1.941 0.817) 3.420 12.075 ( -1.814 0.494 4.295) 4.689 12.182 ( -1.718 -2.359 1.040) 3.098 12.789 ( -8.691 5.552 -4.200) 11.135 13.321 ( 1.801 -10.014 1.648) 10.308 13.765 ( -11.173 4.563 2.920) 12.417 13.840 ( -8.601 0.523 3.258) 9.213 17.635 ( -0.172 1.882 0.103) 1.893 17.717 ( 1.012 0.218 0.285) 1.074 18.207 ( -10.525 9.302 3.368) 14.445 18.327 ( -9.061 3.175 1.839) 9.776 18.787 ( 4.254 4.484 1.280) 6.312 18.925 ( -0.975 1.940 3.831) 4.403 19.011 ( -2.461 -0.480 4.408) 5.071 19.052 ( -3.228 -2.939 1.145) 4.513 20.722 ( 8.512 -1.115 -8.663) 12.196 20.965 ( 12.634 -8.745 -6.138) 16.546 21.260 ( -0.692 -0.191 -0.709) 1.009 21.340 ( 1.019 -1.959 0.333) 2.233 ======================= Grid point 141 (73/170) ======================= q-point: (-0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -0.648 22.112 4.775) 22.631 2.019 ( -10.214 21.434 5.702) 24.419 2.701 ( -3.206 -1.367 -0.002) 3.485 2.756 ( -3.581 -3.493 -1.565) 5.242 2.853 ( 4.867 -4.672 -0.306) 6.754 2.892 ( 3.345 -2.667 4.185) 5.985 2.969 ( 5.738 -6.484 -1.694) 8.822 3.178 ( -6.317 2.634 -3.291) 7.595 3.365 ( 1.620 -5.222 -4.830) 7.296 3.425 ( 3.258 1.019 -2.618) 4.302 3.440 ( -0.753 -1.287 2.204) 2.662 3.776 ( -1.492 -6.267 -3.756) 7.457 3.962 ( 1.873 0.076 -3.755) 4.197 4.140 ( 1.918 -4.866 1.970) 5.589 4.435 ( 6.534 11.028 -2.245) 13.014 4.649 ( 1.634 12.578 -1.693) 12.796 4.757 ( -3.573 5.770 0.796) 6.834 4.836 ( 7.169 0.392 3.253) 7.882 5.109 ( 1.857 3.027 -1.153) 3.734 5.253 ( -8.110 -1.189 1.991) 8.435 5.408 ( -1.278 9.342 -0.167) 9.431 5.809 ( 1.197 -2.612 3.900) 4.844 6.751 ( -0.872 -4.963 0.206) 5.043 6.815 ( 0.231 -4.826 -4.137) 6.361 7.260 ( 2.007 4.943 -1.578) 5.563 7.425 ( 3.675 2.090 0.799) 4.303 7.534 ( 3.187 -2.314 0.338) 3.952 7.749 ( -2.534 1.570 0.741) 3.072 7.938 ( 14.622 -14.043 1.441) 20.324 7.955 ( 5.351 -5.596 0.176) 7.744 8.345 ( -10.901 8.619 -0.924) 13.927 8.536 ( 1.273 9.867 -2.407) 10.236 8.783 ( -4.687 1.178 2.174) 5.299 9.041 ( 5.644 0.859 -1.732) 5.966 9.565 ( -4.150 2.077 0.260) 4.648 9.665 ( -0.882 -1.318 0.413) 1.639 10.877 ( 2.778 1.328 -0.228) 3.088 11.026 ( 1.299 -5.151 1.340) 5.478 11.469 ( 1.512 4.684 0.210) 4.926 11.678 ( 2.465 3.544 -1.003) 4.432 11.802 ( 4.068 -2.002 -2.962) 5.416 11.896 ( 1.795 2.583 0.294) 3.159 12.103 ( -0.121 -2.431 2.734) 3.660 12.153 ( -2.054 -3.414 -0.694) 4.044 12.644 ( -7.207 9.860 0.911) 12.247 13.331 ( -4.081 -10.373 1.647) 11.268 13.584 ( -12.740 4.668 -0.462) 13.576 13.721 ( -7.641 -2.265 0.209) 7.972 17.646 ( 0.223 2.928 1.483) 3.289 17.738 ( 0.588 1.170 1.063) 1.687 18.040 ( -12.496 5.728 1.257) 13.804 18.241 ( -3.595 -3.600 -0.620) 5.125 18.834 ( 2.199 1.703 -1.931) 3.386 18.933 ( -1.553 0.397 0.772) 1.779 18.993 ( -4.115 -1.282 2.692) 5.082 19.032 ( -1.026 -3.004 0.825) 3.280 20.791 ( 7.759 6.648 -2.404) 10.496 21.115 ( 11.622 -5.138 -1.986) 12.861 21.246 ( -0.098 0.660 -0.416) 0.786 21.360 ( 1.213 -1.694 0.196) 2.093 ======================= Grid point 142 (74/170) ======================= q-point: (-0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -2.386 23.385 3.810) 23.813 2.006 ( -3.404 25.059 7.789) 26.461 2.573 ( -10.460 9.800 6.507) 15.741 2.708 ( -0.634 -3.322 -2.419) 4.158 2.851 ( 0.510 -3.714 -4.356) 5.747 2.993 ( 3.645 -1.377 -6.283) 7.393 3.032 ( 5.663 -4.890 0.100) 7.483 3.160 ( 2.096 -7.681 2.769) 8.430 3.333 ( 1.949 -5.874 -3.764) 7.244 3.425 ( 0.068 1.674 -3.139) 3.558 3.486 ( 3.946 -4.643 0.693) 6.132 3.670 ( -3.185 -9.303 -4.692) 10.895 3.988 ( 1.745 3.169 4.054) 5.433 4.221 ( -1.673 -4.265 11.980) 12.826 4.500 ( 4.614 9.892 -2.647) 11.232 4.649 ( 2.476 12.004 -2.492) 12.507 4.767 ( -0.560 5.828 7.302) 9.359 4.944 ( 1.779 -0.728 -2.859) 3.445 5.073 ( -6.769 1.528 3.293) 7.681 5.186 ( 0.265 5.742 -0.183) 5.751 5.394 ( 0.042 10.486 -0.473) 10.497 5.827 ( -0.027 -3.018 -2.280) 3.783 6.725 ( -0.469 -4.798 -3.740) 6.102 6.789 ( 0.525 -5.780 -1.237) 5.934 7.315 ( 3.429 5.330 3.635) 7.306 7.477 ( 1.233 2.596 2.314) 3.690 7.624 ( 5.142 0.855 3.329) 6.185 7.706 ( -2.748 4.028 0.170) 4.878 8.019 ( 1.571 -3.011 1.011) 3.544 8.151 ( -12.102 7.848 1.623) 14.515 8.194 ( 12.519 -12.641 1.588) 17.862 8.546 ( 3.111 7.957 -2.983) 9.049 8.713 ( -5.209 -0.552 1.086) 5.349 9.095 ( 3.889 1.771 -3.146) 5.307 9.516 ( -2.450 1.984 0.389) 3.177 9.652 ( -0.529 -2.909 -1.041) 3.134 10.912 ( 1.837 1.183 -1.160) 2.474 11.073 ( 0.530 -5.264 5.219) 7.432 11.500 ( 3.035 2.893 -1.652) 4.507 11.700 ( 2.344 4.322 -3.046) 5.784 11.834 ( 4.493 -5.337 -4.020) 8.052 11.931 ( 2.047 0.801 -0.563) 2.269 12.101 ( -1.230 -4.589 -1.317) 4.930 12.127 ( -0.061 -3.031 -0.024) 3.032 12.577 ( -5.525 12.100 4.728) 14.117 13.232 ( -8.176 -6.612 1.176) 10.581 13.386 ( -9.005 5.397 -2.687) 10.837 13.635 ( -2.457 -6.358 -1.774) 7.043 17.662 ( -0.450 3.960 1.036) 4.118 17.760 ( 0.508 1.530 1.492) 2.196 17.870 ( -8.756 3.605 -0.663) 9.493 18.186 ( -1.340 -8.627 -2.260) 9.018 18.827 ( 1.431 0.545 -4.092) 4.369 18.904 ( -1.118 -1.575 -1.462) 2.423 18.955 ( -2.844 -0.651 0.374) 2.941 19.014 ( -0.578 -3.300 -2.243) 4.032 20.903 ( 4.499 11.459 4.750) 13.195 21.238 ( 1.578 0.721 0.591) 1.833 21.269 ( 4.586 -2.079 0.833) 5.103 21.393 ( 2.744 -2.143 1.157) 3.668 ======================= Grid point 143 (75/170) ======================= q-point: ( 0.00 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( -3.056 14.462 -5.701) 15.843 2.320 ( -4.731 11.192 -3.314) 12.595 2.540 ( -0.943 -6.285 -1.061) 6.443 2.677 ( -1.935 -8.136 2.717) 8.793 2.832 ( -0.591 4.103 -7.065) 8.192 2.929 ( 1.096 3.888 -5.143) 6.540 2.960 ( -0.961 -4.326 0.112) 4.433 3.074 ( 2.908 -2.449 -1.647) 4.143 3.281 ( 2.982 -3.216 3.457) 5.584 3.309 ( 3.434 -5.449 4.432) 7.819 3.487 ( 1.172 1.274 -2.754) 3.253 3.544 ( 4.748 -5.175 -0.505) 7.041 4.171 ( -0.449 2.761 14.818) 15.080 4.246 ( -2.259 -5.232 16.043) 17.025 4.730 ( 0.046 9.110 -3.984) 9.943 4.843 ( -1.539 -3.262 -3.720) 5.182 4.958 ( 2.652 14.311 2.853) 14.832 4.990 ( -1.205 9.674 6.994) 11.998 5.057 ( -2.383 -0.639 5.241) 5.793 5.247 ( -0.140 -5.943 1.538) 6.140 5.547 ( -0.030 7.368 -2.326) 7.726 5.681 ( -0.977 -6.234 -4.682) 7.857 6.636 ( 1.373 0.400 -3.598) 3.872 6.688 ( 1.944 -4.543 -2.700) 5.631 7.507 ( 0.934 4.116 7.371) 8.494 7.558 ( 0.805 -0.898 6.598) 6.707 7.771 ( -2.051 5.454 1.536) 6.026 7.810 ( -1.888 3.355 0.731) 3.919 8.023 ( -0.263 0.077 1.384) 1.411 8.116 ( -2.620 -8.127 -0.451) 8.551 8.161 ( -0.158 8.458 1.537) 8.598 8.375 ( 2.856 -13.455 -0.499) 13.764 8.864 ( 0.889 11.186 -2.369) 11.468 9.040 ( 1.348 -6.701 -4.678) 8.282 9.537 ( -0.482 2.485 -0.540) 2.588 9.580 ( -0.364 -2.039 -1.527) 2.573 10.966 ( -0.302 3.754 2.826) 4.709 11.048 ( -0.846 -4.816 6.235) 7.924 11.601 ( 1.548 4.900 -0.151) 5.141 11.713 ( 2.244 -6.186 -2.249) 6.954 11.776 ( -0.253 6.205 -6.622) 9.079 11.879 ( 1.200 -3.399 -7.355) 8.191 12.016 ( -1.767 -1.175 -0.673) 2.226 12.043 ( -1.655 -3.165 -1.302) 3.801 12.821 ( -1.062 12.580 4.352) 13.354 13.041 ( -0.613 -9.962 2.779) 10.360 13.377 ( 0.645 4.665 -3.764) 6.028 13.466 ( 0.325 -5.105 -3.400) 6.142 17.720 ( -2.007 3.279 -0.802) 3.928 17.759 ( -2.555 -0.629 -0.626) 2.705 17.878 ( 1.556 4.335 -0.088) 4.607 17.986 ( 1.223 -7.258 -2.029) 7.635 18.808 ( 1.056 1.098 -4.681) 4.923 18.838 ( 0.828 -1.825 -4.420) 4.853 18.916 ( -1.062 0.166 -0.727) 1.298 18.930 ( -0.675 -1.391 -1.597) 2.223 21.222 ( 0.682 8.155 7.393) 11.028 21.281 ( 0.122 2.127 0.410) 2.170 21.291 ( 0.323 -1.305 1.621) 2.106 21.378 ( 0.024 -5.541 3.994) 6.830 ======================= Grid point 144 (76/170) ======================= q-point: ( 0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( -1.893 11.889 -3.990) 12.683 2.245 ( -0.877 1.237 -2.822) 3.204 2.518 ( -0.501 -2.135 -0.468) 2.243 2.656 ( -2.472 -10.281 1.356) 10.661 2.760 ( -1.133 7.378 -2.193) 7.780 2.874 ( -1.353 0.626 -4.528) 4.767 2.947 ( 0.378 0.749 -1.206) 1.469 3.072 ( 3.271 -6.126 -6.465) 9.489 3.347 ( 1.299 -0.278 1.553) 2.043 3.385 ( 0.052 -4.469 1.752) 4.800 3.511 ( 3.534 4.983 0.900) 6.175 3.621 ( 3.084 -6.410 -1.233) 7.220 4.330 ( -1.327 1.512 15.494) 15.624 4.374 ( -2.356 -3.067 12.841) 13.411 4.711 ( 0.669 5.506 -0.842) 5.610 4.786 ( -2.099 -2.378 -1.683) 3.591 5.004 ( -3.652 18.047 7.569) 19.907 5.029 ( -2.955 5.942 4.484) 8.009 5.088 ( 0.237 0.056 2.070) 2.084 5.244 ( -3.498 -4.774 4.015) 7.151 5.518 ( 0.263 5.267 -2.562) 5.863 5.607 ( -0.924 -4.037 -5.097) 6.568 6.645 ( 5.016 1.083 -3.364) 6.136 6.705 ( 4.692 -4.832 -3.225) 7.467 7.585 ( -2.735 5.617 7.848) 10.031 7.614 ( -5.097 2.811 4.505) 7.361 7.703 ( -7.828 1.763 4.312) 9.109 7.760 ( -3.617 0.049 1.209) 3.814 7.935 ( -9.356 -5.005 0.841) 10.644 7.947 ( -10.178 -5.997 0.096) 11.814 8.343 ( 13.293 7.668 1.707) 15.440 8.512 ( 10.337 -9.466 -0.574) 14.028 8.839 ( -0.331 9.454 -2.230) 9.719 8.987 ( -0.683 -5.487 -4.982) 7.443 9.540 ( 1.870 1.858 -0.833) 2.765 9.571 ( 1.651 -1.512 -1.737) 2.833 10.995 ( -1.533 5.038 4.565) 6.969 11.095 ( -3.042 -5.410 7.301) 9.582 11.559 ( -4.084 6.059 -3.475) 8.091 11.654 ( -3.505 -2.594 -4.639) 6.366 11.766 ( 8.762 4.789 -6.740) 12.048 11.870 ( 6.174 -4.668 -5.943) 9.759 11.942 ( -5.222 0.248 -1.777) 5.522 11.995 ( -2.989 -4.986 -0.390) 5.826 12.893 ( 2.605 10.569 6.260) 12.558 13.093 ( 2.132 -10.165 3.546) 10.975 13.399 ( 7.914 4.303 -5.648) 10.633 13.473 ( 6.062 -3.664 -4.868) 8.595 17.685 ( -0.726 2.552 -0.389) 2.682 17.722 ( -0.721 -1.156 -0.707) 1.535 17.941 ( 6.277 3.898 -0.934) 7.447 18.018 ( 5.639 -4.589 -2.770) 7.780 18.770 ( 1.389 0.898 -5.421) 5.667 18.791 ( 0.814 -0.966 -5.972) 6.104 18.911 ( 0.498 -0.279 0.361) 0.676 18.921 ( 0.766 -1.317 -0.205) 1.538 21.262 ( -6.296 4.639 7.483) 10.824 21.276 ( -1.781 1.197 0.894) 2.325 21.304 ( -0.658 0.931 1.816) 2.144 21.386 ( -5.118 -4.424 4.331) 8.033 ======================= Grid point 145 (77/170) ======================= q-point: ( 0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( 2.886 7.315 2.225) 8.173 2.235 ( 2.947 -5.773 -1.506) 6.654 2.516 ( -0.502 2.239 1.224) 2.601 2.646 ( -2.101 -7.279 3.123) 8.195 2.728 ( -2.009 4.266 -0.170) 4.718 2.802 ( -2.413 -1.238 -2.653) 3.794 2.948 ( 1.969 5.672 -2.084) 6.355 3.061 ( 4.522 -4.724 -5.949) 8.841 3.372 ( 0.110 -1.224 -0.392) 1.290 3.378 ( 0.533 -2.035 -1.250) 2.447 3.528 ( -2.364 0.696 -1.769) 3.034 3.582 ( -2.305 -4.382 -5.599) 7.474 4.428 ( -2.998 2.990 7.341) 8.475 4.474 ( -0.828 -1.301 11.076) 11.183 4.713 ( -2.042 2.713 2.369) 4.140 4.744 ( -3.204 -0.576 2.235) 3.948 4.977 ( -5.662 10.760 -0.888) 12.191 5.025 ( -3.851 10.929 6.233) 13.158 5.096 ( -1.255 -0.465 1.269) 1.844 5.227 ( -4.491 -5.850 3.522) 8.172 5.511 ( 1.084 3.227 -1.360) 3.666 5.559 ( 0.250 -1.708 -1.918) 2.580 6.709 ( 6.062 0.638 -2.348) 6.532 6.754 ( 4.972 -3.842 -2.531) 6.774 7.495 ( -10.244 3.876 1.421) 11.045 7.553 ( -7.752 1.867 0.253) 7.978 7.651 ( -6.941 -1.285 6.804) 9.804 7.710 ( -5.274 -3.310 1.531) 6.412 7.839 ( -4.678 -3.044 3.927) 6.824 7.853 ( -4.385 -3.631 1.051) 5.789 8.539 ( 8.438 6.670 1.067) 10.808 8.656 ( 8.425 -5.147 1.039) 9.928 8.818 ( 0.590 7.716 -1.592) 7.901 8.939 ( 1.232 -4.439 -3.163) 5.588 9.571 ( 2.920 1.297 -0.994) 3.346 9.590 ( 2.593 -0.709 -1.330) 2.999 11.006 ( -4.076 4.867 5.236) 8.229 11.102 ( -6.238 -5.185 6.877) 10.635 11.468 ( 1.128 7.149 -7.361) 10.323 11.561 ( 0.481 -2.111 -7.394) 7.704 11.821 ( -1.764 2.567 -3.801) 4.914 11.826 ( 1.044 1.199 -3.135) 3.515 11.904 ( 1.270 -0.843 -0.083) 1.527 11.976 ( 2.732 -6.471 -1.173) 7.121 13.041 ( 5.507 7.084 8.943) 12.669 13.183 ( 3.212 -7.795 5.742) 10.200 13.471 ( 10.044 3.592 -8.322) 13.529 13.528 ( 8.314 -2.544 -6.844) 11.065 17.696 ( 0.821 1.565 2.029) 2.691 17.724 ( 0.486 -1.342 1.307) 1.935 18.046 ( 9.786 4.037 -3.002) 11.003 18.092 ( 8.472 -0.969 -4.189) 9.501 18.735 ( 0.776 0.743 -4.118) 4.256 18.746 ( 1.453 -0.267 -4.583) 4.815 18.933 ( 1.433 -0.254 0.578) 1.566 18.946 ( 2.221 -1.712 0.430) 2.837 21.203 ( -10.257 2.499 5.661) 11.979 21.234 ( -7.452 -0.829 3.240) 8.168 21.300 ( -1.890 0.407 1.230) 2.292 21.328 ( -4.803 -2.184 0.957) 5.362 ======================= Grid point 146 (78/170) ======================= q-point: ( 0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 4.950 2.738 6.112) 8.328 2.306 ( 4.887 -7.021 2.789) 8.998 2.499 ( -3.527 3.374 -0.347) 4.893 2.614 ( -7.316 -6.653 1.182) 9.959 2.714 ( 1.304 4.194 1.668) 4.698 2.770 ( 1.671 -1.713 -0.185) 2.400 2.957 ( 2.271 9.461 -2.624) 10.078 3.087 ( 4.797 -3.645 -3.388) 6.912 3.326 ( -1.851 2.516 -4.890) 5.802 3.382 ( -0.278 -3.034 0.074) 3.047 3.427 ( -4.500 -2.326 -3.019) 5.896 3.480 ( -1.121 -5.543 -5.835) 8.126 4.453 ( -2.283 7.830 6.010) 10.131 4.566 ( -1.299 -3.408 8.560) 9.305 4.683 ( -4.881 3.635 0.666) 6.123 4.720 ( -3.469 -0.200 1.485) 3.779 4.855 ( -6.060 12.875 -2.151) 14.391 5.012 ( -1.973 3.831 -0.301) 4.320 5.073 ( -5.068 -3.860 2.553) 6.863 5.170 ( -4.370 -7.571 -1.141) 8.816 5.503 ( -0.123 3.980 -0.807) 4.063 5.566 ( 0.345 -2.287 0.787) 2.443 6.752 ( 3.132 2.144 -2.940) 4.802 6.806 ( 4.526 -3.519 -1.071) 5.833 7.359 ( -8.595 2.333 1.126) 8.976 7.417 ( -7.505 -2.417 -0.965) 7.944 7.642 ( -2.857 -1.532 2.806) 4.287 7.650 ( -2.408 -2.658 1.245) 3.797 7.802 ( -3.984 -1.030 0.922) 4.217 7.813 ( -3.966 -2.806 2.390) 5.414 8.630 ( 2.266 8.391 1.249) 8.781 8.753 ( -0.142 -2.249 1.236) 2.570 8.873 ( 8.988 4.532 0.015) 10.066 8.971 ( 5.442 -3.894 -0.672) 6.725 9.596 ( 1.552 1.430 -1.126) 2.392 9.613 ( 1.614 -0.318 -0.895) 1.873 10.988 ( -4.823 3.450 4.762) 7.605 11.056 ( -6.842 -3.455 4.187) 8.734 11.422 ( 2.661 4.821 -7.220) 9.080 11.490 ( 1.077 -2.085 -8.689) 9.000 11.755 ( -1.851 4.459 1.654) 5.103 11.823 ( -0.405 -2.310 1.545) 2.808 11.935 ( 3.283 2.823 -2.237) 4.873 12.020 ( 3.686 -5.267 -1.424) 6.585 13.250 ( 6.358 4.203 10.869) 13.275 13.325 ( 4.263 -3.513 8.308) 9.977 13.517 ( 8.673 2.543 -9.578) 13.169 13.564 ( 6.850 -2.300 -8.339) 11.034 17.742 ( 0.843 0.716 3.114) 3.304 17.757 ( 0.541 -0.900 2.449) 2.665 18.175 ( 10.175 4.349 -2.794) 11.413 18.193 ( 10.307 2.513 -3.793) 11.267 18.711 ( 0.595 1.632 -1.833) 2.525 18.739 ( 2.224 -0.976 -2.140) 3.237 18.966 ( 1.889 0.815 0.794) 2.206 18.997 ( 3.284 -2.287 0.574) 4.043 21.064 ( -12.389 0.713 1.817) 12.541 21.101 ( -12.410 -3.086 2.191) 12.974 21.279 ( -1.748 -0.529 0.366) 1.862 21.282 ( -1.704 -0.868 -0.224) 1.926 ======================= Grid point 147 (79/170) ======================= q-point: ( 0.36 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( 2.929 1.524 5.940) 6.796 2.385 ( -0.894 -2.495 -5.222) 5.856 2.447 ( -1.680 -0.555 9.505) 9.668 2.496 ( -6.487 -4.001 1.963) 7.871 2.788 ( 4.479 3.482 1.963) 6.004 2.832 ( 4.990 -0.585 -0.526) 5.052 2.959 ( 2.170 8.097 -2.605) 8.778 3.085 ( -1.317 -3.768 -4.208) 5.800 3.257 ( 2.369 6.727 -4.101) 8.227 3.350 ( -2.930 -2.156 -1.483) 3.929 3.368 ( -2.456 -2.940 0.978) 3.953 3.442 ( 2.032 -7.545 -2.364) 8.164 4.497 ( -1.028 7.244 6.141) 9.552 4.554 ( -6.362 7.428 -5.732) 11.337 4.619 ( -2.937 -3.697 4.852) 6.770 4.656 ( -4.559 -3.614 0.433) 5.834 4.782 ( -1.699 7.792 -0.982) 8.036 4.965 ( -2.440 -0.601 -1.451) 2.901 4.974 ( -5.617 -4.219 -4.757) 8.484 5.086 ( -3.480 -6.514 -1.247) 7.489 5.499 ( -0.381 4.413 0.907) 4.521 5.575 ( -0.350 -3.136 1.111) 3.346 6.773 ( 3.470 6.149 -1.546) 7.228 6.882 ( 5.909 -5.053 0.262) 7.780 7.248 ( -6.434 1.644 0.136) 6.642 7.303 ( -6.108 -3.312 -0.680) 6.981 7.606 ( -0.412 -0.170 -3.765) 3.791 7.638 ( -0.520 -3.858 -2.295) 4.520 7.760 ( -3.311 -0.584 2.545) 4.217 7.776 ( -3.326 -3.002 2.202) 4.992 8.645 ( -0.209 8.804 -1.190) 8.886 8.743 ( -1.604 0.230 0.774) 1.795 9.010 ( 7.803 2.187 -1.459) 8.234 9.072 ( 5.691 -2.998 0.796) 6.482 9.599 ( -0.002 1.631 0.042) 1.632 9.616 ( -0.333 -0.222 -0.047) 0.403 10.966 ( -3.447 1.403 2.637) 4.561 10.994 ( -4.551 -1.345 1.195) 4.894 11.400 ( 1.700 1.224 -1.679) 2.684 11.419 ( 0.479 -0.654 -4.504) 4.577 11.788 ( 1.344 4.483 3.001) 5.560 11.855 ( 0.517 -2.585 3.000) 3.994 11.952 ( 2.016 5.370 -1.622) 5.961 12.054 ( 2.352 -4.922 -0.639) 5.493 13.408 ( 2.670 2.394 -2.428) 4.331 13.427 ( 2.311 0.622 -1.213) 2.683 13.596 ( 6.292 -0.372 4.336) 7.650 13.600 ( 6.359 -0.789 1.701) 6.630 17.773 ( -0.103 0.236 0.802) 0.842 17.779 ( 0.072 -0.389 0.129) 0.416 18.302 ( 7.322 6.322 1.756) 9.832 18.337 ( 8.758 3.482 1.848) 9.604 18.711 ( 0.633 2.560 -0.249) 2.649 18.767 ( 2.726 -2.287 -0.180) 3.563 19.012 ( 2.579 2.284 1.066) 3.606 19.052 ( 2.598 -1.548 0.418) 3.053 20.872 ( -10.142 -1.135 -3.342) 10.739 20.912 ( -10.891 -5.226 -2.535) 12.344 21.259 ( -1.299 -0.870 0.664) 1.699 21.261 ( -1.066 -0.979 0.235) 1.466 ======================= Grid point 148 (80/170) ======================= q-point: ( 0.45 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( -2.864 3.040 -5.073) 6.571 2.345 ( -3.178 -3.079 -1.408) 4.643 2.526 ( -0.924 0.296 10.363) 10.408 2.561 ( -0.707 -3.889 10.758) 11.461 2.843 ( 0.424 5.311 -3.482) 6.365 2.879 ( 4.196 2.218 -2.313) 5.280 2.990 ( 3.321 1.400 -0.337) 3.619 3.030 ( 1.893 -1.631 -1.379) 2.854 3.274 ( -2.031 6.879 -0.957) 7.236 3.287 ( 0.975 0.902 -1.701) 2.158 3.341 ( -2.120 -1.907 1.417) 3.184 3.479 ( 3.486 -9.189 0.672) 9.851 4.386 ( -3.456 5.720 -8.190) 10.570 4.499 ( -5.066 -4.820 -4.881) 8.528 4.580 ( 0.446 1.958 3.866) 4.356 4.664 ( -3.685 -5.565 5.612) 8.720 4.722 ( -0.087 2.993 -7.867) 8.418 4.828 ( -2.407 -6.588 -6.701) 9.701 4.932 ( 1.731 7.315 -2.230) 7.841 5.062 ( -0.014 -5.218 1.921) 5.561 5.515 ( -0.136 4.305 2.950) 5.221 5.587 ( -0.584 -2.801 2.306) 3.675 6.831 ( 3.502 9.604 1.540) 10.338 6.987 ( 4.133 -5.742 2.657) 7.557 7.162 ( -2.578 0.118 -2.000) 3.265 7.203 ( -4.480 -3.509 -1.933) 6.010 7.549 ( 1.239 -0.438 -6.841) 6.966 7.581 ( -0.110 -3.828 -6.480) 7.527 7.746 ( -2.326 -0.355 2.399) 3.360 7.764 ( -1.708 -2.885 2.423) 4.137 8.610 ( -0.406 8.757 -3.558) 9.461 8.722 ( -1.082 -1.529 -0.867) 2.064 9.063 ( 2.661 3.039 -4.194) 5.822 9.121 ( 0.992 -1.907 -2.090) 2.998 9.616 ( 0.320 1.094 2.518) 2.764 9.624 ( 0.398 0.104 2.391) 2.426 10.926 ( -2.112 0.415 -1.479) 2.612 10.939 ( -2.872 -0.884 -0.767) 3.101 11.434 ( 2.844 1.524 2.746) 4.237 11.458 ( 2.790 -0.958 5.337) 6.098 11.814 ( -1.290 4.159 0.817) 4.430 11.875 ( -1.330 -1.746 0.633) 2.285 11.991 ( 2.415 5.614 3.138) 6.870 12.090 ( 1.737 -4.235 1.428) 4.794 13.341 ( 0.210 1.733 -10.159) 10.307 13.366 ( -1.151 -0.951 -9.067) 9.189 13.757 ( 2.985 1.600 10.615) 11.142 13.774 ( 2.875 -0.160 10.858) 11.234 17.755 ( -0.920 0.228 -2.219) 2.413 17.759 ( -0.514 -0.186 -2.703) 2.757 18.444 ( 3.153 7.631 8.124) 11.583 18.498 ( 3.714 4.083 9.053) 10.603 18.718 ( 0.253 3.530 0.013) 3.539 18.809 ( 1.615 -3.739 1.318) 4.281 19.061 ( 1.265 2.439 0.527) 2.798 19.075 ( 0.082 0.863 0.363) 0.940 20.700 ( -2.854 -3.767 -8.026) 9.314 20.724 ( -4.773 -6.339 -7.951) 11.233 21.253 ( -0.611 -0.978 0.845) 1.429 21.255 ( -0.364 -1.135 0.684) 1.374 ======================= Grid point 149 (81/170) ======================= q-point: (-0.45 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -0.583 3.506 -3.396) 4.916 2.276 ( -1.628 -3.197 -3.094) 4.738 2.591 ( -3.118 1.302 7.216) 7.968 2.649 ( -2.812 -4.412 8.026) 9.580 2.779 ( -3.235 5.870 -2.489) 7.149 2.880 ( -2.158 -3.904 0.331) 4.473 3.074 ( 7.161 1.159 -0.342) 7.263 3.083 ( 1.930 2.063 2.819) 3.991 3.216 ( -0.005 4.095 -2.913) 5.025 3.289 ( -1.416 -2.396 1.102) 2.993 3.370 ( 4.059 6.157 1.620) 7.550 3.552 ( 2.700 -8.839 3.091) 9.745 4.265 ( 0.132 3.158 -9.709) 10.211 4.358 ( -4.203 -6.233 -7.307) 10.484 4.513 ( -0.089 4.522 -12.738) 13.517 4.641 ( 2.619 -8.778 -6.165) 11.042 4.717 ( 0.858 4.401 3.731) 5.833 4.820 ( 5.728 -5.229 -0.313) 7.762 4.969 ( 2.638 7.630 1.964) 8.308 5.101 ( 1.960 -5.161 0.947) 5.601 5.557 ( -0.111 3.302 4.658) 5.711 5.602 ( -1.433 -1.155 2.882) 3.420 6.889 ( -1.096 8.818 3.974) 9.734 6.988 ( -6.853 -0.693 1.009) 6.961 7.146 ( 2.675 -1.654 -2.506) 4.022 7.189 ( 6.743 -6.019 -0.949) 9.089 7.497 ( 1.508 -1.819 -8.609) 8.927 7.509 ( 2.031 -2.134 -7.009) 7.603 7.738 ( -1.060 0.114 1.249) 1.642 7.765 ( -0.688 -3.104 1.075) 3.356 8.570 ( 0.690 7.494 -3.489) 8.295 8.691 ( 0.326 -3.951 -3.351) 5.191 9.014 ( -2.320 4.451 -3.877) 6.342 9.077 ( -1.978 -1.188 -2.919) 3.720 9.654 ( 0.282 1.311 3.001) 3.288 9.669 ( 0.653 -0.169 2.887) 2.965 10.878 ( -1.106 0.384 -2.215) 2.506 10.896 ( -0.135 -1.269 -2.091) 2.449 11.548 ( 4.582 2.637 5.884) 7.910 11.582 ( 2.736 -0.385 7.635) 8.120 11.783 ( -3.089 3.733 1.080) 4.965 11.830 ( -3.569 -0.692 -1.102) 3.799 12.070 ( 0.809 3.486 5.101) 6.232 12.133 ( 0.340 -2.783 2.870) 4.012 13.209 ( -3.470 1.133 -9.105) 9.810 13.238 ( -1.032 -1.859 -9.069) 9.315 13.886 ( -1.702 1.947 10.136) 10.460 13.901 ( -1.860 0.458 9.981) 10.163 17.708 ( -0.963 0.475 -2.887) 3.080 17.717 ( -0.378 -0.402 -2.975) 3.026 18.539 ( -4.416 8.718 8.695) 13.081 18.631 ( -4.192 1.920 12.846) 13.649 18.730 ( 1.698 6.000 1.196) 6.349 18.850 ( -0.101 -3.521 4.542) 5.748 19.027 ( -3.160 3.794 -1.041) 5.046 19.083 ( -1.471 -1.224 0.603) 2.006 20.610 ( 4.705 -4.960 -11.759) 13.602 20.626 ( 6.963 -6.251 -10.879) 14.350 21.257 ( 0.008 -0.678 0.669) 0.953 21.264 ( 0.436 -1.289 0.721) 1.540 ======================= Grid point 150 (82/170) ======================= q-point: (-0.36 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.156 ( -1.529 7.583 -1.419) 7.865 2.281 ( 4.025 -3.597 1.226) 5.536 2.584 ( -4.834 2.374 3.086) 6.207 2.648 ( -2.452 -3.699 1.398) 4.653 2.705 ( -3.358 3.372 -0.380) 4.774 2.825 ( -5.782 -7.857 1.404) 9.856 3.106 ( -1.648 7.834 1.594) 8.162 3.189 ( 5.379 -1.615 0.270) 5.623 3.230 ( 5.538 -0.309 -3.081) 6.345 3.298 ( -1.033 -4.852 4.558) 6.737 3.485 ( 5.097 6.788 4.237) 9.487 3.627 ( 1.839 -6.732 4.105) 8.097 4.148 ( 0.910 0.546 -14.253) 14.292 4.190 ( -0.934 -3.286 -14.469) 14.867 4.443 ( 6.419 10.530 -6.834) 14.100 4.658 ( 5.926 -10.755 -2.286) 12.490 4.791 ( 4.155 8.411 1.969) 9.585 4.877 ( 1.456 2.418 -2.135) 3.539 5.054 ( 2.521 -0.634 1.926) 3.235 5.140 ( 2.781 -7.192 1.733) 7.903 5.599 ( -2.305 2.295 2.944) 4.388 5.612 ( 0.043 0.700 4.750) 4.801 6.865 ( -6.796 2.020 -1.976) 7.360 6.874 ( -4.249 2.091 1.580) 4.992 7.221 ( 7.722 1.133 -0.098) 7.805 7.302 ( 6.924 -6.641 0.325) 9.600 7.421 ( 1.766 2.035 -8.163) 8.596 7.486 ( 4.087 -5.107 -6.315) 9.092 7.743 ( 0.105 0.226 0.987) 1.018 7.770 ( 0.535 -2.907 0.267) 2.968 8.563 ( 2.000 5.827 -1.801) 6.419 8.672 ( 2.340 -4.953 -3.529) 6.516 8.929 ( -4.541 6.753 -1.094) 8.211 9.014 ( -2.499 -1.916 -1.974) 3.717 9.675 ( -1.273 1.273 1.780) 2.532 9.691 ( -1.231 -0.308 1.695) 2.117 10.855 ( 1.023 1.363 -1.597) 2.336 10.891 ( 2.172 -2.345 -1.781) 3.659 11.639 ( -0.749 5.289 0.743) 5.393 11.696 ( 2.275 0.951 6.414) 6.872 11.754 ( -3.059 0.902 -1.533) 3.539 11.788 ( 0.612 -1.191 4.637) 4.826 12.110 ( -2.423 2.596 4.148) 5.460 12.154 ( -1.990 -1.991 3.005) 4.118 13.052 ( -4.671 4.132 -6.758) 9.196 13.150 ( -0.393 -6.104 -4.563) 7.631 13.916 ( -6.851 1.937 7.203) 10.127 13.928 ( -6.637 0.636 7.025) 9.685 17.672 ( -0.209 1.053 -1.606) 1.932 17.693 ( 0.506 -1.003 -1.407) 1.801 18.493 ( -10.062 8.154 4.790) 13.808 18.579 ( -13.865 -0.036 5.677) 14.982 18.816 ( 1.289 8.276 6.527) 10.619 18.912 ( -1.124 -0.396 7.505) 7.599 18.983 ( -1.489 0.271 0.840) 1.731 19.037 ( -4.126 -4.191 -0.149) 5.883 20.619 ( 12.734 -1.366 -11.896) 17.479 20.676 ( 14.119 -6.978 -10.682) 19.030 21.265 ( 0.333 0.133 0.187) 0.405 21.282 ( 0.961 -1.552 0.483) 1.888 ======================= Grid point 151 (83/170) ======================= q-point: (-0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( 0.010 15.594 2.893) 15.860 2.374 ( -0.103 0.873 6.300) 6.361 2.533 ( -1.802 -2.547 -0.476) 3.156 2.649 ( 1.069 -4.763 1.255) 5.040 2.698 ( 1.489 -1.118 2.828) 3.386 2.747 ( -3.079 -5.881 -0.964) 6.708 3.079 ( -1.973 8.570 -0.972) 8.848 3.232 ( 4.118 -6.501 -3.913) 8.633 3.282 ( 1.436 -0.090 -0.737) 1.617 3.330 ( -3.664 -4.298 5.841) 8.125 3.561 ( 0.502 6.275 -0.756) 6.340 3.685 ( 0.922 -6.284 0.508) 6.372 4.005 ( 2.603 0.777 -12.817) 13.102 4.056 ( 2.578 -4.005 -11.144) 12.119 4.554 ( 11.106 13.153 -0.132) 17.215 4.737 ( 2.273 -4.074 2.811) 5.447 4.849 ( -0.545 5.488 -2.221) 5.946 4.902 ( 9.329 5.406 -0.273) 10.786 5.038 ( -1.607 0.599 -2.871) 3.344 5.212 ( -0.856 -9.679 3.849) 10.451 5.593 ( -1.620 6.121 1.809) 6.585 5.673 ( 0.719 -2.795 4.724) 5.536 6.753 ( -3.557 1.522 -3.023) 4.910 6.804 ( -3.785 -2.799 -2.125) 5.165 7.344 ( 5.635 3.113 -2.493) 6.903 7.369 ( 6.105 2.402 -1.812) 6.806 7.426 ( 5.353 -2.156 -2.306) 6.215 7.516 ( 7.337 -9.282 -2.448) 12.082 7.764 ( 0.736 0.822 1.732) 2.054 7.798 ( 2.498 -2.886 1.064) 3.963 8.581 ( 0.910 6.317 -0.537) 6.405 8.670 ( -0.354 -1.962 -1.565) 2.535 8.866 ( -2.972 5.689 1.073) 6.507 8.963 ( -0.738 -3.744 -1.603) 4.139 9.653 ( -2.936 1.389 0.607) 3.304 9.673 ( -2.441 -0.606 0.928) 2.681 10.872 ( 2.537 1.976 -0.816) 3.318 10.918 ( 2.752 -2.899 -0.809) 4.079 11.594 ( -2.972 5.836 -0.846) 6.604 11.681 ( -2.131 -2.774 -1.291) 3.728 11.802 ( 2.858 4.137 2.452) 5.594 11.867 ( 3.318 -1.788 2.222) 4.375 12.092 ( -4.367 1.515 2.963) 5.490 12.133 ( -3.844 -2.569 1.767) 4.950 12.930 ( -4.127 9.076 -2.360) 10.246 13.121 ( -0.476 -10.675 -0.120) 10.687 13.830 ( -11.157 2.164 3.246) 11.819 13.849 ( -10.402 -0.016 3.253) 10.899 17.670 ( 0.771 1.810 0.242) 1.983 17.702 ( 1.317 -1.489 0.373) 2.023 18.347 ( -13.454 4.982 2.518) 14.566 18.382 ( -14.740 1.300 1.971) 14.928 18.868 ( -0.103 4.539 1.222) 4.701 18.961 ( -2.370 -0.167 0.507) 2.430 18.967 ( -3.496 -3.216 5.459) 7.236 18.996 ( -1.814 -1.419 4.005) 4.620 20.736 ( 15.518 2.628 -8.015) 17.662 20.821 ( 16.489 -6.218 -7.312) 19.079 21.271 ( 0.346 1.233 -0.139) 1.288 21.302 ( 1.080 -1.943 0.184) 2.231 ======================= Grid point 152 (84/170) ======================= q-point: (-0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( 3.411 19.441 4.124) 20.164 2.380 ( -5.599 16.006 6.410) 18.128 2.557 ( 3.324 -13.699 -0.445) 14.103 2.649 ( -3.754 -10.795 3.548) 11.967 2.760 ( 4.955 0.429 2.187) 5.433 2.816 ( 6.843 -4.774 1.386) 8.458 3.027 ( -1.922 10.397 -2.380) 10.838 3.215 ( -5.974 1.815 -4.658) 7.790 3.251 ( 3.431 -9.750 -3.466) 10.902 3.291 ( -3.748 -5.563 -1.433) 6.859 3.522 ( 0.188 5.097 -3.771) 6.343 3.638 ( -1.838 -7.245 -6.347) 9.806 3.977 ( 2.365 1.775 -0.637) 3.025 4.040 ( 1.619 -4.788 1.209) 5.197 4.716 ( 7.458 13.058 -0.367) 15.043 4.808 ( 3.881 2.765 2.930) 5.594 4.842 ( 1.699 4.917 0.506) 5.226 4.960 ( -4.082 10.398 -0.505) 11.182 5.072 ( 9.835 -6.473 -0.066) 11.774 5.175 ( -6.938 -6.836 1.751) 9.896 5.584 ( -0.920 8.686 0.055) 8.735 5.725 ( 0.543 -6.032 2.106) 6.412 6.690 ( -1.264 -0.735 -1.752) 2.282 6.726 ( -1.497 -4.024 -3.513) 5.547 7.365 ( 3.718 5.837 -2.526) 7.367 7.459 ( 2.617 -2.908 -1.963) 4.377 7.508 ( 9.080 4.530 1.865) 10.318 7.672 ( 11.050 -11.461 1.570) 15.997 7.807 ( 3.317 2.882 1.286) 4.578 7.872 ( 4.193 -3.799 1.946) 5.984 8.512 ( -9.987 8.279 0.188) 12.974 8.627 ( -3.883 -2.219 -1.055) 4.595 8.842 ( -0.754 6.942 0.391) 6.993 8.984 ( 4.876 -6.276 -1.456) 8.079 9.606 ( -3.245 2.192 0.231) 3.923 9.642 ( -2.412 -1.467 0.525) 2.871 10.909 ( 2.411 1.939 0.080) 3.095 10.952 ( 1.506 -2.815 0.871) 3.310 11.559 ( 0.366 4.996 -1.256) 5.165 11.657 ( 1.350 -4.833 -1.700) 5.298 11.842 ( 1.440 5.633 -1.218) 5.941 11.929 ( 3.106 -1.327 -0.412) 3.403 12.053 ( -3.608 -0.810 1.651) 4.049 12.090 ( -2.741 -3.194 0.870) 4.298 12.865 ( -3.963 12.756 1.380) 13.429 13.109 ( -2.756 -12.632 1.567) 13.024 13.654 ( -12.290 2.668 -0.277) 12.579 13.691 ( -10.855 -1.399 -0.154) 10.946 17.697 ( 1.283 2.465 1.473) 3.146 17.736 ( 1.417 -1.331 1.444) 2.422 18.135 ( -13.970 4.082 0.362) 14.559 18.193 ( -10.782 -2.198 -0.315) 11.009 18.861 ( -0.189 1.537 -1.430) 2.108 18.903 ( -2.216 -2.783 -1.254) 3.772 18.984 ( -2.531 0.402 2.831) 3.818 18.998 ( -2.084 -0.994 1.657) 2.842 20.912 ( 13.299 5.956 -1.964) 14.704 21.017 ( 14.376 -5.202 -2.021) 15.422 21.274 ( 0.256 2.130 -0.046) 2.145 21.319 ( 0.933 -2.433 0.121) 2.609 ======================= Grid point 153 (85/170) ======================= q-point: (-0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.258 ( -1.073 17.990 -1.367) 18.074 2.407 ( -1.064 16.456 2.129) 16.627 2.560 ( -0.484 -10.870 -0.511) 10.893 2.656 ( -2.746 -3.260 5.281) 6.787 2.861 ( 4.983 -0.425 -2.861) 5.762 2.908 ( 4.661 -5.070 0.245) 6.892 2.990 ( 0.084 6.208 -2.147) 6.569 3.082 ( -3.175 -0.162 -2.720) 4.183 3.215 ( -0.019 -5.886 -1.333) 6.035 3.266 ( 1.467 -11.794 -1.825) 12.024 3.499 ( 1.370 2.029 -3.226) 4.050 3.545 ( -0.854 -3.690 -4.366) 5.780 4.041 ( 0.231 2.692 8.396) 8.820 4.115 ( -1.076 -5.350 11.512) 12.740 4.774 ( 1.858 11.259 -3.534) 11.945 4.877 ( 2.242 9.920 0.607) 10.188 4.890 ( 1.341 2.936 0.743) 3.312 4.933 ( 0.178 4.657 3.273) 5.695 5.075 ( -6.927 -0.486 3.295) 7.686 5.199 ( 4.898 -6.710 0.886) 8.355 5.567 ( -0.071 8.973 -1.468) 9.092 5.728 ( -0.115 -7.270 -2.011) 7.544 6.661 ( -0.166 -1.060 -2.091) 2.350 6.692 ( 0.729 -3.934 -1.995) 4.471 7.417 ( 2.933 4.986 2.584) 6.335 7.489 ( 1.290 -2.077 2.463) 3.470 7.688 ( 9.724 6.872 2.548) 12.177 7.784 ( 1.120 1.478 1.592) 2.444 7.952 ( 3.884 -3.793 1.648) 5.673 7.970 ( 14.034 -8.295 0.228) 16.304 8.316 ( -14.144 9.288 0.770) 16.938 8.493 ( -10.252 -8.689 -1.395) 13.511 8.857 ( 2.219 11.083 -1.189) 11.365 9.038 ( 4.228 -7.095 -2.953) 8.771 9.563 ( -2.301 2.729 -0.028) 3.570 9.610 ( -1.825 -2.078 -0.421) 2.798 10.942 ( 0.877 2.098 1.062) 2.510 10.992 ( 0.495 -3.280 3.905) 5.124 11.571 ( 2.724 4.779 -1.530) 5.710 11.681 ( 4.032 -6.388 -2.222) 7.875 11.831 ( 0.170 6.006 -2.918) 6.680 11.940 ( 0.789 -3.199 -4.036) 5.210 12.028 ( -1.188 -0.373 1.108) 1.667 12.069 ( -0.619 -3.036 -0.528) 3.143 12.825 ( -4.017 13.376 2.993) 14.284 13.063 ( -4.692 -11.130 1.743) 12.203 13.471 ( -7.918 3.753 -2.440) 9.095 13.539 ( -5.922 -3.883 -2.067) 7.377 17.731 ( 0.503 3.116 1.227) 3.386 17.770 ( 0.518 -0.769 1.519) 1.779 17.945 ( -8.741 4.370 -1.250) 9.852 18.044 ( -5.836 -6.257 -1.910) 8.767 18.838 ( 0.326 0.905 -2.807) 2.967 18.866 ( -0.294 -1.980 -2.065) 2.876 18.954 ( -2.265 0.310 -0.642) 2.375 18.969 ( -1.547 -1.411 -1.457) 2.551 21.092 ( 7.728 8.043 3.708) 11.754 21.203 ( 8.058 -3.893 2.185) 9.212 21.279 ( 0.140 2.338 0.335) 2.366 21.337 ( 1.004 -3.486 0.770) 3.709 ======================= Grid point 198 (86/170) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 1.645 0.000 29.691) 29.737 1.389 ( 3.876 0.000 31.875) 32.110 2.338 ( -3.138 0.000 -19.759) 20.007 2.419 ( -7.004 0.000 45.881) 46.412 2.496 ( -1.724 0.000 -19.848) 19.923 3.018 ( 0.771 0.000 0.472) 0.904 3.250 ( -3.701 0.000 -0.120) 3.703 3.331 ( 0.541 0.000 -1.360) 1.464 3.381 ( 0.511 0.000 0.002) 0.511 3.646 ( 0.161 0.000 2.590) 2.595 3.784 ( -2.723 0.000 -9.534) 9.915 3.888 ( 5.109 0.000 5.153) 7.256 4.006 ( 6.703 0.000 -11.808) 13.578 4.095 ( -0.896 0.000 -5.785) 5.854 4.469 ( 5.807 0.000 6.776) 8.924 4.592 ( 0.149 0.000 -2.061) 2.066 4.682 ( 3.408 0.000 4.752) 5.847 4.964 ( -6.850 0.000 -6.334) 9.330 5.019 ( 3.808 0.000 7.481) 8.395 5.258 ( 1.155 0.000 1.390) 1.807 5.473 ( -8.346 0.000 9.341) 12.526 5.475 ( -0.616 0.000 -4.472) 4.514 6.595 ( 4.001 0.000 2.440) 4.686 6.886 ( 0.065 0.000 -3.969) 3.969 7.224 ( -3.818 0.000 4.536) 5.929 7.435 ( -1.435 0.000 -2.072) 2.521 7.512 ( 0.233 0.000 3.986) 3.993 7.620 ( 1.323 0.000 -0.867) 1.582 7.955 ( 1.601 0.000 6.425) 6.621 8.287 ( 1.345 0.000 4.356) 4.559 8.385 ( 4.080 0.000 -5.580) 6.912 8.454 ( 3.004 0.000 -9.261) 9.736 8.459 ( -1.335 0.000 6.087) 6.232 8.772 ( -9.352 0.000 -8.259) 12.477 9.512 ( -0.500 0.000 3.636) 3.671 9.705 ( 0.302 0.000 -6.354) 6.362 10.923 ( -0.699 0.000 0.761) 1.034 10.957 ( -0.059 0.000 -1.000) 1.002 11.478 ( 5.005 0.000 -1.039) 5.111 11.524 ( -2.034 0.000 -2.388) 3.137 12.014 ( -2.787 0.000 0.009) 2.787 12.030 ( 2.287 0.000 -0.829) 2.433 12.292 ( 0.695 0.000 0.661) 0.959 12.305 ( -0.719 0.000 0.110) 0.728 12.404 ( 0.989 0.000 8.596) 8.653 12.780 ( -1.498 0.000 -8.485) 8.616 13.528 ( -1.499 0.000 3.943) 4.218 13.745 ( 0.174 0.000 -5.657) 5.659 17.555 ( -0.179 0.000 2.575) 2.582 17.652 ( 0.206 0.000 -1.914) 1.925 17.885 ( 2.943 0.000 9.468) 9.915 18.488 ( -1.043 0.000 -18.648) 18.677 18.642 ( -0.987 0.000 0.167) 1.002 18.647 ( -0.952 0.000 -0.272) 0.990 19.039 ( 2.940 0.000 0.155) 2.944 19.045 ( -3.354 0.000 -0.412) 3.379 20.855 ( 4.098 0.000 16.690) 17.185 21.255 ( 0.174 0.000 2.597) 2.603 21.293 ( -0.842 0.000 -4.518) 4.596 21.425 ( -2.138 0.000 -5.193) 5.616 ======================= Grid point 199 (87/170) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( 10.319 0.000 25.602) 27.604 1.843 ( 10.259 0.000 27.677) 29.518 2.094 ( 2.780 0.000 -22.321) 22.493 2.240 ( 2.043 0.000 -22.940) 23.031 2.824 ( 2.450 0.000 24.692) 24.814 3.039 ( 0.072 0.000 1.643) 1.645 3.195 ( -2.630 0.000 1.434) 2.996 3.283 ( -6.136 0.000 1.178) 6.248 3.424 ( 1.612 0.000 5.691) 5.915 3.663 ( 0.647 0.000 -8.884) 8.907 3.683 ( -1.303 0.000 5.981) 6.121 3.957 ( 6.785 0.000 -15.977) 17.358 4.028 ( 1.726 0.000 -6.270) 6.503 4.039 ( 7.138 0.000 3.669) 8.026 4.538 ( 0.727 0.000 -0.193) 0.752 4.558 ( -3.551 0.000 -5.153) 6.258 4.687 ( -13.646 0.000 -4.948) 14.515 4.799 ( -1.020 0.000 7.408) 7.478 5.162 ( -5.675 0.000 -5.842) 8.144 5.183 ( 4.002 0.000 9.532) 10.338 5.338 ( -11.265 0.000 -2.444) 11.527 5.455 ( -5.518 0.000 7.314) 9.162 6.744 ( 6.595 0.000 6.071) 8.964 6.833 ( 0.942 0.000 -7.580) 7.638 7.249 ( -1.853 0.000 8.022) 8.233 7.384 ( -0.601 0.000 -2.571) 2.640 7.602 ( 4.908 0.000 3.354) 5.944 7.698 ( 7.995 0.000 -1.462) 8.127 8.109 ( 6.430 0.000 9.788) 11.712 8.270 ( -5.064 0.000 1.432) 5.263 8.290 ( 4.619 0.000 -16.812) 17.435 8.428 ( -1.040 0.000 -5.951) 6.041 8.592 ( 4.544 0.000 10.116) 11.089 8.630 ( 0.539 0.000 -3.750) 3.789 9.543 ( -1.210 0.000 3.344) 3.556 9.635 ( -1.038 0.000 -4.570) 4.687 10.923 ( -0.341 0.000 0.613) 0.701 10.945 ( -0.261 0.000 -0.086) 0.274 11.444 ( -3.379 0.000 -3.533) 4.889 11.504 ( -1.208 0.000 0.808) 1.453 11.921 ( -7.733 0.000 -0.126) 7.734 11.993 ( -5.573 0.000 -0.505) 5.596 12.238 ( -6.799 0.000 -0.085) 6.800 12.270 ( -2.693 0.000 0.505) 2.740 12.607 ( 9.535 0.000 9.747) 13.636 12.756 ( 9.624 0.000 -9.389) 13.445 13.599 ( 3.136 0.000 3.425) 4.644 13.695 ( 1.215 0.000 -4.488) 4.650 17.579 ( -0.279 0.000 2.387) 2.403 17.630 ( -0.172 0.000 -2.097) 2.104 18.024 ( -1.198 0.000 12.442) 12.500 18.212 ( -6.606 0.000 -17.400) 18.612 18.640 ( -0.092 0.000 0.871) 0.876 18.646 ( 0.276 0.000 0.125) 0.303 18.991 ( -3.443 0.000 0.187) 3.449 19.049 ( -1.248 0.000 0.099) 1.252 21.116 ( 6.976 0.000 12.751) 14.534 21.230 ( 2.425 0.000 -8.789) 9.118 21.298 ( 1.043 0.000 3.702) 3.846 21.354 ( -0.145 0.000 -4.182) 4.185 ======================= Grid point 200 (88/170) ======================= q-point: ( 0.18 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( 8.224 0.000 -17.057) 18.936 1.995 ( 8.375 0.000 -14.030) 16.340 2.198 ( 8.403 0.000 12.482) 15.047 2.292 ( 10.908 0.000 20.371) 23.107 2.984 ( 0.052 0.000 4.907) 4.907 3.012 ( -7.143 0.000 1.525) 7.304 3.155 ( -2.699 0.000 -3.148) 4.147 3.234 ( -0.790 0.000 3.514) 3.601 3.502 ( -7.376 0.000 4.352) 8.564 3.576 ( -0.883 0.000 -8.437) 8.483 3.735 ( -2.758 0.000 8.678) 9.106 3.879 ( 6.607 0.000 -16.625) 17.890 4.014 ( 4.880 0.000 -6.338) 7.999 4.126 ( 1.107 0.000 -1.145) 1.592 4.408 ( 2.711 0.000 1.102) 2.927 4.547 ( 1.230 0.000 -0.871) 1.507 4.604 ( -1.162 0.000 0.943) 1.496 4.750 ( -10.673 0.000 1.244) 10.745 5.037 ( -1.833 0.000 -3.626) 4.063 5.139 ( -3.991 0.000 -5.659) 6.925 5.342 ( 3.244 0.000 6.234) 7.028 5.426 ( -10.267 0.000 8.409) 13.271 6.773 ( 4.663 0.000 -9.425) 10.515 6.868 ( 1.271 0.000 2.587) 2.882 7.326 ( 0.870 0.000 6.452) 6.511 7.363 ( 0.774 0.000 -1.935) 2.084 7.730 ( 5.818 0.000 5.244) 7.832 7.784 ( 3.753 0.000 -1.464) 4.028 8.170 ( -6.504 0.000 3.377) 7.329 8.211 ( 7.800 0.000 -14.927) 16.842 8.325 ( -1.241 0.000 -6.920) 7.030 8.384 ( 9.216 0.000 9.352) 13.130 8.631 ( 2.662 0.000 -3.159) 4.131 8.759 ( 1.232 0.000 9.686) 9.765 9.524 ( -5.074 0.000 1.900) 5.418 9.581 ( -0.912 0.000 -2.299) 2.473 10.924 ( -0.062 0.000 0.136) 0.149 10.964 ( 2.028 0.000 1.646) 2.613 11.365 ( -1.124 0.000 -3.230) 3.420 11.472 ( -4.662 0.000 2.519) 5.300 11.790 ( -7.600 0.000 -1.361) 7.720 11.870 ( -8.805 0.000 -0.338) 8.812 12.126 ( -6.684 0.000 0.161) 6.686 12.226 ( -2.923 0.000 -0.348) 2.943 12.824 ( 11.354 0.000 -9.544) 14.832 12.888 ( 11.247 0.000 10.531) 15.407 13.668 ( 1.230 0.000 2.168) 2.493 13.698 ( 2.698 0.000 -0.323) 2.718 17.598 ( -0.406 0.000 1.997) 2.038 17.602 ( -0.392 0.000 -2.150) 2.186 17.948 ( -5.129 0.000 -11.768) 12.838 18.112 ( -5.666 0.000 13.009) 14.189 18.652 ( 0.226 0.000 0.254) 0.339 18.655 ( 0.287 0.000 1.296) 1.328 18.939 ( -2.682 0.000 -0.841) 2.811 19.019 ( -2.700 0.000 0.584) 2.762 21.180 ( 5.553 0.000 -11.597) 12.858 21.299 ( 3.446 0.000 3.914) 5.214 21.325 ( 1.189 0.000 -2.707) 2.957 21.389 ( 2.783 0.000 7.491) 7.991 ======================= Grid point 201 (89/170) ======================= q-point: ( 0.27 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 14.655 0.000 -17.286) 22.662 1.983 ( 14.414 0.000 -9.618) 17.329 2.451 ( 0.028 0.000 13.431) 13.431 2.592 ( 3.415 0.000 11.002) 11.520 2.915 ( -8.106 0.000 6.889) 10.638 2.989 ( -4.861 0.000 3.149) 5.792 3.060 ( -3.617 0.000 -3.636) 5.129 3.269 ( -12.221 0.000 -4.854) 13.150 3.272 ( -2.176 0.000 -1.072) 2.426 3.449 ( -3.384 0.000 -3.483) 4.856 3.777 ( -4.812 0.000 8.825) 10.052 3.802 ( 3.025 0.000 -10.987) 11.396 4.021 ( 5.330 0.000 -8.081) 9.680 4.158 ( 4.816 0.000 -3.367) 5.876 4.464 ( -2.396 0.000 -7.569) 7.939 4.550 ( 6.665 0.000 0.704) 6.702 4.640 ( 1.578 0.000 5.323) 5.552 4.713 ( 6.259 0.000 0.784) 6.308 5.067 ( 5.897 0.000 2.969) 6.602 5.072 ( 3.159 0.000 -7.858) 8.469 5.304 ( -9.020 0.000 -1.447) 9.135 5.426 ( -0.033 0.000 4.553) 4.553 6.794 ( 6.736 0.000 -3.666) 7.669 6.832 ( -7.460 0.000 1.260) 7.566 7.356 ( 0.519 0.000 -1.764) 1.839 7.392 ( 1.739 0.000 1.200) 2.113 7.795 ( 0.313 0.000 -0.023) 0.314 7.900 ( 6.619 0.000 6.200) 9.069 8.122 ( -5.678 0.000 5.668) 8.023 8.184 ( 3.238 0.000 -7.812) 8.457 8.258 ( 4.578 0.000 -9.257) 10.327 8.570 ( 3.605 0.000 3.135) 4.777 8.634 ( 2.602 0.000 -3.743) 4.559 8.810 ( -4.076 0.000 3.917) 5.653 9.454 ( -6.493 0.000 4.173) 7.718 9.556 ( -0.903 0.000 0.214) 0.928 10.933 ( 1.767 0.000 -0.415) 1.815 11.042 ( 4.729 0.000 2.099) 5.174 11.348 ( 1.640 0.000 -1.273) 2.076 11.425 ( -4.985 0.000 3.075) 5.857 11.656 ( -6.898 0.000 -2.274) 7.263 11.715 ( -9.701 0.000 -1.271) 9.784 12.053 ( -4.069 0.000 2.476) 4.763 12.176 ( -2.213 0.000 -1.031) 2.441 12.899 ( 11.064 0.000 -8.373) 13.875 13.173 ( 9.723 0.000 10.400) 14.237 13.679 ( -1.855 0.000 0.756) 2.003 13.759 ( 1.730 0.000 3.941) 4.304 17.571 ( -0.396 0.000 -2.106) 2.143 17.610 ( -0.616 0.000 1.441) 1.567 17.813 ( -0.690 0.000 -4.517) 4.569 18.127 ( -9.051 0.000 10.515) 13.874 18.657 ( -0.045 0.000 0.371) 0.374 18.673 ( -0.085 0.000 1.481) 1.483 18.897 ( -1.081 0.000 -0.784) 1.336 18.989 ( -2.115 0.000 1.501) 2.593 21.152 ( 7.208 0.000 -11.377) 13.468 21.329 ( 2.277 0.000 -1.770) 2.884 21.361 ( 1.425 0.000 1.758) 2.263 21.481 ( 0.394 0.000 2.794) 2.822 ======================= Grid point 202 (90/170) ======================= q-point: ( 0.36 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( 17.493 0.000 -9.802) 20.052 2.160 ( 16.217 0.000 -3.859) 16.670 2.420 ( -13.033 0.000 4.107) 13.665 2.671 ( -2.101 0.000 6.873) 7.187 2.876 ( -8.225 0.000 3.116) 8.795 2.934 ( -6.570 0.000 2.057) 6.885 3.023 ( 3.777 0.000 2.020) 4.284 3.071 ( -13.638 0.000 -3.804) 14.159 3.159 ( -0.450 0.000 -0.869) 0.978 3.455 ( 0.530 0.000 1.971) 2.041 3.744 ( -8.570 0.000 3.479) 9.249 3.759 ( 2.254 0.000 -2.498) 3.365 3.998 ( 4.947 0.000 -10.274) 11.403 4.206 ( 5.625 0.000 -1.447) 5.808 4.436 ( 4.601 0.000 -3.392) 5.716 4.623 ( 3.244 0.000 -0.576) 3.294 4.699 ( -0.941 0.000 2.651) 2.813 4.854 ( 11.470 0.000 -4.515) 12.326 5.056 ( 8.220 0.000 -8.348) 11.716 5.066 ( -8.314 0.000 -1.500) 8.448 5.297 ( 9.923 0.000 -1.863) 10.096 5.451 ( -0.946 0.000 1.731) 1.973 6.703 ( -10.473 0.000 2.826) 10.847 6.861 ( 3.177 0.000 -0.613) 3.236 7.333 ( -0.438 0.000 -2.363) 2.403 7.409 ( 0.814 0.000 -1.820) 1.994 7.840 ( 2.441 0.000 5.285) 5.822 8.031 ( 4.085 0.000 0.999) 4.205 8.111 ( -6.505 0.000 9.670) 11.654 8.146 ( 0.979 0.000 -2.499) 2.684 8.254 ( 6.859 0.000 -9.014) 11.326 8.535 ( -5.359 0.000 -4.286) 6.862 8.629 ( 3.163 0.000 -5.593) 6.425 8.771 ( -2.654 0.000 -0.928) 2.811 9.440 ( -3.716 0.000 7.576) 8.438 9.555 ( -1.050 0.000 2.262) 2.494 10.980 ( 4.995 0.000 -0.391) 5.011 11.149 ( 6.341 0.000 1.176) 6.449 11.351 ( -1.894 0.000 -0.088) 1.896 11.382 ( -5.164 0.000 3.191) 6.070 11.529 ( -5.155 0.000 -2.882) 5.906 11.554 ( -6.577 0.000 -2.981) 7.221 12.045 ( -2.653 0.000 4.663) 5.365 12.142 ( -0.459 0.000 -1.191) 1.276 13.001 ( 11.638 0.000 -5.094) 12.704 13.394 ( 2.760 0.000 8.867) 9.287 13.642 ( -1.307 0.000 -0.299) 1.341 13.818 ( -1.099 0.000 5.116) 5.232 17.551 ( 0.493 0.000 -1.278) 1.370 17.610 ( -0.978 0.000 0.810) 1.270 17.806 ( 2.095 0.000 -0.063) 2.096 18.061 ( -10.707 0.000 6.175) 12.360 18.660 ( -0.018 0.000 0.254) 0.254 18.682 ( -0.672 0.000 1.115) 1.301 18.899 ( 0.791 0.000 1.680) 1.857 18.991 ( -0.914 0.000 2.954) 3.092 21.158 ( 7.883 0.000 -9.197) 12.113 21.354 ( 2.705 0.000 -1.011) 2.888 21.390 ( 0.176 0.000 1.142) 1.155 21.460 ( -2.528 0.000 -2.964) 3.896 ======================= Grid point 203 (91/170) ======================= q-point: ( 0.45 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( -2.480 0.000 5.345) 5.893 2.313 ( 8.019 0.000 -3.617) 8.797 2.367 ( 10.714 0.000 -0.340) 10.719 2.685 ( -2.810 0.000 -8.058) 8.534 2.747 ( -8.105 0.000 8.709) 11.896 2.860 ( -10.402 0.000 3.740) 11.054 2.890 ( 0.225 0.000 0.662) 0.699 3.109 ( 5.458 0.000 -3.992) 6.762 3.187 ( -0.050 0.000 6.663) 6.663 3.452 ( -0.897 0.000 -1.725) 1.944 3.610 ( -8.927 0.000 0.062) 8.927 3.810 ( 5.651 0.000 -3.034) 6.414 3.962 ( 3.499 0.000 -5.933) 6.888 4.286 ( 5.215 0.000 -2.715) 5.879 4.461 ( -0.674 0.000 0.988) 1.196 4.596 ( -1.851 0.000 -5.665) 5.960 4.683 ( -3.769 0.000 2.286) 4.408 4.894 ( 5.495 0.000 -9.632) 11.089 5.006 ( 0.473 0.000 4.241) 4.268 5.207 ( 15.094 0.000 -3.224) 15.435 5.340 ( -4.257 0.000 -1.304) 4.452 5.433 ( -0.717 0.000 -2.790) 2.881 6.605 ( -6.121 0.000 4.839) 7.803 6.858 ( -0.075 0.000 -3.500) 3.500 7.308 ( 0.935 0.000 -1.952) 2.164 7.375 ( -1.378 0.000 -3.363) 3.634 7.964 ( 1.742 0.000 8.419) 8.597 8.053 ( -0.130 0.000 -0.988) 0.997 8.132 ( -5.869 0.000 11.502) 12.912 8.196 ( 4.420 0.000 2.435) 5.046 8.269 ( 8.195 0.000 -7.361) 11.016 8.390 ( -5.899 0.000 -4.553) 7.452 8.612 ( 4.177 0.000 -7.629) 8.698 8.676 ( -4.825 0.000 -5.982) 7.685 9.488 ( -0.948 0.000 7.074) 7.138 9.570 ( -0.576 0.000 2.732) 2.792 11.080 ( 7.369 0.000 0.534) 7.389 11.234 ( -2.967 0.000 -1.105) 3.166 11.285 ( 0.881 0.000 1.382) 1.639 11.314 ( -7.701 0.000 2.647) 8.143 11.451 ( -0.503 0.000 -2.611) 2.659 11.473 ( 0.416 0.000 -3.823) 3.845 12.053 ( -2.792 0.000 4.364) 5.180 12.138 ( 1.518 0.000 -1.069) 1.857 13.158 ( 12.214 0.000 -0.752) 12.237 13.377 ( -10.612 0.000 1.881) 10.778 13.708 ( 5.590 0.000 3.735) 6.723 13.829 ( -3.767 0.000 3.761) 5.323 17.561 ( 1.747 0.000 -0.274) 1.769 17.595 ( -1.640 0.000 0.151) 1.647 17.864 ( 4.587 0.000 1.253) 4.755 17.944 ( -9.697 0.000 2.744) 10.078 18.665 ( 0.346 0.000 0.279) 0.444 18.677 ( -1.025 0.000 0.573) 1.174 18.951 ( 1.384 0.000 4.070) 4.298 19.017 ( -0.492 0.000 3.331) 3.367 21.196 ( 7.761 0.000 -6.287) 9.988 21.341 ( -5.008 0.000 -5.848) 7.700 21.387 ( 2.377 0.000 -0.419) 2.414 21.398 ( -1.097 0.000 0.260) 1.127 ======================= Grid point 204 (92/170) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -15.512 0.000 6.289) 16.738 2.321 ( -13.415 0.000 -5.715) 14.581 2.489 ( 12.018 0.000 -0.447) 12.026 2.583 ( -1.268 0.000 -3.744) 3.952 2.735 ( 2.479 0.000 7.967) 8.344 2.900 ( 1.376 0.000 5.444) 5.615 2.975 ( 9.012 0.000 0.253) 9.016 3.125 ( 6.485 0.000 -7.960) 10.267 3.245 ( -1.698 0.000 4.990) 5.271 3.416 ( 1.724 0.000 -4.322) 4.653 3.527 ( -4.388 0.000 4.386) 6.204 3.795 ( 5.451 0.000 -12.916) 14.019 4.039 ( 4.906 0.000 5.438) 7.324 4.216 ( -4.183 0.000 -10.537) 11.337 4.442 ( -3.149 0.000 1.832) 3.643 4.551 ( -0.358 0.000 -4.380) 4.394 4.640 ( -3.463 0.000 5.726) 6.692 4.867 ( 2.628 0.000 -6.570) 7.076 5.128 ( 0.800 0.000 5.397) 5.456 5.154 ( -12.591 0.000 3.525) 13.075 5.294 ( -1.603 0.000 -5.183) 5.425 5.398 ( 2.154 0.000 -3.345) 3.979 6.644 ( 3.703 0.000 5.344) 6.502 6.826 ( 3.368 0.000 -5.330) 6.305 7.303 ( -2.919 0.000 -2.689) 3.968 7.319 ( 1.906 0.000 -0.617) 2.004 8.019 ( -5.827 0.000 3.179) 6.638 8.020 ( -3.744 0.000 3.573) 5.176 8.180 ( -4.385 0.000 10.244) 11.143 8.262 ( -2.539 0.000 -4.485) 5.154 8.262 ( 3.619 0.000 1.532) 3.930 8.427 ( 12.558 0.000 0.426) 12.565 8.494 ( -6.840 0.000 -9.739) 11.901 8.603 ( 6.231 0.000 -7.798) 9.982 9.551 ( 0.235 0.000 4.744) 4.749 9.595 ( 0.704 0.000 1.609) 1.756 11.098 ( -8.857 0.000 -0.316) 8.863 11.195 ( 0.852 0.000 1.462) 1.692 11.228 ( -2.597 0.000 2.885) 3.882 11.381 ( 6.924 0.000 -0.426) 6.937 11.449 ( 3.942 0.000 -2.469) 4.651 11.455 ( 2.138 0.000 -3.113) 3.776 12.056 ( -1.894 0.000 3.289) 3.795 12.160 ( 2.559 0.000 -1.109) 2.789 13.178 ( -14.334 0.000 -0.773) 14.355 13.356 ( 11.294 0.000 2.381) 11.542 13.781 ( -5.924 0.000 1.264) 6.058 13.832 ( 4.202 0.000 3.846) 5.696 17.561 ( -2.417 0.000 -0.357) 2.443 17.593 ( 2.130 0.000 0.215) 2.141 17.837 ( -6.501 0.000 1.623) 6.700 17.986 ( 9.082 0.000 1.683) 9.237 18.664 ( -1.118 0.000 0.307) 1.159 18.677 ( 0.642 0.000 0.429) 0.772 19.016 ( 0.732 0.000 4.194) 4.257 19.037 ( -0.898 0.000 1.787) 2.000 21.170 ( -7.640 0.000 -6.453) 10.001 21.259 ( 6.769 0.000 -3.355) 7.554 21.374 ( -2.321 0.000 0.158) 2.326 21.416 ( 1.610 0.000 -0.236) 1.627 ======================= Grid point 205 (93/170) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( -25.459 0.000 5.674) 26.084 1.953 ( -23.374 0.000 -5.143) 23.934 2.609 ( 7.843 0.000 -0.308) 7.849 2.653 ( 6.572 0.000 1.777) 6.808 2.875 ( 3.002 0.000 2.164) 3.700 2.968 ( 3.458 0.000 4.998) 6.078 3.067 ( 5.632 0.000 -6.105) 8.306 3.173 ( 4.559 0.000 -4.687) 6.539 3.274 ( -1.286 0.000 4.835) 5.003 3.406 ( 2.600 0.000 -5.988) 6.528 3.503 ( -6.522 0.000 5.599) 8.596 3.774 ( 8.628 0.000 -8.720) 12.267 4.029 ( -4.700 0.000 -6.540) 8.053 4.174 ( 3.796 0.000 4.305) 5.740 4.423 ( -6.236 0.000 -3.796) 7.301 4.428 ( -1.276 0.000 3.828) 4.035 4.696 ( -2.191 0.000 5.625) 6.037 4.829 ( -0.030 0.000 -4.027) 4.027 4.946 ( -4.629 0.000 0.396) 4.646 5.136 ( -7.032 0.000 -7.819) 10.516 5.320 ( 5.905 0.000 8.141) 10.057 5.344 ( -6.486 0.000 -1.093) 6.578 6.783 ( 5.404 0.000 3.560) 6.471 6.855 ( 6.375 0.000 -3.895) 7.470 7.241 ( -3.039 0.000 0.189) 3.045 7.344 ( 1.226 0.000 0.451) 1.307 7.941 ( -9.065 0.000 4.076) 9.940 7.965 ( -5.069 0.000 1.406) 5.260 8.137 ( -4.012 0.000 0.020) 4.012 8.263 ( -7.188 0.000 -9.383) 11.820 8.297 ( 0.718 0.000 5.339) 5.387 8.346 ( 2.714 0.000 2.910) 3.980 8.522 ( 4.089 0.000 -6.759) 7.899 8.709 ( 11.998 0.000 -0.817) 12.025 9.587 ( -0.732 0.000 2.090) 2.215 9.630 ( 2.803 0.000 -0.128) 2.806 10.976 ( -5.834 0.000 -0.053) 5.834 11.126 ( -6.400 0.000 2.140) 6.748 11.286 ( 0.294 0.000 2.586) 2.603 11.457 ( 2.674 0.000 -0.641) 2.749 11.502 ( 8.303 0.000 -2.058) 8.555 11.536 ( 9.960 0.000 -1.952) 10.150 12.075 ( 0.458 0.000 2.433) 2.476 12.185 ( 2.212 0.000 -1.565) 2.710 12.930 ( -15.378 0.000 -0.900) 15.405 13.543 ( 6.159 0.000 4.308) 7.517 13.675 ( -5.361 0.000 -2.705) 6.005 13.920 ( 2.646 0.000 2.228) 3.459 17.520 ( -2.083 0.000 -0.045) 2.083 17.626 ( 1.790 0.000 0.073) 1.791 17.778 ( -3.509 0.000 1.783) 3.936 18.184 ( 13.643 0.000 0.988) 13.679 18.651 ( -0.992 0.000 0.451) 1.090 18.693 ( 0.881 0.000 0.429) 0.980 19.022 ( -1.575 0.000 -1.140) 1.945 19.062 ( 0.234 0.000 2.691) 2.701 20.968 ( -10.465 0.000 -3.899) 11.168 21.331 ( 4.905 0.000 -0.443) 4.925 21.331 ( -3.138 0.000 0.042) 3.138 21.431 ( 0.934 0.000 -0.637) 1.131 ======================= Grid point 206 (94/170) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( -27.801 0.000 0.844) 27.814 1.533 ( -28.824 0.000 10.590) 30.708 2.636 ( -22.597 0.000 9.685) 24.585 2.789 ( 13.209 0.000 -1.755) 13.325 2.881 ( -1.307 0.000 1.301) 1.844 2.998 ( -8.549 0.000 -1.326) 8.652 3.125 ( 4.837 0.000 -6.618) 8.197 3.133 ( 9.571 0.000 3.564) 10.213 3.288 ( -0.106 0.000 3.407) 3.409 3.357 ( 3.655 0.000 -8.814) 9.542 3.534 ( 2.491 0.000 3.193) 4.050 3.870 ( 9.210 0.000 -1.424) 9.319 3.918 ( -3.767 0.000 -4.883) 6.167 4.205 ( -0.173 0.000 -3.614) 3.618 4.340 ( -0.514 0.000 -0.689) 0.860 4.515 ( 2.198 0.000 8.465) 8.746 4.732 ( 0.868 0.000 7.658) 7.707 4.774 ( -2.306 0.000 -3.214) 3.956 4.946 ( -8.839 0.000 -1.526) 8.970 4.988 ( 9.313 0.000 -5.718) 10.928 5.199 ( -8.239 0.000 -1.412) 8.359 5.480 ( 5.578 0.000 3.669) 6.676 6.847 ( 0.515 0.000 -1.248) 1.350 6.921 ( 5.503 0.000 -2.219) 5.934 7.211 ( -3.712 0.000 4.096) 5.527 7.367 ( 0.503 0.000 1.324) 1.416 7.820 ( -11.023 0.000 2.366) 11.274 7.922 ( -3.623 0.000 3.220) 4.847 8.053 ( -6.822 0.000 -5.380) 8.688 8.112 ( 0.696 0.000 -0.978) 1.201 8.374 ( -0.713 0.000 7.218) 7.253 8.380 ( -2.224 0.000 1.198) 2.526 8.499 ( 3.767 0.000 -5.795) 6.912 8.868 ( 9.071 0.000 -1.110) 9.138 9.571 ( -2.999 0.000 0.596) 3.057 9.685 ( 5.541 0.000 -1.929) 5.867 10.923 ( -1.111 0.000 0.253) 1.139 11.052 ( -5.519 0.000 1.228) 5.654 11.300 ( -1.422 0.000 2.362) 2.757 11.495 ( 3.127 0.000 -0.589) 3.182 11.630 ( 10.137 0.000 -1.337) 10.225 11.693 ( 11.241 0.000 -0.840) 11.273 12.125 ( 2.860 0.000 1.752) 3.354 12.189 ( 1.037 0.000 -2.490) 2.698 12.694 ( -14.102 0.000 1.046) 14.141 13.471 ( -11.925 0.000 -1.561) 12.027 13.715 ( 7.370 0.000 -0.749) 7.408 13.958 ( 1.255 0.000 -1.610) 2.041 17.502 ( -0.871 0.000 0.925) 1.271 17.650 ( 1.460 0.000 -0.386) 1.510 17.756 ( -1.958 0.000 1.457) 2.441 18.407 ( 14.050 0.000 -1.909) 14.179 18.647 ( -0.418 0.000 1.135) 1.210 18.715 ( 1.771 0.000 -0.193) 1.782 18.963 ( -2.150 0.000 -3.756) 4.328 19.089 ( 1.247 0.000 0.466) 1.331 20.769 ( -12.686 0.000 1.772) 12.810 21.282 ( -3.097 0.000 0.327) 3.114 21.395 ( 1.235 0.000 1.820) 2.200 21.439 ( 2.156 0.000 -0.785) 2.295 ======================= Grid point 207 (95/170) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -25.707 0.000 13.907) 29.227 1.248 ( -26.361 0.000 17.073) 31.407 2.252 ( -44.576 0.000 31.471) 54.565 2.795 ( -6.150 0.000 -2.766) 6.744 2.904 ( -0.456 0.000 -8.404) 8.417 2.955 ( 8.326 0.000 -5.035) 9.730 3.159 ( 5.276 0.000 -2.032) 5.654 3.269 ( 4.514 0.000 -1.942) 4.914 3.359 ( 1.953 0.000 5.788) 6.109 3.487 ( 21.825 0.000 -0.539) 21.832 3.596 ( 2.822 0.000 0.099) 2.823 3.797 ( -6.189 0.000 -0.326) 6.197 3.993 ( 5.123 0.000 1.856) 5.449 4.129 ( 0.136 0.000 -8.470) 8.471 4.417 ( 4.554 0.000 10.150) 11.125 4.560 ( -4.219 0.000 -4.158) 5.923 4.667 ( -7.289 0.000 2.193) 7.611 4.850 ( 8.473 0.000 -4.322) 9.512 4.878 ( -4.447 0.000 6.656) 8.004 5.055 ( 8.707 0.000 -7.202) 11.299 5.161 ( 1.192 0.000 8.871) 8.951 5.565 ( 3.564 0.000 -1.596) 3.905 6.770 ( -3.731 0.000 -7.216) 8.123 6.959 ( 1.932 0.000 -1.913) 2.718 7.217 ( -2.595 0.000 5.696) 6.259 7.394 ( 1.031 0.000 1.493) 1.814 7.661 ( -11.727 0.000 2.551) 12.001 7.881 ( -5.298 0.000 -1.001) 5.392 7.932 ( -4.274 0.000 -0.613) 4.318 8.131 ( 0.779 0.000 1.858) 2.015 8.325 ( -3.147 0.000 0.050) 3.148 8.430 ( -1.549 0.000 6.003) 6.200 8.528 ( 3.084 0.000 -0.676) 3.157 8.982 ( 7.205 0.000 -1.133) 7.294 9.523 ( -3.584 0.000 1.039) 3.732 9.746 ( 6.298 0.000 -5.013) 8.049 10.934 ( 1.723 0.000 -0.049) 1.724 10.982 ( -4.342 0.000 0.502) 4.370 11.308 ( -0.031 0.000 2.135) 2.135 11.536 ( 2.710 0.000 -0.728) 2.806 11.787 ( 11.321 0.000 -1.266) 11.391 11.858 ( 9.942 0.000 0.048) 9.942 12.171 ( 0.938 0.000 -2.372) 2.550 12.198 ( 4.096 0.000 1.160) 4.257 12.523 ( -11.203 0.000 4.104) 11.931 13.235 ( -13.081 0.000 -4.701) 13.900 13.790 ( 4.015 0.000 -2.228) 4.592 13.887 ( -4.560 0.000 -8.780) 9.893 17.509 ( -0.235 0.000 1.677) 1.694 17.663 ( 1.125 0.000 -0.960) 1.479 17.739 ( -1.476 0.000 0.520) 1.565 18.550 ( 8.419 0.000 -4.570) 9.579 18.666 ( 0.841 0.000 1.030) 1.329 18.740 ( 3.213 0.000 -3.406) 4.682 18.898 ( -0.961 0.000 -1.288) 1.607 19.112 ( 2.810 0.000 -2.611) 3.836 20.636 ( -11.382 0.000 10.107) 15.222 21.246 ( -2.235 0.000 0.990) 2.445 21.391 ( -1.135 0.000 -1.048) 1.545 21.497 ( 2.561 0.000 1.932) 3.208 ======================= Grid point 208 (96/170) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( -11.403 0.000 28.841) 31.013 1.108 ( -17.996 0.000 24.623) 30.499 2.123 ( -27.382 0.000 49.860) 56.884 2.601 ( -7.318 0.000 -11.685) 13.788 2.744 ( -3.233 0.000 -15.059) 15.402 3.000 ( 3.610 0.000 -2.941) 4.656 3.236 ( 5.584 0.000 -1.237) 5.720 3.310 ( 4.479 0.000 -2.963) 5.370 3.412 ( -2.421 0.000 1.569) 2.885 3.620 ( 1.709 0.000 -0.881) 1.923 3.780 ( -0.144 0.000 6.281) 6.282 3.827 ( 16.210 0.000 -4.560) 16.839 4.017 ( 0.838 0.000 -5.392) 5.457 4.101 ( 4.681 0.000 -0.548) 4.713 4.382 ( -6.624 0.000 -1.587) 6.811 4.603 ( 0.322 0.000 5.020) 5.030 4.635 ( -1.023 0.000 1.806) 2.075 4.912 ( 0.609 0.000 5.340) 5.374 4.956 ( 14.106 0.000 -3.011) 14.423 5.125 ( 6.932 0.000 -1.114) 7.020 5.365 ( 0.835 0.000 18.469) 18.488 5.553 ( 0.570 0.000 -6.264) 6.290 6.619 ( -2.707 0.000 -7.585) 8.054 6.936 ( -1.201 0.000 -2.822) 3.067 7.236 ( -2.409 0.000 3.821) 4.517 7.432 ( 2.246 0.000 0.216) 2.257 7.532 ( -8.841 0.000 4.717) 10.021 7.722 ( -9.284 0.000 -3.408) 9.890 7.902 ( -1.488 0.000 3.308) 3.628 8.188 ( 2.312 0.000 4.647) 5.191 8.327 ( 2.567 0.000 0.937) 2.733 8.453 ( -2.961 0.000 4.532) 5.414 8.530 ( 1.072 0.000 -5.848) 5.946 8.997 ( -3.222 0.000 -7.127) 7.821 9.496 ( -2.077 0.000 2.509) 3.257 9.753 ( 3.495 0.000 -7.452) 8.231 10.936 ( -2.265 0.000 0.760) 2.389 10.957 ( 1.408 0.000 -0.762) 1.601 11.376 ( 6.610 0.000 0.808) 6.659 11.554 ( 0.707 0.000 -1.284) 1.465 11.943 ( 9.543 0.000 -1.267) 9.627 11.988 ( 5.909 0.000 -0.316) 5.917 12.205 ( 4.786 0.000 1.294) 4.958 12.271 ( 3.635 0.000 0.507) 3.671 12.421 ( -8.995 0.000 5.660) 10.628 12.975 ( -11.045 0.000 -6.764) 12.951 13.640 ( -12.429 0.000 -4.845) 13.340 13.793 ( 1.264 0.000 -4.400) 4.578 17.529 ( -0.101 0.000 2.443) 2.445 17.664 ( 0.686 0.000 -1.512) 1.660 17.758 ( 1.756 0.000 4.602) 4.925 18.588 ( 4.901 0.000 -7.253) 8.753 18.665 ( -0.900 0.000 -0.977) 1.328 18.711 ( 0.257 0.000 -7.299) 7.304 18.950 ( 5.267 0.000 2.609) 5.878 19.100 ( -0.293 0.000 -3.421) 3.434 20.661 ( -3.928 0.000 16.510) 16.971 21.236 ( -0.986 0.000 1.816) 2.066 21.350 ( -1.531 0.000 -2.357) 2.811 21.509 ( -1.359 0.000 -2.656) 2.983 ======================= Grid point 209 (97/170) ======================= q-point: ( 0.00 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -2.140 12.678 25.084) 28.187 1.570 ( 2.221 15.059 28.000) 31.870 2.358 ( -2.344 2.634 -18.834) 19.161 2.551 ( -1.344 6.980 3.449) 7.900 2.576 ( -3.884 12.518 16.836) 21.336 2.997 ( 0.116 -1.996 -0.149) 2.005 3.232 ( -4.557 -3.641 -1.092) 5.934 3.302 ( 2.486 -5.753 -1.817) 6.525 3.324 ( 2.524 -1.632 1.694) 3.450 3.616 ( 0.833 -5.221 1.730) 5.563 3.682 ( 0.772 -3.079 -1.075) 3.352 3.862 ( 0.433 -5.250 -3.203) 6.165 4.115 ( 1.393 7.898 -6.434) 10.282 4.179 ( 3.645 9.303 -8.428) 13.071 4.484 ( 2.364 2.194 5.793) 6.630 4.596 ( 1.449 -2.482 0.735) 2.967 4.658 ( 2.985 1.752 1.719) 3.864 4.905 ( -4.385 -3.471 -4.099) 6.933 5.086 ( 4.993 -0.989 8.502) 9.909 5.179 ( 0.529 -1.068 7.765) 7.856 5.348 ( -7.770 -8.011 6.080) 12.709 5.543 ( -2.669 3.987 -6.940) 8.437 6.601 ( 3.362 0.535 1.038) 3.559 6.864 ( 0.235 -2.155 -4.352) 4.862 7.329 ( -3.832 8.723 4.071) 10.361 7.474 ( 1.099 3.180 -0.154) 3.368 7.537 ( -3.089 2.955 3.288) 5.393 7.631 ( 1.732 1.228 -0.508) 2.183 7.983 ( 1.134 2.566 6.699) 7.263 8.270 ( 2.246 -2.161 4.840) 5.756 8.333 ( 2.450 -0.760 -0.989) 2.750 8.460 ( -0.323 0.240 -3.092) 3.118 8.586 ( 0.708 8.782 -3.874) 9.624 8.823 ( -4.834 3.933 -7.181) 9.508 9.524 ( -0.717 0.520 2.214) 2.384 9.685 ( 0.624 -2.094 -5.662) 6.069 10.879 ( -0.067 -1.850 1.884) 2.641 11.024 ( -1.540 4.929 -4.336) 6.743 11.476 ( 5.160 -0.037 -0.888) 5.236 11.537 ( -1.958 1.189 -2.536) 3.418 11.917 ( -2.717 -8.469 0.557) 8.912 11.996 ( 1.952 -3.353 -2.768) 4.766 12.267 ( -0.413 -2.973 0.781) 3.102 12.276 ( 0.085 -2.815 0.396) 2.844 12.468 ( 0.049 5.917 9.515) 11.204 12.856 ( -0.695 7.018 -8.367) 10.942 13.471 ( -0.448 -5.007 5.346) 7.338 13.711 ( -0.272 -3.627 -6.271) 7.249 17.565 ( -0.229 1.147 2.726) 2.966 17.664 ( -0.309 1.217 -1.842) 2.230 17.859 ( 1.659 -1.985 8.274) 8.669 18.383 ( -0.969 -8.809 -14.042) 16.605 18.647 ( 1.752 1.662 -0.825) 2.552 18.709 ( -2.506 3.031 -4.015) 5.621 19.019 ( -1.169 -1.893 0.401) 2.260 19.035 ( 0.444 -1.241 -0.673) 1.480 20.917 ( 3.281 6.150 15.668) 17.149 21.258 ( 0.208 0.392 2.276) 2.319 21.301 ( -0.357 0.607 -3.116) 3.194 21.449 ( -1.444 2.170 -4.831) 5.489 ======================= Grid point 210 (98/170) ======================= q-point: ( 0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( 9.175 5.629 24.800) 27.035 1.942 ( 5.940 8.260 25.817) 27.749 2.146 ( 3.806 5.212 -19.859) 20.882 2.336 ( 1.655 8.868 -21.886) 23.672 2.890 ( 1.964 5.676 16.954) 17.986 3.003 ( -0.206 -3.355 1.531) 3.694 3.161 ( -3.036 -4.206 -0.141) 5.189 3.249 ( -6.110 -4.312 -0.511) 7.496 3.426 ( 2.415 0.342 8.061) 8.422 3.608 ( 0.616 -5.476 -5.910) 8.080 3.690 ( -0.819 -0.375 3.796) 3.901 3.880 ( 5.354 -5.956 -4.287) 9.084 4.047 ( 0.447 4.354 -4.324) 6.152 4.155 ( 4.571 10.286 -6.277) 12.888 4.535 ( 1.073 1.699 0.616) 2.102 4.601 ( 1.887 0.387 -2.645) 3.272 4.643 ( -14.842 0.346 -5.966) 16.000 4.795 ( 0.130 0.100 5.218) 5.221 5.170 ( -9.612 -2.755 -1.443) 10.103 5.259 ( 2.973 2.380 6.503) 7.536 5.269 ( -5.505 -2.727 8.332) 10.352 5.427 ( -2.579 0.981 -4.034) 4.887 6.732 ( 6.469 -1.349 5.187) 8.401 6.823 ( 2.453 -1.079 -7.446) 7.914 7.312 ( -4.200 5.651 6.214) 9.391 7.430 ( -2.480 4.210 -0.979) 4.983 7.613 ( 4.736 1.465 2.654) 5.623 7.713 ( 6.884 1.438 -0.002) 7.033 8.122 ( 5.056 1.275 9.342) 10.699 8.279 ( -4.452 0.831 1.783) 4.868 8.308 ( 3.953 0.659 -11.934) 12.589 8.418 ( -0.711 -1.049 -5.105) 5.260 8.635 ( 3.610 5.311 5.452) 8.424 8.709 ( 0.201 6.279 -4.324) 7.626 9.537 ( -1.542 -0.706 2.745) 3.227 9.627 ( -0.753 -0.897 -4.084) 4.248 10.914 ( 0.361 -0.528 3.474) 3.533 10.963 ( -0.428 2.294 -3.292) 4.035 11.448 ( -3.381 0.400 -3.868) 5.153 11.515 ( -1.382 1.052 1.298) 2.168 11.843 ( -6.124 -7.321 0.308) 9.550 11.951 ( -4.373 -3.596 -1.783) 5.936 12.204 ( -6.244 -3.181 0.632) 7.036 12.262 ( -2.450 -1.527 0.087) 2.888 12.657 ( 8.520 4.930 10.176) 14.158 12.834 ( 9.088 7.181 -9.291) 14.848 13.562 ( 3.661 -3.596 3.990) 6.500 13.649 ( 0.999 -4.442 -5.024) 6.780 17.588 ( -0.554 1.125 2.119) 2.462 17.654 ( 1.378 2.231 -1.427) 2.985 17.974 ( -1.260 -4.404 11.074) 11.984 18.164 ( -4.797 -4.407 -14.960) 16.316 18.648 ( -1.664 1.307 -1.316) 2.492 18.673 ( 1.535 1.592 0.542) 2.277 18.985 ( -2.591 -0.644 0.556) 2.727 19.042 ( -0.144 -0.964 -0.183) 0.991 21.134 ( 3.988 2.033 10.351) 11.278 21.257 ( 2.309 2.108 -5.661) 6.467 21.302 ( 0.495 0.443 3.940) 3.995 21.372 ( -0.669 1.838 -4.974) 5.345 ======================= Grid point 211 (99/170) ======================= q-point: ( 0.18 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( 8.366 8.553 -13.749) 18.226 2.101 ( 6.822 10.160 -8.668) 14.997 2.220 ( 8.514 2.359 6.134) 10.755 2.316 ( 7.037 2.210 20.865) 22.130 2.988 ( -2.076 -0.495 1.665) 2.706 2.996 ( -4.118 -1.368 2.726) 5.124 3.112 ( -2.276 -4.647 -2.655) 5.816 3.168 ( -1.812 -6.589 2.753) 7.367 3.477 ( -7.506 -3.101 0.107) 8.122 3.527 ( -1.366 -4.040 -7.108) 8.290 3.723 ( -2.289 -2.913 6.388) 7.385 3.869 ( 3.438 -1.877 -11.554) 12.200 4.035 ( 2.785 4.313 -3.755) 6.361 4.174 ( 2.671 5.373 -1.081) 6.097 4.442 ( 0.443 4.278 -0.673) 4.353 4.546 ( -0.720 -2.147 -0.216) 2.275 4.620 ( -2.065 3.577 0.019) 4.130 4.791 ( -2.235 5.602 1.655) 6.254 4.997 ( -2.387 -2.356 -3.886) 5.133 5.210 ( -2.885 4.240 -3.446) 6.179 5.344 ( -4.963 -3.481 6.211) 8.679 5.433 ( 0.815 4.648 6.065) 7.684 6.774 ( 3.779 -0.212 -7.682) 8.564 6.862 ( 2.697 -0.603 1.661) 3.225 7.335 ( -1.000 1.182 3.344) 3.685 7.396 ( -0.428 2.491 -0.233) 2.538 7.699 ( 3.317 -1.282 0.699) 3.624 7.823 ( 4.504 2.355 3.930) 6.424 8.205 ( -4.871 3.711 -1.333) 6.267 8.227 ( 2.085 -0.611 -7.289) 7.607 8.327 ( 5.069 -2.822 4.531) 7.361 8.341 ( 1.727 0.901 -4.784) 5.165 8.726 ( 4.595 7.500 -0.999) 8.853 8.745 ( 0.403 -0.472 6.245) 6.276 9.518 ( -4.185 -0.501 1.621) 4.516 9.580 ( -0.647 -0.100 -2.106) 2.205 10.934 ( 0.810 1.623 -1.434) 2.312 10.975 ( 1.411 0.928 4.011) 4.352 11.364 ( -1.012 0.058 -3.710) 3.846 11.482 ( -5.546 0.725 3.425) 6.559 11.740 ( -5.997 -4.347 -2.000) 7.672 11.846 ( -6.555 -2.264 -0.349) 6.943 12.108 ( -6.186 -1.781 0.548) 6.461 12.219 ( -2.633 -1.014 -0.370) 2.845 12.883 ( 10.661 5.522 -7.782) 14.308 12.938 ( 10.732 4.973 8.737) 14.705 13.642 ( 1.982 -2.746 0.914) 3.508 13.650 ( 2.892 -4.600 0.574) 5.464 17.594 ( -0.138 1.657 0.262) 1.683 17.675 ( 1.788 5.244 0.409) 5.556 17.933 ( -4.334 -1.643 -9.971) 10.995 18.066 ( -4.440 -3.983 11.062) 12.568 18.621 ( -0.533 -0.206 -0.496) 0.757 18.706 ( 1.013 1.989 1.756) 2.840 18.950 ( -2.162 0.881 -0.120) 2.337 19.027 ( -1.598 0.627 0.124) 1.721 21.171 ( 2.622 -0.617 -8.326) 8.751 21.296 ( 2.706 -0.198 0.578) 2.774 21.333 ( 1.092 0.536 -2.091) 2.419 21.380 ( 1.251 -0.827 6.684) 6.850 ======================= Grid point 212 (100/170) ======================= q-point: ( 0.27 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( 11.316 6.978 -16.430) 21.135 2.117 ( 13.468 10.514 -8.804) 19.221 2.454 ( -0.028 0.402 12.486) 12.493 2.588 ( 2.212 -0.497 11.747) 11.964 2.898 ( -9.052 -1.810 6.910) 11.531 2.975 ( -4.922 -1.712 2.624) 5.835 3.032 ( -2.123 -3.741 -5.004) 6.599 3.231 ( -1.179 -4.603 1.955) 5.138 3.260 ( -7.374 -1.357 -3.686) 8.355 3.374 ( -5.908 -4.517 -6.946) 10.176 3.752 ( -3.255 -3.729 5.883) 7.688 3.778 ( -0.050 -2.475 -7.521) 7.918 4.070 ( 6.374 5.921 -4.781) 9.927 4.213 ( 3.775 5.358 -2.955) 7.189 4.439 ( -2.711 -4.429 -4.472) 6.853 4.524 ( 5.223 0.157 -6.305) 8.189 4.608 ( 3.631 0.446 4.793) 6.030 4.829 ( 3.605 8.014 1.102) 8.856 5.053 ( 3.179 0.756 1.016) 3.422 5.147 ( 2.245 4.365 -2.947) 5.725 5.279 ( -3.653 -0.904 -1.981) 4.253 5.497 ( -0.601 5.739 4.054) 7.052 6.763 ( -0.890 -2.118 -1.508) 2.748 6.871 ( 0.471 2.694 -0.626) 2.805 7.330 ( -0.247 -1.701 -1.633) 2.371 7.408 ( 0.710 0.260 0.380) 0.847 7.735 ( 1.876 -3.481 -0.054) 3.955 7.947 ( 3.199 1.636 6.279) 7.234 8.101 ( -4.325 0.019 -3.474) 5.548 8.176 ( -1.234 -3.432 -2.966) 4.701 8.319 ( 3.660 6.273 -4.019) 8.300 8.439 ( 0.827 -7.874 2.466) 8.293 8.736 ( -2.589 1.275 -2.298) 3.689 8.820 ( 5.133 6.039 0.501) 7.941 9.464 ( -4.972 1.284 3.719) 6.341 9.566 ( -0.091 0.949 0.484) 1.069 10.936 ( 1.661 0.632 -1.782) 2.517 11.060 ( 2.937 1.281 4.827) 5.794 11.339 ( 1.320 -0.678 -2.676) 3.061 11.438 ( -4.773 1.221 4.089) 6.403 11.614 ( -6.125 -2.763 -2.284) 7.097 11.739 ( -6.455 1.578 -1.114) 6.738 12.043 ( -3.832 -0.990 2.673) 4.776 12.175 ( -1.870 -0.251 -0.882) 2.083 12.945 ( 10.262 4.507 -9.110) 14.444 13.214 ( 9.083 3.945 10.659) 14.549 13.658 ( -0.947 -2.136 0.233) 2.348 13.724 ( 2.675 -3.360 4.195) 6.003 17.596 ( 0.751 3.584 -0.750) 3.738 17.703 ( 0.031 7.881 0.296) 7.887 17.815 ( -0.160 0.332 -3.377) 3.397 18.091 ( -7.316 -3.179 9.843) 12.670 18.619 ( 0.696 -0.545 -0.229) 0.913 18.741 ( -0.048 3.073 3.085) 4.354 18.917 ( -1.348 1.899 -0.562) 2.396 19.002 ( -1.915 1.330 0.877) 2.491 21.121 ( 4.594 -3.033 -10.175) 11.568 21.314 ( 1.809 -1.317 -1.604) 2.753 21.355 ( 1.354 -0.904 0.601) 1.735 21.437 ( -0.720 -4.151 1.825) 4.591 ======================= Grid point 213 (101/170) ======================= q-point: ( 0.36 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 14.997 1.481 -10.598) 18.424 2.271 ( 11.368 8.601 -1.822) 14.371 2.450 ( -8.840 3.385 3.270) 10.015 2.644 ( -1.957 -2.659 4.863) 5.877 2.837 ( -8.784 -3.405 2.611) 9.777 2.926 ( -4.996 -1.191 4.161) 6.610 3.018 ( 3.694 -1.286 2.187) 4.482 3.086 ( -12.451 0.831 -2.481) 12.723 3.147 ( -2.374 -0.214 -2.829) 3.699 3.367 ( 2.569 -7.525 1.306) 8.058 3.726 ( -5.565 -1.997 2.132) 6.285 3.734 ( -0.117 -2.887 0.207) 2.897 4.079 ( 4.279 7.476 -9.314) 12.687 4.237 ( 4.763 3.464 -3.393) 6.797 4.403 ( 0.864 -2.440 0.395) 2.619 4.626 ( 12.515 -1.842 -4.864) 13.553 4.669 ( 1.955 0.417 0.303) 2.022 4.930 ( 0.373 2.626 -0.922) 2.808 4.977 ( 1.271 -1.516 -4.296) 4.730 5.148 ( 1.759 4.476 -2.817) 5.573 5.318 ( 6.581 2.383 -1.760) 7.217 5.505 ( -1.615 5.043 0.998) 5.388 6.675 ( -8.693 -2.208 2.335) 9.268 6.906 ( 2.369 3.872 -0.198) 4.544 7.298 ( -0.760 -2.943 -2.625) 4.017 7.410 ( 0.544 -0.996 -1.865) 2.183 7.788 ( 3.174 -4.176 2.543) 5.829 8.001 ( -5.012 -6.942 1.192) 8.645 8.022 ( 0.544 -3.625 -1.386) 3.918 8.156 ( 1.058 -0.377 1.709) 2.045 8.334 ( -0.741 4.983 -0.018) 5.037 8.406 ( -2.749 -8.268 -2.909) 9.186 8.673 ( 2.211 4.317 -6.170) 7.848 8.868 ( 2.019 7.889 -3.331) 8.798 9.463 ( -2.616 2.610 6.731) 7.679 9.580 ( -0.449 2.033 2.467) 3.228 10.955 ( 3.452 -1.876 -1.678) 4.272 11.163 ( 2.787 -0.403 4.675) 5.458 11.298 ( -2.478 -2.321 -3.790) 5.088 11.428 ( -2.271 3.581 3.749) 5.660 11.532 ( -1.190 1.428 -1.418) 2.338 11.615 ( -6.571 4.393 -2.208) 8.207 12.042 ( -2.388 -0.283 4.950) 5.503 12.146 ( -0.284 0.387 -1.051) 1.156 13.021 ( 10.655 2.112 -6.274) 12.545 13.416 ( 0.769 1.857 8.072) 8.318 13.640 ( 0.717 0.045 0.406) 0.825 13.806 ( 0.309 -1.035 5.604) 5.707 17.601 ( 1.384 5.000 -1.253) 5.337 17.675 ( -1.464 4.911 -1.357) 5.302 17.846 ( 2.568 5.296 2.686) 6.470 18.053 ( -8.788 -0.186 6.574) 10.977 18.637 ( 1.809 0.044 -0.103) 1.813 18.759 ( -2.309 4.950 2.637) 6.065 18.909 ( 0.506 1.165 1.141) 1.707 18.997 ( -0.949 0.726 2.545) 2.811 21.099 ( 6.027 -5.841 -8.759) 12.131 21.325 ( 1.112 -3.723 -1.771) 4.270 21.368 ( -0.096 -3.017 -0.855) 3.137 21.410 ( -1.332 -3.404 -1.570) 3.978 ======================= Grid point 214 (102/170) ======================= q-point: ( 0.45 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 9.617 -2.470 -1.343) 10.020 2.316 ( -3.891 2.925 4.890) 6.900 2.433 ( 1.922 3.978 -2.319) 4.990 2.671 ( 4.943 -0.608 -8.654) 9.985 2.755 ( -5.187 0.862 8.539) 10.028 2.863 ( -10.490 2.105 2.590) 11.008 2.913 ( -1.575 1.259 2.720) 3.386 3.108 ( -1.158 -6.844 3.255) 7.667 3.131 ( 5.101 1.123 -1.290) 5.380 3.381 ( 0.394 -6.316 -2.881) 6.953 3.615 ( -8.393 -0.076 1.202) 8.479 3.796 ( 4.824 -1.954 0.761) 5.260 4.017 ( 2.880 5.125 -10.458) 11.997 4.253 ( 0.962 -2.754 -5.279) 6.031 4.443 ( 2.343 1.062 3.082) 4.014 4.647 ( -1.143 2.983 -5.567) 6.419 4.752 ( 4.261 4.280 -0.134) 6.041 4.850 ( -2.514 -2.919 -0.698) 3.915 5.027 ( 6.457 0.849 -1.108) 6.606 5.249 ( 10.166 2.683 -0.511) 10.526 5.309 ( -5.588 -1.057 -2.095) 6.061 5.471 ( -1.828 3.910 -2.479) 4.977 6.600 ( -4.331 -0.133 4.679) 6.377 6.894 ( -1.215 3.546 -3.502) 5.129 7.268 ( 0.772 -3.442 -1.738) 3.932 7.379 ( -0.620 -0.690 -3.734) 3.847 7.866 ( 3.126 -9.285 0.810) 9.831 7.930 ( -5.508 -9.562 1.336) 11.115 8.023 ( 1.629 -9.241 0.893) 9.426 8.243 ( -0.845 -2.108 4.886) 5.388 8.266 ( 0.022 -0.825 0.760) 1.122 8.380 ( 0.059 4.983 -0.222) 4.988 8.659 ( 4.604 6.030 -7.095) 10.387 8.799 ( -2.733 8.420 -7.700) 11.733 9.519 ( -0.016 3.117 6.441) 7.155 9.600 ( -0.761 2.498 2.727) 3.776 11.008 ( 4.713 -5.101 -0.569) 6.969 11.146 ( -7.416 -7.313 -0.623) 10.433 11.305 ( 5.806 3.965 1.368) 7.162 11.419 ( -4.167 5.735 1.705) 7.291 11.511 ( -2.414 5.858 -1.532) 6.519 11.524 ( 1.685 4.744 -2.028) 5.427 12.057 ( -2.679 0.379 4.613) 5.348 12.145 ( 1.508 0.686 -0.981) 1.925 13.150 ( 11.196 -0.673 -1.693) 11.344 13.367 ( -10.201 -1.193 0.640) 10.290 13.736 ( 5.088 2.944 4.786) 7.580 13.845 ( -2.487 1.659 4.376) 5.300 17.612 ( 1.563 4.322 -1.023) 4.709 17.641 ( -1.413 3.748 -0.776) 4.080 17.926 ( 3.738 7.128 2.834) 8.533 17.974 ( -7.886 4.088 3.879) 9.693 18.673 ( 2.570 1.428 0.254) 2.952 18.726 ( -3.645 4.210 0.719) 5.615 18.957 ( 1.322 0.537 3.991) 4.238 19.022 ( -0.308 0.540 3.220) 3.279 21.117 ( 6.660 -7.987 -6.268) 12.142 21.248 ( -4.347 -9.076 -6.250) 11.846 21.371 ( 1.534 -1.566 -0.355) 2.220 21.392 ( -0.587 -1.180 -0.299) 1.352 ======================= Grid point 215 (103/170) ======================= q-point: (-0.45 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( -15.715 2.184 4.054) 16.375 2.292 ( -13.240 -1.817 -1.696) 13.471 2.454 ( 12.657 -2.882 -1.447) 13.062 2.634 ( -0.644 5.186 -4.018) 6.591 2.775 ( 1.801 3.310 7.396) 8.301 2.899 ( 2.047 0.571 4.516) 4.991 3.000 ( 8.835 1.883 1.721) 9.196 3.116 ( 3.927 -4.354 -4.431) 7.349 3.180 ( 0.488 -2.796 1.084) 3.039 3.350 ( 2.724 -5.420 -5.263) 8.031 3.542 ( -4.835 1.030 4.880) 6.947 3.825 ( 5.003 2.023 -10.577) 11.874 4.012 ( 4.186 -2.212 1.174) 4.878 4.153 ( -2.661 -4.431 -8.096) 9.605 4.501 ( -1.515 4.441 -0.110) 4.694 4.570 ( 0.636 1.192 -2.934) 3.231 4.672 ( -12.257 1.737 2.632) 12.656 4.889 ( 3.807 3.407 0.151) 5.111 5.121 ( -12.140 -2.379 0.189) 12.373 5.162 ( 5.646 0.885 3.700) 6.809 5.365 ( 1.957 6.429 -1.482) 6.882 5.391 ( -0.875 1.116 -4.173) 4.407 6.660 ( 3.819 1.716 5.681) 7.057 6.834 ( 1.602 0.884 -5.658) 5.947 7.275 ( 0.263 -2.494 -0.546) 2.567 7.324 ( -0.010 -0.263 -3.198) 3.209 7.826 ( -5.818 -13.349 -0.176) 14.562 7.938 ( 2.780 -10.021 0.908) 10.439 8.088 ( 2.650 -10.451 2.263) 11.016 8.170 ( -4.744 -4.871 1.822) 7.039 8.355 ( -2.547 5.542 2.094) 6.448 8.447 ( 6.506 4.058 6.436) 10.011 8.620 ( -3.617 7.821 -9.219) 12.619 8.665 ( 3.746 6.465 -8.296) 11.164 9.588 ( 0.715 3.187 4.282) 5.386 9.617 ( -0.030 2.065 1.496) 2.550 11.013 ( -6.792 -5.527 -0.498) 8.771 11.093 ( 4.479 -7.476 0.690) 8.742 11.332 ( -6.574 7.570 1.674) 10.165 11.425 ( 6.090 1.720 -0.207) 6.332 11.498 ( 1.478 6.793 -0.645) 6.982 11.541 ( 3.858 6.679 -2.230) 8.029 12.063 ( -1.911 0.714 3.448) 4.006 12.166 ( 2.388 0.595 -1.070) 2.683 13.161 ( -13.618 -1.675 -1.089) 13.763 13.336 ( 10.821 -2.185 1.430) 11.132 13.812 ( -4.972 3.240 2.417) 6.408 13.859 ( 2.577 2.734 3.681) 5.260 17.600 ( -2.420 3.371 -0.404) 4.170 17.632 ( 1.429 2.745 -0.573) 3.147 17.908 ( -4.902 8.234 2.833) 9.993 18.037 ( 7.273 5.980 2.002) 9.626 18.671 ( -3.476 1.484 0.267) 3.789 18.724 ( 2.991 3.875 0.603) 4.932 19.019 ( 0.515 0.317 4.132) 4.176 19.045 ( -0.579 0.868 1.820) 2.098 21.088 ( -6.544 -8.487 -6.542) 12.556 21.166 ( 6.209 -9.209 -3.567) 11.665 21.367 ( -1.670 -1.096 -0.307) 2.021 21.395 ( 1.223 -1.889 -0.174) 2.257 ======================= Grid point 216 (104/170) ======================= q-point: (-0.36 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( -23.496 -0.625 -1.130) 23.532 2.026 ( -22.494 6.521 4.310) 23.814 2.624 ( 9.575 -1.371 -0.144) 9.674 2.658 ( 7.697 3.503 -1.594) 8.605 2.895 ( 2.082 0.666 2.867) 3.605 2.949 ( 1.847 -1.824 3.661) 4.488 3.115 ( 7.252 3.801 -7.279) 10.955 3.142 ( 1.398 -3.253 -1.399) 3.807 3.220 ( 0.945 -3.855 4.294) 5.848 3.353 ( 4.372 -3.243 -5.807) 7.959 3.524 ( -5.913 1.534 4.845) 7.797 3.794 ( 6.342 1.536 -8.754) 10.918 4.037 ( -0.948 0.599 -4.790) 4.919 4.111 ( 2.754 -5.742 2.993) 7.036 4.409 ( -8.755 -1.917 3.171) 9.507 4.465 ( -5.391 2.976 -2.880) 6.798 4.653 ( 2.540 -2.170 1.639) 3.721 4.810 ( -10.122 0.884 0.301) 10.165 5.048 ( 0.389 6.037 -0.996) 6.131 5.210 ( -3.541 4.926 -3.470) 6.988 5.309 ( -0.447 -2.190 0.921) 2.417 5.430 ( 3.393 10.982 3.098) 11.905 6.781 ( 4.063 -0.050 1.802) 4.445 6.850 ( 5.642 -0.569 -1.529) 5.873 7.242 ( -2.128 -0.050 -0.720) 2.247 7.335 ( 1.942 -1.096 0.331) 2.254 7.745 ( -4.526 -11.401 0.903) 12.300 7.972 ( -1.181 -7.003 2.036) 7.388 8.082 ( -2.079 -5.351 0.149) 5.743 8.200 ( 1.653 -7.933 0.692) 8.133 8.309 ( -4.463 4.000 1.440) 6.164 8.423 ( -3.350 6.029 -6.891) 9.749 8.626 ( 2.402 5.613 2.511) 6.602 8.672 ( 7.305 2.317 -3.553) 8.447 9.619 ( -1.156 2.678 1.559) 3.307 9.638 ( 1.786 0.758 -0.021) 1.941 10.917 ( -4.563 -3.781 0.060) 5.927 11.169 ( 2.117 -4.414 2.213) 5.372 11.260 ( -3.895 5.051 1.325) 6.515 11.469 ( 2.263 1.985 -1.601) 3.410 11.549 ( 5.502 4.444 -1.656) 7.263 11.617 ( 7.538 6.435 -0.551) 9.927 12.081 ( 0.207 0.628 2.545) 2.629 12.189 ( 2.038 0.385 -1.512) 2.567 12.918 ( -14.929 -1.069 -0.953) 14.998 13.519 ( 8.314 -3.036 3.069) 9.368 13.715 ( -7.581 4.295 -1.314) 8.812 13.920 ( 0.672 0.262 1.976) 2.103 17.558 ( -2.370 3.480 0.243) 4.218 17.649 ( 1.056 1.628 -0.061) 1.941 17.879 ( -2.712 10.333 2.223) 10.912 18.198 ( 10.890 2.082 0.586) 11.103 18.627 ( -2.223 -0.034 0.186) 2.231 18.781 ( 3.024 6.159 1.060) 6.943 19.033 ( -1.191 1.210 -1.104) 2.025 19.063 ( 0.028 0.153 2.548) 2.553 20.908 ( -8.699 -6.240 -3.813) 11.364 21.228 ( 4.307 -9.116 -0.691) 10.106 21.333 ( -1.592 -1.410 -0.525) 2.191 21.407 ( 0.369 -1.864 -0.203) 1.911 ======================= Grid point 217 (105/170) ======================= q-point: (-0.27 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( -25.135 3.678 4.771) 25.847 1.715 ( -25.430 12.362 9.963) 29.980 2.710 ( -6.188 5.011 3.007) 8.512 2.803 ( 11.488 1.331 -2.114) 11.757 2.888 ( -4.347 1.229 2.002) 4.941 2.963 ( -10.211 -4.351 -0.781) 11.127 3.111 ( 4.510 0.608 1.399) 4.761 3.161 ( 6.057 1.770 -3.005) 6.989 3.222 ( -1.310 -5.692 2.773) 6.465 3.345 ( 4.933 -1.220 -8.565) 9.959 3.512 ( 0.562 -1.291 2.277) 2.677 3.825 ( 3.562 -1.117 -3.088) 4.845 4.029 ( 2.898 7.159 -0.523) 7.741 4.123 ( -1.049 -6.488 -1.806) 6.815 4.356 ( -3.207 1.650 -1.174) 3.793 4.425 ( 0.294 -7.803 5.155) 9.357 4.720 ( 3.129 -0.376 3.051) 4.387 4.749 ( 1.235 -0.411 2.658) 2.960 4.975 ( -6.327 8.645 -0.428) 10.722 5.118 ( -1.634 -1.620 -5.474) 5.938 5.292 ( -1.011 9.572 -2.101) 9.852 5.549 ( 6.176 8.840 2.249) 11.015 6.823 ( 1.378 -1.734 -1.873) 2.901 6.928 ( 4.060 -0.136 -0.243) 4.070 7.208 ( -3.007 -0.287 2.446) 3.887 7.370 ( 0.855 0.040 1.425) 1.662 7.697 ( -4.531 -7.151 2.326) 8.779 7.953 ( -4.491 -4.307 3.981) 7.387 8.071 ( 0.471 -2.728 -4.061) 4.915 8.112 ( -5.165 5.150 -0.205) 7.297 8.287 ( -6.059 2.158 1.632) 6.635 8.408 ( 7.319 -8.607 0.433) 11.306 8.623 ( -0.180 10.114 -2.123) 10.336 8.779 ( 5.022 -2.637 0.894) 5.742 9.587 ( -4.036 1.360 0.521) 4.291 9.675 ( 4.328 -0.790 -1.992) 4.830 10.874 ( -1.558 -2.361 0.709) 2.916 11.179 ( -1.559 7.981 0.336) 8.139 11.261 ( 0.246 -3.291 2.314) 4.031 11.497 ( 3.147 0.876 -0.882) 3.384 11.634 ( 8.507 1.545 -2.407) 8.975 11.739 ( 8.303 3.424 -0.647) 9.004 12.127 ( 2.350 0.146 1.906) 3.029 12.190 ( 0.843 0.040 -2.683) 2.813 12.693 ( -13.660 0.117 1.850) 13.785 13.527 ( -11.619 5.323 -1.476) 12.865 13.670 ( 6.140 -4.636 -0.671) 7.723 13.916 ( -1.741 -3.434 -1.579) 4.162 17.538 ( -1.322 3.563 1.228) 3.994 17.667 ( 1.130 1.269 0.432) 1.753 17.857 ( -2.509 9.518 0.482) 9.855 18.366 ( 10.543 -4.084 -2.145) 11.508 18.610 ( 0.141 1.264 -0.087) 1.275 18.841 ( 3.049 7.176 1.159) 7.882 18.980 ( -1.524 1.890 -4.374) 5.002 19.087 ( 1.122 -0.193 0.304) 1.178 20.745 ( -10.112 -2.369 2.055) 10.587 21.259 ( -1.214 -3.086 0.861) 3.426 21.339 ( 2.758 -6.727 1.237) 7.375 21.402 ( -0.459 -1.280 -0.455) 1.434 ======================= Grid point 218 (106/170) ======================= q-point: (-0.18 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( -18.836 12.903 16.416) 28.121 1.476 ( -22.390 17.509 15.154) 32.211 2.417 ( -38.176 15.754 24.064) 47.798 2.792 ( -5.605 -0.503 -1.945) 5.954 2.876 ( 2.021 -2.169 -7.511) 8.075 2.959 ( 7.476 -0.529 -4.969) 8.992 3.178 ( 4.690 -0.962 -2.665) 5.480 3.245 ( 3.176 -2.916 2.066) 4.782 3.260 ( 3.892 -5.183 -1.591) 6.674 3.434 ( 13.309 -5.386 -0.064) 14.358 3.567 ( 4.911 -2.094 0.350) 5.350 3.809 ( -1.611 2.134 1.319) 2.982 4.057 ( -2.592 -0.856 -1.015) 2.912 4.116 ( 5.985 4.604 -2.514) 7.959 4.329 ( -0.845 -3.825 4.643) 6.075 4.485 ( 2.270 -6.790 1.401) 7.295 4.759 ( -1.273 6.650 -2.217) 7.124 4.846 ( 2.216 1.730 6.518) 7.098 4.942 ( 0.831 6.090 2.045) 6.478 5.093 ( 2.732 -5.203 3.071) 6.631 5.201 ( -2.372 6.885 -8.382) 11.103 5.641 ( 4.671 7.669 -1.995) 9.198 6.769 ( -2.594 -0.212 -6.233) 6.754 6.951 ( 0.770 -1.035 -2.208) 2.557 7.227 ( -0.189 0.683 5.992) 6.034 7.391 ( 0.101 0.176 1.252) 1.268 7.635 ( -6.126 -1.462 2.079) 6.633 7.926 ( -4.655 -3.213 2.985) 6.395 7.986 ( -8.257 8.897 -0.418) 12.145 8.068 ( -0.446 -3.158 0.034) 3.189 8.252 ( -1.093 -0.596 4.098) 4.283 8.527 ( 4.376 -2.922 -2.254) 5.724 8.612 ( -0.578 9.731 4.432) 10.709 8.857 ( 5.682 -6.285 -0.288) 8.478 9.527 ( -3.604 0.501 1.001) 3.774 9.719 ( 5.221 -2.459 -4.563) 7.357 10.873 ( -0.226 -1.541 0.982) 1.841 11.154 ( -0.076 10.207 -3.050) 10.654 11.293 ( 1.386 -1.630 2.056) 2.967 11.542 ( 3.169 0.598 -0.676) 3.295 11.760 ( 10.250 -1.861 -2.290) 10.667 11.862 ( 8.274 0.158 -0.766) 8.311 12.165 ( 0.718 -0.682 -2.631) 2.812 12.191 ( 3.369 -0.719 1.253) 3.666 12.542 ( -10.877 2.116 5.654) 12.440 13.293 ( -12.817 5.421 -4.988) 14.783 13.698 ( -3.499 -8.578 -1.925) 9.462 13.834 ( -1.815 -4.083 -5.436) 7.037 17.538 ( -0.778 3.148 1.556) 3.597 17.696 ( 1.486 1.668 1.248) 2.559 17.798 ( -3.577 6.108 -2.279) 7.436 18.463 ( 6.362 -9.491 -4.247) 12.189 18.625 ( 2.687 3.544 -2.016) 4.883 18.895 ( 0.775 6.103 -6.146) 8.696 18.905 ( 1.078 2.186 1.516) 2.870 19.102 ( 2.030 -1.119 -2.759) 3.603 20.661 ( -8.204 2.810 10.203) 13.390 21.241 ( -1.638 -0.487 1.031) 1.996 21.375 ( -0.710 -2.919 -1.222) 3.243 21.427 ( 2.980 -4.486 3.736) 6.554 ======================= Grid point 219 (107/170) ======================= q-point: (-0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.273 ( -8.515 18.267 24.534) 31.751 1.349 ( -15.062 19.734 19.380) 31.494 2.287 ( -22.554 16.303 41.945) 50.337 2.614 ( -6.545 1.114 -11.745) 13.492 2.765 ( -2.206 1.675 -12.246) 12.555 2.993 ( 3.396 -0.848 -3.633) 5.045 3.231 ( 5.274 -3.263 -1.501) 6.381 3.285 ( 2.520 -3.541 -1.612) 4.635 3.304 ( 1.143 -5.961 -1.325) 6.213 3.569 ( 3.215 -5.716 1.270) 6.680 3.660 ( 2.852 -4.273 0.695) 5.184 3.898 ( 4.012 -1.433 -0.746) 4.326 4.029 ( 8.037 3.404 -0.205) 8.731 4.173 ( 3.579 6.082 -1.902) 7.309 4.395 ( 1.264 1.346 3.289) 3.771 4.547 ( 0.817 -6.369 3.780) 7.451 4.734 ( -5.010 11.687 2.139) 12.895 4.886 ( 4.414 -5.837 -8.037) 10.870 4.936 ( 3.581 2.730 3.472) 5.686 5.126 ( 1.005 1.217 0.583) 1.683 5.274 ( 0.128 -7.825 15.957) 17.773 5.638 ( 0.730 6.159 -6.322) 8.856 6.638 ( -2.483 1.557 -7.330) 7.894 6.917 ( -1.402 -2.100 -2.764) 3.744 7.306 ( 1.197 5.576 4.540) 7.289 7.414 ( 1.913 -0.456 1.336) 2.378 7.576 ( -4.689 2.959 3.187) 6.395 7.755 ( -12.659 2.776 -2.732) 13.244 7.929 ( -1.875 2.439 4.412) 5.378 8.147 ( 3.724 -2.080 6.087) 7.433 8.291 ( 0.613 -0.233 2.921) 2.994 8.506 ( -0.916 2.018 -2.779) 3.554 8.633 ( -0.395 7.826 -2.138) 8.122 8.925 ( 1.117 -4.719 -2.137) 5.300 9.512 ( -0.386 0.696 1.371) 1.586 9.724 ( 3.231 -2.880 -6.568) 7.866 10.875 ( -0.657 -1.441 0.545) 1.674 11.099 ( -1.256 8.362 -4.728) 9.688 11.374 ( 7.072 -0.395 0.178) 7.086 11.567 ( 0.964 1.137 -1.232) 1.933 11.884 ( 7.421 -5.246 -1.872) 9.278 11.963 ( 5.690 -2.332 -2.054) 6.484 12.194 ( 4.642 -1.277 0.868) 4.892 12.252 ( 2.604 -2.023 0.813) 3.396 12.461 ( -8.879 3.953 7.509) 12.282 13.037 ( -10.313 5.806 -6.942) 13.721 13.527 ( -11.313 -8.563 0.539) 14.199 13.777 ( 0.548 -2.776 -5.585) 6.261 17.545 ( -0.660 2.019 1.995) 2.914 17.706 ( -1.961 3.409 -2.302) 4.557 17.761 ( 1.340 0.321 4.042) 4.270 18.478 ( 3.385 -10.512 -7.399) 13.293 18.637 ( 2.307 2.703 -2.824) 4.539 18.806 ( -1.602 3.183 -6.647) 7.542 18.974 ( 3.705 1.678 1.050) 4.201 19.077 ( -0.945 -2.321 -2.963) 3.881 20.726 ( -2.050 6.568 15.735) 17.174 21.238 ( -0.669 0.192 1.742) 1.875 21.341 ( -1.110 -0.909 -1.939) 2.412 21.489 ( 1.017 -1.498 -0.294) 1.834 ======================= Grid point 220 (108/170) ======================= q-point: ( 0.00 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -5.800 17.392 15.849) 24.235 1.864 ( -1.369 15.171 22.087) 26.830 2.421 ( -1.336 3.433 -16.135) 16.550 2.659 ( 0.067 4.667 -10.317) 11.324 2.838 ( 1.174 9.242 13.644) 16.521 2.940 ( -0.933 -4.998 0.230) 5.090 3.046 ( 0.554 -9.950 -1.604) 10.094 3.193 ( 1.238 -8.139 -6.740) 10.640 3.338 ( 1.881 2.365 4.101) 5.095 3.503 ( 1.249 -5.463 0.622) 5.638 3.663 ( 0.314 -3.956 3.346) 5.191 3.736 ( -0.318 -2.701 -2.396) 3.624 4.247 ( 0.417 5.826 -1.005) 5.927 4.392 ( 7.694 11.123 0.581) 13.537 4.521 ( 1.105 0.095 4.578) 4.710 4.575 ( -2.350 3.600 6.097) 7.461 4.733 ( 2.187 4.264 -0.038) 4.793 4.892 ( -4.020 5.617 -3.906) 7.935 5.045 ( 1.999 1.975 3.513) 4.499 5.184 ( -5.736 -7.885 6.703) 11.832 5.288 ( 1.582 7.039 6.240) 9.539 5.613 ( -2.311 2.644 -8.369) 9.076 6.603 ( 1.857 -0.626 -0.825) 2.126 6.804 ( 1.014 -4.183 -4.698) 6.372 7.483 ( -3.684 6.436 6.018) 9.551 7.546 ( 5.605 5.150 2.548) 8.027 7.621 ( -7.394 5.101 2.073) 9.219 7.666 ( 1.655 2.462 0.343) 2.986 8.040 ( 0.646 3.293 6.865) 7.641 8.217 ( -0.386 -3.227 4.441) 5.503 8.335 ( 2.104 -1.637 -1.909) 3.279 8.465 ( 0.060 2.075 -2.983) 3.634 8.731 ( 1.419 3.600 -3.141) 4.985 8.887 ( -0.895 3.666 -4.717) 6.041 9.516 ( -1.013 -0.993 1.590) 2.130 9.629 ( 1.049 -3.505 -4.226) 5.589 10.878 ( -0.469 1.859 2.661) 3.279 11.137 ( -1.805 6.784 -6.726) 9.722 11.478 ( 6.919 0.038 -0.676) 6.952 11.558 ( -2.809 0.562 -1.543) 3.254 11.752 ( -5.013 -7.272 -0.406) 8.842 11.921 ( 3.893 -4.407 -5.694) 8.185 12.180 ( -2.647 -5.697 1.141) 6.385 12.206 ( 1.025 -4.557 -0.179) 4.674 12.603 ( -0.772 7.978 10.834) 13.477 13.007 ( 0.342 8.215 -8.082) 11.529 13.370 ( 0.666 -5.354 5.359) 7.605 13.612 ( -0.758 -6.479 -6.365) 9.114 17.600 ( -0.702 2.384 2.297) 3.384 17.695 ( -1.245 1.865 -1.612) 2.761 17.834 ( 0.568 -0.305 5.212) 5.251 18.204 ( 0.053 -9.367 -10.283) 13.910 18.678 ( 1.746 1.301 -2.324) 3.185 18.746 ( -1.682 0.997 -4.992) 5.362 18.976 ( -1.242 -2.375 0.631) 2.753 18.998 ( 0.533 -2.532 -0.806) 2.710 21.065 ( 1.687 8.772 12.697) 15.524 21.270 ( 0.452 0.887 2.299) 2.506 21.310 ( -0.111 0.348 -1.285) 1.336 21.489 ( -0.304 1.628 -2.747) 3.208 ======================= Grid point 221 (109/170) ======================= q-point: ( 0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( 4.953 9.453 20.102) 22.759 2.110 ( 1.303 8.903 21.641) 23.437 2.268 ( 4.258 6.956 -14.574) 16.701 2.523 ( 2.405 9.495 -17.187) 19.782 2.913 ( -0.929 -6.184 1.520) 6.436 2.966 ( 0.466 -0.724 2.073) 2.245 3.016 ( -1.755 -9.749 -0.635) 9.926 3.111 ( -3.331 -8.176 -4.199) 9.776 3.429 ( 0.489 -0.514 5.283) 5.331 3.499 ( 0.079 -5.009 -2.667) 5.675 3.666 ( -2.873 -1.722 -1.112) 3.530 3.759 ( 4.052 -6.359 1.757) 7.742 4.241 ( -1.409 14.812 1.853) 14.994 4.406 ( -1.753 14.920 -2.937) 15.308 4.562 ( -1.986 -1.255 -0.763) 2.470 4.612 ( 2.905 5.546 2.866) 6.885 4.720 ( -6.673 4.001 -4.538) 9.007 4.841 ( 3.465 5.762 4.367) 8.017 5.081 ( -7.616 -4.433 0.651) 8.836 5.144 ( -0.548 -2.426 5.707) 6.226 5.386 ( 0.931 5.261 5.790) 7.878 5.493 ( -0.751 3.788 -6.617) 7.662 6.691 ( 5.765 -2.977 2.983) 7.141 6.788 ( 4.666 -2.737 -6.274) 8.284 7.431 ( -6.541 6.575 3.039) 9.760 7.515 ( -6.330 4.263 1.209) 7.727 7.670 ( 4.049 4.519 2.432) 6.537 7.746 ( 4.312 1.845 2.104) 5.140 8.151 ( 1.849 1.282 8.745) 9.030 8.213 ( -3.633 -6.220 0.525) 7.223 8.332 ( 1.203 -1.721 -4.042) 4.555 8.431 ( 2.366 4.514 -5.894) 7.792 8.736 ( 1.001 3.111 0.130) 3.271 8.826 ( 0.718 5.723 -3.108) 6.552 9.519 ( -0.951 -0.856 1.773) 2.187 9.599 ( 0.274 -2.009 -3.007) 3.627 10.926 ( 0.158 2.253 5.941) 6.355 11.047 ( 0.361 6.646 -6.804) 9.518 11.459 ( -3.572 0.486 -4.139) 5.489 11.532 ( -4.570 0.241 3.882) 6.001 11.693 ( -0.411 -6.902 -0.742) 6.954 11.881 ( -2.060 -3.469 -4.269) 5.874 12.124 ( -5.106 -5.124 1.550) 7.398 12.203 ( -1.280 -4.565 -0.090) 4.742 12.774 ( 6.711 6.961 10.788) 14.487 12.989 ( 8.443 8.404 -9.233) 15.072 13.469 ( 3.642 -6.132 3.968) 8.161 13.547 ( 1.611 -5.717 -5.157) 7.866 17.623 ( -0.055 2.349 2.180) 3.205 17.701 ( 3.639 2.406 -0.335) 4.375 17.896 ( -1.606 -2.981 6.552) 7.375 18.073 ( -1.121 -4.622 -10.222) 11.274 18.676 ( -1.577 1.362 -2.789) 3.481 18.692 ( 1.621 0.464 -0.188) 1.697 18.967 ( -0.857 -1.176 0.742) 1.634 19.008 ( 1.372 -2.486 -0.307) 2.856 21.190 ( -0.365 3.593 6.164) 7.145 21.289 ( 1.268 1.105 -2.451) 2.972 21.317 ( -0.856 1.262 5.654) 5.856 21.416 ( -2.383 2.397 -5.078) 6.100 ======================= Grid point 222 (110/170) ======================= q-point: ( 0.18 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 7.475 9.477 2.623) 12.352 2.255 ( 9.161 5.148 6.008) 12.105 2.344 ( 1.816 5.704 -2.554) 6.508 2.380 ( 2.688 9.603 3.048) 10.427 2.916 ( -1.979 -8.545 1.816) 8.957 2.936 ( -4.384 -7.960 0.553) 9.105 2.969 ( -1.699 -7.644 -4.713) 9.140 3.049 ( -0.475 -2.866 1.436) 3.240 3.409 ( -5.496 -3.330 -1.997) 6.729 3.464 ( -0.871 -2.306 -5.040) 5.611 3.615 ( -1.862 -6.888 1.201) 7.236 3.791 ( -0.773 -6.508 -3.224) 7.304 4.186 ( -2.198 10.037 -0.890) 10.313 4.337 ( -1.793 11.754 -4.224) 12.618 4.551 ( -0.019 3.165 -0.477) 3.201 4.574 ( -2.144 8.789 -0.534) 9.062 4.665 ( -3.930 1.624 -2.284) 4.827 4.964 ( 3.991 9.917 3.597) 11.278 4.990 ( 2.132 2.403 0.266) 3.223 5.182 ( -3.022 -4.256 4.501) 6.892 5.354 ( -1.235 3.794 -4.839) 6.272 5.529 ( 1.785 4.058 5.291) 6.903 6.750 ( 2.179 -2.360 -3.552) 4.789 6.844 ( 5.774 -1.645 -0.578) 6.032 7.372 ( -3.251 2.771 -0.439) 4.294 7.434 ( -4.553 1.633 0.271) 4.845 7.710 ( -0.240 2.094 0.021) 2.108 7.844 ( 3.066 -0.225 4.633) 5.560 8.128 ( -4.691 -9.084 -3.574) 10.830 8.228 ( -4.608 -5.989 3.885) 8.497 8.304 ( 1.344 4.478 -0.704) 4.728 8.429 ( 4.556 7.463 -3.792) 9.531 8.762 ( 1.074 2.098 1.543) 2.817 8.857 ( 5.043 5.217 -0.658) 7.286 9.516 ( -1.533 0.533 0.864) 1.839 9.578 ( 0.525 -0.009 -1.330) 1.430 10.996 ( -1.206 3.228 4.912) 6.000 11.003 ( 2.092 3.903 -2.496) 5.084 11.371 ( -0.742 0.459 -4.419) 4.505 11.480 ( -7.760 -1.463 6.632) 10.312 11.668 ( -1.325 -2.153 -4.454) 5.121 11.805 ( -2.646 -1.581 -0.309) 3.097 12.060 ( -4.961 -3.203 1.321) 6.051 12.179 ( -1.313 -3.336 -0.163) 3.589 13.005 ( 9.534 6.796 -1.377) 11.789 13.056 ( 9.894 6.874 2.145) 12.237 13.537 ( 4.050 -6.471 0.173) 7.636 13.577 ( 3.032 -4.210 0.922) 5.270 17.651 ( 1.572 3.845 1.152) 4.311 17.785 ( 5.584 5.808 1.356) 8.170 17.884 ( -2.945 -3.156 -2.874) 5.186 18.006 ( -1.479 -1.516 3.146) 3.793 18.638 ( -0.611 1.530 -0.959) 1.906 18.723 ( 1.307 0.003 1.596) 2.063 18.962 ( -0.880 0.218 0.563) 1.067 19.027 ( 1.110 -0.885 -0.162) 1.429 21.168 ( -2.806 0.504 -4.227) 5.099 21.292 ( 1.099 -0.270 -1.188) 1.641 21.339 ( -0.817 -0.013 -3.024) 3.132 21.361 ( -2.171 -1.019 5.091) 5.628 ======================= Grid point 223 (111/170) ======================= q-point: ( 0.27 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( 4.262 10.503 -15.743) 19.399 2.331 ( 10.522 10.580 -4.929) 15.715 2.478 ( 0.054 2.686 10.259) 10.605 2.572 ( 0.560 -0.956 12.150) 12.201 2.849 ( -9.669 -3.326 5.932) 11.821 2.877 ( -3.348 -9.986 -0.445) 10.542 2.926 ( 1.598 -5.151 -0.768) 5.448 3.123 ( 5.754 -4.503 2.169) 7.621 3.221 ( -11.167 -2.406 -3.888) 12.067 3.355 ( -3.702 1.294 -7.127) 8.135 3.634 ( -1.503 -7.756 4.851) 9.271 3.716 ( -1.452 -4.726 -4.039) 6.384 4.219 ( 5.033 8.564 -2.468) 10.236 4.289 ( 0.884 2.663 -0.797) 2.917 4.450 ( -2.586 7.693 -4.651) 9.355 4.536 ( 2.217 1.360 -9.991) 10.324 4.663 ( 1.300 4.241 4.421) 6.262 4.976 ( 2.722 7.304 -1.426) 7.924 5.037 ( -6.166 -3.448 -1.273) 7.179 5.227 ( 3.824 4.300 2.199) 6.160 5.320 ( 3.379 4.734 -2.403) 6.293 5.593 ( -0.482 3.582 4.048) 5.427 6.720 ( -3.333 -2.275 -0.782) 4.110 6.910 ( 4.489 0.730 -0.700) 4.602 7.307 ( -2.252 -0.448 -3.111) 3.866 7.386 ( -2.230 -1.833 0.084) 2.888 7.704 ( 0.274 -0.305 0.301) 0.509 7.901 ( -1.239 -5.387 0.288) 5.536 8.006 ( -5.386 -10.493 -2.531) 12.063 8.150 ( -3.954 -3.439 -0.883) 5.314 8.308 ( -2.372 -0.208 -0.034) 2.381 8.482 ( 2.916 9.933 1.519) 10.463 8.779 ( 2.491 3.724 -3.403) 5.626 8.950 ( 6.464 5.464 -0.821) 8.504 9.504 ( -1.601 2.716 2.595) 4.083 9.588 ( 0.765 1.292 0.782) 1.694 10.963 ( 0.024 2.262 -3.927) 4.532 11.069 ( -0.763 -0.339 7.007) 7.057 11.336 ( 1.470 0.477 -4.584) 4.838 11.459 ( -4.278 0.259 7.323) 8.485 11.586 ( -1.758 0.717 -2.783) 3.369 11.772 ( -2.350 1.992 -0.776) 3.178 12.016 ( -3.116 -1.887 3.199) 4.848 12.160 ( -0.732 -1.583 -0.391) 1.787 13.052 ( 8.760 6.209 -10.471) 14.998 13.304 ( 7.540 4.971 10.527) 13.870 13.601 ( 2.063 -3.704 -0.919) 4.339 13.652 ( 4.278 -3.652 5.579) 7.922 17.690 ( 2.169 5.253 -0.286) 5.690 17.800 ( -1.595 0.614 -4.570) 4.879 17.899 ( 5.079 9.594 3.843) 11.515 18.043 ( -2.417 -0.728 8.099) 8.483 18.635 ( 0.762 1.769 -0.003) 1.926 18.771 ( 1.001 0.238 3.736) 3.875 18.953 ( -0.870 1.557 0.447) 1.838 19.033 ( -0.430 1.400 0.031) 1.465 21.055 ( -1.595 -3.396 -8.364) 9.167 21.271 ( -2.125 -4.357 -2.235) 5.338 21.316 ( 0.597 -2.446 -1.702) 3.039 21.363 ( -1.510 -2.667 1.625) 3.469 ======================= Grid point 224 (112/170) ======================= q-point: ( 0.36 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 6.937 4.438 -10.906) 13.666 2.412 ( -2.183 5.178 3.709) 6.733 2.564 ( 7.876 6.855 -0.128) 10.443 2.590 ( -4.091 -0.529 0.593) 4.168 2.762 ( -6.859 -4.227 2.769) 8.519 2.886 ( -2.082 -2.749 7.818) 8.545 2.967 ( -0.027 -4.035 1.295) 4.238 3.065 ( -3.900 -2.435 -0.400) 4.615 3.185 ( -7.120 2.459 -1.069) 7.608 3.242 ( 3.714 -3.496 -2.284) 5.589 3.635 ( -4.819 -6.602 4.276) 9.224 3.688 ( 0.543 -2.737 0.365) 2.814 4.191 ( 3.062 1.907 -11.120) 11.690 4.335 ( 0.466 7.168 -1.021) 7.255 4.422 ( 3.532 6.123 -0.965) 7.134 4.564 ( 13.719 -3.594 -7.062) 15.843 4.708 ( 1.177 2.686 1.538) 3.311 4.873 ( -5.608 -3.947 -6.587) 9.509 5.027 ( 3.114 1.825 -0.892) 3.718 5.239 ( -1.944 4.495 1.531) 5.131 5.379 ( 2.492 3.523 -0.670) 4.367 5.604 ( -2.130 4.313 1.760) 5.122 6.641 ( -5.886 -0.954 1.667) 6.191 6.978 ( 3.693 2.961 -0.032) 4.733 7.239 ( -2.182 -2.917 -2.938) 4.680 7.354 ( -0.602 -4.139 -1.938) 4.609 7.722 ( 0.786 -3.296 -0.196) 3.394 7.811 ( -4.872 -11.603 -4.072) 13.227 7.913 ( -4.136 -6.195 -1.025) 7.519 8.106 ( -2.130 -10.670 -0.567) 10.895 8.267 ( -0.061 4.796 -0.077) 4.797 8.529 ( -1.065 10.257 4.077) 11.089 8.783 ( 4.984 5.999 -6.459) 10.127 9.003 ( 2.858 5.518 -4.244) 7.525 9.531 ( -0.520 4.014 5.002) 6.434 9.614 ( 0.272 1.395 2.328) 2.728 10.928 ( 0.676 -0.829 -2.953) 3.141 11.100 ( -3.697 -4.599 2.959) 6.601 11.311 ( 2.081 2.554 -2.068) 3.890 11.505 ( -0.921 3.257 7.164) 7.923 11.575 ( 2.517 3.699 -1.503) 4.720 11.705 ( -3.843 5.077 -1.507) 6.544 12.033 ( -1.613 -0.702 5.667) 5.934 12.150 ( 0.284 -0.171 -0.495) 0.595 13.076 ( 8.313 3.425 -8.730) 12.532 13.432 ( -3.243 -0.837 3.165) 4.608 13.661 ( 5.408 2.463 4.576) 7.500 13.790 ( 3.241 -0.429 7.071) 7.790 17.698 ( 0.800 3.558 -2.777) 4.584 17.739 ( -1.072 2.139 -2.639) 3.562 18.021 ( 3.163 11.489 6.054) 13.366 18.102 ( -1.669 7.066 8.042) 10.834 18.658 ( 2.304 1.761 -0.071) 2.901 18.829 ( -0.677 1.974 5.346) 5.739 18.946 ( -0.412 2.607 0.180) 2.645 19.022 ( -1.181 1.934 1.365) 2.645 20.956 ( 1.449 -8.591 -8.786) 12.373 21.169 ( -4.564 -11.288 -5.839) 13.503 21.317 ( 1.498 -2.083 -1.190) 2.828 21.361 ( -0.556 -2.473 0.641) 2.614 ======================= Grid point 225 (113/170) ======================= q-point: ( 0.45 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 6.778 -2.633 -3.356) 8.009 2.393 ( -5.883 3.080 6.137) 9.042 2.478 ( -6.549 2.988 -4.120) 8.295 2.723 ( 12.203 5.846 -5.962) 14.786 2.753 ( -0.619 -2.131 7.144) 7.481 2.914 ( -4.700 -0.329 2.079) 5.150 2.931 ( 0.004 0.059 4.134) 4.135 3.012 ( -9.057 1.966 3.031) 9.751 3.128 ( 4.418 -1.849 -0.531) 4.819 3.265 ( 2.395 -4.818 -4.074) 6.748 3.581 ( -6.797 -3.778 3.883) 8.692 3.740 ( 3.110 -3.520 2.747) 5.441 4.098 ( 2.765 1.728 -13.807) 14.187 4.241 ( -3.283 2.496 -9.726) 10.565 4.498 ( 5.559 3.805 0.643) 6.767 4.703 ( -3.316 2.646 -4.475) 6.166 4.752 ( 11.865 -4.894 -1.267) 12.897 4.802 ( 1.370 -0.657 2.804) 3.189 5.015 ( -0.820 -3.809 -1.241) 4.089 5.233 ( -4.770 -0.431 2.521) 5.413 5.389 ( 2.652 5.879 0.047) 6.450 5.566 ( -3.262 5.299 -0.857) 6.281 6.618 ( -0.447 2.577 4.479) 5.187 6.978 ( -2.736 4.927 -2.996) 6.382 7.193 ( 0.785 -4.131 -1.849) 4.593 7.324 ( 0.957 -5.194 -4.227) 6.765 7.681 ( -4.271 -9.903 -2.379) 11.044 7.715 ( 1.072 -10.700 -6.194) 12.410 7.882 ( -1.548 -5.660 3.639) 6.904 8.061 ( -1.840 -10.767 -1.192) 10.988 8.334 ( 4.018 4.388 5.308) 7.973 8.542 ( -2.845 9.946 4.297) 11.202 8.787 ( 4.941 6.117 -7.240) 10.689 8.935 ( -2.448 5.697 -8.070) 10.177 9.590 ( 0.663 3.793 4.914) 6.243 9.643 ( -0.141 1.813 2.551) 3.132 10.927 ( 2.356 -3.320 -1.479) 4.332 11.022 ( -5.857 -5.462 -1.287) 8.111 11.378 ( 4.888 3.865 2.378) 6.670 11.535 ( -3.060 6.620 2.098) 7.588 11.612 ( 3.013 4.023 -0.171) 5.029 11.650 ( -1.261 7.886 0.242) 7.990 12.068 ( -2.101 0.690 5.350) 5.789 12.159 ( 1.449 0.607 -0.528) 1.657 13.137 ( 8.629 -0.609 -4.066) 9.559 13.328 ( -8.777 -2.864 -1.976) 9.442 13.812 ( 3.913 4.730 6.744) 9.120 13.890 ( 0.096 2.899 5.775) 6.462 17.673 ( 0.466 1.762 -2.407) 3.019 17.696 ( -1.626 1.505 -1.831) 2.875 18.130 ( 2.461 13.375 5.159) 14.545 18.150 ( -2.441 14.524 6.381) 16.051 18.710 ( 3.869 2.127 0.687) 4.469 18.821 ( -5.354 5.417 1.446) 7.752 18.968 ( 1.115 0.636 3.433) 3.665 19.040 ( 0.142 1.440 2.854) 3.200 20.913 ( 4.498 -12.827 -7.400) 15.476 21.018 ( -4.499 -14.530 -7.917) 17.147 21.333 ( 1.526 -2.315 -0.412) 2.803 21.354 ( -0.896 -2.561 0.013) 2.713 ======================= Grid point 226 (114/170) ======================= q-point: (-0.45 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( -12.503 -2.510 -2.474) 12.991 2.292 ( -4.083 -0.399 3.827) 5.610 2.448 ( 2.611 4.504 0.553) 5.235 2.763 ( 1.763 7.443 -3.610) 8.458 2.810 ( -1.240 -0.775 3.813) 4.084 2.930 ( 0.978 -0.520 2.661) 2.882 2.945 ( -1.532 -5.366 3.083) 6.376 3.051 ( 8.915 2.834 2.808) 9.767 3.182 ( 5.718 -0.080 -4.018) 6.989 3.263 ( 4.882 -2.831 -5.436) 7.836 3.548 ( -4.732 -0.692 7.389) 8.801 3.811 ( 3.031 -3.841 -0.558) 4.925 3.997 ( 3.658 0.638 -11.160) 11.762 4.090 ( -1.266 -1.796 -9.042) 9.306 4.541 ( -10.775 -4.084 -2.814) 11.861 4.596 ( 4.245 4.256 0.491) 6.032 4.690 ( -10.471 1.516 0.904) 10.618 4.973 ( 10.565 1.021 -0.973) 10.658 5.026 ( -8.736 -5.143 3.765) 10.814 5.165 ( 3.636 0.573 1.464) 3.962 5.476 ( -5.092 6.552 -3.768) 9.113 5.497 ( 6.898 6.407 2.995) 9.879 6.717 ( 3.763 4.501 6.525) 8.775 6.862 ( -3.464 2.167 -5.753) 7.057 7.211 ( 2.153 -4.081 -0.548) 4.647 7.296 ( 2.468 -2.831 -5.170) 6.390 7.588 ( -3.668 -10.509 -1.470) 11.227 7.712 ( 5.792 -12.192 -4.315) 14.171 7.917 ( -0.999 -7.475 5.125) 9.118 8.020 ( -1.655 -9.094 -1.299) 9.334 8.447 ( -1.406 2.929 5.687) 6.550 8.566 ( 2.434 7.949 4.568) 9.485 8.737 ( -4.005 4.585 -8.462) 10.424 8.814 ( 2.243 8.301 -6.535) 10.800 9.643 ( -0.076 2.315 2.886) 3.701 9.665 ( 0.129 2.607 1.575) 3.049 10.921 ( -4.719 -4.055 -1.029) 6.306 10.968 ( 3.786 -5.209 0.130) 6.441 11.448 ( -1.543 4.483 -0.026) 4.741 11.510 ( 0.898 7.438 1.875) 7.723 11.631 ( 1.173 6.420 -1.156) 6.628 11.677 ( 2.523 7.070 1.193) 7.601 12.085 ( -1.854 1.598 3.696) 4.433 12.179 ( 1.872 0.682 -0.704) 2.113 13.122 ( -11.720 -2.251 -2.168) 12.130 13.273 ( 9.037 -4.250 -0.255) 9.990 13.894 ( -3.196 4.978 4.224) 7.269 13.928 ( -0.271 4.266 3.662) 5.628 17.648 ( -2.013 1.179 -1.028) 2.549 17.669 ( 1.045 1.209 -0.818) 1.795 18.144 ( -3.941 15.354 3.987) 16.345 18.238 ( 3.850 15.063 3.198) 15.872 18.715 ( -5.971 2.866 0.524) 6.644 18.808 ( 4.558 4.620 1.106) 6.584 19.027 ( 0.328 0.441 4.261) 4.297 19.070 ( 0.003 1.736 1.651) 2.396 20.864 ( -3.959 -14.413 -7.229) 16.603 20.932 ( 6.359 -14.789 -5.067) 16.877 21.332 ( -1.556 -2.318 -0.408) 2.821 21.353 ( 1.192 -2.454 0.010) 2.728 ======================= Grid point 227 (115/170) ======================= q-point: (-0.36 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( -17.537 3.273 -0.970) 17.866 2.184 ( -17.764 9.597 7.823) 21.653 2.579 ( 12.436 -2.531 -1.295) 12.757 2.756 ( 2.991 4.880 -2.910) 6.421 2.833 ( 0.790 -4.944 2.187) 5.463 2.942 ( -1.749 0.798 0.479) 1.981 2.978 ( 1.952 -9.996 1.340) 10.272 3.203 ( 5.180 0.432 -0.412) 5.214 3.244 ( 7.314 6.380 -3.886) 10.454 3.302 ( 7.101 -2.215 -6.022) 9.571 3.566 ( -6.102 3.306 8.140) 10.697 3.798 ( 3.103 -2.016 -7.719) 8.560 3.981 ( 0.915 -5.300 -2.287) 5.844 4.053 ( 4.658 -0.936 0.230) 4.757 4.332 ( -10.302 -5.246 0.891) 11.595 4.542 ( -7.329 5.014 -1.560) 9.016 4.670 ( 2.749 3.423 1.813) 4.750 4.840 ( -9.998 1.724 -1.196) 10.216 5.085 ( 4.037 -2.839 -2.321) 5.454 5.306 ( 3.650 2.339 3.786) 5.755 5.331 ( -5.962 8.512 -2.750) 10.750 5.641 ( 6.711 8.504 2.770) 11.182 6.782 ( 2.085 -0.376 -3.229) 3.862 6.838 ( 1.172 0.135 4.310) 4.469 7.228 ( 0.930 -1.505 -2.272) 2.879 7.302 ( 3.705 -2.147 -1.121) 4.426 7.555 ( -0.274 -8.360 1.131) 8.440 7.780 ( 6.145 -11.657 -1.945) 13.320 7.952 ( -0.289 -7.860 3.381) 8.561 7.993 ( 0.433 -10.356 -0.610) 10.383 8.397 ( -5.581 4.339 -1.773) 7.288 8.558 ( -7.505 7.960 -3.686) 11.545 8.708 ( 4.025 4.907 7.339) 9.703 8.809 ( 3.806 7.601 -5.013) 9.869 9.651 ( -0.952 0.882 0.548) 1.408 9.672 ( -0.819 2.362 0.275) 2.515 10.860 ( -2.338 -2.169 0.136) 3.193 11.043 ( 4.198 -6.504 1.683) 7.922 11.389 ( -3.719 6.727 -0.197) 7.689 11.539 ( 1.639 5.097 -1.699) 5.618 11.651 ( 2.194 5.793 -0.169) 6.197 11.738 ( 4.422 5.780 -0.502) 7.294 12.099 ( -0.476 1.316 2.673) 3.017 12.197 ( 1.410 0.306 -1.236) 1.900 12.900 ( -13.121 -0.538 -1.023) 13.172 13.425 ( 7.852 -6.593 2.045) 10.455 13.822 ( -8.031 6.336 0.036) 10.230 13.938 ( -2.997 1.699 1.516) 3.763 17.616 ( -1.447 1.949 0.432) 2.466 17.684 ( 0.863 1.817 0.329) 2.039 18.119 ( -3.665 13.299 2.213) 13.971 18.303 ( 1.368 9.862 0.201) 9.958 18.654 ( -0.880 2.547 0.032) 2.695 18.889 ( 2.846 4.795 2.048) 5.940 19.067 ( -0.286 0.248 2.507) 2.535 19.069 ( -0.360 2.336 -1.150) 2.628 20.744 ( -3.313 -10.453 -3.700) 11.573 20.999 ( 6.982 -14.105 -1.916) 15.854 21.298 ( -1.998 -1.863 -0.430) 2.766 21.369 ( 0.715 -2.176 0.084) 2.292 ======================= Grid point 228 (116/170) ======================= q-point: (-0.27 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -14.886 12.774 6.778) 20.754 1.978 ( -19.698 15.053 10.846) 27.059 2.732 ( 8.296 -1.775 -2.888) 8.962 2.810 ( 4.551 -4.578 -0.632) 6.486 2.851 ( 2.226 -0.535 -2.184) 3.164 2.927 ( -3.449 -0.487 2.138) 4.087 3.035 ( 3.046 -9.885 1.106) 10.402 3.190 ( -8.195 4.784 -0.993) 9.541 3.255 ( 4.220 5.029 -3.425) 7.405 3.316 ( 5.336 -2.330 -8.702) 10.470 3.518 ( -5.618 2.624 4.662) 7.758 3.806 ( 4.148 -2.064 -2.716) 5.370 3.979 ( 0.602 -6.170 -1.153) 6.305 4.166 ( 2.931 4.059 6.454) 8.168 4.295 ( 2.050 -4.368 2.341) 5.363 4.428 ( -4.307 6.678 -2.294) 8.271 4.736 ( 3.154 1.972 1.762) 4.116 4.756 ( 0.115 1.114 2.618) 2.848 5.062 ( -1.747 -0.757 -3.589) 4.063 5.194 ( -4.685 11.142 -1.334) 12.160 5.383 ( -0.968 1.966 0.933) 2.382 5.746 ( 5.155 7.983 -1.304) 9.592 6.798 ( 2.239 -1.120 -3.196) 4.059 6.887 ( 0.659 -4.366 2.829) 5.244 7.203 ( -0.764 -0.104 -0.281) 0.821 7.365 ( 2.989 -0.262 1.175) 3.223 7.589 ( 0.342 -4.633 3.811) 6.009 7.823 ( -0.485 -7.011 0.811) 7.074 7.986 ( 3.421 -5.637 -1.052) 6.677 8.067 ( 7.492 -15.312 3.670) 17.437 8.282 ( -3.865 5.605 -3.982) 7.887 8.422 ( -8.725 9.388 1.808) 12.943 8.790 ( -2.459 6.954 3.184) 8.033 8.842 ( 6.257 5.693 -2.257) 8.755 9.610 ( -4.310 0.863 0.000) 4.396 9.668 ( 1.359 0.406 -1.478) 2.049 10.848 ( -0.180 -0.516 1.040) 1.175 11.128 ( 3.032 -6.739 2.918) 7.945 11.348 ( -0.257 6.457 -1.422) 6.616 11.545 ( 2.001 4.060 -1.790) 4.868 11.688 ( 4.352 3.510 -2.305) 6.047 11.798 ( 4.839 2.677 -1.729) 5.794 12.131 ( 1.162 0.299 1.921) 2.265 12.186 ( 0.057 -0.605 -3.080) 3.139 12.712 ( -11.846 2.324 3.536) 12.580 13.541 ( 3.508 -8.050 1.608) 8.927 13.651 ( -11.159 6.477 -3.286) 13.314 13.863 ( -5.943 -1.692 -1.834) 6.445 17.611 ( -0.951 3.314 1.834) 3.906 17.701 ( 0.583 2.356 0.890) 2.585 18.058 ( -6.358 10.633 0.044) 12.389 18.301 ( 1.124 -1.607 -2.405) 3.103 18.680 ( 3.824 4.879 -1.630) 6.410 18.932 ( -0.014 2.730 1.509) 3.120 19.027 ( -0.677 1.997 -4.028) 4.547 19.084 ( 0.466 -0.145 -0.374) 0.615 20.692 ( -2.073 -2.702 2.693) 4.342 21.109 ( 6.957 -10.694 1.941) 12.905 21.265 ( -1.680 -1.451 0.054) 2.220 21.377 ( 0.400 -1.521 0.024) 1.573 ======================= Grid point 229 (117/170) ======================= q-point: (-0.18 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( -8.359 20.988 14.499) 26.844 1.830 ( -16.256 19.277 13.479) 28.593 2.714 ( -19.369 9.022 9.919) 23.557 2.762 ( -5.068 -2.438 -0.771) 5.677 2.848 ( 3.001 1.524 -5.942) 6.829 2.930 ( 6.625 -3.091 -4.826) 8.760 3.015 ( 0.241 -8.254 -0.872) 8.303 3.212 ( 6.244 -3.523 -2.626) 7.635 3.285 ( 3.571 4.288 -2.627) 6.167 3.327 ( 7.020 -5.330 -2.368) 9.126 3.536 ( 1.284 -0.656 4.418) 4.647 3.814 ( 0.254 -4.176 -2.749) 5.006 3.971 ( -0.083 -3.181 1.326) 3.448 4.274 ( 3.098 8.215 4.269) 9.762 4.364 ( 1.187 7.392 -0.257) 7.492 4.387 ( 2.262 -2.037 3.626) 4.735 4.829 ( 3.753 1.669 3.556) 5.433 4.846 ( 3.295 -1.682 4.541) 5.857 5.013 ( 0.972 0.409 -1.007) 1.458 5.155 ( -1.410 12.246 2.322) 12.543 5.280 ( -8.448 2.665 -5.582) 10.471 5.773 ( 2.738 4.333 -5.012) 7.169 6.757 ( -1.710 -1.260 -4.587) 5.055 6.900 ( -0.667 -4.860 -1.182) 5.046 7.238 ( 2.526 0.904 4.633) 5.353 7.416 ( 1.859 2.332 1.580) 3.375 7.622 ( -1.260 -0.134 2.892) 3.157 7.808 ( -3.873 -6.218 4.114) 8.402 8.038 ( 3.137 -2.481 0.157) 4.003 8.164 ( -7.944 7.755 -0.995) 11.146 8.285 ( 10.532 -8.186 5.678) 14.498 8.349 ( -1.694 1.991 1.521) 3.024 8.765 ( -3.678 5.694 2.222) 7.133 8.897 ( 4.746 6.181 -3.627) 8.596 9.543 ( -3.914 1.069 0.651) 4.110 9.672 ( 2.235 -2.010 -3.457) 4.581 10.868 ( 0.550 0.665 1.204) 1.482 11.200 ( 1.419 -4.944 3.855) 6.427 11.337 ( 2.909 5.924 -5.175) 8.387 11.568 ( 2.870 2.499 -1.264) 4.010 11.742 ( 6.871 -0.308 -4.129) 8.022 11.860 ( 5.541 -0.094 -1.853) 5.844 12.143 ( 0.023 -1.739 -3.298) 3.729 12.171 ( 1.673 -1.516 0.843) 2.410 12.609 ( -9.868 5.168 8.053) 13.745 13.412 ( -12.417 6.450 -5.562) 15.057 13.529 ( -7.316 -8.543 0.028) 11.248 13.750 ( -2.454 -4.485 -3.964) 6.469 17.615 ( -1.407 4.328 1.802) 4.894 17.727 ( 0.999 1.929 1.748) 2.788 17.923 ( -8.316 6.349 -2.541) 10.766 18.297 ( 2.644 -7.451 -4.116) 8.913 18.704 ( 3.050 3.851 -4.399) 6.594 18.914 ( -1.575 0.357 -3.091) 3.487 18.984 ( 0.527 1.734 -2.102) 2.776 19.067 ( -0.579 -2.626 -2.545) 3.703 20.745 ( -0.053 5.753 9.687) 11.267 21.227 ( 1.517 -1.696 1.834) 2.922 21.272 ( 3.261 -4.828 2.261) 6.250 21.392 ( 1.619 -1.037 0.915) 2.129 ======================= Grid point 230 (118/170) ======================= q-point: (-0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -4.821 21.581 19.018) 29.166 1.735 ( -13.465 20.430 11.679) 27.113 2.624 ( -5.303 0.437 -6.708) 8.562 2.633 ( -10.122 14.242 19.281) 26.021 2.799 ( 0.562 2.679 -7.986) 8.443 2.951 ( 1.775 -6.046 -2.699) 6.855 3.032 ( 3.246 -8.039 -2.416) 9.000 3.224 ( 3.780 -4.893 -6.721) 9.133 3.306 ( 2.569 1.973 -2.638) 4.177 3.446 ( 4.385 -6.540 2.338) 8.214 3.618 ( 1.201 -1.322 4.188) 4.553 3.772 ( 0.002 -8.884 -3.762) 9.648 4.089 ( 8.546 0.898 8.643) 12.188 4.320 ( 3.646 9.881 -2.964) 10.941 4.461 ( 2.134 -0.765 2.807) 3.608 4.468 ( 2.831 6.258 9.468) 11.697 4.816 ( -1.370 -0.100 -7.059) 7.191 4.936 ( -2.339 6.356 4.557) 8.163 5.043 ( -3.341 7.690 -4.120) 9.342 5.115 ( 0.732 -5.694 8.964) 10.645 5.210 ( 0.288 7.159 5.122) 8.808 5.724 ( -0.369 2.377 -7.101) 7.497 6.657 ( -2.589 0.017 -5.741) 6.298 6.855 ( -1.639 -4.441 -2.863) 5.533 7.369 ( 5.818 1.764 5.850) 8.437 7.468 ( 1.921 5.299 2.655) 6.231 7.626 ( -1.229 2.623 2.175) 3.622 7.771 ( -7.968 -1.339 2.670) 8.510 8.006 ( -4.644 5.000 2.518) 7.274 8.146 ( 1.376 1.030 5.308) 5.579 8.331 ( 0.104 3.303 -0.632) 3.365 8.462 ( 4.207 -5.315 0.120) 6.779 8.744 ( -0.981 2.083 0.635) 2.388 8.918 ( 3.104 4.396 -4.049) 6.735 9.515 ( -1.215 0.006 1.322) 1.795 9.657 ( 1.871 -3.614 -4.876) 6.351 10.876 ( -0.761 1.330 0.563) 1.633 11.224 ( -2.047 3.649 -1.408) 4.414 11.362 ( 8.448 -0.016 -3.504) 9.146 11.589 ( 0.797 1.206 -1.077) 1.803 11.793 ( 3.887 -3.452 -3.808) 6.444 11.909 ( 4.697 -3.228 -4.664) 7.365 12.151 ( 3.151 -3.225 0.171) 4.512 12.197 ( 0.766 -3.671 0.286) 3.761 12.565 ( -8.138 7.003 9.919) 14.617 13.165 ( -9.028 6.981 -7.069) 13.425 13.385 ( -8.850 -6.245 2.678) 11.158 13.688 ( -0.370 -6.170 -5.254) 8.113 17.604 ( -1.859 3.844 1.197) 4.434 17.766 ( -1.991 2.081 0.569) 2.936 17.779 ( -2.717 2.477 0.112) 3.678 18.279 ( 2.162 -10.067 -6.669) 12.268 18.689 ( 1.920 2.393 -4.552) 5.489 18.834 ( -1.427 0.224 -6.112) 6.280 18.982 ( 0.053 -0.959 -0.015) 0.960 19.021 ( -1.390 -3.166 -1.982) 3.986 20.889 ( 1.547 9.955 13.421) 16.781 21.244 ( 0.093 0.462 1.541) 1.612 21.319 ( 0.634 -1.272 -0.481) 1.501 21.466 ( 3.837 -1.055 1.583) 4.283 ======================= Grid point 231 (119/170) ======================= q-point: ( 0.00 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( -6.725 9.656 8.194) 14.339 2.143 ( -3.302 13.746 12.985) 19.196 2.476 ( 0.553 2.103 -12.816) 12.999 2.720 ( 1.351 2.357 -8.565) 8.985 2.754 ( -0.318 -9.401 -0.718) 9.434 2.861 ( -1.064 -6.338 1.775) 6.667 2.965 ( 2.049 -1.864 -6.946) 7.478 3.069 ( 1.556 -2.802 -5.216) 6.122 3.362 ( 1.639 -1.953 2.430) 3.523 3.426 ( 2.156 -0.409 2.659) 3.447 3.524 ( 1.285 -7.407 2.419) 7.897 3.696 ( 1.355 -5.710 -0.295) 5.876 4.423 ( 0.900 9.030 14.994) 17.526 4.498 ( 2.992 4.598 2.099) 5.874 4.573 ( -2.475 1.707 5.810) 6.542 4.717 ( 0.325 13.270 3.055) 13.621 4.825 ( 1.570 4.941 2.693) 5.842 5.050 ( -5.547 4.745 -0.100) 7.300 5.098 ( -2.308 1.461 5.317) 5.978 5.160 ( 2.748 9.679 -0.607) 10.079 5.413 ( 0.711 5.768 1.959) 6.133 5.631 ( -1.879 -0.876 -7.056) 7.354 6.573 ( 0.829 -2.245 -2.248) 3.283 6.709 ( 1.814 -5.666 -4.924) 7.723 7.588 ( -0.394 5.312 7.941) 9.562 7.652 ( 2.401 4.818 4.884) 7.269 7.717 ( -1.532 5.133 1.238) 5.498 7.724 ( -2.020 3.869 1.013) 4.481 8.101 ( 2.464 1.771 4.998) 5.847 8.156 ( -5.727 -1.851 4.327) 7.412 8.243 ( -1.548 -7.052 -1.742) 7.428 8.501 ( 6.825 -2.439 -7.640) 10.531 8.723 ( -1.825 0.467 3.508) 3.982 8.955 ( 1.252 1.469 -7.060) 7.319 9.508 ( -0.935 0.375 0.793) 1.282 9.570 ( 0.596 -2.303 -2.835) 3.701 10.949 ( -0.896 5.426 4.874) 7.348 11.248 ( -1.224 2.851 -0.155) 3.107 11.471 ( 7.823 0.269 -4.555) 9.057 11.562 ( -3.846 0.937 0.314) 3.971 11.684 ( -5.229 -0.500 -4.766) 7.093 11.827 ( 5.652 -5.596 -6.949) 10.561 12.069 ( -3.218 -5.495 0.674) 6.403 12.110 ( 0.378 -5.313 -0.903) 5.402 12.766 ( -1.272 9.107 10.059) 13.629 13.152 ( 1.005 6.928 -7.581) 10.319 13.263 ( 0.249 -6.315 4.369) 7.683 13.483 ( -0.391 -6.606 -5.756) 8.770 17.650 ( -1.386 2.725 0.952) 3.203 17.728 ( -2.215 1.373 -1.519) 3.016 17.847 ( 0.814 1.483 2.557) 3.066 18.044 ( 1.000 -7.199 -6.456) 9.721 18.695 ( 1.131 0.647 -3.125) 3.386 18.750 ( -0.463 -0.562 -5.181) 5.232 18.936 ( -0.511 -1.779 0.443) 1.903 18.948 ( -0.124 -2.347 -0.447) 2.392 21.224 ( 0.407 7.067 6.786) 9.806 21.291 ( 1.260 1.383 2.689) 3.276 21.317 ( -0.554 0.741 1.747) 1.977 21.502 ( 0.194 -0.391 0.234) 0.495 ======================= Grid point 232 (120/170) ======================= q-point: ( 0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( 0.597 4.241 14.379) 15.003 2.247 ( -1.212 4.012 10.751) 11.539 2.393 ( 5.273 6.117 -8.443) 11.684 2.649 ( 4.282 2.552 -11.994) 12.988 2.745 ( -2.317 -7.094 2.353) 7.825 2.867 ( -0.382 -5.188 0.580) 5.234 2.897 ( -1.548 -1.620 -4.402) 4.939 3.032 ( 1.141 -3.148 -4.857) 5.899 3.405 ( -0.982 -2.165 -0.031) 2.377 3.414 ( 0.155 -4.102 -0.293) 4.115 3.608 ( -1.266 -4.168 1.176) 4.512 3.653 ( -0.368 -4.561 -2.088) 5.029 4.457 ( -5.632 5.275 -0.987) 7.779 4.558 ( 0.734 0.653 5.833) 5.915 4.671 ( 1.519 9.073 7.402) 11.808 4.746 ( 0.051 7.316 0.691) 7.349 4.831 ( -8.718 11.733 -0.472) 14.624 4.982 ( 2.176 7.936 4.030) 9.162 5.059 ( -5.597 2.854 2.265) 6.678 5.207 ( 1.801 7.614 -0.527) 7.842 5.455 ( -0.219 2.162 2.300) 3.164 5.539 ( 0.325 0.976 -4.241) 4.364 6.624 ( 5.644 -3.666 0.623) 6.759 6.715 ( 6.077 -4.881 -5.173) 9.355 7.560 ( -7.548 6.937 1.490) 10.359 7.592 ( -8.971 4.152 1.998) 10.085 7.760 ( 1.163 3.843 2.496) 4.728 7.778 ( 1.411 1.731 3.212) 3.912 8.076 ( -7.163 -7.611 0.042) 10.452 8.117 ( -6.607 -6.081 4.895) 10.227 8.311 ( 8.180 1.728 1.510) 8.496 8.518 ( 7.525 2.333 -8.106) 11.304 8.750 ( -0.603 0.255 3.777) 3.833 8.900 ( 1.530 1.391 -5.280) 5.670 9.515 ( 0.716 0.419 0.721) 1.099 9.562 ( 1.550 -1.516 -1.671) 2.737 11.003 ( -1.376 5.694 7.468) 9.492 11.201 ( 1.505 8.742 -7.742) 11.774 11.420 ( -8.154 -5.175 3.137) 10.155 11.530 ( -6.167 0.329 -2.227) 6.565 11.634 ( 7.699 0.516 -2.952) 8.262 11.822 ( 1.334 -2.823 -5.297) 6.149 12.020 ( -3.828 -5.334 2.337) 6.970 12.098 ( -0.951 -6.141 -0.270) 6.220 12.910 ( 5.024 7.209 10.431) 13.638 13.138 ( 7.872 7.124 -8.981) 13.906 13.336 ( 2.144 -7.610 3.657) 8.712 13.447 ( 3.897 -4.831 -4.704) 7.788 17.667 ( 0.750 2.047 2.319) 3.182 17.728 ( 3.174 0.191 0.758) 3.269 17.880 ( 0.441 1.295 1.206) 1.824 18.000 ( 2.451 -2.876 -5.648) 6.796 18.692 ( 0.696 -0.026 -1.373) 1.540 18.695 ( 0.155 0.240 -2.922) 2.936 18.942 ( 0.458 -1.456 0.551) 1.623 18.957 ( 1.578 -2.502 -0.040) 2.958 21.253 ( -1.815 2.574 1.657) 3.559 21.300 ( -0.063 0.211 -1.035) 1.058 21.355 ( -3.293 2.716 7.043) 8.236 21.450 ( -4.457 0.941 -2.737) 5.315 ======================= Grid point 233 (121/170) ======================= q-point: ( 0.18 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 3.259 -2.722 15.958) 16.513 2.343 ( 4.469 -0.251 5.225) 6.880 2.428 ( 4.005 5.073 -3.861) 7.529 2.592 ( 2.908 8.103 -7.563) 11.459 2.741 ( -0.941 -2.604 2.983) 4.070 2.813 ( -2.136 -2.469 -3.304) 4.645 2.863 ( -4.082 -4.792 1.657) 6.509 3.016 ( 2.583 -1.752 -1.912) 3.660 3.343 ( -4.082 -3.619 -3.482) 6.472 3.425 ( 0.836 -2.437 -1.356) 2.911 3.510 ( -2.648 -3.769 -4.741) 6.610 3.632 ( -3.269 -9.463 -1.476) 10.120 4.369 ( -3.487 8.904 1.607) 9.696 4.597 ( -5.178 11.563 -3.826) 13.235 4.644 ( -2.278 7.117 1.777) 7.681 4.705 ( -2.283 3.644 -5.478) 6.965 4.726 ( -3.751 6.536 2.500) 7.940 5.026 ( -2.578 -0.043 3.292) 4.182 5.090 ( 1.256 5.810 2.577) 6.479 5.220 ( 2.862 5.383 -0.528) 6.120 5.420 ( -0.951 3.347 -2.462) 4.263 5.574 ( 1.628 0.833 3.186) 3.673 6.695 ( 2.869 -2.920 -1.651) 4.414 6.786 ( 7.077 -4.365 -1.678) 8.483 7.442 ( -5.487 4.552 -2.761) 7.646 7.472 ( -8.575 2.596 1.439) 9.075 7.738 ( -3.732 -0.185 -0.633) 3.790 7.832 ( 0.013 -0.700 3.446) 3.516 7.937 ( -7.824 -9.574 -3.248) 12.784 8.062 ( -7.126 -9.819 4.461) 12.926 8.420 ( 4.017 7.097 -0.232) 8.158 8.585 ( 8.373 7.924 -3.416) 12.023 8.787 ( 0.903 -0.033 2.810) 2.952 8.911 ( 5.209 0.389 -2.039) 5.608 9.537 ( 0.994 1.430 0.311) 1.769 9.580 ( 1.944 0.159 -0.138) 1.955 11.050 ( -3.854 3.679 7.941) 9.563 11.124 ( -0.292 6.894 -8.337) 10.822 11.359 ( -2.583 -2.252 1.650) 3.804 11.440 ( -3.538 -1.873 0.545) 4.040 11.676 ( 1.497 2.795 -4.107) 5.189 11.792 ( 0.504 0.159 0.346) 0.632 11.993 ( -3.426 -3.687 2.090) 5.449 12.092 ( 0.416 -5.672 0.370) 5.699 13.128 ( 8.538 5.960 3.995) 11.153 13.183 ( 8.955 6.301 -3.471) 11.486 13.419 ( 5.163 -5.728 2.726) 8.179 13.489 ( 4.593 -4.906 -1.542) 6.896 17.717 ( 2.327 2.577 1.930) 3.972 17.808 ( 0.823 -2.540 2.934) 3.967 17.913 ( 6.414 5.506 -0.552) 8.471 18.008 ( 3.220 1.266 -1.053) 3.616 18.667 ( 0.080 1.402 -0.977) 1.711 18.713 ( 1.407 -0.885 0.862) 1.873 18.957 ( 0.577 -0.633 0.622) 1.059 18.994 ( 2.811 -2.298 0.090) 3.632 21.190 ( -6.610 1.637 -2.355) 7.206 21.282 ( -1.630 -0.865 -1.026) 2.111 21.335 ( -4.600 -0.269 -2.949) 5.471 21.346 ( -4.230 -0.595 3.220) 5.349 ======================= Grid point 234 (122/170) ======================= q-point: ( 0.27 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.355 ( -1.843 4.876 -8.737) 10.174 2.415 ( 2.908 -3.391 2.750) 5.246 2.539 ( 2.403 0.974 9.582) 9.926 2.615 ( 2.492 6.371 4.102) 7.977 2.735 ( 0.152 -1.410 -1.673) 2.193 2.788 ( -7.403 -3.190 3.711) 8.874 2.827 ( 3.380 -2.968 3.704) 5.827 3.078 ( 5.711 -0.856 0.096) 5.776 3.179 ( -8.589 -1.737 -5.723) 10.466 3.376 ( -1.411 0.337 -5.947) 6.121 3.490 ( 0.323 -7.016 2.021) 7.309 3.576 ( -0.387 -9.479 -1.183) 9.561 4.391 ( 0.497 9.278 2.238) 9.557 4.416 ( -6.075 10.999 -4.679) 13.408 4.589 ( 0.336 3.874 -10.274) 10.986 4.628 ( -1.246 9.472 -2.820) 9.961 4.733 ( -1.720 2.657 5.132) 6.030 4.957 ( -5.597 -3.458 -4.773) 8.128 5.090 ( -0.511 3.325 -1.879) 3.853 5.265 ( -0.082 -1.567 2.289) 2.775 5.417 ( 1.879 4.913 -0.065) 5.260 5.623 ( -0.004 -0.219 3.267) 3.275 6.687 ( -1.491 -0.773 -1.065) 1.989 6.877 ( 6.433 -4.109 -0.591) 7.656 7.321 ( -5.074 1.805 -4.089) 6.762 7.374 ( -5.477 0.923 0.805) 5.612 7.674 ( -3.004 -3.620 -0.838) 4.778 7.773 ( -5.917 -8.086 -5.591) 11.474 7.848 ( -1.567 -3.928 1.459) 4.474 7.985 ( -6.135 -9.327 1.008) 11.209 8.439 ( 0.102 9.666 -1.565) 9.792 8.675 ( 2.931 9.946 2.488) 10.663 8.828 ( 4.762 0.443 -3.326) 5.825 9.005 ( 6.986 0.327 -0.597) 7.019 9.556 ( 0.610 2.542 1.505) 3.016 9.612 ( 0.920 1.010 1.207) 1.823 11.014 ( -3.404 2.733 -4.608) 6.347 11.063 ( -3.275 0.075 3.892) 5.087 11.351 ( 1.690 0.865 -3.277) 3.787 11.434 ( -2.148 -2.289 7.016) 7.687 11.658 ( 1.627 6.174 -1.117) 6.481 11.815 ( 0.567 2.487 0.146) 2.555 11.974 ( -2.132 -2.343 3.754) 4.912 12.109 ( 0.929 -3.791 0.461) 3.930 13.167 ( 7.236 5.777 -11.166) 14.506 13.380 ( 4.422 2.293 6.492) 8.183 13.532 ( 6.990 -2.861 0.763) 7.591 13.594 ( 6.222 -2.441 7.777) 10.254 17.756 ( 1.065 1.606 -0.930) 2.140 17.799 ( -1.393 -0.518 -0.969) 1.774 18.078 ( 8.069 8.263 3.575) 12.090 18.093 ( 6.603 5.683 6.056) 10.610 18.672 ( 0.561 1.852 0.454) 1.988 18.760 ( 1.896 -1.113 3.135) 3.829 18.973 ( 0.516 0.682 0.900) 1.242 19.038 ( 2.245 -0.897 0.172) 2.423 21.007 ( -8.358 -1.383 -7.303) 11.185 21.160 ( -8.724 -6.105 -4.457) 11.544 21.289 ( -0.076 -0.759 -1.106) 1.343 21.323 ( -1.848 -1.798 1.421) 2.944 ======================= Grid point 235 (123/170) ======================= q-point: ( 0.36 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( -1.721 3.853 -8.052) 9.091 2.459 ( -2.902 -0.297 4.595) 5.443 2.590 ( 0.981 3.343 -1.006) 3.626 2.665 ( -2.842 -1.979 4.243) 5.477 2.755 ( 5.655 4.607 -1.018) 7.364 2.833 ( 0.066 -3.195 10.743) 11.208 2.890 ( -1.149 -0.751 0.417) 1.435 3.027 ( -1.437 -1.535 -2.416) 3.203 3.164 ( 3.607 -1.310 0.488) 3.868 3.280 ( -4.731 3.503 -2.795) 6.517 3.502 ( -2.603 -7.112 3.371) 8.290 3.594 ( 2.414 -7.500 0.617) 7.903 4.245 ( -3.352 6.343 -8.405) 11.050 4.472 ( 1.521 5.143 -0.629) 5.400 4.500 ( 5.943 -0.148 -13.842) 15.065 4.591 ( 1.376 7.864 -2.100) 8.255 4.755 ( 0.070 2.312 2.426) 3.352 4.820 ( -3.248 -0.896 -3.228) 4.666 5.007 ( -5.476 -4.569 -4.780) 8.585 5.267 ( -5.106 -2.910 5.262) 7.889 5.449 ( 1.343 4.224 1.030) 4.551 5.647 ( -1.343 0.266 2.981) 3.280 6.660 ( -0.400 3.357 0.775) 3.469 6.986 ( 7.337 -2.669 0.202) 7.810 7.204 ( -4.440 -0.347 -3.266) 5.523 7.299 ( -4.283 -1.145 -1.389) 4.646 7.594 ( -4.674 -7.990 -3.058) 9.749 7.649 ( -1.338 -7.004 -6.825) 9.871 7.828 ( -2.437 -2.469 0.830) 3.567 7.914 ( -2.742 -7.970 -0.255) 8.433 8.415 ( -0.387 9.171 -1.081) 9.242 8.714 ( -2.610 7.734 4.205) 9.182 8.866 ( 6.841 2.899 -7.110) 10.284 9.068 ( 3.131 1.473 -3.597) 4.991 9.596 ( 0.956 2.604 3.348) 4.348 9.635 ( -0.015 0.906 2.310) 2.481 10.926 ( -1.671 0.604 -3.685) 4.091 11.026 ( -4.234 -3.031 -0.175) 5.210 11.365 ( 2.517 2.936 1.395) 4.111 11.516 ( 0.864 -1.252 8.664) 8.797 11.692 ( 3.116 7.544 -1.300) 8.265 11.804 ( -1.014 5.191 -0.484) 5.311 12.014 ( -0.501 -1.282 6.366) 6.513 12.132 ( 1.235 -1.952 0.675) 2.407 13.145 ( 5.595 3.804 -10.417) 12.421 13.385 ( -3.091 -3.734 -2.970) 5.685 13.722 ( 7.186 3.397 8.828) 11.879 13.791 ( 5.737 0.386 8.933) 10.624 17.732 ( -0.304 0.827 -3.411) 3.523 17.759 ( -1.777 0.056 -1.845) 2.562 18.237 ( 6.096 11.292 6.865) 14.553 18.307 ( 6.899 11.816 9.031) 16.395 18.689 ( 1.155 1.340 0.440) 1.823 18.838 ( 1.665 -0.774 5.494) 5.792 18.995 ( 0.683 2.395 0.954) 2.667 19.059 ( -0.202 1.415 0.641) 1.566 20.801 ( -4.931 -6.937 -9.771) 12.958 20.947 ( -8.618 -11.246 -8.374) 16.458 21.283 ( 0.476 -1.402 -0.566) 1.585 21.313 ( -1.168 -2.360 0.936) 2.795 ======================= Grid point 236 (124/170) ======================= q-point: ( 0.45 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( 0.683 0.378 -2.975) 3.076 2.392 ( -8.472 -2.318 -1.468) 8.905 2.603 ( 2.090 8.147 0.319) 8.417 2.690 ( -0.406 -2.267 4.670) 5.207 2.830 ( -3.954 -2.293 0.811) 4.642 2.849 ( 6.468 3.217 -1.275) 7.335 2.962 ( 5.150 1.332 3.948) 6.625 3.063 ( 3.782 -3.132 1.396) 5.105 3.147 ( -9.390 7.962 3.270) 12.738 3.215 ( 2.869 0.046 -2.442) 3.768 3.486 ( -4.924 -5.631 5.365) 9.206 3.658 ( 3.194 -5.720 2.344) 6.958 4.113 ( 0.348 1.806 -11.620) 11.765 4.306 ( -2.693 3.054 -17.666) 18.130 4.504 ( 5.430 -5.124 -5.527) 9.289 4.684 ( 4.708 -2.201 -0.050) 5.197 4.730 ( -3.995 0.507 -3.285) 5.197 4.812 ( -1.653 2.319 3.308) 4.365 4.905 ( 3.073 -5.225 1.600) 6.269 5.213 ( -7.825 -3.186 3.281) 9.063 5.498 ( 2.479 5.620 3.128) 6.893 5.644 ( -2.528 2.431 1.629) 3.867 6.714 ( 3.599 7.599 4.286) 9.438 7.059 ( -2.860 2.662 -0.679) 3.966 7.135 ( 2.823 -1.575 -2.670) 4.193 7.209 ( -1.557 -5.514 -4.057) 7.020 7.508 ( 0.050 -8.184 -4.620) 9.398 7.543 ( -2.621 -7.523 -6.819) 10.486 7.803 ( -1.871 -2.823 1.582) 3.738 7.887 ( -1.081 -7.191 -0.218) 7.276 8.425 ( 1.352 5.388 2.015) 5.909 8.697 ( -2.888 3.961 0.821) 4.970 8.876 ( 3.522 4.653 -5.936) 8.324 9.026 ( -0.970 3.808 -5.824) 7.025 9.649 ( 0.531 2.263 3.512) 4.211 9.669 ( 0.745 0.997 2.481) 2.776 10.883 ( 0.232 -1.335 -2.165) 2.554 10.942 ( -4.021 -3.069 -2.115) 5.483 11.455 ( 3.977 4.294 4.310) 7.268 11.626 ( 0.364 1.198 7.960) 8.058 11.700 ( 1.364 6.519 -3.093) 7.343 11.791 ( -0.651 6.393 0.314) 6.434 12.080 ( -0.496 0.656 6.342) 6.395 12.162 ( 1.485 -0.383 0.768) 1.716 13.131 ( 5.138 0.163 -6.617) 8.379 13.264 ( -6.356 -3.734 -4.718) 8.752 13.902 ( 3.142 4.323 8.145) 9.741 13.946 ( 2.054 2.661 7.237) 7.980 17.692 ( 0.012 0.514 -2.760) 2.807 17.706 ( -2.015 -0.053 -2.087) 2.901 18.408 ( 5.912 14.140 6.317) 16.577 18.456 ( -1.448 16.678 8.069) 18.584 18.739 ( 4.034 0.531 2.186) 4.619 18.911 ( -2.649 2.838 5.796) 6.976 18.989 ( -0.841 2.415 -0.146) 2.562 19.074 ( 0.587 1.930 2.421) 3.151 20.660 ( 1.393 -12.837 -9.962) 16.309 20.728 ( -5.348 -14.978 -10.249) 18.920 21.291 ( 0.818 -1.968 -0.075) 2.133 21.304 ( -0.960 -2.420 0.382) 2.632 ======================= Grid point 237 (125/170) ======================= q-point: (-0.45 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -6.103 -0.253 -0.627) 6.140 2.265 ( 2.156 -1.778 -1.003) 2.969 2.592 ( -6.674 8.486 3.187) 11.257 2.749 ( 0.783 -3.832 2.028) 4.406 2.780 ( -2.508 -4.975 0.256) 5.578 2.911 ( 3.593 5.351 -3.177) 7.186 3.021 ( -5.085 2.266 0.745) 5.617 3.090 ( 7.442 0.063 -1.231) 7.543 3.152 ( 3.997 0.434 1.865) 4.432 3.283 ( 6.651 4.691 -0.085) 8.139 3.510 ( -2.582 -3.071 11.747) 12.413 3.727 ( 1.155 -4.049 2.952) 5.142 3.994 ( 2.942 -0.949 -14.159) 14.492 4.094 ( -0.058 1.843 -15.063) 15.175 4.409 ( -12.876 -8.385 -2.056) 15.502 4.639 ( 7.017 -2.623 -3.457) 8.251 4.759 ( -3.957 4.991 0.483) 6.388 4.830 ( 3.157 -5.901 1.351) 6.828 5.046 ( -0.311 0.213 3.183) 3.205 5.158 ( 6.132 -2.026 1.049) 6.543 5.590 ( 0.753 4.589 2.429) 5.247 5.600 ( -1.337 4.873 1.741) 5.345 6.833 ( 1.785 7.616 6.788) 10.357 6.917 ( -8.726 3.486 -3.742) 10.114 7.135 ( 3.112 -3.558 -2.493) 5.344 7.238 ( 7.544 -2.096 -5.221) 9.411 7.432 ( -3.064 -7.053 -3.420) 8.416 7.503 ( 4.866 -9.357 -3.617) 11.150 7.807 ( -1.029 -4.135 2.869) 5.137 7.864 ( -0.942 -6.790 -0.866) 6.909 8.484 ( 0.090 1.692 4.097) 4.433 8.655 ( 1.185 -0.142 -3.977) 4.152 8.843 ( -2.819 7.453 -1.038) 8.036 8.955 ( 0.487 5.903 -4.759) 7.598 9.679 ( -0.729 1.630 2.058) 2.725 9.702 ( 0.417 1.261 1.301) 1.859 10.861 ( -2.214 -2.192 -0.912) 3.246 10.895 ( 1.907 -2.783 -0.968) 3.510 11.541 ( 0.685 5.380 2.183) 5.846 11.658 ( -1.136 7.468 0.177) 7.556 11.716 ( 1.529 2.204 1.187) 2.934 11.795 ( 0.143 4.728 1.795) 5.059 12.123 ( -1.333 2.360 3.804) 4.671 12.190 ( 1.027 0.426 0.408) 1.185 13.083 ( -8.587 -1.658 -3.622) 9.466 13.184 ( 5.830 -4.811 -1.938) 7.803 13.986 ( -2.353 4.371 5.180) 7.174 14.008 ( -1.926 3.736 4.133) 5.894 17.659 ( -1.419 0.318 -1.149) 1.854 17.679 ( 1.052 -0.056 -1.056) 1.492 18.440 ( -6.711 14.598 3.892) 16.532 18.562 ( 5.069 16.915 3.938) 18.092 18.773 ( -9.317 3.514 2.692) 10.315 18.894 ( 2.982 4.521 1.821) 5.714 19.032 ( 0.331 -0.157 4.847) 4.861 19.107 ( 0.183 1.895 1.604) 2.490 20.573 ( -0.075 -15.072 -8.889) 17.498 20.635 ( 7.522 -15.618 -7.658) 18.951 21.290 ( -1.030 -1.908 -0.038) 2.169 21.307 ( 1.054 -2.258 0.117) 2.495 ======================= Grid point 238 (126/170) ======================= q-point: (-0.36 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -8.513 7.807 1.082) 11.601 2.352 ( -4.499 6.210 7.017) 10.395 2.547 ( 4.627 -0.381 -0.399) 4.660 2.710 ( -1.964 -2.946 -0.668) 3.603 2.788 ( -0.867 -8.042 2.580) 8.490 2.908 ( 0.105 4.437 -2.334) 5.014 2.953 ( -1.996 0.720 -1.981) 2.903 3.180 ( 6.505 -3.428 -3.366) 8.087 3.242 ( 4.569 -0.323 -0.595) 4.619 3.371 ( 5.438 4.376 -2.943) 7.575 3.625 ( -5.284 0.380 11.439) 12.606 3.733 ( 1.834 -2.151 -3.663) 4.627 3.904 ( 0.531 -3.742 -8.299) 9.119 4.013 ( 4.952 -3.247 -1.767) 6.180 4.260 ( -2.113 -0.209 0.410) 2.162 4.660 ( -2.954 7.597 -0.524) 8.168 4.752 ( 2.798 4.056 0.699) 4.977 4.839 ( -3.591 -3.118 1.386) 4.954 5.013 ( 3.859 -2.383 -5.824) 7.382 5.333 ( 5.057 -1.689 4.306) 6.853 5.502 ( -5.089 8.582 -1.593) 10.104 5.716 ( 5.132 0.223 3.901) 6.450 6.768 ( -3.376 0.333 -3.485) 4.863 6.871 ( -4.156 2.340 3.499) 5.915 7.203 ( 5.220 -0.331 -2.906) 5.983 7.268 ( 5.050 -1.029 -2.485) 5.722 7.417 ( 2.815 -6.541 0.703) 7.155 7.568 ( 6.929 -10.052 -1.825) 12.344 7.827 ( -0.941 -4.526 3.481) 5.787 7.849 ( 0.482 -5.492 -0.664) 5.553 8.470 ( -2.526 3.591 -1.254) 4.566 8.664 ( -0.447 1.334 -0.652) 1.551 8.810 ( -0.317 6.561 3.498) 7.442 8.930 ( 0.925 4.840 -2.770) 5.653 9.671 ( -1.922 1.223 0.245) 2.292 9.704 ( -1.055 0.950 0.087) 1.422 10.835 ( -0.386 -0.515 0.284) 0.704 10.941 ( 3.344 -4.299 1.001) 5.538 11.515 ( -3.474 6.578 -0.956) 7.500 11.641 ( 0.728 4.927 -2.415) 5.535 11.746 ( -0.193 3.816 1.837) 4.239 11.824 ( 2.234 3.054 -0.660) 3.841 12.131 ( -1.493 1.916 2.238) 3.303 12.197 ( -0.117 -0.358 -0.893) 0.969 12.910 ( -9.241 1.915 -0.764) 9.468 13.279 ( 5.340 -8.443 1.680) 10.130 13.934 ( -7.887 4.964 0.587) 9.337 13.979 ( -5.819 2.311 1.157) 6.367 17.641 ( -0.304 1.052 0.473) 1.193 17.699 ( 1.685 -0.225 0.503) 1.772 18.357 ( -7.033 11.713 1.322) 13.727 18.537 ( -13.133 11.763 0.520) 17.639 18.717 ( 4.193 4.744 -0.235) 6.336 18.961 ( 0.599 2.987 2.708) 4.077 19.067 ( -1.197 -0.325 1.992) 2.347 19.108 ( -1.502 1.069 0.366) 1.880 20.544 ( 5.531 -9.427 -3.795) 11.570 20.726 ( 11.372 -13.911 -3.131) 18.238 21.271 ( -1.115 -0.893 -0.151) 1.437 21.326 ( 1.109 -2.270 0.110) 2.529 ======================= Grid point 239 (127/170) ======================= q-point: (-0.27 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( -4.916 15.775 7.000) 17.945 2.267 ( -12.210 14.569 7.708) 20.512 2.678 ( 6.387 -6.444 -0.395) 9.081 2.716 ( 3.649 -0.696 -1.087) 3.871 2.834 ( 2.189 -9.544 2.909) 10.215 2.879 ( 0.229 0.788 -1.715) 1.901 2.913 ( -0.588 -0.636 -0.364) 0.940 3.210 ( 0.715 -1.519 -4.693) 4.984 3.249 ( 2.170 -3.248 -6.682) 7.740 3.360 ( 0.573 4.944 -5.057) 7.096 3.530 ( -7.536 -4.833 0.507) 8.968 3.727 ( 1.784 -6.906 -5.805) 9.196 3.928 ( 1.943 1.782 5.661) 6.245 4.155 ( 4.444 -3.824 10.948) 12.419 4.323 ( 6.241 7.953 1.058) 10.165 4.620 ( -0.179 12.836 -2.005) 12.993 4.783 ( 0.828 2.551 0.954) 2.847 4.808 ( -0.250 4.521 1.174) 4.678 5.045 ( 4.167 -2.758 -1.564) 5.236 5.356 ( -3.658 1.541 -0.052) 3.970 5.436 ( -2.470 7.086 -0.369) 7.513 5.802 ( 2.607 -1.782 -0.753) 3.246 6.743 ( 2.793 -4.485 -2.331) 5.775 6.813 ( -5.377 -2.351 1.077) 5.966 7.214 ( 2.501 1.656 -1.393) 3.307 7.370 ( 5.336 0.835 1.662) 5.651 7.497 ( 3.757 -5.406 3.442) 7.429 7.685 ( 10.142 -9.096 -1.176) 13.674 7.831 ( -1.157 -5.214 1.426) 5.528 7.898 ( 4.124 -4.495 2.451) 6.574 8.427 ( -1.076 8.296 -1.131) 8.442 8.590 ( -7.856 7.396 1.537) 10.898 8.879 ( -1.978 2.217 4.867) 5.702 8.918 ( 4.711 2.066 -4.289) 6.698 9.625 ( -3.329 1.107 -0.645) 3.567 9.682 ( -1.142 0.542 -0.580) 1.391 10.852 ( 1.169 0.900 1.481) 2.090 11.013 ( 2.961 -5.086 2.730) 6.488 11.454 ( -0.938 5.122 -2.578) 5.811 11.630 ( 1.111 3.687 -2.054) 4.364 11.740 ( 0.500 2.131 -2.813) 3.564 11.851 ( 2.680 3.133 -1.219) 4.299 12.130 ( -0.842 -0.797 0.720) 1.365 12.162 ( -1.312 -1.781 -2.983) 3.714 12.793 ( -8.084 6.390 4.496) 11.243 13.363 ( 1.894 -10.396 2.087) 10.771 13.764 ( -11.566 4.954 -2.991) 12.933 13.852 ( -9.030 0.150 -2.317) 9.324 17.657 ( 0.431 1.856 1.880) 2.677 17.735 ( 1.307 0.579 1.379) 1.986 18.241 ( -9.817 8.372 -0.349) 12.907 18.323 ( -10.193 3.494 -2.171) 10.991 18.767 ( 3.321 4.063 -2.708) 5.905 18.964 ( -1.926 0.509 -0.225) 2.005 19.038 ( -1.286 -0.446 -2.635) 2.966 19.071 ( -3.109 -1.160 -0.193) 3.324 20.658 ( 8.757 -0.570 3.184) 9.335 20.914 ( 12.824 -9.362 2.138) 16.021 21.254 ( -0.906 0.201 0.179) 0.945 21.344 ( 1.107 -1.996 0.050) 2.283 ======================= Grid point 240 (128/170) ======================= q-point: (-0.18 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( -3.258 18.460 9.856) 21.178 2.188 ( -9.033 17.411 8.193) 21.258 2.696 ( -1.374 -2.756 -3.082) 4.357 2.748 ( -0.144 -0.856 1.369) 1.621 2.819 ( -0.490 -6.013 -4.199) 7.351 2.905 ( 1.146 -0.626 -0.346) 1.351 2.939 ( 1.401 -1.965 -0.809) 2.546 3.133 ( 1.098 -3.648 -2.757) 4.702 3.228 ( 4.997 -4.618 -4.642) 8.237 3.361 ( 3.158 3.425 -4.950) 6.798 3.469 ( -0.514 -8.548 1.895) 8.770 3.656 ( -1.532 -9.756 -6.368) 11.751 4.035 ( 0.450 7.506 11.100) 13.407 4.354 ( 1.836 -2.112 14.494) 14.762 4.425 ( 4.655 10.333 1.142) 11.390 4.603 ( 0.931 14.506 -1.680) 14.632 4.830 ( 1.493 3.128 6.035) 6.959 4.866 ( 4.425 1.236 -0.855) 4.673 5.088 ( 2.647 4.840 -0.701) 5.561 5.269 ( -6.913 -0.884 -0.311) 6.976 5.391 ( -1.084 8.957 -1.080) 9.087 5.790 ( 0.659 -2.282 -4.983) 5.520 6.718 ( -2.336 -2.715 -3.351) 4.905 6.777 ( -0.647 -7.064 0.440) 7.107 7.279 ( 4.699 3.587 3.087) 6.669 7.464 ( 4.014 2.456 2.658) 5.404 7.598 ( 3.158 -3.097 4.954) 6.641 7.755 ( -1.687 1.338 0.369) 2.185 7.933 ( 11.956 -10.679 -0.669) 16.044 8.017 ( 7.076 -8.007 4.215) 11.487 8.370 ( -9.170 9.443 3.188) 13.544 8.502 ( -2.095 8.358 -0.928) 8.667 8.827 ( -6.700 1.273 1.978) 7.101 8.975 ( 5.902 0.941 -4.434) 7.442 9.566 ( -3.250 1.517 -0.180) 3.591 9.652 ( -1.188 -0.388 -1.868) 2.248 10.895 ( 1.073 2.140 2.287) 3.311 11.095 ( 2.595 -5.196 4.880) 7.586 11.428 ( 2.074 4.036 -4.562) 6.434 11.631 ( 2.218 2.643 -2.833) 4.464 11.725 ( 3.452 -0.469 -4.613) 5.781 11.878 ( 2.510 1.894 -2.066) 3.762 12.098 ( -0.830 -3.025 -3.182) 4.468 12.129 ( -0.320 -2.879 -0.523) 2.944 12.744 ( -7.500 8.991 7.940) 14.147 13.361 ( -5.006 -9.578 1.213) 10.875 13.523 ( -12.327 4.888 -5.385) 14.312 13.679 ( -6.761 -2.798 -4.163) 8.418 17.684 ( -0.272 2.873 2.044) 3.536 17.767 ( 0.616 1.659 1.747) 2.487 18.033 ( -12.587 5.166 -2.234) 13.789 18.193 ( -3.504 -3.415 -4.138) 6.408 18.762 ( 1.455 2.328 -4.644) 5.395 18.901 ( -1.915 -2.060 -4.718) 5.492 18.991 ( -1.493 -0.420 -1.791) 2.369 19.015 ( -2.701 -2.181 -1.134) 3.652 20.863 ( 8.214 6.301 8.472) 13.377 21.148 ( 10.669 -4.774 4.485) 12.520 21.250 ( -0.141 0.803 0.782) 1.130 21.366 ( 1.813 -1.744 0.495) 2.564 ======================= Grid point 241 (129/170) ======================= q-point: (-0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.014 ( -5.948 13.999 9.942) 18.171 2.122 ( -8.672 18.407 5.865) 21.176 2.607 ( -1.525 -0.124 -8.146) 8.288 2.765 ( 0.954 -1.653 0.267) 1.927 2.772 ( -2.363 -3.313 -0.103) 4.071 2.870 ( -0.056 -1.726 -2.465) 3.010 2.975 ( 4.085 -1.861 -4.522) 6.372 3.101 ( 2.083 -5.254 -6.630) 8.712 3.322 ( 3.053 -4.720 0.880) 5.690 3.337 ( 3.071 -0.686 -0.397) 3.171 3.522 ( 0.771 -7.216 -0.006) 7.257 3.618 ( 3.621 -8.730 1.573) 9.581 4.208 ( 1.989 10.066 16.619) 19.531 4.461 ( 1.883 9.332 -1.516) 9.640 4.513 ( -1.664 0.232 12.110) 12.226 4.648 ( 3.643 13.192 2.796) 13.969 4.851 ( -1.621 2.840 -4.555) 5.607 4.961 ( 2.206 -0.192 10.470) 10.702 5.113 ( 0.458 4.761 0.677) 4.831 5.173 ( -2.978 4.844 -1.422) 5.861 5.389 ( 0.805 9.121 0.398) 9.165 5.727 ( -0.605 -2.013 -6.417) 6.752 6.634 ( -2.916 -2.051 -3.850) 5.247 6.751 ( -0.974 -6.113 -2.748) 6.773 7.427 ( 7.170 4.466 6.133) 10.439 7.559 ( 2.701 3.878 4.937) 6.834 7.689 ( 2.053 3.843 1.465) 4.596 7.743 ( -1.725 -0.300 4.303) 4.645 8.036 ( 2.635 -2.316 0.369) 3.527 8.172 ( 2.074 -3.419 1.733) 4.358 8.271 ( -4.639 -2.011 4.284) 6.627 8.481 ( 2.300 3.474 -3.685) 5.562 8.748 ( -5.386 0.655 2.285) 5.887 8.992 ( 3.831 1.200 -6.421) 7.573 9.525 ( -2.191 1.155 0.537) 2.535 9.606 ( -0.769 -1.595 -3.157) 3.619 10.924 ( -0.739 3.669 2.733) 4.635 11.205 ( 1.803 -4.231 7.052) 8.419 11.414 ( 5.583 4.598 -7.615) 10.503 11.622 ( -0.010 2.132 -2.937) 3.629 11.743 ( 4.319 -2.477 -4.761) 6.889 11.857 ( 0.102 -1.620 -5.661) 5.890 12.080 ( 0.900 -3.913 -0.542) 4.052 12.117 ( -0.053 -4.525 -1.009) 4.636 12.725 ( -6.506 9.725 9.210) 14.891 13.269 ( -6.416 -5.081 1.704) 8.360 13.290 ( -7.893 4.384 -5.900) 10.786 13.564 ( -2.285 -6.281 -4.857) 8.262 17.679 ( -2.240 3.816 0.587) 4.464 17.795 ( -0.490 1.155 1.581) 2.018 17.841 ( -6.895 3.497 -1.669) 7.909 18.106 ( -0.729 -7.916 -5.478) 9.654 18.725 ( 0.905 1.465 -4.794) 5.094 18.820 ( -0.614 -1.604 -6.030) 6.269 18.952 ( -1.852 -1.633 -0.115) 2.472 18.970 ( -1.346 -2.165 -1.191) 2.814 21.078 ( 4.933 9.315 10.574) 14.930 21.256 ( 0.748 0.778 1.184) 1.602 21.297 ( 2.406 -0.987 1.163) 2.848 21.438 ( 4.758 -2.096 2.582) 5.805 ======================= Grid point 242 (130/170) ======================= q-point: ( 0.00 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( -4.758 6.201 -1.184) 7.905 2.256 ( -4.039 -6.150 -3.830) 8.295 2.507 ( 0.679 6.600 -1.628) 6.832 2.671 ( 0.567 -8.084 -2.859) 8.593 2.753 ( -0.961 9.027 -1.070) 9.141 2.833 ( 0.084 3.630 -1.283) 3.851 2.928 ( 1.846 -2.765 -4.080) 5.263 2.974 ( 0.181 -8.151 -5.685) 9.939 3.327 ( 1.898 0.713 0.317) 2.052 3.392 ( -0.178 -5.520 -0.544) 5.549 3.480 ( 4.325 3.903 5.328) 7.895 3.573 ( 3.833 -5.917 2.357) 7.433 4.475 ( -0.937 1.485 10.436) 10.583 4.516 ( -3.440 -2.534 7.128) 8.310 4.706 ( 0.799 7.875 3.109) 8.504 4.806 ( -1.201 -2.692 0.669) 3.023 5.048 ( 3.548 11.448 5.376) 13.136 5.113 ( -0.955 2.439 3.562) 4.422 5.179 ( -3.131 7.240 7.591) 10.947 5.297 ( 1.383 1.117 2.966) 3.458 5.497 ( -0.354 3.494 -2.096) 4.090 5.578 ( -1.407 -4.470 -4.978) 6.836 6.548 ( 1.143 0.506 -4.124) 4.310 6.603 ( 1.885 -4.888 -5.066) 7.288 7.676 ( 1.554 3.346 7.836) 8.661 7.703 ( 0.865 0.540 6.191) 6.275 7.804 ( -1.958 4.892 1.466) 5.469 7.827 ( -1.791 4.255 0.811) 4.687 8.055 ( -0.762 -2.767 1.523) 3.249 8.101 ( -2.163 -6.793 -0.937) 7.190 8.214 ( -1.913 5.601 3.584) 6.919 8.357 ( 4.054 -9.345 -1.504) 10.297 8.810 ( 0.423 6.433 -2.154) 6.797 8.921 ( 1.717 -4.542 -6.403) 8.036 9.524 ( -0.597 1.095 -0.577) 1.374 9.543 ( -0.232 -0.900 -1.765) 1.995 11.071 ( -1.193 7.066 7.419) 10.315 11.201 ( -1.161 -6.041 8.326) 10.352 11.544 ( 6.628 5.864 -11.126) 14.216 11.596 ( 0.542 1.509 -3.057) 3.452 11.682 ( -5.746 -0.383 -4.418) 7.258 11.717 ( 3.869 -5.204 -5.263) 8.352 11.996 ( -2.240 -1.512 -0.586) 2.765 12.020 ( -0.625 -3.600 -1.217) 3.851 12.944 ( -1.427 9.558 7.415) 12.181 13.120 ( -0.885 -8.616 4.732) 9.869 13.270 ( 1.084 5.537 -6.405) 8.536 13.371 ( 0.661 -5.334 -5.689) 7.826 17.700 ( -2.079 2.481 -0.851) 3.347 17.735 ( -2.639 -0.839 -1.734) 3.267 17.883 ( 1.350 2.227 0.649) 2.684 17.938 ( 1.549 -3.944 -2.270) 4.807 18.708 ( 0.723 0.861 -3.910) 4.068 18.730 ( 0.402 -1.310 -4.761) 4.955 18.913 ( -0.412 -0.530 0.106) 0.679 18.917 ( -0.368 -0.928 -0.155) 1.010 21.291 ( 0.023 1.131 0.527) 1.248 21.303 ( 0.640 -0.248 0.134) 0.699 21.388 ( 0.116 5.384 7.276) 9.053 21.470 ( 0.228 -3.041 3.568) 4.694 ======================= Grid point 243 (131/170) ======================= q-point: ( 0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( -0.080 1.842 5.248) 5.563 2.189 ( 0.668 -7.675 -2.078) 7.979 2.526 ( 1.200 8.197 1.444) 8.410 2.661 ( 2.792 -3.782 -4.010) 6.179 2.739 ( -1.234 5.757 1.682) 6.123 2.824 ( -2.289 0.211 1.787) 2.912 2.905 ( 2.321 0.179 -5.194) 5.692 2.940 ( 2.467 -5.518 -3.636) 7.054 3.352 ( -0.096 -1.929 -1.754) 2.609 3.355 ( 0.322 -2.150 -0.893) 2.350 3.557 ( -1.347 -0.643 0.961) 1.775 3.581 ( -2.144 -2.844 -3.104) 4.725 4.516 ( -2.379 2.298 2.590) 4.201 4.552 ( 0.637 -1.331 5.125) 5.333 4.763 ( -0.408 2.973 5.068) 5.890 4.798 ( -1.557 -0.429 0.946) 1.871 5.067 ( -5.972 7.313 -0.418) 9.451 5.118 ( -2.170 1.440 1.063) 2.813 5.187 ( -4.963 12.571 7.473) 15.444 5.320 ( -3.170 0.620 1.452) 3.541 5.485 ( 0.767 2.049 -0.648) 2.282 5.531 ( 1.469 -1.780 -1.323) 2.660 6.577 ( 6.570 -0.487 -2.116) 6.919 6.619 ( 6.758 -4.453 -4.351) 9.189 7.671 ( -8.508 4.591 1.618) 9.803 7.692 ( -8.331 4.949 1.758) 9.848 7.781 ( -3.477 0.008 1.206) 3.680 7.812 ( -3.500 -0.234 3.734) 5.123 7.953 ( -8.267 -4.036 0.120) 9.200 7.977 ( -8.339 -6.266 3.008) 10.856 8.384 ( 11.838 5.160 2.173) 13.095 8.485 ( 11.872 -4.738 -2.265) 12.982 8.799 ( 0.252 4.361 -0.649) 4.416 8.878 ( 1.536 -3.261 -4.952) 6.125 9.529 ( 1.601 0.852 -0.105) 1.817 9.543 ( 1.928 -0.697 -0.711) 2.170 11.129 ( -3.193 7.181 8.470) 11.554 11.260 ( -2.962 -5.699 8.256) 10.460 11.400 ( -3.597 6.323 -10.600) 12.856 11.506 ( -3.015 -3.643 -9.434) 10.552 11.686 ( 6.860 4.330 -0.771) 8.149 11.767 ( 5.448 -3.498 -3.066) 7.164 11.950 ( -3.455 -1.138 1.569) 3.961 11.989 ( -2.160 -4.697 -0.063) 5.170 13.047 ( 3.461 7.303 8.421) 11.672 13.188 ( 2.788 -7.380 4.758) 9.213 13.261 ( 6.256 5.402 -6.912) 10.775 13.357 ( 5.509 -4.753 -5.984) 9.420 17.698 ( 1.058 1.249 1.662) 2.333 17.718 ( 1.426 -0.925 0.666) 1.826 17.921 ( 3.680 2.349 -0.944) 4.466 17.959 ( 4.410 -1.781 -2.537) 5.390 18.690 ( 1.030 0.050 -2.002) 2.252 18.695 ( 0.650 -0.332 -2.973) 3.061 18.919 ( 0.857 -0.607 0.363) 1.111 18.924 ( 1.081 -1.036 0.245) 1.517 21.286 ( -1.343 1.094 0.193) 1.743 21.299 ( -0.858 -0.357 -0.231) 0.957 21.411 ( -5.579 2.736 4.546) 7.699 21.448 ( -5.765 -1.094 0.716) 5.911 ======================= Grid point 244 (132/170) ======================= q-point: ( 0.18 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( 2.828 -2.390 8.891) 9.631 2.244 ( 5.422 -6.320 3.242) 8.936 2.549 ( -0.335 7.782 0.443) 7.802 2.676 ( 2.452 -3.350 -1.597) 4.448 2.743 ( -2.243 3.300 3.477) 5.293 2.785 ( -4.368 -1.703 1.514) 4.927 2.894 ( 2.660 5.712 -4.006) 7.466 2.975 ( 4.748 -2.746 -0.905) 5.559 3.299 ( -1.417 0.423 -4.360) 4.604 3.365 ( 0.328 -4.383 -0.662) 4.445 3.461 ( -3.460 -1.418 -5.932) 7.013 3.482 ( -5.367 -4.591 -3.400) 7.839 4.520 ( -0.785 6.861 3.149) 7.590 4.619 ( 1.276 -3.122 3.603) 4.935 4.764 ( -2.164 2.263 -2.133) 3.788 4.779 ( -3.904 1.133 2.264) 4.653 4.935 ( -6.891 13.328 -2.779) 15.259 5.061 ( -4.207 1.764 0.031) 4.562 5.165 ( -5.002 1.792 1.149) 5.436 5.234 ( -5.256 -3.623 -2.465) 6.842 5.499 ( 0.671 4.520 0.281) 4.578 5.564 ( 1.209 -1.988 1.422) 2.726 6.661 ( 5.400 -0.127 -1.743) 5.675 6.700 ( 7.077 -3.929 -2.159) 8.378 7.522 ( -9.538 3.438 -1.422) 10.238 7.537 ( -10.554 3.086 0.806) 11.025 7.707 ( -5.237 -1.692 -1.342) 5.665 7.753 ( -7.402 -6.122 2.103) 9.833 7.860 ( -3.189 0.655 -0.966) 3.396 7.910 ( -5.347 -5.187 2.508) 7.861 8.560 ( 7.710 7.166 0.723) 10.551 8.663 ( 12.429 -2.004 -1.347) 12.662 8.800 ( -0.447 3.535 1.111) 3.732 8.879 ( 4.119 -3.440 -2.142) 5.778 9.563 ( 2.142 1.236 0.416) 2.508 9.579 ( 2.446 -0.404 0.466) 2.523 11.133 ( -6.822 4.817 6.070) 10.324 11.204 ( -8.032 -0.755 -2.297) 8.388 11.332 ( 2.405 1.932 -0.113) 3.086 11.397 ( 0.808 -3.157 -6.318) 7.109 11.757 ( 3.002 4.789 -1.708) 5.905 11.802 ( 2.288 0.224 0.386) 2.331 11.936 ( -1.899 -1.524 2.458) 3.460 11.977 ( 0.776 -5.569 1.224) 5.754 13.230 ( 7.459 4.916 6.017) 10.770 13.293 ( 6.997 5.234 -4.960) 10.048 13.321 ( 7.047 -4.566 4.950) 9.747 13.394 ( 6.230 -5.111 -4.148) 9.063 17.748 ( 1.706 1.060 2.251) 3.017 17.769 ( 1.011 -1.413 2.785) 3.282 18.002 ( 8.958 3.358 -0.642) 9.589 18.030 ( 7.687 0.351 -1.031) 7.764 18.686 ( 0.897 0.620 -0.708) 1.300 18.697 ( 1.406 -0.663 -0.095) 1.557 18.945 ( 1.675 -0.289 0.599) 1.803 18.956 ( 2.491 -1.423 0.474) 2.907 21.225 ( -7.347 1.921 -1.839) 7.813 21.259 ( -5.282 -1.591 -1.425) 5.697 21.333 ( -6.158 0.091 -0.823) 6.213 21.337 ( -5.526 -0.345 1.251) 5.676 ======================= Grid point 245 (133/170) ======================= q-point: ( 0.27 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( 3.536 -1.726 4.674) 6.109 2.366 ( 1.301 -3.098 3.635) 4.950 2.555 ( -0.917 3.734 6.668) 7.697 2.644 ( -5.842 -3.963 3.297) 7.792 2.755 ( 1.374 0.631 0.460) 1.580 2.759 ( 0.790 0.873 -2.019) 2.337 2.907 ( 2.208 8.479 -0.273) 8.766 3.042 ( 2.877 -4.580 -0.698) 5.453 3.197 ( -1.985 5.027 -6.262) 8.272 3.344 ( 0.038 -8.293 -2.660) 8.709 3.380 ( -0.525 -0.289 -2.997) 3.057 3.420 ( 0.080 -4.853 0.588) 4.889 4.543 ( 0.042 6.879 -0.027) 6.879 4.608 ( -4.752 2.357 -5.965) 7.982 4.674 ( -4.196 5.431 -3.916) 7.902 4.721 ( -2.404 -0.695 3.358) 4.188 4.827 ( -5.177 10.325 -1.426) 11.638 4.977 ( -4.540 6.579 -2.744) 8.451 5.048 ( -7.213 -8.014 -4.604) 11.724 5.155 ( -3.784 -9.139 1.792) 10.052 5.511 ( 0.296 4.965 1.072) 5.088 5.591 ( 0.141 -3.116 1.966) 3.687 6.705 ( 3.209 2.740 -1.442) 4.459 6.783 ( 6.317 -5.053 -1.063) 8.159 7.367 ( -7.820 2.781 -1.817) 8.496 7.397 ( -7.845 0.318 0.138) 7.852 7.609 ( -4.027 -1.772 -3.505) 5.625 7.639 ( -4.934 -5.004 -4.166) 8.169 7.820 ( -1.992 0.085 0.614) 2.087 7.856 ( -4.304 -4.056 1.754) 6.168 8.624 ( 1.284 9.300 -1.643) 9.531 8.770 ( 0.432 -5.210 -0.771) 5.285 8.853 ( 8.337 7.292 -0.457) 11.086 8.967 ( 7.429 -4.198 -0.136) 8.535 9.597 ( 1.063 1.739 1.212) 2.371 9.618 ( 1.009 -0.384 1.334) 1.716 11.056 ( -5.902 1.556 -2.462) 6.582 11.069 ( -5.041 0.141 -1.124) 5.167 11.367 ( 1.695 0.941 -0.053) 1.940 11.392 ( 0.462 -1.856 3.820) 4.272 11.784 ( 2.080 6.056 0.791) 6.452 11.850 ( 2.168 -0.105 1.099) 2.433 11.946 ( -0.458 0.763 3.253) 3.373 12.019 ( 2.035 -5.349 1.389) 5.889 13.271 ( 5.265 5.198 -9.928) 12.381 13.360 ( 2.753 -3.843 -5.463) 7.224 13.522 ( 10.023 1.433 9.184) 13.670 13.555 ( 8.344 -1.820 9.724) 12.942 17.773 ( 0.055 0.577 -0.755) 0.952 17.785 ( -0.783 -0.775 -0.043) 1.102 18.192 ( 10.283 3.798 4.369) 11.801 18.199 ( 12.445 3.252 4.610) 13.664 18.702 ( 0.738 1.539 0.949) 1.953 18.734 ( 2.024 -1.642 1.829) 3.183 18.984 ( 2.219 0.767 1.013) 2.557 19.009 ( 3.282 -1.733 0.675) 3.772 21.007 ( -12.605 1.397 -6.669) 14.329 21.060 ( -12.584 -4.146 -5.877) 14.494 21.283 ( -1.465 0.145 -0.032) 1.472 21.295 ( -2.148 -1.088 0.905) 2.572 ======================= Grid point 246 (134/170) ======================= q-point: ( 0.36 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( -4.396 4.621 -3.338) 7.199 2.400 ( -3.417 -5.356 1.161) 6.459 2.639 ( -1.205 1.639 8.957) 9.185 2.672 ( -0.022 0.106 6.374) 6.375 2.763 ( 3.293 1.449 -1.861) 4.050 2.803 ( 3.905 -0.831 1.791) 4.376 2.945 ( 1.748 2.654 0.281) 3.191 2.993 ( -1.650 -2.458 -3.781) 4.802 3.200 ( 5.160 6.046 -1.008) 8.012 3.335 ( -1.065 -0.326 0.814) 1.379 3.366 ( 1.238 -4.661 -0.170) 4.826 3.441 ( 0.460 -6.977 1.338) 7.119 4.407 ( -7.632 7.712 -8.745) 13.935 4.474 ( 0.420 -0.859 -11.518) 11.557 4.596 ( -2.665 6.979 -8.902) 11.622 4.678 ( -5.083 1.477 0.235) 5.298 4.769 ( -1.525 -1.159 4.321) 4.726 4.842 ( -7.643 -8.441 -7.048) 13.392 4.924 ( -1.839 8.676 1.092) 8.935 5.129 ( -4.382 -10.409 4.271) 12.074 5.540 ( 0.708 4.956 2.945) 5.808 5.620 ( -0.171 -3.038 3.310) 4.496 6.764 ( 5.541 6.928 0.538) 8.887 6.894 ( 8.354 -6.299 0.562) 10.478 7.229 ( -6.964 2.786 -2.218) 7.822 7.282 ( -6.776 -1.807 -0.881) 7.068 7.497 ( -2.967 -1.797 -6.047) 6.971 7.528 ( -1.425 -4.668 -6.909) 8.459 7.801 ( -2.178 -0.601 1.025) 2.481 7.815 ( -2.701 -2.570 1.024) 3.867 8.592 ( -1.233 9.050 -3.033) 9.624 8.735 ( -2.096 -5.030 -2.204) 5.878 8.959 ( 5.997 6.531 -2.336) 9.169 9.055 ( 4.462 -3.002 -2.225) 5.820 9.631 ( 0.855 1.231 2.562) 2.968 9.644 ( 0.083 -0.091 2.372) 2.375 10.947 ( -3.186 1.558 -3.719) 5.139 10.981 ( -3.897 -1.953 -2.531) 5.041 11.422 ( 2.548 3.006 4.647) 6.093 11.477 ( 2.144 -2.680 7.339) 8.102 11.824 ( 1.304 5.607 0.235) 5.761 11.878 ( 0.542 0.996 -0.244) 1.161 12.003 ( 1.412 1.540 5.828) 6.191 12.073 ( 2.274 -4.155 2.431) 5.324 13.221 ( 2.656 4.211 -9.963) 11.137 13.304 ( -0.461 -4.504 -7.303) 8.593 13.775 ( 7.406 1.962 10.371) 12.893 13.795 ( 7.055 -0.232 10.226) 12.426 17.743 ( -0.810 0.510 -2.823) 2.981 17.753 ( -1.458 -0.508 -2.162) 2.657 18.422 ( 9.386 7.195 7.775) 14.153 18.470 ( 11.356 3.359 9.244) 15.023 18.723 ( -0.197 3.150 1.640) 3.557 18.799 ( 2.132 -3.515 4.064) 5.781 19.036 ( 2.496 1.941 1.339) 3.434 19.064 ( 2.232 -0.793 0.966) 2.558 20.720 ( -10.690 -1.042 -10.605) 15.094 20.772 ( -11.838 -6.426 -10.137) 16.858 21.267 ( -0.709 -0.196 0.206) 0.764 21.278 ( -1.323 -1.272 0.787) 1.997 ======================= Grid point 247 (135/170) ======================= q-point: ( 0.45 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -3.020 4.677 -2.565) 6.130 2.308 ( -5.891 -6.003 -2.743) 8.847 2.675 ( 1.020 2.195 0.703) 2.520 2.728 ( -0.856 -1.626 1.438) 2.333 2.803 ( -0.077 5.509 3.497) 6.526 2.901 ( 0.987 -1.475 6.445) 6.685 2.955 ( 4.632 0.392 -3.404) 5.762 3.004 ( 3.723 -3.037 -1.267) 4.969 3.277 ( -0.727 5.333 1.728) 5.653 3.313 ( 1.171 9.406 2.834) 9.893 3.382 ( -3.780 -5.013 5.877) 8.600 3.509 ( 5.746 -9.754 3.217) 11.769 4.203 ( -4.471 7.295 -11.034) 13.963 4.332 ( 0.053 -3.417 -18.278) 18.595 4.410 ( -2.232 0.681 -7.877) 8.216 4.540 ( -6.505 -10.059 -9.507) 15.293 4.761 ( 0.668 1.974 3.580) 4.142 4.808 ( -1.149 -2.901 4.230) 5.256 4.954 ( 1.976 8.335 3.125) 9.118 5.109 ( -2.408 -7.275 1.822) 7.877 5.596 ( 0.933 4.397 4.435) 6.314 5.653 ( -0.821 -1.403 3.681) 4.024 6.889 ( 6.639 9.885 3.829) 12.508 7.046 ( 8.093 -5.625 1.774) 10.015 7.105 ( -4.567 1.182 -2.936) 5.557 7.158 ( -7.194 -2.595 -1.138) 7.732 7.395 ( 0.032 -1.562 -8.225) 8.373 7.436 ( -0.859 -4.276 -6.548) 7.868 7.770 ( -1.919 -0.498 0.296) 2.005 7.792 ( -1.563 -2.943 0.192) 3.338 8.541 ( -0.691 6.706 -2.444) 7.171 8.664 ( -1.813 -5.498 -4.469) 7.314 8.990 ( 1.574 5.884 -2.100) 6.442 9.058 ( 0.530 -0.874 -3.417) 3.567 9.676 ( 0.570 0.766 2.878) 3.032 9.681 ( 0.950 0.225 2.614) 2.790 10.875 ( -1.380 0.515 -2.756) 3.125 10.898 ( -2.535 -1.750 -2.817) 4.174 11.538 ( 3.695 4.203 6.281) 8.412 11.606 ( 3.116 -2.679 7.513) 8.563 11.819 ( -1.154 5.063 -0.990) 5.286 11.865 ( -1.458 0.780 -0.394) 1.699 12.100 ( 1.750 1.748 5.994) 6.485 12.140 ( 1.970 -1.936 3.261) 4.273 13.148 ( 1.094 1.675 -7.832) 8.084 13.195 ( -2.969 -3.223 -6.986) 8.247 13.965 ( 2.993 2.148 8.644) 9.396 13.979 ( 2.860 0.646 8.289) 8.792 17.698 ( -0.650 0.229 -2.670) 2.758 17.702 ( -1.423 -0.209 -2.385) 2.785 18.621 ( 4.819 7.989 6.144) 11.171 18.718 ( 1.773 -1.815 1.802) 3.112 18.742 ( 3.702 11.174 10.986) 16.102 18.895 ( 1.592 -4.258 8.134) 9.318 19.065 ( -1.533 3.953 0.340) 4.253 19.100 ( 0.658 0.272 2.065) 2.184 20.474 ( -2.876 -5.308 -12.765) 14.121 20.498 ( -5.660 -7.764 -12.756) 15.970 21.265 ( -0.052 -0.623 0.329) 0.707 21.269 ( -0.658 -1.112 0.506) 1.388 ======================= Grid point 248 (136/170) ======================= q-point: (-0.45 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( -0.889 2.653 -0.253) 2.809 2.222 ( 1.746 -2.889 -1.778) 3.816 2.676 ( -3.718 0.268 0.521) 3.764 2.695 ( -1.904 -1.909 -0.729) 2.793 2.795 ( -5.412 6.678 3.452) 9.263 2.928 ( -4.177 -6.080 2.135) 7.680 3.010 ( 6.843 2.697 -4.636) 8.695 3.063 ( 5.877 -2.383 -3.214) 7.110 3.255 ( -2.295 6.487 4.963) 8.484 3.345 ( 1.263 -1.849 0.186) 2.247 3.508 ( 1.607 5.946 15.274) 16.469 3.643 ( 2.356 -5.884 7.610) 9.905 4.003 ( -1.481 3.034 -16.393) 16.738 4.097 ( -3.549 -4.135 -18.275) 19.071 4.319 ( -0.290 2.583 -3.496) 4.356 4.474 ( 9.797 -11.110 -6.098) 16.019 4.807 ( -1.021 2.635 3.382) 4.407 4.847 ( 1.892 0.460 1.291) 2.336 5.037 ( 2.531 1.129 3.214) 4.244 5.098 ( 1.909 -3.808 -0.862) 4.346 5.656 ( 0.114 2.245 4.149) 4.719 5.664 ( -2.082 1.543 2.564) 3.645 6.972 ( -6.766 4.424 0.982) 8.143 6.987 ( -7.700 3.618 1.700) 8.676 7.096 ( 7.429 1.393 -0.939) 7.616 7.206 ( 7.438 -4.906 1.561) 9.046 7.312 ( 0.839 -1.501 -8.069) 8.250 7.373 ( 2.551 -5.211 -5.950) 8.310 7.758 ( -0.498 -1.025 0.914) 1.461 7.773 ( -0.557 -2.764 -0.104) 2.821 8.528 ( 0.785 3.187 -0.321) 3.298 8.602 ( 1.146 -4.138 -4.377) 6.131 8.974 ( -1.890 5.215 -0.279) 5.554 9.019 ( -0.866 0.578 -2.455) 2.667 9.704 ( -0.465 0.946 1.639) 1.949 9.714 ( 0.049 0.005 1.324) 1.325 10.840 ( -0.514 -0.046 -1.216) 1.321 10.855 ( 0.624 -1.490 -1.515) 2.215 11.642 ( 1.493 4.933 3.493) 6.226 11.713 ( 1.854 -2.195 2.581) 3.862 11.780 ( -1.981 5.064 0.549) 5.465 11.837 ( -1.652 -0.517 0.570) 1.822 12.167 ( -0.412 2.048 3.640) 4.197 12.192 ( 0.156 -0.460 2.243) 2.295 13.069 ( -4.024 0.438 -4.362) 5.951 13.104 ( 1.275 -3.271 -3.582) 5.016 14.049 ( -2.373 1.998 5.261) 6.108 14.057 ( -2.356 1.189 4.819) 5.494 17.665 ( -0.577 0.388 -1.196) 1.383 17.673 ( 0.339 -0.433 -1.201) 1.321 18.655 ( -5.930 7.494 2.555) 9.892 18.726 ( -0.284 0.151 0.367) 0.488 18.922 ( -0.973 9.228 10.478) 13.996 18.994 ( -5.280 7.077 1.997) 9.053 19.012 ( 0.717 -2.121 5.563) 5.997 19.113 ( -2.895 -2.584 2.885) 4.835 20.354 ( 5.449 -6.115 -11.202) 13.877 20.386 ( 8.520 -8.971 -10.685) 16.348 21.266 ( -0.193 -0.468 0.217) 0.551 21.273 ( 0.576 -1.164 0.227) 1.319 ======================= Grid point 249 (137/170) ======================= q-point: (-0.36 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( 0.921 9.760 2.301) 10.070 2.335 ( 8.609 -6.912 3.669) 11.634 2.590 ( -4.884 3.688 -1.625) 6.332 2.663 ( -2.139 -4.688 1.010) 5.251 2.739 ( -5.280 5.408 3.459) 8.312 2.863 ( -5.898 -6.187 2.216) 8.830 3.029 ( 2.950 4.303 -5.299) 7.437 3.106 ( 5.239 -3.976 -4.148) 7.776 3.298 ( -0.488 5.636 2.862) 6.340 3.396 ( 2.800 -2.743 1.323) 4.137 3.605 ( -6.754 1.662 0.778) 6.999 3.693 ( -3.907 -5.082 -1.504) 6.585 3.863 ( 3.486 1.307 -5.155) 6.358 3.931 ( 4.115 -4.792 -2.811) 6.914 4.380 ( 9.820 11.848 -0.130) 15.389 4.634 ( 12.785 -12.758 0.501) 18.069 4.822 ( 0.456 6.299 0.097) 6.316 4.851 ( -1.381 2.460 -0.582) 2.881 5.033 ( -0.464 4.762 -2.545) 5.419 5.203 ( 5.702 -10.693 2.496) 12.373 5.637 ( -2.610 5.291 0.326) 5.908 5.700 ( 0.391 -1.667 2.562) 3.081 6.818 ( -8.080 4.242 -2.120) 9.368 6.885 ( -7.760 -1.671 0.027) 7.938 7.228 ( 6.517 2.828 -1.949) 7.367 7.279 ( 4.262 1.543 -0.388) 4.549 7.312 ( 6.140 -3.148 -1.798) 7.130 7.399 ( 5.567 -7.789 -1.085) 9.635 7.775 ( 0.689 -1.172 1.979) 2.400 7.780 ( 1.021 -1.816 0.905) 2.271 8.543 ( 1.850 4.259 -0.449) 4.665 8.626 ( 4.021 -4.029 -0.117) 5.694 8.930 ( -3.581 5.016 0.761) 6.210 8.979 ( -2.130 0.050 -0.893) 2.310 9.695 ( -1.894 1.120 0.111) 2.203 9.709 ( -1.410 -0.313 0.044) 1.445 10.841 ( 1.242 1.125 0.331) 1.708 10.876 ( 2.445 -2.599 0.492) 3.602 11.631 ( -3.407 5.199 -1.882) 6.494 11.691 ( -1.610 -0.501 -2.725) 3.204 11.805 ( 0.144 3.047 2.402) 3.882 11.848 ( 1.573 -0.697 1.347) 2.185 12.164 ( -2.759 1.412 0.559) 3.150 12.185 ( -2.149 -0.832 -0.523) 2.364 12.982 ( -3.660 5.665 0.118) 6.746 13.117 ( 1.548 -8.242 1.105) 8.459 14.001 ( -7.815 2.063 0.847) 8.126 14.012 ( -7.319 0.824 0.950) 7.427 17.661 ( 0.604 1.148 0.488) 1.386 17.684 ( 1.432 -1.141 0.481) 1.893 18.547 ( -9.985 7.665 0.851) 12.617 18.632 ( -12.803 -0.985 0.544) 12.853 18.880 ( -2.384 10.205 -1.564) 10.596 18.998 ( -1.974 -0.585 -0.190) 2.067 19.054 ( -2.442 -0.146 3.964) 4.658 19.091 ( -4.134 -2.638 4.073) 6.375 20.431 ( 14.453 -1.446 -4.127) 15.100 20.503 ( 15.886 -8.591 -4.023) 18.502 21.267 ( 0.104 0.455 0.039) 0.469 21.287 ( 0.954 -1.642 0.103) 1.902 ======================= Grid point 250 (138/170) ======================= q-point: (-0.27 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 1.503 15.311 4.701) 16.087 2.497 ( 2.970 -8.977 -1.362) 9.553 2.511 ( -1.971 7.161 5.315) 9.133 2.665 ( 1.093 -6.372 0.809) 6.516 2.749 ( 1.009 1.781 3.803) 4.319 2.822 ( -3.321 -5.121 4.767) 7.745 3.000 ( 0.567 7.961 -4.706) 9.266 3.138 ( 4.848 -5.612 -4.694) 8.777 3.249 ( -3.979 3.226 -5.017) 7.171 3.372 ( -8.093 -8.961 -4.690) 12.953 3.454 ( 1.347 5.067 -6.487) 8.341 3.575 ( 0.216 -7.702 -8.339) 11.354 3.983 ( 2.372 3.364 11.010) 11.754 4.063 ( 3.165 -5.063 11.825) 13.247 4.573 ( 11.205 15.915 1.689) 19.537 4.796 ( 1.531 -1.847 2.302) 3.325 4.821 ( 0.753 3.652 -1.478) 4.011 4.893 ( 11.834 -5.075 0.459) 12.884 5.001 ( -1.082 10.977 -1.159) 11.091 5.257 ( -1.145 -11.057 0.228) 11.118 5.596 ( -1.648 7.906 -1.550) 8.223 5.722 ( 0.752 -5.526 -0.815) 5.636 6.706 ( -3.297 1.120 -1.377) 3.744 6.760 ( -6.453 -3.458 -1.205) 7.420 7.278 ( 4.989 5.021 -1.098) 7.163 7.383 ( 5.312 -4.761 -0.444) 7.147 7.410 ( 6.901 2.179 3.394) 7.993 7.512 ( 9.048 -7.836 0.981) 12.009 7.805 ( 0.428 0.720 1.706) 1.901 7.835 ( 3.238 -2.323 2.274) 4.589 8.577 ( 1.698 7.087 0.213) 7.291 8.663 ( -1.817 -0.701 1.040) 2.208 8.898 ( -1.730 1.178 1.343) 2.487 8.927 ( -2.512 -1.034 -1.188) 2.965 9.654 ( -2.728 1.632 -0.571) 3.230 9.679 ( -1.940 -0.869 -0.449) 2.173 10.882 ( 2.199 2.192 1.949) 3.666 10.934 ( 2.702 -3.336 2.352) 4.895 11.549 ( -1.907 4.879 -3.598) 6.355 11.630 ( -1.097 -3.127 -3.645) 4.926 11.817 ( 0.291 5.401 -0.769) 5.463 11.886 ( 1.850 -0.683 -0.034) 1.972 12.107 ( -3.203 -0.530 -1.622) 3.629 12.126 ( -2.642 -1.905 -2.183) 3.921 12.952 ( -3.647 9.955 4.107) 11.370 13.156 ( -0.307 -11.176 3.118) 11.607 13.833 ( -11.576 2.302 -2.956) 12.167 13.855 ( -10.860 -0.198 -2.740) 11.202 17.691 ( 1.345 1.792 1.714) 2.821 17.723 ( 1.891 -1.458 1.558) 2.851 18.365 ( -13.040 4.270 -0.900) 13.751 18.387 ( -15.825 1.902 -1.340) 15.995 18.841 ( -0.021 4.064 -3.238) 5.196 18.925 ( -3.124 -4.287 -3.325) 6.260 19.037 ( -2.492 0.691 -0.076) 2.588 19.053 ( -3.704 -0.814 0.128) 3.794 20.678 ( 16.206 2.746 3.121) 16.731 20.764 ( 17.111 -6.315 2.608) 18.425 21.271 ( 0.267 1.431 0.179) 1.467 21.305 ( 1.100 -2.025 0.101) 2.307 ======================= Grid point 251 (139/170) ======================= q-point: (-0.18 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -1.334 14.292 2.395) 14.553 2.450 ( -2.581 6.817 -0.750) 7.327 2.574 ( -0.681 -5.179 2.256) 5.690 2.713 ( 2.101 -7.219 1.723) 7.713 2.784 ( 1.039 1.030 -1.160) 1.868 2.839 ( 1.443 -4.505 -1.414) 4.937 2.964 ( -0.134 8.184 -2.968) 8.706 3.107 ( -3.377 -1.514 -4.620) 5.919 3.159 ( 3.772 -1.360 -2.031) 4.494 3.264 ( -1.526 -10.549 0.115) 10.659 3.421 ( 2.653 3.084 -5.304) 6.684 3.502 ( -0.116 -6.052 -5.527) 8.197 4.149 ( 0.392 5.108 15.458) 16.285 4.257 ( 0.766 -6.261 16.961) 18.096 4.709 ( 4.306 14.227 -0.380) 14.869 4.839 ( 3.273 7.114 -0.920) 7.884 4.849 ( 2.654 1.481 0.838) 3.153 4.979 ( -0.697 7.028 2.250) 7.412 5.094 ( 9.758 -3.466 1.717) 10.497 5.197 ( -5.306 -6.363 0.441) 8.297 5.553 ( -0.716 8.333 -2.524) 8.736 5.700 ( 0.134 -6.714 -3.964) 7.798 6.668 ( -1.934 -1.916 -1.907) 3.324 6.674 ( -1.994 -3.013 0.002) 3.613 7.372 ( 5.744 5.839 2.883) 8.683 7.474 ( 4.371 -3.650 3.105) 6.486 7.569 ( 8.416 3.425 4.011) 9.932 7.710 ( 13.117 -10.460 1.882) 16.883 7.825 ( 0.969 4.767 0.285) 4.873 7.915 ( 3.617 -4.659 1.929) 6.205 8.532 ( -10.212 7.005 1.739) 12.505 8.603 ( -4.960 0.758 -0.980) 5.113 8.852 ( -3.309 2.844 0.452) 4.387 8.934 ( 4.273 -4.407 -3.259) 6.950 9.603 ( -2.774 2.178 -0.578) 3.574 9.638 ( -2.331 -1.306 -1.004) 2.854 10.946 ( 1.667 3.144 3.724) 5.151 11.011 ( 2.291 -3.788 4.694) 6.452 11.506 ( 1.764 4.391 -4.208) 6.332 11.594 ( 2.485 -4.569 -4.471) 6.859 11.799 ( -0.042 6.347 -2.690) 6.894 11.893 ( 0.615 -1.922 -2.878) 3.515 12.045 ( -1.427 -1.040 -2.029) 2.689 12.072 ( -1.175 -2.786 -2.049) 3.652 12.941 ( -4.994 11.374 5.762) 13.694 13.160 ( -3.894 -11.366 3.336) 12.469 13.596 ( -11.668 2.878 -5.329) 13.146 13.638 ( -10.085 -1.848 -4.832) 11.335 17.732 ( 1.079 2.368 1.841) 3.188 17.770 ( 1.476 -1.274 1.772) 2.635 18.114 ( -14.165 3.273 -2.544) 14.759 18.155 ( -11.031 -1.341 -3.328) 11.600 18.799 ( 0.133 1.955 -4.433) 4.847 18.846 ( -1.197 -3.037 -4.689) 5.713 18.984 ( -2.562 -0.085 -1.744) 3.101 18.990 ( -3.019 -0.703 -1.244) 3.340 20.973 ( 13.180 5.165 7.021) 15.801 21.062 ( 13.726 -4.423 5.629) 15.480 21.280 ( 0.345 2.179 0.640) 2.297 21.326 ( 1.306 -2.438 0.526) 2.815 ======================= Grid point 252 (140/170) ======================= q-point: (-0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( -5.665 9.613 -2.056) 11.346 2.366 ( -4.756 2.253 -2.935) 6.026 2.546 ( -1.857 -0.433 -2.482) 3.130 2.712 ( -0.993 -10.865 -3.276) 11.392 2.778 ( 0.386 7.207 -1.557) 7.383 2.847 ( 2.596 3.273 -3.806) 5.651 2.934 ( 1.494 -0.488 -3.111) 3.485 3.039 ( -1.071 -5.132 -3.697) 6.415 3.256 ( 4.638 -0.420 3.736) 5.970 3.300 ( 3.009 -3.717 5.623) 7.381 3.435 ( 2.804 -0.909 -2.297) 3.737 3.476 ( 3.176 -5.026 -0.617) 5.977 4.332 ( -0.591 4.842 16.945) 17.633 4.436 ( -1.921 -5.997 15.567) 16.792 4.704 ( -0.572 10.942 -2.538) 11.247 4.838 ( -0.928 -3.927 -2.671) 4.839 4.928 ( 4.695 14.367 3.514) 15.518 5.044 ( 1.967 4.658 5.681) 7.605 5.151 ( -2.911 0.628 3.949) 4.946 5.227 ( 4.806 -1.797 1.723) 5.412 5.524 ( 0.127 6.243 -2.253) 6.638 5.648 ( -0.481 -6.073 -4.821) 7.769 6.606 ( -2.228 -0.135 -2.986) 3.728 6.646 ( -0.743 -4.301 -2.800) 5.186 7.522 ( 6.147 4.858 6.669) 10.289 7.589 ( 3.435 -1.546 6.409) 7.434 7.753 ( 8.500 5.475 3.084) 10.571 7.812 ( -0.816 4.365 1.307) 4.629 7.952 ( 10.872 -5.419 -1.213) 12.209 7.999 ( 6.914 -8.651 2.127) 11.277 8.353 ( -13.987 6.018 2.731) 15.470 8.461 ( -10.112 -4.752 -1.603) 11.287 8.826 ( 0.131 6.705 -1.558) 6.885 8.948 ( 3.349 -5.176 -5.439) 8.221 9.556 ( -2.246 1.822 -0.672) 2.969 9.585 ( -2.159 -1.125 -1.862) 3.065 11.010 ( -0.065 5.144 5.588) 7.595 11.110 ( 1.372 -5.300 7.459) 9.252 11.508 ( 5.426 5.166 -5.608) 9.359 11.605 ( 5.186 -4.518 -5.264) 8.661 11.753 ( -1.450 4.252 -3.880) 5.935 11.830 ( -2.682 -2.519 -5.829) 6.893 12.021 ( 0.047 -1.429 -1.271) 1.913 12.041 ( -0.100 -3.014 -1.970) 3.602 12.924 ( -5.177 10.835 6.481) 13.645 13.120 ( -5.015 -9.461 3.865) 11.384 13.382 ( -6.541 4.367 -6.113) 9.961 13.463 ( -4.751 -4.474 -5.253) 8.378 17.747 ( -1.423 3.301 0.085) 3.595 17.795 ( -1.032 -1.411 0.463) 1.808 17.909 ( -6.933 3.599 -1.804) 8.017 17.985 ( -4.697 -4.867 -3.392) 7.567 18.750 ( 0.340 1.389 -4.928) 5.131 18.783 ( 0.108 -2.032 -5.402) 5.772 18.933 ( -1.841 -0.315 -0.716) 2.000 18.940 ( -1.798 -0.984 -0.860) 2.223 21.220 ( 7.422 4.752 6.705) 11.074 21.263 ( 3.989 -0.767 2.076) 4.562 21.302 ( 0.956 2.767 2.605) 3.919 21.380 ( 3.910 -4.073 3.613) 6.703 ======================= Grid point 297 (141/170) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 85 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( -1.317 0.000 -23.330) 23.367 1.852 ( 1.317 0.000 23.330) 23.367 2.006 ( -1.646 0.000 -24.633) 24.687 2.006 ( 1.646 0.000 24.633) 24.687 2.999 ( 2.554 0.000 -7.085) 7.531 2.999 ( -2.554 0.000 7.085) 7.531 3.322 ( -5.344 0.000 0.647) 5.383 3.322 ( 5.344 0.000 -0.647) 5.383 3.476 ( -0.612 0.000 -18.428) 18.438 3.476 ( 0.612 0.000 18.428) 18.438 3.767 ( 1.307 0.000 -9.157) 9.250 3.767 ( -1.307 0.000 9.157) 9.250 3.992 ( -3.490 0.000 -4.991) 6.090 3.992 ( 3.490 0.000 4.991) 6.090 4.548 ( -0.375 0.000 -2.260) 2.291 4.548 ( 0.375 0.000 2.260) 2.291 4.817 ( -8.397 0.000 -7.732) 11.415 4.817 ( 8.397 0.000 7.732) 11.415 5.180 ( -5.079 0.000 -7.620) 9.157 5.180 ( 5.079 0.000 7.620) 9.157 5.488 ( -7.729 0.000 -3.821) 8.622 5.488 ( 7.729 0.000 3.821) 8.622 6.760 ( -1.360 0.000 -9.024) 9.126 6.760 ( 1.360 0.000 9.024) 9.126 7.342 ( 0.891 0.000 -6.499) 6.560 7.342 ( -0.891 0.000 6.499) 6.560 7.582 ( 1.055 0.000 -2.756) 2.951 7.582 ( -1.055 0.000 2.756) 2.951 8.142 ( -2.241 0.000 -12.271) 12.474 8.142 ( 2.241 0.000 12.271) 12.474 8.364 ( 3.473 0.000 -3.361) 4.833 8.364 ( -3.473 0.000 3.361) 4.833 8.606 ( -3.947 0.000 -7.910) 8.840 8.606 ( 3.947 0.000 7.910) 8.840 9.595 ( 0.465 0.000 -4.587) 4.610 9.595 ( -0.465 0.000 4.587) 4.610 10.938 ( 0.403 0.000 -0.838) 0.929 10.938 ( -0.403 0.000 0.838) 0.929 11.482 ( -3.736 0.000 -1.395) 3.988 11.482 ( 3.736 0.000 1.395) 3.988 12.018 ( -2.469 0.000 0.388) 2.500 12.018 ( 2.469 0.000 -0.388) 2.500 12.303 ( -0.547 0.000 -0.329) 0.638 12.303 ( 0.547 0.000 0.329) 0.638 12.592 ( -1.617 0.000 -9.581) 9.716 12.592 ( 1.617 0.000 9.581) 9.716 13.627 ( 0.646 0.000 -5.601) 5.638 13.627 ( -0.646 0.000 5.601) 5.638 17.607 ( 0.277 0.000 -2.434) 2.450 17.607 ( -0.277 0.000 2.434) 2.450 18.136 ( -3.106 0.000 -15.150) 15.465 18.136 ( 3.106 0.000 15.150) 15.465 18.645 ( -0.004 0.000 -0.086) 0.086 18.645 ( 0.004 0.000 0.086) 0.086 19.042 ( -2.325 0.000 -0.086) 2.326 19.042 ( 2.325 0.000 0.086) 2.326 21.142 ( -3.161 0.000 -10.933) 11.381 21.142 ( 3.161 0.000 10.933) 11.381 21.322 ( -0.674 0.000 -4.205) 4.258 21.322 ( 0.674 0.000 4.205) 4.258 ======================= Grid point 299 (142/170) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( 8.464 0.000 -24.592) 26.008 1.680 ( 4.302 0.000 -27.716) 28.048 2.238 ( 8.397 0.000 21.675) 23.245 2.358 ( 6.447 0.000 22.480) 23.386 2.938 ( 11.088 0.000 -21.153) 23.883 3.006 ( -0.807 0.000 -0.370) 0.887 3.245 ( -6.786 0.000 2.819) 7.349 3.271 ( -5.812 0.000 -7.027) 9.119 3.410 ( 6.520 0.000 -3.366) 7.338 3.660 ( -3.188 0.000 12.363) 12.767 3.687 ( 0.356 0.000 -7.694) 7.703 3.844 ( -1.425 0.000 9.053) 9.165 3.907 ( 0.774 0.000 -6.174) 6.222 4.102 ( 2.919 0.000 2.049) 3.566 4.429 ( -6.692 0.000 -5.927) 8.940 4.575 ( 0.523 0.000 3.637) 3.674 4.645 ( -3.343 0.000 -0.134) 3.346 4.922 ( -5.812 0.000 3.875) 6.985 5.030 ( -3.033 0.000 -6.282) 6.976 5.196 ( -10.314 0.000 -7.340) 12.659 5.391 ( -0.274 0.000 9.061) 9.065 5.573 ( -1.701 0.000 0.467) 1.763 6.634 ( 1.088 0.000 -9.205) 9.269 6.863 ( 2.526 0.000 4.630) 5.275 7.311 ( 2.255 0.000 -3.933) 4.534 7.391 ( -1.629 0.000 4.708) 4.982 7.632 ( 9.358 0.000 -4.615) 10.434 7.664 ( 6.724 0.000 2.769) 7.272 8.019 ( 1.231 0.000 -8.933) 9.017 8.302 ( -2.650 0.000 -6.218) 6.759 8.306 ( -6.139 0.000 2.557) 6.650 8.348 ( 5.901 0.000 11.324) 12.769 8.547 ( 3.178 0.000 -4.490) 5.501 8.805 ( 5.647 0.000 10.695) 12.095 9.556 ( 0.553 0.000 -3.354) 3.399 9.623 ( -3.148 0.000 4.883) 5.809 10.939 ( -0.909 0.000 0.914) 1.289 10.945 ( 1.412 0.000 -0.082) 1.415 11.390 ( -4.956 0.000 -1.500) 5.178 11.525 ( -0.182 0.000 1.378) 1.389 11.925 ( -8.980 0.000 0.499) 8.994 11.986 ( -5.551 0.000 -0.129) 5.552 12.229 ( -6.542 0.000 -0.857) 6.598 12.276 ( -3.184 0.000 0.015) 3.184 12.569 ( 9.520 0.000 -8.618) 12.841 12.806 ( 10.416 0.000 9.468) 14.076 13.623 ( 5.152 0.000 -2.014) 5.532 13.691 ( 0.273 0.000 5.224) 5.232 17.582 ( 0.049 0.000 -2.556) 2.557 17.626 ( -0.557 0.000 2.151) 2.222 17.918 ( -4.714 0.000 -11.228) 12.177 18.314 ( -2.821 0.000 15.529) 15.783 18.651 ( 0.419 0.000 0.432) 0.602 18.657 ( 0.817 0.000 0.887) 1.206 18.984 ( -4.048 0.000 -0.926) 4.152 19.059 ( -0.754 0.000 0.982) 1.238 20.988 ( 2.298 0.000 -14.604) 14.784 21.284 ( 0.634 0.000 -2.867) 2.937 21.285 ( 3.144 0.000 4.486) 5.478 21.410 ( 2.785 0.000 6.555) 7.122 ======================= Grid point 300 (143/170) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 15.227 0.000 -22.698) 27.333 1.597 ( 18.264 0.000 -17.308) 25.162 2.565 ( 4.363 0.000 16.949) 17.501 2.658 ( 3.928 0.000 15.179) 15.679 2.938 ( 21.815 0.000 -25.063) 33.227 2.975 ( 0.042 0.000 -4.025) 4.025 3.129 ( -4.682 0.000 -2.666) 5.388 3.180 ( -6.521 0.000 5.103) 8.280 3.445 ( 0.273 0.000 -1.283) 1.312 3.511 ( -20.450 0.000 -1.989) 20.547 3.612 ( 0.351 0.000 -5.972) 5.982 3.878 ( 4.159 0.000 -6.518) 7.732 3.928 ( -2.853 0.000 9.703) 10.113 4.077 ( 0.582 0.000 -3.556) 3.603 4.463 ( 7.273 0.000 3.948) 8.276 4.638 ( -20.163 0.000 0.590) 20.172 4.655 ( 1.696 0.000 2.772) 3.250 4.669 ( 3.201 0.000 -1.321) 3.463 4.978 ( 3.896 0.000 -2.811) 4.805 5.029 ( -4.497 0.000 -2.452) 5.122 5.416 ( -9.528 0.000 -10.515) 14.190 5.482 ( -0.681 0.000 6.119) 6.157 6.661 ( 7.164 0.000 0.925) 7.224 6.916 ( -1.439 0.000 2.198) 2.627 7.308 ( 2.221 0.000 -3.447) 4.101 7.400 ( -0.919 0.000 1.200) 1.511 7.729 ( 7.831 0.000 -3.600) 8.619 7.825 ( 8.044 0.000 3.831) 8.909 7.985 ( 5.392 0.000 -6.482) 8.432 8.205 ( -1.356 0.000 -5.032) 5.211 8.261 ( -4.346 0.000 5.034) 6.650 8.519 ( 4.583 0.000 2.825) 5.383 8.547 ( 2.968 0.000 -5.141) 5.936 8.926 ( -3.721 0.000 5.546) 6.678 9.546 ( 1.472 0.000 -1.299) 1.963 9.608 ( -6.115 0.000 6.643) 9.029 10.929 ( -1.038 0.000 0.348) 1.095 10.986 ( 3.653 0.000 0.277) 3.664 11.328 ( -0.768 0.000 -0.608) 0.980 11.512 ( -3.129 0.000 1.565) 3.498 11.775 ( -9.816 0.000 -0.115) 9.816 11.863 ( -9.447 0.000 -0.345) 9.454 12.135 ( -4.265 0.000 0.984) 4.377 12.216 ( -3.657 0.000 -0.665) 3.717 12.646 ( 11.132 0.000 -7.697) 13.534 13.091 ( 12.072 0.000 9.031) 15.077 13.729 ( -1.914 0.000 3.422) 3.921 13.739 ( 6.176 0.000 4.675) 7.746 17.553 ( -0.094 0.000 -2.511) 2.513 17.636 ( -0.858 0.000 1.660) 1.868 17.782 ( -0.866 0.000 -4.650) 4.730 18.377 ( -8.555 0.000 11.983) 14.723 18.663 ( 0.029 0.000 0.681) 0.682 18.685 ( 0.448 0.000 1.852) 1.906 18.912 ( -2.395 0.000 -1.597) 2.879 19.048 ( -2.620 0.000 2.515) 3.632 20.906 ( 7.919 0.000 -14.567) 16.581 21.277 ( 1.882 0.000 -2.000) 2.746 21.355 ( 1.671 0.000 2.210) 2.771 21.499 ( 0.511 0.000 2.572) 2.622 ======================= Grid point 301 (144/170) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( 22.449 0.000 -12.395) 25.644 1.773 ( 23.001 0.000 -11.339) 25.644 2.676 ( -9.974 0.000 8.625) 13.186 2.780 ( -2.812 0.000 5.239) 5.946 2.940 ( 1.429 0.000 -4.478) 4.700 3.011 ( 1.626 0.000 -1.786) 2.415 3.088 ( 7.135 0.000 -8.406) 11.026 3.160 ( -9.575 0.000 8.916) 13.083 3.190 ( -7.681 0.000 -2.124) 7.969 3.411 ( 3.677 0.000 -6.199) 7.207 3.583 ( 3.045 0.000 -4.509) 5.441 3.887 ( 3.579 0.000 -2.984) 4.660 3.897 ( -8.007 0.000 0.640) 8.033 4.120 ( 4.767 0.000 1.981) 5.163 4.364 ( -5.493 0.000 -2.718) 6.129 4.582 ( 2.667 0.000 1.745) 3.187 4.721 ( 1.550 0.000 2.558) 2.991 4.791 ( 4.138 0.000 5.343) 6.758 4.922 ( -3.697 0.000 -5.377) 6.525 5.075 ( 7.252 0.000 -9.923) 12.291 5.169 ( -2.202 0.000 -0.708) 2.313 5.497 ( -2.783 0.000 1.731) 3.277 6.799 ( 5.266 0.000 2.770) 5.950 6.870 ( -6.947 0.000 2.412) 7.354 7.298 ( 1.534 0.000 -3.856) 4.150 7.393 ( -0.235 0.000 -0.851) 0.883 7.819 ( 6.058 0.000 2.041) 6.392 7.958 ( 5.075 0.000 0.143) 5.077 8.031 ( 7.348 0.000 -4.630) 8.685 8.145 ( -0.187 0.000 -3.403) 3.408 8.282 ( -3.077 0.000 8.795) 9.317 8.524 ( 2.509 0.000 -6.823) 7.269 8.531 ( -0.736 0.000 -5.608) 5.656 8.852 ( -7.262 0.000 0.883) 7.315 9.568 ( 1.458 0.000 0.667) 1.603 9.589 ( -6.035 0.000 7.135) 9.345 10.927 ( 1.201 0.000 -0.182) 1.215 11.061 ( 5.458 0.000 0.120) 5.459 11.336 ( 1.676 0.000 -0.795) 1.855 11.473 ( -3.776 0.000 1.660) 4.125 11.623 ( -8.810 0.000 -0.712) 8.839 11.690 ( -11.185 0.000 -0.724) 11.209 12.121 ( -1.819 0.000 3.841) 4.250 12.155 ( -2.617 0.000 -1.187) 2.874 12.758 ( 12.603 0.000 -5.228) 13.644 13.367 ( 10.463 0.000 8.040) 13.196 13.699 ( -5.016 0.000 0.951) 5.106 13.867 ( 1.458 0.000 6.012) 6.187 17.530 ( 0.350 0.000 -1.768) 1.802 17.635 ( -1.150 0.000 1.048) 1.556 17.771 ( 1.903 0.000 -0.502) 1.968 18.314 ( -12.578 0.000 7.218) 14.502 18.663 ( -0.290 0.000 -0.135) 0.320 18.701 ( -0.573 0.000 1.135) 1.272 18.900 ( 1.007 0.000 1.620) 1.907 19.044 ( -1.964 0.000 3.509) 4.021 20.914 ( 10.700 0.000 -10.950) 15.310 21.298 ( 2.886 0.000 -1.197) 3.124 21.395 ( 0.839 0.000 1.503) 1.721 21.475 ( -2.821 0.000 -2.715) 3.915 ======================= Grid point 302 (145/170) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( 22.806 0.000 -3.647) 23.096 2.043 ( 23.740 0.000 -7.764) 24.977 2.532 ( -13.931 0.000 6.047) 15.186 2.712 ( -6.537 0.000 -3.017) 7.200 2.899 ( -0.961 0.000 -1.410) 1.706 2.958 ( -8.913 0.000 5.057) 10.248 3.051 ( -2.864 0.000 -2.758) 3.977 3.066 ( -6.411 0.000 4.209) 7.669 3.253 ( 0.237 0.000 8.644) 8.647 3.415 ( 2.438 0.000 -7.200) 7.601 3.619 ( 9.197 0.000 -7.268) 11.722 3.739 ( -9.110 0.000 -2.527) 9.454 3.928 ( 2.038 0.000 2.898) 3.543 4.209 ( 3.000 0.000 0.603) 3.060 4.388 ( 7.689 0.000 -0.413) 7.700 4.556 ( -1.519 0.000 -7.002) 7.165 4.755 ( -1.008 0.000 3.328) 3.477 4.807 ( -3.197 0.000 -3.696) 4.887 4.938 ( 12.266 0.000 -1.363) 12.341 5.016 ( 2.159 0.000 1.597) 2.686 5.314 ( 7.080 0.000 1.972) 7.350 5.439 ( -3.467 0.000 -3.197) 4.716 6.775 ( -8.739 0.000 3.943) 9.587 6.842 ( -0.800 0.000 -1.876) 2.040 7.275 ( 0.806 0.000 -2.810) 2.923 7.370 ( -0.916 0.000 -1.844) 2.059 7.975 ( 7.499 0.000 5.035) 9.032 8.001 ( 3.228 0.000 -2.220) 3.918 8.092 ( 4.622 0.000 -1.096) 4.750 8.152 ( 4.460 0.000 -0.383) 4.477 8.334 ( -4.721 0.000 10.660) 11.658 8.428 ( -3.587 0.000 -5.001) 6.155 8.475 ( 2.481 0.000 -9.099) 9.431 8.732 ( -7.864 0.000 -2.303) 8.194 9.580 ( -3.438 0.000 5.019) 6.084 9.595 ( 0.323 0.000 1.174) 1.218 10.977 ( 5.416 0.000 -0.036) 5.416 11.153 ( 6.209 0.000 -0.521) 6.230 11.338 ( -0.248 0.000 -1.901) 1.917 11.436 ( -3.568 0.000 1.894) 4.040 11.485 ( -7.278 0.000 -0.919) 7.336 11.514 ( -9.538 0.000 -0.297) 9.543 12.115 ( -0.382 0.000 -1.535) 1.582 12.133 ( -2.342 0.000 3.608) 4.302 12.934 ( 14.330 0.000 -1.503) 14.409 13.550 ( -5.254 0.000 5.471) 7.586 13.632 ( 4.673 0.000 -0.457) 4.696 13.909 ( -2.237 0.000 3.085) 3.811 17.529 ( 1.496 0.000 -0.825) 1.708 17.623 ( -1.523 0.000 0.430) 1.583 17.806 ( 3.170 0.000 -0.543) 3.216 18.159 ( -13.515 0.000 3.236) 13.897 18.659 ( 0.346 0.000 -0.282) 0.446 18.696 ( -0.884 0.000 0.248) 0.918 18.962 ( 2.052 0.000 4.001) 4.497 19.058 ( -0.947 0.000 2.715) 2.876 20.992 ( 10.623 0.000 -5.804) 12.105 21.337 ( 3.180 0.000 -0.585) 3.233 21.373 ( -4.732 0.000 -4.179) 6.313 21.413 ( -0.273 0.000 0.996) 1.032 ======================= Grid point 303 (146/170) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( 17.384 0.000 0.692) 17.398 2.301 ( 16.460 0.000 -6.444) 17.677 2.437 ( -9.194 0.000 9.319) 13.091 2.535 ( -9.323 0.000 -5.353) 10.751 2.869 ( -8.682 0.000 6.967) 11.132 2.876 ( 0.590 0.000 -4.260) 4.300 2.999 ( 2.284 0.000 -3.905) 4.524 3.025 ( -6.760 0.000 6.593) 9.442 3.315 ( -2.158 0.000 4.606) 5.086 3.343 ( 0.634 0.000 -6.855) 6.884 3.623 ( -4.457 0.000 3.314) 5.554 3.640 ( 3.316 0.000 -7.131) 7.864 4.033 ( 3.926 0.000 7.235) 8.232 4.176 ( -2.508 0.000 -7.128) 7.556 4.487 ( 1.471 0.000 1.929) 2.426 4.491 ( 2.178 0.000 -3.520) 4.140 4.750 ( 2.924 0.000 -5.456) 6.191 4.759 ( -3.915 0.000 4.471) 5.943 5.142 ( 4.275 0.000 8.461) 9.480 5.158 ( 15.319 0.000 -1.572) 15.400 5.322 ( -2.790 0.000 -7.808) 8.292 5.350 ( -5.584 0.000 1.565) 5.799 6.712 ( -4.843 0.000 5.585) 7.392 6.760 ( -2.175 0.000 -5.684) 6.086 7.281 ( 2.232 0.000 -0.364) 2.261 7.326 ( -2.234 0.000 -1.394) 2.633 8.042 ( 3.380 0.000 0.107) 3.381 8.076 ( 1.210 0.000 -0.758) 1.428 8.181 ( 6.423 0.000 1.512) 6.598 8.297 ( 7.823 0.000 7.464) 10.813 8.308 ( -6.104 0.000 -2.619) 6.642 8.367 ( -5.533 0.000 9.586) 11.068 8.418 ( 5.356 0.000 -10.584) 11.863 8.546 ( -9.940 0.000 -5.367) 11.297 9.590 ( -0.862 0.000 2.545) 2.687 9.601 ( -0.196 0.000 -0.178) 0.265 11.093 ( 8.546 0.000 0.438) 8.557 11.217 ( -1.856 0.000 -0.764) 2.007 11.283 ( 0.875 0.000 -1.832) 2.031 11.359 ( -7.724 0.000 1.682) 7.905 11.421 ( -1.086 0.000 0.045) 1.087 11.423 ( -1.540 0.000 -0.464) 1.609 12.109 ( 1.872 0.000 -1.914) 2.677 12.124 ( -2.891 0.000 2.539) 3.848 13.162 ( 14.532 0.000 0.798) 14.554 13.390 ( -12.933 0.000 -0.654) 12.949 13.772 ( 6.810 0.000 2.084) 7.122 13.872 ( -4.494 0.000 0.122) 4.496 17.558 ( 2.447 0.000 -0.018) 2.448 17.596 ( -2.141 0.000 -0.048) 2.142 17.868 ( 6.168 0.000 -0.969) 6.244 17.988 ( -10.650 0.000 1.321) 10.732 18.667 ( 0.795 0.000 -0.005) 0.795 18.682 ( -0.936 0.000 -0.058) 0.937 19.030 ( 1.531 0.000 2.671) 3.078 19.063 ( -0.891 0.000 0.240) 0.923 21.111 ( 8.993 0.000 -1.068) 9.056 21.244 ( -6.820 0.000 -2.427) 7.239 21.379 ( 2.618 0.000 -0.340) 2.640 21.408 ( -1.493 0.000 0.508) 1.577 ======================= Grid point 309 (147/170) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( -0.974 6.092 -23.872) 24.656 1.911 ( 0.974 6.092 23.872) 24.656 2.116 ( -1.960 9.968 -24.890) 26.883 2.116 ( 1.960 9.968 24.890) 26.883 2.989 ( 0.626 -1.159 -4.114) 4.319 2.989 ( -0.626 -1.159 4.114) 4.319 3.265 ( 3.387 -6.352 -1.787) 7.417 3.265 ( -3.387 -6.352 1.787) 7.417 3.486 ( -0.723 0.233 -13.535) 13.557 3.486 ( 0.723 0.233 13.535) 13.557 3.765 ( 1.605 -1.595 -7.618) 7.947 3.765 ( -1.605 -1.595 7.618) 7.947 4.043 ( -2.942 8.088 -1.500) 8.736 4.043 ( 2.942 8.088 1.500) 8.736 4.555 ( -0.323 0.898 -2.693) 2.857 4.555 ( 0.323 0.898 2.693) 2.857 4.784 ( -8.369 -1.304 -7.289) 11.175 4.784 ( 8.369 -1.304 7.289) 11.175 5.253 ( -5.790 2.728 -6.459) 9.093 5.253 ( 5.790 2.728 6.459) 9.093 5.397 ( -3.440 -5.222 -7.446) 9.723 5.397 ( 3.440 -5.222 7.446) 9.723 6.736 ( -1.424 -2.141 -8.381) 8.767 6.736 ( 1.424 -2.141 8.381) 8.767 7.424 ( 1.840 7.084 -4.403) 8.541 7.424 ( -1.840 7.084 4.403) 8.541 7.599 ( 2.489 1.948 -2.507) 4.034 7.599 ( -2.489 1.948 2.507) 4.034 8.170 ( -1.119 2.582 -11.397) 11.739 8.170 ( 1.119 2.582 11.397) 11.739 8.362 ( 2.130 -0.678 -4.150) 4.714 8.362 ( -2.130 -0.678 4.150) 4.714 8.662 ( -1.619 5.424 -7.581) 9.462 8.662 ( 1.619 5.424 7.581) 9.462 9.589 ( 0.744 -0.851 -3.923) 4.082 9.589 ( -0.744 -0.851 3.923) 4.082 10.940 ( -0.729 0.624 -3.793) 3.912 10.940 ( 0.729 0.624 3.793) 3.912 11.487 ( -4.006 0.586 -1.810) 4.435 11.487 ( 4.006 0.586 1.810) 4.435 11.946 ( 0.408 -6.466 -1.769) 6.717 11.946 ( -0.408 -6.466 1.769) 6.717 12.278 ( -1.567 -2.828 -0.103) 3.235 12.278 ( 1.567 -2.828 0.103) 3.235 12.668 ( -0.540 6.962 -9.813) 12.044 12.668 ( 0.540 6.962 9.813) 12.044 13.585 ( 0.004 -4.148 -5.982) 7.279 13.585 ( -0.004 -4.148 5.982) 7.279 17.620 ( -0.201 1.286 -2.437) 2.762 17.620 ( 0.201 1.286 2.437) 2.762 18.083 ( -2.135 -4.812 -13.608) 14.590 18.083 ( 2.135 -4.812 13.608) 14.590 18.659 ( -1.507 1.169 -1.459) 2.402 18.659 ( 1.507 1.169 1.459) 2.402 19.026 ( -1.648 -1.564 -0.009) 2.272 19.026 ( 1.648 -1.564 0.009) 2.272 21.179 ( -2.176 3.364 -9.181) 10.017 21.179 ( 2.176 3.364 9.181) 10.017 21.336 ( -0.659 1.509 -4.965) 5.231 21.336 ( 0.659 1.509 4.965) 5.231 ======================= Grid point 311 (148/170) ======================= q-point: ( 0.09 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( 9.329 10.922 -20.789) 25.269 1.831 ( 3.130 13.837 -25.537) 29.213 2.249 ( 7.602 1.869 21.337) 22.728 2.426 ( 4.374 5.593 20.697) 21.881 2.941 ( 6.085 -0.129 -12.750) 14.128 3.000 ( 0.567 -0.936 -1.922) 2.211 3.199 ( -6.385 -5.251 2.394) 8.606 3.255 ( -6.035 -4.548 0.060) 7.557 3.358 ( 5.316 -1.927 -12.181) 13.429 3.587 ( -2.300 -5.950 3.583) 7.316 3.705 ( 1.453 1.998 -6.879) 7.309 3.813 ( -0.798 -4.794 5.850) 7.605 4.011 ( -2.865 10.738 0.668) 11.134 4.133 ( 2.296 3.741 2.471) 5.037 4.472 ( -5.838 4.143 -5.542) 9.053 4.582 ( -3.113 -2.547 -0.233) 4.029 4.637 ( 3.796 4.325 5.769) 8.148 4.879 ( -4.100 -1.781 1.509) 4.718 5.040 ( -9.568 -3.099 -7.932) 12.809 5.207 ( -3.563 4.083 -6.930) 8.798 5.421 ( 1.349 -2.307 4.603) 5.322 5.507 ( -0.298 -1.422 5.715) 5.897 6.639 ( 2.258 0.506 -7.651) 7.993 6.844 ( 2.940 -2.011 4.539) 5.770 7.383 ( -1.234 6.349 -3.245) 7.237 7.409 ( -2.965 1.741 2.408) 4.198 7.633 ( 4.307 0.791 -1.479) 4.622 7.714 ( 10.903 4.024 1.079) 11.672 8.060 ( 1.878 3.675 -9.310) 10.184 8.271 ( -2.433 -1.728 -4.011) 4.999 8.315 ( -0.118 -0.745 -0.703) 1.031 8.366 ( -1.560 2.774 9.756) 10.262 8.635 ( 4.415 6.880 -2.499) 8.549 8.803 ( 2.124 0.317 8.736) 8.996 9.557 ( 0.376 -0.045 -2.814) 2.840 9.607 ( -3.106 -1.702 4.335) 5.598 10.904 ( 0.516 -0.762 -2.218) 2.402 11.003 ( 1.039 3.615 4.716) 6.032 11.387 ( -5.192 -0.312 -1.769) 5.494 11.540 ( 0.170 1.451 1.331) 1.977 11.858 ( -8.267 -5.938 0.908) 10.218 11.934 ( -4.029 -4.815 0.393) 6.290 12.208 ( -5.945 -2.215 -0.301) 6.351 12.262 ( -2.668 -1.806 -0.194) 3.228 12.637 ( 8.830 6.348 -9.449) 14.407 12.865 ( 9.520 5.582 9.612) 14.635 13.564 ( 4.677 -5.410 -3.116) 7.801 13.662 ( 0.848 -3.200 5.541) 6.454 17.590 ( -0.139 1.256 -1.949) 2.323 17.659 ( 1.474 2.899 2.012) 3.824 17.901 ( -3.528 -1.559 -9.899) 10.624 18.239 ( -2.299 -6.890 13.786) 15.582 18.628 ( -1.031 0.220 -0.675) 1.252 18.708 ( 1.581 2.141 2.977) 3.994 18.988 ( -2.791 0.111 -0.250) 2.804 19.045 ( 0.113 -1.476 0.599) 1.597 21.034 ( 0.744 4.603 -13.449) 14.235 21.273 ( 1.241 -0.325 0.591) 1.412 21.302 ( 1.324 0.902 -0.171) 1.611 21.420 ( 1.279 0.927 5.964) 6.169 ======================= Grid point 312 (149/170) ======================= q-point: ( 0.18 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( 11.392 11.911 -22.258) 27.696 1.766 ( 16.858 14.378 -14.131) 26.279 2.565 ( 4.036 0.403 16.364) 16.859 2.681 ( 2.371 1.535 14.174) 14.453 2.922 ( 6.864 -1.816 -10.838) 12.957 2.989 ( 8.227 0.837 -9.766) 12.797 3.138 ( -2.773 -2.861 -0.117) 3.986 3.148 ( -7.087 -1.397 3.038) 7.836 3.321 ( -0.927 -8.359 -4.009) 9.317 3.470 ( -13.293 -4.460 -2.585) 14.257 3.626 ( 0.029 1.636 -7.542) 7.717 3.851 ( -1.852 -3.573 1.854) 4.431 3.972 ( 1.576 4.396 0.936) 4.762 4.148 ( 0.519 7.038 -2.132) 7.372 4.406 ( 0.963 -3.361 -1.858) 3.960 4.551 ( -6.069 -5.283 -4.400) 9.171 4.670 ( -7.574 1.268 5.656) 9.537 4.826 ( 2.573 11.553 4.133) 12.537 4.956 ( 5.881 1.301 -0.322) 6.032 5.112 ( -1.742 5.046 -3.352) 6.303 5.335 ( -6.885 -6.714 -9.357) 13.417 5.561 ( -1.573 5.962 5.583) 8.318 6.677 ( 6.424 1.371 0.676) 6.603 6.905 ( -0.535 -1.250 2.192) 2.579 7.322 ( -1.321 0.775 -3.221) 3.567 7.405 ( -0.001 0.768 0.099) 0.774 7.679 ( 4.256 -1.975 -2.038) 5.116 7.906 ( 7.972 3.550 3.398) 9.365 8.034 ( 6.421 4.256 -5.789) 9.637 8.147 ( -3.556 -2.065 -5.940) 7.224 8.302 ( -0.576 1.091 -0.022) 1.234 8.454 ( -0.161 -1.022 4.481) 4.599 8.695 ( 4.599 8.448 -2.453) 9.926 8.844 ( -5.067 -6.158 2.244) 8.285 9.549 ( 1.663 0.261 -1.130) 2.028 9.595 ( -5.146 -1.158 6.083) 8.052 10.900 ( 1.047 -0.796 -1.546) 2.030 11.073 ( 1.282 6.218 4.706) 7.903 11.316 ( -1.293 -1.333 -1.112) 2.165 11.526 ( -3.098 1.381 1.112) 3.570 11.726 ( -9.148 -4.079 0.705) 10.041 11.848 ( -7.246 -1.551 0.511) 7.428 12.124 ( -4.067 -1.164 1.224) 4.404 12.210 ( -3.142 -0.868 -0.593) 3.313 12.693 ( 10.595 4.683 -8.852) 14.579 13.143 ( 11.655 4.887 9.297) 15.689 13.654 ( 5.044 -6.081 1.775) 8.097 13.724 ( 0.723 -2.575 4.829) 5.520 17.574 ( 0.609 2.667 -1.763) 3.255 17.707 ( 0.708 5.982 1.708) 6.261 17.784 ( -0.291 0.433 -3.669) 3.705 18.304 ( -6.760 -6.871 10.835) 14.502 18.612 ( -0.287 -0.101 -0.262) 0.401 18.772 ( 0.856 3.286 4.910) 5.970 18.937 ( -2.373 2.274 -1.152) 3.483 19.045 ( -1.665 -0.364 1.921) 2.568 20.926 ( 5.114 2.129 -13.965) 15.024 21.272 ( 1.408 -0.527 -1.879) 2.406 21.345 ( 1.385 -1.157 1.637) 2.437 21.465 ( -1.136 -2.964 1.007) 3.330 ======================= Grid point 313 (150/170) ======================= q-point: ( 0.27 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( 18.857 5.913 -14.245) 24.361 1.937 ( 20.586 13.282 -9.915) 26.430 2.670 ( -8.625 -0.228 8.522) 12.127 2.765 ( -5.766 -1.807 4.282) 7.406 2.909 ( 2.000 -3.305 -2.719) 4.724 3.002 ( -2.261 -0.940 -0.781) 2.570 3.116 ( -1.596 0.185 2.924) 3.336 3.138 ( 1.442 -0.212 -0.003) 1.458 3.199 ( -8.611 0.802 -2.261) 8.939 3.312 ( 2.825 -8.828 -2.573) 9.619 3.590 ( 5.798 1.362 -7.261) 9.391 3.823 ( -2.408 -1.866 -1.103) 3.240 4.011 ( -2.029 2.938 1.913) 4.051 4.132 ( 3.766 5.257 -3.930) 7.567 4.361 ( -0.053 -0.463 -2.068) 2.120 4.473 ( 2.270 -8.158 -0.269) 8.472 4.693 ( -1.955 1.132 3.401) 4.083 4.880 ( 2.602 3.722 -2.330) 5.104 4.981 ( -2.973 2.457 0.043) 3.857 5.109 ( 0.597 1.911 -10.101) 10.297 5.205 ( 5.637 6.727 4.849) 10.027 5.558 ( -3.608 5.878 1.498) 7.058 6.774 ( 0.681 -1.903 2.288) 3.053 6.897 ( -1.876 1.907 2.285) 3.519 7.276 ( 0.112 -1.928 -3.543) 4.035 7.400 ( -0.248 -0.046 -1.077) 1.106 7.734 ( 4.589 -4.865 -0.687) 6.723 7.994 ( 2.555 -0.393 0.498) 2.633 8.046 ( -2.248 -5.706 -3.390) 7.007 8.121 ( 4.936 5.167 -0.171) 7.148 8.315 ( 3.298 2.762 -0.198) 4.307 8.441 ( -4.503 -6.282 -0.880) 7.779 8.639 ( -3.559 4.624 -5.164) 7.792 8.811 ( 0.828 1.270 -1.341) 2.024 9.581 ( -0.073 1.282 2.234) 2.577 9.587 ( -2.312 -0.126 4.976) 5.488 10.899 ( 1.582 -1.428 -1.643) 2.691 11.149 ( 2.771 6.680 3.291) 7.946 11.298 ( -0.508 -4.049 -1.612) 4.388 11.486 ( -2.890 1.306 0.720) 3.252 11.600 ( -7.448 -0.324 0.856) 7.504 11.726 ( -8.236 2.207 0.101) 8.527 12.116 ( -1.524 -0.504 4.107) 4.410 12.156 ( -2.238 0.082 -1.076) 2.485 12.781 ( 11.801 2.429 -6.586) 13.731 13.414 ( 9.726 4.487 8.515) 13.683 13.666 ( -3.516 -3.349 0.247) 4.862 13.831 ( 3.065 -3.063 5.718) 7.174 17.568 ( 1.093 4.002 -1.632) 4.459 17.685 ( -1.457 3.117 -1.305) 3.680 17.827 ( 3.046 6.744 2.670) 7.867 18.270 ( -9.894 -3.979 7.127) 12.826 18.613 ( 0.781 -0.243 -0.298) 0.871 18.824 ( -2.017 6.740 3.934) 8.060 18.909 ( 0.559 1.141 0.652) 1.428 19.044 ( -1.666 0.066 3.059) 3.484 20.893 ( 8.077 -2.040 -10.889) 13.710 21.283 ( 2.098 -1.580 -1.372) 2.963 21.370 ( -0.310 -4.088 0.258) 4.108 21.417 ( -2.127 -3.772 -2.711) 5.109 ======================= Grid point 314 (151/170) ======================= q-point: ( 0.36 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( 21.331 -0.223 -5.581) 22.050 2.175 ( 21.187 10.310 -7.448) 24.711 2.560 ( -12.308 2.818 6.529) 14.215 2.650 ( -7.963 -4.957 -2.437) 9.691 2.909 ( -1.251 -0.374 0.878) 1.574 2.943 ( -6.252 -1.380 4.203) 7.659 3.073 ( -3.418 0.540 -2.846) 4.481 3.083 ( -6.432 2.152 2.456) 7.214 3.198 ( -1.577 -3.841 9.121) 10.021 3.337 ( 1.323 -7.069 -4.975) 8.745 3.645 ( 9.610 2.520 -7.314) 12.336 3.735 ( -6.653 -0.279 -0.881) 6.717 3.975 ( -2.149 2.700 0.801) 3.543 4.175 ( 3.519 -1.238 -3.016) 4.797 4.424 ( 4.963 2.174 1.471) 5.614 4.507 ( 7.660 -4.938 -5.994) 10.908 4.676 ( -1.830 -0.066 -0.623) 1.934 4.844 ( 5.071 -3.265 -3.290) 6.871 5.000 ( -1.384 8.029 2.461) 8.511 5.117 ( 6.022 5.242 2.408) 8.339 5.324 ( 2.650 2.297 0.987) 3.643 5.491 ( -3.823 5.950 -2.407) 7.471 6.739 ( -6.588 -2.456 3.571) 7.886 6.888 ( -1.568 3.365 -2.221) 4.326 7.248 ( 0.314 -2.429 -1.601) 2.926 7.368 ( -1.354 -0.975 -2.250) 2.801 7.787 ( 4.295 -9.899 -2.591) 11.097 7.998 ( -2.076 -9.204 -0.825) 9.471 8.036 ( 0.520 -5.084 3.586) 6.243 8.193 ( 5.731 5.068 0.910) 7.704 8.319 ( -4.299 -11.251 -1.261) 12.110 8.401 ( 3.738 7.388 0.861) 8.324 8.565 ( -2.153 7.357 -1.468) 7.805 8.769 ( -1.816 4.932 -5.958) 7.945 9.588 ( -2.168 1.444 4.476) 5.179 9.625 ( 0.669 1.955 1.423) 2.509 10.928 ( 4.077 -3.322 -0.964) 5.347 11.222 ( 0.783 0.443 -2.413) 2.576 11.249 ( -0.820 -2.165 2.010) 3.066 11.455 ( -1.444 2.099 -0.154) 2.553 11.525 ( -3.152 5.059 0.474) 5.980 11.602 ( -7.859 5.687 0.790) 9.733 12.122 ( -0.251 0.642 -1.474) 1.627 12.136 ( -2.071 0.289 3.783) 4.322 12.931 ( 13.586 -0.151 -2.431) 13.803 13.533 ( -8.469 -2.504 2.451) 9.166 13.667 ( 7.955 4.087 2.435) 9.269 13.904 ( -0.328 -0.230 3.346) 3.370 17.574 ( 1.782 4.138 -1.203) 4.663 17.655 ( -1.112 2.370 -0.621) 2.691 17.893 ( 2.715 9.339 1.077) 9.785 18.162 ( -10.870 1.031 3.851) 11.578 18.632 ( 2.194 -0.129 -0.299) 2.218 18.791 ( -3.711 6.745 0.283) 7.703 18.969 ( 1.963 0.738 4.287) 4.773 19.059 ( -0.740 0.095 2.625) 2.729 20.935 ( 8.785 -5.874 -5.973) 12.139 21.265 ( -3.272 -8.696 -3.745) 10.018 21.338 ( 1.274 -2.201 -1.000) 2.733 21.400 ( -0.229 -1.193 0.300) 1.251 ======================= Grid point 315 (152/170) ======================= q-point: ( 0.45 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 18.416 -3.390 -0.406) 18.730 2.391 ( 9.454 6.314 -4.085) 12.080 2.465 ( -8.015 -0.959 -0.145) 8.074 2.496 ( -5.957 1.254 2.414) 6.548 2.882 ( -3.685 1.550 3.450) 5.280 2.909 ( -2.822 2.279 1.201) 3.821 3.006 ( 0.994 0.135 -3.661) 3.796 3.031 ( -5.937 0.474 4.857) 7.685 3.240 ( -2.607 -5.969 4.512) 7.923 3.269 ( 0.385 -6.619 -6.208) 9.083 3.648 ( -3.134 2.058 2.569) 4.545 3.669 ( 2.488 2.809 -6.596) 7.588 4.005 ( 1.667 -2.728 5.600) 6.448 4.118 ( -2.435 -4.858 -6.980) 8.845 4.493 ( 3.297 1.402 1.597) 3.923 4.555 ( -0.815 4.220 -2.108) 4.787 4.725 ( 11.772 0.313 -2.343) 12.006 4.867 ( -6.298 5.115 1.454) 8.243 5.083 ( 9.179 -1.929 4.274) 10.307 5.256 ( 2.704 5.383 -0.577) 6.051 5.286 ( -1.725 -2.735 0.140) 3.236 5.401 ( -4.292 5.928 -2.960) 7.895 6.709 ( -2.428 0.098 5.559) 6.067 6.790 ( -3.491 2.861 -5.957) 7.474 7.262 ( 1.757 -2.112 0.993) 2.921 7.314 ( -2.089 -1.652 -2.349) 3.552 7.839 ( 5.782 -13.776 -1.543) 15.020 7.928 ( -5.854 -13.923 -0.076) 15.104 8.106 ( 2.227 -6.651 4.771) 8.482 8.195 ( -1.891 -8.396 -4.707) 9.810 8.398 ( 7.312 3.977 6.742) 10.711 8.471 ( 1.973 9.270 4.018) 10.294 8.514 ( -2.105 7.469 -2.016) 8.017 8.625 ( -5.548 7.054 -8.763) 12.543 9.611 ( 0.070 2.233 2.322) 3.222 9.632 ( -0.606 2.490 -0.037) 2.563 11.006 ( 6.156 -5.927 0.202) 8.548 11.118 ( -6.452 -7.663 -1.665) 10.154 11.338 ( 5.660 5.074 1.114) 7.683 11.424 ( -3.309 3.154 -0.289) 4.581 11.497 ( -0.422 7.270 -0.668) 7.313 11.509 ( -4.135 8.125 0.962) 9.167 12.116 ( 1.786 0.782 -1.802) 2.655 12.131 ( -2.708 0.705 2.459) 3.725 13.143 ( 13.971 -1.881 0.596) 14.110 13.364 ( -12.426 -2.732 -0.946) 12.758 13.814 ( 5.990 4.094 2.214) 7.586 13.896 ( -3.176 2.468 0.344) 4.037 17.599 ( 2.221 3.340 -0.283) 4.021 17.630 ( -1.559 2.631 -0.282) 3.071 17.948 ( 4.572 8.903 -0.715) 10.034 18.036 ( -8.463 5.844 1.867) 10.453 18.674 ( 3.315 1.474 -0.062) 3.628 18.732 ( -3.775 4.188 -0.115) 5.640 19.037 ( 1.340 0.711 2.746) 3.137 19.066 ( -0.674 0.406 0.259) 0.828 21.029 ( 7.883 -8.459 -1.228) 11.628 21.148 ( -6.195 -9.711 -2.392) 11.765 21.366 ( 2.139 -1.503 -0.159) 2.619 21.392 ( -1.258 -1.547 0.173) 2.002 ======================= Grid point 321 (153/170) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.063 ( 1.129 9.091 -17.811) 20.029 2.063 ( -1.129 9.091 17.811) 20.029 2.315 ( 1.140 9.562 -20.583) 22.724 2.315 ( -1.140 9.562 20.583) 22.724 2.946 ( 0.561 -4.369 -2.401) 5.017 2.946 ( -0.561 -4.369 2.401) 5.017 3.078 ( 0.048 -11.335 -4.270) 12.113 3.078 ( -0.048 -11.335 4.270) 12.113 3.468 ( -0.744 -1.946 -4.972) 5.391 3.468 ( 0.744 -1.946 4.972) 5.391 3.712 ( -3.737 -3.503 -1.635) 5.377 3.712 ( 3.737 -3.503 1.635) 5.377 4.318 ( 3.369 18.337 -6.814) 19.850 4.318 ( -3.369 18.337 6.814) 19.850 4.586 ( -3.581 2.772 -2.440) 5.144 4.586 ( 3.581 2.772 2.440) 5.144 4.807 ( -7.314 3.672 -4.900) 9.539 4.807 ( 7.314 3.672 4.900) 9.539 5.167 ( -5.606 -5.258 -6.502) 10.067 5.167 ( 5.606 -5.258 6.502) 10.067 5.437 ( -2.256 4.351 -8.340) 9.673 5.437 ( 2.256 4.351 8.340) 9.673 6.685 ( -0.581 -3.397 -6.564) 7.414 6.685 ( 0.581 -3.397 6.564) 7.414 7.564 ( -5.878 7.150 0.945) 9.304 7.564 ( 5.878 7.150 -0.945) 9.304 7.657 ( -6.173 3.867 1.368) 7.411 7.657 ( 6.173 3.867 -1.368) 7.411 8.217 ( -0.964 1.590 -8.631) 8.829 8.217 ( 0.964 1.590 8.631) 8.829 8.331 ( 1.773 -2.293 -5.380) 6.111 8.331 ( -1.773 -2.293 5.380) 6.111 8.771 ( 0.449 4.792 -5.509) 7.316 8.771 ( -0.449 4.792 5.509) 7.316 9.560 ( 1.184 -2.017 -2.661) 3.543 9.560 ( -1.184 -2.017 2.661) 3.543 10.983 ( -0.410 4.324 -7.199) 8.407 10.983 ( 0.410 4.324 7.199) 8.407 11.503 ( -4.829 0.972 -2.637) 5.587 11.503 ( 4.829 0.972 2.637) 5.587 11.811 ( 3.408 -7.126 -4.639) 9.161 11.811 ( -3.408 -7.126 4.639) 9.161 12.198 ( -1.410 -5.315 -0.026) 5.499 12.198 ( 1.410 -5.315 0.026) 5.499 12.819 ( 0.655 8.361 -10.159) 13.174 12.819 ( -0.655 8.361 10.159) 13.174 13.484 ( -0.815 -6.068 -5.988) 8.564 13.484 ( 0.815 -6.068 5.988) 8.564 17.652 ( -0.770 2.002 -2.416) 3.231 17.652 ( 0.770 2.002 2.416) 3.231 17.987 ( -0.679 -4.671 -9.711) 10.798 17.987 ( 0.679 -4.671 9.711) 10.798 18.677 ( -1.441 0.573 -1.834) 2.402 18.677 ( 1.441 0.573 1.834) 2.402 18.987 ( 0.146 -2.412 -0.284) 2.433 18.987 ( -0.146 -2.412 0.284) 2.433 21.243 ( -0.384 2.888 -4.431) 5.303 21.243 ( 0.384 2.888 4.431) 5.303 21.381 ( -0.557 3.208 -6.795) 7.535 21.381 ( 0.557 3.208 6.795) 7.535 ======================= Grid point 323 (154/170) ======================= q-point: ( 0.09 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 9.965 14.230 -13.280) 21.867 2.111 ( 3.607 13.889 -21.418) 25.780 2.315 ( 5.363 4.656 18.153) 19.493 2.525 ( 0.528 4.096 17.476) 17.957 2.918 ( 0.544 -3.346 -3.656) 4.986 2.955 ( -0.593 -4.547 0.388) 4.601 3.008 ( -3.801 -11.316 -0.761) 11.962 3.113 ( -2.166 -8.795 3.669) 9.772 3.373 ( -0.525 1.442 -8.735) 8.869 3.483 ( -2.455 -4.926 -0.389) 5.517 3.657 ( -1.758 -8.350 0.879) 8.578 3.760 ( 1.451 -0.258 -2.517) 2.917 4.238 ( -6.146 10.501 -5.052) 13.175 4.291 ( -0.558 14.738 -2.134) 14.902 4.537 ( -1.127 3.751 -2.957) 4.908 4.628 ( -5.065 6.892 -4.480) 9.656 4.701 ( 1.545 0.725 4.038) 4.384 4.923 ( 4.349 7.803 3.219) 9.496 5.008 ( -5.105 2.035 -2.449) 6.017 5.253 ( -1.428 -7.802 -0.231) 7.935 5.324 ( -1.017 4.441 -5.797) 7.373 5.566 ( 1.784 3.185 8.121) 8.904 6.644 ( 3.840 -0.502 -4.722) 6.107 6.785 ( 3.734 -4.248 4.013) 6.935 7.446 ( -6.767 3.067 -1.531) 7.586 7.514 ( -5.297 6.160 -1.468) 8.256 7.674 ( 3.107 3.521 -1.921) 5.074 7.781 ( 8.293 2.433 1.121) 8.715 8.112 ( -0.186 0.190 -7.623) 7.628 8.265 ( -0.532 0.333 -4.758) 4.799 8.315 ( 1.856 1.912 0.184) 2.671 8.373 ( -2.234 -2.415 8.109) 8.750 8.761 ( 3.770 5.436 -1.523) 6.788 8.825 ( -1.730 1.732 4.951) 5.523 9.549 ( 0.843 -0.820 -1.979) 2.302 9.567 ( -1.888 -1.942 3.288) 4.260 10.927 ( 1.442 3.368 -4.470) 5.780 11.086 ( 0.619 5.290 9.029) 10.483 11.378 ( -5.656 -0.637 -3.279) 6.569 11.575 ( 1.140 2.141 0.888) 2.583 11.733 ( -7.770 -6.778 2.856) 10.700 11.836 ( -0.676 -4.752 0.888) 4.882 12.147 ( -4.500 -4.045 0.698) 6.091 12.201 ( -1.102 -4.527 -0.170) 4.663 12.779 ( 7.945 7.991 -10.601) 15.471 12.991 ( 7.907 7.109 9.679) 14.379 13.449 ( 4.084 -6.249 -3.730) 8.345 13.574 ( 1.744 -5.749 5.486) 8.136 17.632 ( 1.027 2.887 -1.160) 3.276 17.721 ( 4.332 3.373 2.226) 5.924 17.871 ( -1.949 -1.264 -6.635) 7.030 18.097 ( -1.099 -7.147 9.945) 12.296 18.646 ( -1.151 1.256 -0.031) 1.704 18.729 ( 1.249 0.110 3.601) 3.813 18.979 ( -0.675 -1.127 0.387) 1.369 19.005 ( 1.505 -2.547 0.048) 2.959 21.143 ( -2.150 6.202 -9.792) 11.789 21.273 ( 0.130 0.251 -0.131) 0.312 21.319 ( 0.001 0.972 -2.207) 2.411 21.440 ( -1.858 1.058 4.294) 4.797 ======================= Grid point 324 (155/170) ======================= q-point: ( 0.18 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( 5.833 17.041 -19.704) 26.696 2.058 ( 14.147 15.120 -9.439) 22.756 2.584 ( 3.672 1.088 14.454) 14.953 2.692 ( -0.420 -0.839 10.782) 10.823 2.864 ( -2.686 -4.135 -3.479) 6.035 2.962 ( -0.915 -10.794 3.168) 11.286 2.981 ( 4.217 -1.927 -2.224) 5.142 3.099 ( -4.261 -4.509 4.632) 7.742 3.286 ( -0.091 2.120 -6.261) 6.611 3.370 ( -9.079 -5.587 -3.576) 11.244 3.644 ( -0.052 -2.960 -4.085) 5.045 3.728 ( -1.569 -7.083 2.834) 7.788 4.108 ( 0.742 9.403 -9.061) 13.079 4.274 ( 0.283 7.091 0.801) 7.142 4.435 ( -3.380 5.502 -6.039) 8.841 4.506 ( -4.997 2.680 -6.855) 8.896 4.725 ( -2.244 4.221 6.833) 8.339 4.955 ( -0.879 4.722 -0.097) 4.805 5.106 ( 0.080 4.276 2.100) 4.765 5.138 ( 3.908 0.818 -4.083) 5.710 5.264 ( 0.059 3.233 -4.993) 5.949 5.655 ( -0.898 3.088 6.252) 7.030 6.696 ( 4.592 0.093 0.332) 4.605 6.865 ( 2.122 -3.219 1.750) 4.234 7.326 ( -4.379 0.366 -3.640) 5.706 7.437 ( -3.403 2.510 -0.287) 4.238 7.678 ( 1.579 1.307 -2.647) 3.348 7.879 ( 3.078 -4.838 -1.685) 5.977 8.052 ( -2.017 -3.763 -1.684) 4.590 8.185 ( -1.484 2.493 -3.380) 4.454 8.349 ( -0.475 2.587 -0.379) 2.658 8.396 ( 1.822 -1.137 -0.730) 2.268 8.802 ( -3.414 2.707 0.098) 4.358 8.838 ( 4.865 5.053 0.587) 7.039 9.550 ( 0.798 -0.237 0.487) 0.964 9.584 ( -0.809 0.487 3.562) 3.685 10.913 ( 1.338 2.126 -3.271) 4.124 11.179 ( -2.402 3.965 9.248) 10.345 11.282 ( -0.657 -1.421 -4.121) 4.408 11.564 ( -2.202 2.673 -0.099) 3.465 11.648 ( -7.311 -4.021 4.146) 9.318 11.821 ( -3.260 -0.774 1.671) 3.744 12.091 ( -3.318 -2.347 1.828) 4.457 12.177 ( -1.555 -2.623 -0.051) 3.050 12.805 ( 9.639 6.639 -10.638) 15.816 13.252 ( 10.771 6.048 9.572) 15.628 13.529 ( 7.024 -6.575 -0.079) 9.622 13.652 ( 1.560 -4.527 5.004) 6.926 17.648 ( 2.162 4.597 -1.230) 5.227 17.783 ( -1.409 1.238 -3.935) 4.360 17.845 ( 6.479 6.308 4.036) 9.902 18.166 ( -2.901 -6.569 8.499) 11.127 18.640 ( -0.759 2.260 1.472) 2.802 18.799 ( 1.187 -0.122 5.699) 5.823 18.970 ( -0.899 0.782 0.287) 1.225 19.031 ( 1.023 -1.250 0.761) 1.785 20.985 ( -1.659 3.923 -12.073) 12.802 21.261 ( 0.276 -0.514 -1.757) 1.851 21.308 ( -0.922 -2.544 -0.865) 2.841 21.413 ( -3.586 -2.226 -0.110) 4.222 ======================= Grid point 325 (156/170) ======================= q-point: ( 0.27 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( 10.070 12.767 -14.532) 21.808 2.200 ( 16.436 13.215 -8.850) 22.872 2.673 ( -8.276 0.147 6.763) 10.689 2.716 ( -6.601 -2.338 4.515) 8.332 2.816 ( 0.655 -6.003 -0.300) 6.046 2.972 ( -0.590 -2.819 0.447) 2.915 3.032 ( -3.747 -5.742 5.524) 8.805 3.142 ( 0.889 -3.804 1.635) 4.235 3.187 ( -2.855 -1.988 1.404) 3.752 3.239 ( -1.788 3.267 -2.445) 4.455 3.616 ( 4.591 -0.279 -4.621) 6.520 3.755 ( -3.094 -6.411 4.568) 8.458 4.036 ( 2.880 3.028 -9.474) 10.355 4.301 ( 1.406 8.773 -3.948) 9.723 4.355 ( -0.088 -1.159 -2.579) 2.829 4.399 ( 1.516 4.287 -1.574) 4.812 4.736 ( -2.955 3.120 2.101) 4.783 4.893 ( -5.137 -3.509 -10.043) 11.814 4.992 ( 1.523 2.840 2.669) 4.184 5.226 ( 2.447 8.329 -3.882) 9.509 5.331 ( 5.347 5.044 4.959) 8.867 5.676 ( -3.449 5.099 4.125) 7.411 6.736 ( -2.370 -2.197 2.243) 3.934 6.912 ( 3.054 -0.958 0.272) 3.212 7.239 ( -1.776 -1.519 -3.248) 4.002 7.386 ( -3.109 -0.700 -0.413) 3.214 7.677 ( 1.730 -1.928 -3.393) 4.269 7.857 ( -2.276 -9.399 -2.408) 9.966 7.972 ( -4.865 -6.104 -0.802) 7.846 8.140 ( -4.167 -10.920 -1.091) 11.738 8.265 ( -1.229 4.582 -2.923) 5.572 8.481 ( 8.630 9.430 -2.453) 13.016 8.748 ( -4.022 6.148 1.652) 7.530 8.903 ( 4.462 5.270 -3.587) 7.781 9.585 ( 0.372 0.151 3.417) 3.441 9.616 ( 0.812 2.147 2.306) 3.254 10.889 ( 0.481 0.339 -2.949) 3.007 11.184 ( -3.907 -5.714 0.169) 6.924 11.278 ( 1.174 5.066 2.266) 5.672 11.534 ( -0.670 3.970 -0.516) 4.059 11.613 ( -3.670 0.759 5.358) 6.538 11.767 ( -4.680 2.565 0.593) 5.370 12.100 ( -0.679 -1.207 4.727) 4.926 12.153 ( -1.120 -0.609 -0.444) 1.350 12.847 ( 9.887 4.403 -8.998) 14.075 13.493 ( 3.479 0.926 7.210) 8.058 13.598 ( 4.753 -1.418 0.613) 4.998 13.778 ( 5.718 -2.161 5.961) 8.537 17.657 ( 1.270 4.156 -2.419) 4.974 17.731 ( -0.845 2.378 -2.168) 3.327 18.003 ( 6.055 10.343 5.011) 12.991 18.206 ( -2.362 -1.599 6.820) 7.393 18.646 ( -0.615 2.945 1.251) 3.259 18.889 ( 1.091 0.515 7.197) 7.297 18.956 ( -1.151 2.926 -0.111) 3.146 19.050 ( -0.359 0.473 1.768) 1.865 20.847 ( 0.646 -2.409 -10.688) 10.976 21.197 ( -5.301 -8.608 -5.011) 11.284 21.281 ( 1.245 -1.913 -1.423) 2.690 21.376 ( -0.890 -1.732 0.136) 1.952 ======================= Grid point 326 (157/170) ======================= q-point: ( 0.36 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 13.812 4.737 -6.899) 16.150 2.376 ( 17.632 9.664 -8.426) 21.801 2.561 ( -9.640 -2.610 -0.105) 9.988 2.641 ( -8.357 4.539 6.702) 11.635 2.829 ( -1.349 -6.135 2.750) 6.858 2.946 ( -0.790 0.877 -0.405) 1.248 2.994 ( -3.111 -7.679 -0.469) 8.298 3.147 ( -3.139 -0.301 6.883) 7.571 3.176 ( -5.347 3.375 2.197) 6.694 3.230 ( -1.534 -2.123 -0.092) 2.621 3.683 ( 6.507 0.540 -1.712) 6.750 3.709 ( -5.777 -3.068 1.814) 6.788 3.978 ( -0.168 -0.967 -5.800) 5.882 4.201 ( -3.611 1.996 -10.249) 11.049 4.376 ( 8.946 -4.333 -3.287) 10.469 4.510 ( 9.648 3.939 1.213) 10.492 4.717 ( -1.976 3.315 -2.054) 4.372 4.799 ( 3.797 -0.723 1.048) 4.005 5.038 ( -1.264 -2.898 1.848) 3.662 5.258 ( 3.854 9.196 1.346) 10.062 5.385 ( -1.358 3.273 -0.518) 3.581 5.639 ( -5.526 7.433 1.766) 9.429 6.701 ( -4.474 -1.401 3.936) 6.122 6.943 ( 2.226 1.959 -4.008) 4.986 7.195 ( -1.356 -2.883 -0.393) 3.211 7.320 ( -3.607 -3.424 -1.642) 5.238 7.634 ( 0.322 -6.931 -6.106) 9.242 7.766 ( -6.365 -12.885 -0.603) 14.385 7.932 ( -1.408 -5.977 2.373) 6.583 8.055 ( -0.899 -12.008 -3.924) 12.664 8.310 ( 4.478 5.866 4.299) 8.541 8.581 ( 6.661 10.248 -1.428) 12.305 8.702 ( -4.479 6.018 1.379) 7.628 8.880 ( 0.211 5.642 -7.286) 9.218 9.624 ( -0.036 1.900 3.309) 3.816 9.657 ( 1.178 1.580 1.596) 2.536 10.879 ( 1.726 -1.759 -1.706) 2.997 11.092 ( -5.009 -6.892 -2.645) 8.922 11.345 ( 2.881 5.591 3.752) 7.323 11.526 ( 0.380 5.184 -1.133) 5.320 11.634 ( -0.358 5.328 3.002) 6.126 11.702 ( -4.732 5.141 1.613) 7.171 12.136 ( 0.021 0.829 -0.770) 1.131 12.142 ( -1.053 0.136 4.042) 4.179 12.935 ( 11.248 0.803 -4.552) 12.161 13.453 ( -7.743 -5.715 -0.474) 9.635 13.771 ( 8.125 6.138 4.770) 11.245 13.910 ( 3.271 1.005 4.097) 5.338 17.643 ( 0.687 2.251 -2.159) 3.194 17.701 ( -0.863 2.307 -1.326) 2.797 18.118 ( 3.274 12.400 2.574) 13.081 18.247 ( -1.723 9.216 5.449) 10.844 18.656 ( 1.808 2.156 -0.110) 2.816 18.916 ( -4.080 5.815 0.001) 7.103 18.986 ( 1.479 0.825 5.793) 6.035 19.066 ( -0.249 0.781 2.110) 2.264 20.782 ( 3.426 -9.646 -6.746) 12.260 21.040 ( -6.184 -13.915 -5.464) 16.178 21.299 ( 2.051 -1.788 -0.500) 2.767 21.368 ( -0.718 -2.126 0.152) 2.249 ======================= Grid point 327 (158/170) ======================= q-point: ( 0.45 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( 14.132 -2.151 -0.038) 14.294 2.368 ( -11.724 -4.429 -3.249) 12.947 2.544 ( 12.434 7.676 -5.960) 15.781 2.618 ( -6.020 8.685 7.008) 12.680 2.853 ( 2.113 -5.401 2.079) 6.161 2.933 ( -4.025 -3.835 -0.442) 5.577 2.976 ( 3.490 0.270 0.911) 3.616 3.079 ( -9.043 4.807 2.060) 10.446 3.158 ( -2.018 -2.114 2.007) 3.545 3.182 ( -0.935 -0.993 -2.088) 2.494 3.671 ( -2.985 -0.256 5.478) 6.244 3.715 ( 2.639 1.628 -7.100) 7.748 3.941 ( -0.105 -3.737 2.916) 4.742 4.034 ( -2.962 -3.446 -8.507) 9.645 4.509 ( 8.145 -0.897 0.619) 8.218 4.629 ( -4.769 3.205 -2.461) 6.250 4.715 ( 15.463 -1.195 -1.674) 15.600 4.901 ( -7.999 -1.062 4.765) 9.372 5.034 ( 8.175 -4.260 2.192) 9.475 5.244 ( -9.302 0.596 -2.937) 9.773 5.407 ( 6.756 8.508 2.318) 11.109 5.541 ( -6.785 7.544 -1.473) 10.253 6.732 ( 1.781 2.745 6.338) 7.133 6.866 ( -3.583 5.171 -7.261) 9.608 7.198 ( 0.682 -4.566 2.088) 5.067 7.250 ( -2.373 -4.947 -2.370) 5.977 7.603 ( 3.178 -10.611 -3.144) 11.514 7.662 ( -6.126 -12.434 0.394) 13.867 7.963 ( 0.615 -7.738 3.602) 8.558 8.012 ( -0.253 -9.514 -3.542) 10.155 8.467 ( 6.828 2.977 6.283) 9.744 8.621 ( -6.125 3.637 -1.746) 7.335 8.666 ( 4.950 10.060 0.837) 11.243 8.770 ( -3.284 7.978 -6.409) 10.748 9.659 ( 0.840 2.368 1.514) 2.933 9.676 ( -0.362 1.946 0.464) 2.033 10.910 ( 3.580 -3.947 -0.073) 5.329 10.987 ( -4.930 -5.786 -1.628) 7.774 11.439 ( 3.885 5.752 2.650) 7.429 11.507 ( -1.469 5.515 -1.547) 5.914 11.651 ( 0.974 7.922 -0.807) 8.022 11.661 ( -3.167 7.356 2.429) 8.369 12.137 ( 1.582 1.394 -1.388) 2.525 12.149 ( -2.145 1.152 2.256) 3.319 13.098 ( 12.026 -2.634 -0.012) 12.311 13.291 ( -10.772 -4.732 -1.589) 11.872 13.912 ( 4.445 5.762 2.425) 7.671 13.960 ( -0.539 3.993 0.844) 4.117 17.643 ( 1.378 1.161 -0.595) 1.898 17.669 ( -1.608 1.177 -0.718) 2.118 18.186 ( 3.958 14.825 0.188) 15.345 18.243 ( -4.273 15.880 2.439) 16.625 18.719 ( 5.993 2.904 0.148) 6.661 18.826 ( -6.421 5.550 -0.599) 8.508 19.056 ( 0.661 1.159 3.396) 3.649 19.079 ( -0.009 0.958 -0.007) 0.958 20.804 ( 5.245 -14.574 -1.876) 15.602 20.898 ( -5.941 -15.926 -2.514) 17.183 21.328 ( 1.846 -2.217 -0.036) 2.885 21.353 ( -1.273 -2.378 -0.031) 2.697 ======================= Grid point 333 (159/170) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( 2.359 2.922 -12.719) 13.262 2.202 ( -2.359 2.922 12.719) 13.262 2.444 ( 3.671 4.614 -15.279) 16.377 2.444 ( -3.671 4.614 15.279) 16.377 2.813 ( 1.453 -4.730 -4.999) 7.034 2.813 ( -1.453 -4.730 4.999) 7.034 2.953 ( 1.673 -3.614 -4.960) 6.361 2.953 ( -1.673 -3.614 4.960) 6.361 3.416 ( -1.282 -3.605 -2.447) 4.542 3.416 ( 1.282 -3.605 2.447) 4.542 3.636 ( -3.190 -4.080 -5.541) 7.585 3.636 ( 3.190 -4.080 5.541) 7.585 4.533 ( -5.029 2.939 -1.521) 6.020 4.533 ( 5.029 2.939 1.521) 6.020 4.729 ( 0.239 8.779 -4.534) 9.883 4.729 ( -0.239 8.779 4.534) 9.883 4.940 ( -6.650 11.973 -7.492) 15.611 4.940 ( 6.650 11.973 7.492) 15.611 5.158 ( -1.677 4.451 -0.554) 4.788 5.158 ( 1.677 4.451 0.554) 4.788 5.492 ( -2.048 1.408 -5.810) 6.319 5.492 ( 2.048 1.408 5.810) 6.319 6.604 ( 0.429 -4.912 -4.515) 6.686 6.604 ( -0.429 -4.912 4.515) 6.686 7.694 ( -6.081 6.356 -0.793) 8.832 7.694 ( 6.081 6.356 0.793) 8.832 7.733 ( -5.924 4.026 0.241) 7.166 7.733 ( 5.924 4.026 -0.241) 7.166 8.191 ( -3.925 -4.558 -2.323) 6.449 8.191 ( 3.925 -4.558 2.323) 6.449 8.303 ( 7.103 -0.424 -9.953) 12.235 8.303 ( -7.103 -0.424 9.953) 12.235 8.820 ( 1.782 0.514 -5.887) 6.172 8.820 ( -1.782 0.514 5.887) 6.172 9.528 ( 0.831 -1.038 -1.312) 1.868 9.528 ( -0.831 -1.038 1.312) 1.868 11.102 ( 0.747 7.743 -9.555) 12.321 11.102 ( -0.747 7.743 9.555) 12.321 11.510 ( -4.824 -0.987 -4.636) 6.763 11.510 ( 4.824 -0.987 4.636) 6.763 11.695 ( 5.591 -4.326 -4.794) 8.541 11.695 ( -5.591 -4.326 4.794) 8.541 12.088 ( 0.942 -5.833 -0.916) 5.979 12.088 ( -0.942 -5.833 0.916) 5.979 12.972 ( 1.278 7.615 -9.825) 12.496 12.972 ( -1.278 7.615 9.825) 12.496 13.365 ( -0.507 -6.329 -5.560) 8.440 13.365 ( 0.507 -6.329 5.560) 8.440 17.687 ( -0.838 1.371 -2.260) 2.773 17.687 ( 0.838 1.371 2.260) 2.773 17.921 ( -0.091 -2.098 -4.878) 5.310 17.921 ( 0.091 -2.098 4.878) 5.310 18.680 ( -0.708 -0.247 -1.489) 1.667 18.680 ( 0.708 -0.247 1.489) 1.667 18.943 ( 0.071 -2.045 -0.241) 2.060 18.943 ( -0.071 -2.045 0.241) 2.060 21.283 ( 0.395 1.395 -1.384) 2.004 21.283 ( -0.395 1.395 1.384) 2.004 21.445 ( -0.204 3.111 -5.747) 6.538 21.445 ( 0.204 3.111 5.747) 6.538 ======================= Grid point 335 (160/170) ======================= q-point: ( 0.09 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( 8.602 4.529 -7.428) 12.235 2.340 ( 3.938 10.114 -12.126) 16.274 2.375 ( 3.821 -0.200 12.826) 13.385 2.565 ( -1.293 1.418 12.831) 12.974 2.781 ( 0.135 -5.776 -2.383) 6.250 2.841 ( -2.638 -3.519 5.192) 6.804 2.917 ( -1.328 -2.783 -0.625) 3.146 2.995 ( 0.038 -2.969 3.429) 4.536 3.362 ( -1.854 -4.317 -2.603) 5.371 3.417 ( -2.559 -0.349 -3.442) 4.303 3.516 ( -2.491 -6.065 -2.765) 7.116 3.670 ( -2.688 -7.833 -1.047) 8.347 4.439 ( -4.252 7.581 0.116) 8.692 4.554 ( 0.424 11.495 -11.827) 16.499 4.663 ( 0.783 -1.088 -3.821) 4.050 4.712 ( -3.968 14.799 -3.423) 15.700 4.796 ( -3.040 6.608 0.427) 7.286 5.086 ( -2.974 2.830 -0.041) 4.106 5.103 ( 1.767 8.842 4.577) 10.112 5.168 ( 1.177 3.074 -3.586) 4.868 5.416 ( -1.383 4.468 -2.451) 5.280 5.594 ( 1.579 -0.179 6.198) 6.399 6.612 ( 4.794 -2.670 -2.060) 5.862 6.687 ( 4.320 -5.794 3.089) 7.860 7.531 ( -8.974 5.737 -3.655) 11.261 7.617 ( -7.690 5.003 -0.081) 9.175 7.743 ( 1.121 2.803 -3.559) 4.667 7.808 ( 3.178 1.163 -1.031) 3.537 8.051 ( -7.836 -5.603 -1.575) 9.761 8.197 ( -4.977 -8.242 0.690) 9.652 8.356 ( 7.167 2.412 -2.459) 7.952 8.389 ( 6.067 4.009 2.445) 7.672 8.808 ( 4.127 0.311 -3.606) 5.489 8.857 ( -2.600 0.657 6.237) 6.789 9.533 ( 0.697 -0.343 0.252) 0.817 9.550 ( 1.621 -0.180 1.298) 2.085 11.027 ( 1.536 6.778 -7.275) 10.061 11.202 ( -1.857 6.714 10.766) 12.823 11.355 ( -5.161 -2.162 -6.483) 8.564 11.591 ( -1.758 -4.767 2.071) 5.487 11.637 ( -3.821 1.001 4.637) 6.092 11.772 ( 3.600 -1.905 1.102) 4.219 12.063 ( -2.823 -4.561 1.594) 5.596 12.098 ( -0.113 -5.924 0.416) 5.940 12.930 ( 6.995 7.887 -10.385) 14.798 13.120 ( 6.459 6.356 9.331) 13.007 13.335 ( 3.942 -5.817 -3.541) 7.869 13.456 ( 2.682 -6.431 5.183) 8.684 17.687 ( 2.332 2.644 -0.150) 3.529 17.773 ( 5.720 1.403 2.853) 6.544 17.864 ( -0.722 0.856 -2.970) 3.174 17.988 ( 1.259 -4.107 4.813) 6.451 18.666 ( -0.354 0.838 0.688) 1.140 18.718 ( 0.651 -1.087 3.354) 3.585 18.950 ( 0.874 -1.732 0.244) 1.956 18.958 ( 1.664 -2.101 0.150) 2.684 21.244 ( -3.517 3.793 -3.539) 6.267 21.281 ( -0.504 0.506 -0.809) 1.079 21.346 ( -2.394 2.211 -5.429) 6.332 21.454 ( -4.509 0.219 1.812) 4.864 ======================= Grid point 336 (161/170) ======================= q-point: ( 0.18 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( 4.903 9.220 -12.403) 16.214 2.316 ( 7.979 10.229 -5.357) 14.036 2.574 ( 3.993 -0.873 8.930) 9.821 2.675 ( -1.251 0.814 9.967) 10.078 2.765 ( -1.430 -6.549 -1.003) 6.778 2.845 ( -3.381 -1.391 6.607) 7.551 2.911 ( -0.434 -5.136 2.746) 5.841 3.033 ( 1.015 -0.982 3.031) 3.344 3.263 ( -7.356 -5.076 -4.037) 9.807 3.325 ( -0.234 1.434 -4.465) 4.696 3.502 ( -0.469 -8.450 1.188) 8.546 3.586 ( -2.242 -9.237 -1.370) 9.604 4.361 ( -0.435 13.798 -17.694) 22.442 4.420 ( -0.948 8.905 2.020) 9.180 4.558 ( -6.131 7.723 -6.124) 11.607 4.636 ( -2.028 8.206 -3.284) 9.069 4.806 ( -1.595 3.942 4.256) 6.017 4.991 ( -4.806 -3.546 -7.552) 9.628 5.084 ( -1.360 6.465 -0.485) 6.624 5.239 ( 5.335 1.188 2.091) 5.852 5.390 ( 0.395 7.478 -0.939) 7.548 5.670 ( -0.285 -1.319 5.783) 5.939 6.676 ( 3.097 -1.884 0.481) 3.657 6.777 ( 4.517 -5.724 0.262) 7.296 7.362 ( -6.295 3.547 -4.526) 8.526 7.498 ( -7.303 3.697 0.148) 8.187 7.690 ( -1.865 -1.204 -3.761) 4.367 7.797 ( -0.551 -2.241 -3.813) 4.456 7.921 ( -8.416 -8.725 0.587) 12.137 8.089 ( -7.079 -8.955 -1.945) 11.580 8.423 ( 1.922 7.395 -0.472) 7.656 8.517 ( 11.044 7.411 -2.905) 13.613 8.850 ( -0.154 1.453 1.264) 1.932 8.890 ( 3.361 0.165 1.807) 3.820 9.555 ( 1.376 1.025 0.990) 1.981 9.601 ( 1.995 0.881 2.291) 3.163 10.975 ( 0.350 4.207 -5.676) 7.074 11.183 ( -6.917 -2.331 -0.213) 7.302 11.312 ( 1.372 3.614 2.975) 4.878 11.564 ( -4.688 -4.451 5.530) 8.507 11.640 ( -0.825 5.036 1.493) 5.317 11.825 ( 0.171 0.945 2.575) 2.748 12.039 ( -2.172 -2.960 2.480) 4.430 12.109 ( 0.251 -4.527 1.148) 4.677 12.939 ( 8.238 7.471 -10.732) 15.455 13.349 ( 7.516 2.366 6.680) 10.330 13.412 ( 8.917 -4.462 0.703) 9.995 13.569 ( 4.796 -3.899 6.100) 8.684 17.722 ( 1.851 2.789 -1.305) 3.593 17.805 ( -0.957 0.831 -1.879) 2.266 17.959 ( 10.537 5.360 4.169) 12.535 18.080 ( 3.084 -2.157 6.249) 7.295 18.681 ( -0.216 1.913 2.499) 3.155 18.778 ( 1.098 -1.783 5.449) 5.838 18.970 ( 0.922 -0.597 0.665) 1.283 18.998 ( 2.875 -1.960 0.433) 3.507 21.064 ( -8.324 4.101 -9.468) 13.257 21.238 ( -5.403 -2.408 -3.380) 6.813 21.278 ( -0.869 0.220 -2.021) 2.210 21.377 ( -4.090 -1.805 -0.135) 4.472 ======================= Grid point 337 (162/170) ======================= q-point: ( 0.27 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( 2.456 12.065 -11.320) 16.725 2.400 ( 8.831 7.002 -4.216) 12.033 2.671 ( -5.567 -1.305 -0.344) 5.728 2.706 ( -1.442 0.264 7.574) 7.715 2.721 ( -0.264 -1.476 1.453) 2.088 2.889 ( 0.701 -3.009 0.994) 3.246 2.950 ( -1.654 -4.570 3.876) 6.216 3.082 ( -3.946 -2.142 2.509) 5.144 3.138 ( 0.231 -2.692 3.642) 4.535 3.302 ( -0.320 2.960 -0.085) 2.978 3.511 ( 3.126 -10.193 0.304) 10.666 3.607 ( -0.793 -8.147 4.607) 9.393 4.181 ( 1.065 10.357 -16.029) 19.113 4.362 ( -5.159 4.043 -5.683) 8.675 4.432 ( -0.909 4.063 -7.622) 8.685 4.579 ( -0.843 12.221 0.127) 12.251 4.793 ( -3.137 2.155 0.299) 3.818 4.844 ( -2.922 0.914 -3.327) 4.521 5.047 ( -3.189 0.341 -1.537) 3.557 5.329 ( 1.934 0.077 2.565) 3.214 5.419 ( 3.115 6.069 0.819) 6.871 5.716 ( -1.965 -1.043 5.609) 6.034 6.693 ( -1.919 -1.872 1.642) 3.144 6.855 ( 6.933 -4.519 -1.749) 8.458 7.237 ( -4.154 1.704 -3.305) 5.575 7.391 ( -6.459 1.043 -0.007) 6.543 7.611 ( -1.819 -5.576 -5.990) 8.383 7.685 ( -9.175 -8.617 -1.688) 12.700 7.846 ( -0.345 -4.287 -0.659) 4.351 7.961 ( -5.089 -6.576 -2.848) 8.790 8.419 ( -0.697 9.265 -0.345) 9.298 8.655 ( 10.453 7.761 -3.996) 13.618 8.831 ( -4.904 2.256 3.637) 6.509 8.965 ( 5.414 1.103 -3.299) 6.435 9.599 ( 2.037 1.342 1.970) 3.135 9.651 ( 0.903 1.154 2.241) 2.678 10.910 ( -1.183 1.780 -4.206) 4.718 11.080 ( -4.061 -4.645 -2.953) 6.841 11.367 ( 0.543 4.287 4.779) 6.444 11.582 ( -0.470 -1.515 4.714) 4.974 11.659 ( 0.436 6.389 2.675) 6.940 11.829 ( -1.735 3.574 0.962) 4.087 12.069 ( 0.350 -2.061 5.076) 5.490 12.126 ( 0.495 -2.298 1.009) 2.559 12.946 ( 7.330 6.123 -9.810) 13.692 13.400 ( -0.878 -7.760 -1.505) 7.953 13.652 ( 11.118 4.157 7.432) 14.005 13.753 ( 8.248 -0.622 6.953) 10.806 17.707 ( -0.235 1.617 -2.878) 3.310 17.768 ( -1.357 0.782 -1.779) 2.370 18.184 ( 8.906 8.222 5.044) 13.129 18.235 ( 9.184 4.466 6.375) 12.039 18.703 ( -1.104 2.854 2.776) 4.131 18.874 ( 1.900 -2.004 7.282) 7.788 18.993 ( 0.766 1.157 1.010) 1.716 19.050 ( 2.314 -0.684 1.115) 2.658 20.815 ( -8.489 -0.686 -10.329) 13.388 21.029 ( -11.083 -8.212 -7.481) 15.692 21.266 ( 0.674 0.012 -0.952) 1.167 21.341 ( -1.487 -1.951 0.381) 2.482 ======================= Grid point 338 (163/170) ======================= q-point: ( 0.36 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( 3.958 7.688 -6.214) 10.649 2.495 ( 3.622 3.325 -5.874) 7.660 2.537 ( -4.706 -2.738 1.489) 5.645 2.714 ( 3.259 3.081 -1.740) 4.810 2.790 ( -2.121 2.159 6.767) 7.413 2.849 ( -1.326 -4.401 -2.807) 5.386 2.954 ( 1.827 -0.585 -0.813) 2.084 3.094 ( -3.057 -3.636 6.887) 8.366 3.191 ( -0.296 0.366 2.967) 3.005 3.297 ( -4.119 4.929 3.434) 7.284 3.613 ( -1.168 -6.339 2.623) 6.959 3.628 ( 2.725 -7.240 8.293) 11.341 4.016 ( -1.438 5.629 -14.081) 15.233 4.194 ( -3.873 -2.058 -14.127) 14.792 4.329 ( 3.669 -0.396 -7.179) 8.072 4.624 ( 3.566 7.997 2.789) 9.189 4.783 ( -2.552 3.045 -1.458) 4.232 4.824 ( 4.116 2.682 3.066) 5.791 4.944 ( -7.450 -6.482 -0.372) 9.882 5.355 ( -3.614 -1.886 2.343) 4.702 5.472 ( 2.956 7.090 1.167) 7.770 5.717 ( -4.352 0.724 3.036) 5.355 6.701 ( 1.379 2.101 3.031) 3.937 6.950 ( 8.217 -1.312 -3.556) 9.049 7.156 ( -3.837 -0.645 -0.268) 3.900 7.280 ( -7.407 -0.334 -1.168) 7.506 7.486 ( -3.399 -8.523 -6.173) 11.059 7.562 ( -4.982 -8.509 -1.186) 9.931 7.838 ( -1.342 -3.366 0.398) 3.646 7.887 ( -0.556 -6.098 -2.270) 6.530 8.425 ( 1.081 6.198 1.964) 6.591 8.727 ( 2.780 1.255 -5.625) 6.399 8.798 ( -1.770 7.179 3.595) 8.222 8.970 ( 1.480 3.602 -5.288) 6.567 9.654 ( 1.913 1.383 1.924) 3.045 9.684 ( 0.486 0.998 1.992) 2.280 10.861 ( -0.244 -0.124 -2.338) 2.354 10.983 ( -4.010 -4.591 -2.884) 6.744 11.448 ( 2.831 5.287 5.113) 7.881 11.626 ( 1.883 3.482 -0.211) 3.964 11.708 ( 0.161 3.992 4.946) 6.358 11.808 ( -1.489 5.393 0.308) 5.603 12.135 ( 0.506 -0.822 4.514) 4.616 12.148 ( 0.924 0.181 0.881) 1.289 12.969 ( 7.416 2.919 -6.285) 10.150 13.325 ( -5.229 -7.478 -2.659) 9.505 13.879 ( 7.917 4.896 5.700) 10.916 13.939 ( 6.049 1.710 5.003) 8.034 17.670 ( -0.288 1.052 -2.344) 2.585 17.722 ( -2.043 -0.112 -1.617) 2.608 18.342 ( 6.893 11.494 2.909) 13.715 18.478 ( 10.007 12.452 6.298) 17.171 18.701 ( -1.155 2.681 0.849) 3.040 18.982 ( 2.051 -0.645 3.907) 4.460 19.010 ( -1.126 3.288 3.370) 4.841 19.089 ( 0.568 1.290 1.801) 2.287 20.600 ( -4.850 -8.531 -8.237) 12.812 20.771 ( -10.343 -13.494 -7.061) 18.410 21.273 ( 1.042 -0.878 -0.355) 1.408 21.325 ( -1.175 -2.284 0.231) 2.579 ======================= Grid point 339 (164/170) ======================= q-point: ( 0.45 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 7.189 0.848 0.388) 7.249 2.300 ( -10.384 -3.016 -4.676) 11.781 2.657 ( 9.212 2.005 -0.029) 9.428 2.772 ( -2.721 -0.714 2.236) 3.593 2.778 ( 2.094 4.835 -1.300) 5.427 2.826 ( -1.700 -1.094 0.711) 2.143 2.998 ( 4.118 -0.292 0.696) 4.187 3.076 ( -3.952 -3.345 0.158) 5.180 3.214 ( 0.936 4.441 -0.582) 4.576 3.237 ( -6.662 6.899 4.023) 10.400 3.641 ( -1.309 -2.285 9.423) 9.784 3.739 ( 0.221 1.251 -1.591) 2.036 3.871 ( 0.732 -3.111 -2.974) 4.366 3.983 ( -3.112 -2.232 -11.617) 12.232 4.415 ( 12.759 -7.829 -2.710) 15.213 4.620 ( -11.485 -6.193 -1.931) 13.191 4.748 ( 5.604 4.025 1.568) 7.075 4.846 ( -5.180 -1.147 0.042) 5.306 4.997 ( 10.082 0.079 5.393) 11.434 5.225 ( -11.660 -3.823 -2.461) 12.515 5.561 ( 4.677 7.240 2.770) 9.054 5.656 ( -4.397 4.324 -1.009) 6.249 6.821 ( 7.150 6.537 5.495) 11.138 6.983 ( -0.665 6.772 -6.708) 9.556 7.107 ( -0.544 -4.267 0.469) 4.327 7.158 ( -5.691 -3.515 0.255) 6.694 7.423 ( 1.630 -8.690 -2.042) 9.074 7.474 ( -4.603 -8.146 -0.828) 9.393 7.835 ( -0.064 -5.276 1.619) 5.519 7.861 ( -0.218 -6.157 -2.167) 6.531 8.503 ( 3.951 1.101 4.603) 6.165 8.632 ( -4.741 -1.889 -5.108) 7.221 8.851 ( 2.765 8.752 1.905) 9.373 8.916 ( -1.397 6.711 -3.799) 7.837 9.695 ( 1.264 1.446 0.683) 2.039 9.705 ( -0.185 1.129 0.998) 1.518 10.855 ( 1.549 -1.932 -0.445) 2.516 10.900 ( -3.261 -3.521 -1.490) 5.025 11.553 ( 3.024 5.964 4.339) 7.971 11.621 ( -0.266 5.973 -3.040) 6.707 11.760 ( -0.167 3.675 3.988) 5.426 11.789 ( -0.374 5.374 -1.296) 5.540 12.167 ( 1.400 1.555 -0.458) 2.142 12.173 ( -0.920 1.399 2.306) 2.850 13.053 ( 8.299 -1.757 -1.000) 8.542 13.192 ( -7.757 -5.481 -2.236) 9.758 14.015 ( 3.377 4.766 2.503) 6.355 14.036 ( 1.553 3.664 1.391) 4.215 17.655 ( 0.758 0.373 -0.823) 1.180 17.676 ( -1.826 -0.199 -0.723) 1.974 18.474 ( 7.289 14.162 0.534) 15.936 18.571 ( -5.338 16.106 2.709) 17.183 18.780 ( 10.015 4.102 1.523) 10.929 18.938 ( -6.048 6.049 -1.905) 8.763 19.077 ( 0.264 1.098 4.865) 4.994 19.105 ( 0.198 1.806 -0.366) 1.853 20.507 ( 1.411 -15.711 -3.155) 16.087 20.574 ( -6.972 -17.174 -2.912) 18.762 21.289 ( 1.174 -1.725 -0.026) 2.087 21.308 ( -1.170 -2.238 0.027) 2.525 ======================= Grid point 345 (165/170) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 0.611 -4.063 -4.966) 6.445 2.152 ( -0.611 -4.063 4.966) 6.445 2.554 ( 0.948 5.363 -5.995) 8.099 2.554 ( -0.948 5.363 5.995) 8.099 2.804 ( 2.053 1.241 -5.359) 5.871 2.804 ( -2.053 1.241 5.359) 5.871 2.886 ( 0.480 -3.119 -3.848) 4.977 2.886 ( -0.480 -3.119 3.848) 4.977 3.349 ( -1.189 -2.405 -2.097) 3.405 3.349 ( 1.189 -2.405 2.097) 3.405 3.579 ( -0.963 -1.630 -2.496) 3.133 3.579 ( 0.963 -1.630 2.496) 3.133 4.557 ( -1.823 0.491 -0.776) 2.041 4.557 ( 1.823 0.491 0.776) 2.041 4.806 ( -0.415 1.283 -2.940) 3.235 4.806 ( 0.415 1.283 2.940) 3.235 5.130 ( -2.466 4.673 -1.816) 5.587 5.130 ( 2.466 4.673 1.816) 5.587 5.313 ( 3.018 8.749 -3.117) 9.765 5.313 ( -3.018 8.749 3.117) 9.765 5.493 ( -1.506 -1.162 -2.506) 3.146 5.493 ( 1.506 -1.162 2.506) 3.146 6.519 ( 0.440 -3.090 -1.973) 3.692 6.519 ( -0.440 -3.090 1.973) 3.692 7.767 ( -1.592 1.445 -0.293) 2.170 7.767 ( 1.592 1.445 0.293) 2.170 7.831 ( -2.058 5.233 -0.700) 5.667 7.831 ( 2.058 5.233 0.700) 5.667 8.081 ( -1.965 -5.513 -0.818) 5.910 8.081 ( 1.965 -5.513 0.818) 5.910 8.298 ( 3.076 -0.156 -4.176) 5.189 8.298 ( -3.076 -0.156 4.176) 5.189 8.814 ( 0.990 -0.440 -3.131) 3.313 8.814 ( -0.990 -0.440 3.131) 3.313 9.520 ( 0.154 -0.019 -0.339) 0.373 9.520 ( -0.154 -0.019 0.339) 0.373 11.253 ( 1.339 7.094 -8.755) 11.347 11.253 ( -1.339 7.094 8.755) 11.347 11.442 ( -0.147 -5.240 -7.619) 9.248 11.442 ( 0.147 -5.240 7.619) 9.248 11.664 ( 3.201 0.213 -1.521) 3.550 11.664 ( -3.201 0.213 1.521) 3.550 11.998 ( 0.836 -2.960 -0.711) 3.157 11.998 ( -0.836 -2.960 0.711) 3.157 13.104 ( 1.268 6.059 -7.682) 9.866 13.104 ( -1.268 6.059 7.682) 9.866 13.249 ( 0.651 -5.648 -5.755) 8.090 13.249 ( -0.651 -5.648 5.755) 8.090 17.701 ( -0.335 0.258 -1.083) 1.163 17.701 ( 0.335 0.258 1.083) 1.163 17.903 ( -0.081 -0.225 -1.209) 1.232 17.903 ( 0.081 -0.225 1.209) 1.232 18.673 ( -0.157 -0.297 -0.586) 0.676 18.673 ( 0.157 -0.297 0.586) 0.676 18.915 ( -0.097 -0.756 -0.057) 0.764 18.915 ( 0.097 -0.756 0.057) 0.764 21.300 ( 0.215 0.426 -0.344) 0.588 21.300 ( -0.215 0.426 0.344) 0.588 21.488 ( -0.016 1.200 -2.105) 2.423 21.488 ( 0.016 1.200 2.105) 2.423 ======================= Grid point 347 (166/170) ======================= q-point: ( 0.09 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( 5.005 -0.235 1.415) 5.207 2.259 ( 3.073 -8.120 9.253) 12.688 2.518 ( 1.547 8.546 -2.987) 9.184 2.624 ( 1.916 -0.475 3.983) 4.446 2.789 ( 1.361 5.862 -2.168) 6.396 2.830 ( -1.125 1.780 0.913) 2.295 2.858 ( -1.173 -2.752 2.149) 3.683 2.941 ( 1.624 -5.098 3.975) 6.665 3.302 ( -2.278 0.521 -1.806) 2.953 3.377 ( -0.716 -5.360 1.478) 5.606 3.465 ( -4.856 1.626 -7.098) 8.752 3.533 ( -5.038 -5.518 -3.618) 8.302 4.536 ( 0.168 3.909 -1.246) 4.106 4.602 ( 2.812 -2.924 -0.516) 4.089 4.743 ( -0.773 6.275 -6.196) 8.852 4.822 ( -0.275 -1.817 0.025) 1.838 5.012 ( -6.530 11.778 -4.249) 14.121 5.119 ( -3.011 0.177 -1.361) 3.309 5.254 ( -4.749 5.235 -0.607) 7.094 5.259 ( -2.447 3.605 -5.842) 7.288 5.490 ( 0.782 3.564 1.064) 3.801 5.563 ( 1.615 -3.213 3.341) 4.909 6.565 ( 5.422 -1.342 0.243) 5.590 6.588 ( 4.734 -3.807 2.198) 6.461 7.642 ( -8.968 5.184 -4.342) 11.232 7.695 ( -6.916 1.151 -2.382) 7.405 7.778 ( -4.927 3.258 -0.432) 5.922 7.847 ( -0.297 1.232 -0.692) 1.444 7.940 ( -11.001 -3.727 -0.638) 11.633 8.021 ( -6.661 -8.713 0.506) 10.979 8.411 ( 11.690 2.645 -1.594) 12.091 8.436 ( 12.429 0.473 -0.158) 12.439 8.813 ( 1.824 0.828 -0.849) 2.175 8.841 ( -1.322 -1.735 4.288) 4.811 9.539 ( 1.747 0.664 0.877) 2.065 9.548 ( 2.248 -0.219 1.252) 2.582 11.165 ( 0.292 7.243 -9.335) 11.819 11.286 ( -2.019 -5.160 -9.275) 10.804 11.334 ( -5.226 7.067 10.101) 13.389 11.468 ( -6.074 -6.942 7.974) 12.193 11.698 ( 3.205 3.810 1.516) 5.205 11.750 ( 5.300 -1.301 1.550) 5.673 11.991 ( -1.692 -2.389 2.051) 3.575 11.999 ( -0.823 -3.538 1.319) 3.864 13.077 ( 5.945 7.527 -8.077) 12.540 13.205 ( 5.841 -3.628 -0.480) 6.893 13.245 ( 3.873 2.431 3.407) 5.702 13.340 ( 3.578 -5.633 6.133) 9.064 17.730 ( 2.695 2.012 1.444) 3.660 17.766 ( 3.325 -1.594 3.105) 4.821 17.900 ( 2.852 2.272 -0.902) 3.756 17.937 ( 3.542 -1.807 0.720) 4.040 18.679 ( 0.262 0.621 1.514) 1.657 18.695 ( 0.379 -1.108 2.526) 2.784 18.925 ( 1.265 -0.596 0.255) 1.422 18.929 ( 1.395 -0.948 0.311) 1.715 21.282 ( -2.468 0.789 -0.677) 2.678 21.288 ( -1.202 0.118 -0.823) 1.462 21.401 ( -5.214 2.982 -4.956) 7.787 21.444 ( -5.736 -1.386 -1.388) 6.062 ======================= Grid point 348 (167/170) ======================= q-point: ( 0.18 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( 5.313 3.110 2.161) 6.525 2.393 ( 2.272 -3.967 4.876) 6.684 2.562 ( 4.028 3.997 3.691) 6.770 2.683 ( 0.926 -5.409 2.074) 5.866 2.760 ( -2.259 4.645 -0.311) 5.175 2.800 ( -2.998 -1.480 -0.312) 3.358 2.899 ( 1.332 5.091 3.845) 6.517 3.019 ( 1.836 -3.583 4.391) 5.957 3.209 ( -5.418 1.731 -4.553) 7.286 3.324 ( -1.044 -6.874 -5.205) 8.685 3.371 ( -2.527 0.218 -0.177) 2.543 3.435 ( -1.547 -5.493 0.189) 5.710 4.481 ( 0.305 4.762 -12.117) 13.023 4.568 ( -0.558 -3.383 -10.132) 10.696 4.695 ( -0.936 10.239 -0.454) 10.291 4.801 ( -3.329 -0.202 1.805) 3.793 4.885 ( -4.188 11.973 -2.455) 12.920 5.033 ( -4.312 4.614 -2.595) 6.828 5.136 ( -8.129 -2.312 -2.502) 8.814 5.199 ( -0.062 -4.416 -0.208) 4.421 5.510 ( 0.634 5.852 1.190) 6.006 5.613 ( 0.244 -4.488 3.611) 5.765 6.646 ( 3.600 -0.489 0.242) 3.641 6.677 ( 5.111 -3.885 -0.320) 6.428 7.453 ( -7.859 5.680 -4.289) 10.603 7.542 ( -8.594 -1.404 -2.084) 8.954 7.655 ( -6.844 0.752 -3.727) 7.829 7.744 ( -11.561 -6.890 -1.667) 13.561 7.834 ( -0.253 3.246 -1.045) 3.419 7.936 ( -4.528 -6.844 0.068) 8.207 8.562 ( 6.836 6.196 -0.515) 9.241 8.613 ( 11.351 1.657 -2.423) 11.724 8.854 ( 0.960 -0.468 1.524) 1.861 8.863 ( 1.938 -1.804 2.042) 3.343 9.584 ( 2.168 1.624 1.236) 2.977 9.606 ( 2.404 -0.529 1.852) 3.081 11.059 ( -1.938 4.273 -7.250) 8.636 11.130 ( -4.845 -3.172 -6.101) 8.411 11.387 ( -1.241 4.255 6.547) 7.907 11.474 ( -3.408 -4.837 7.198) 9.318 11.754 ( 1.991 6.194 1.300) 6.634 11.833 ( 2.225 -1.215 2.535) 3.585 11.992 ( -1.071 -1.235 2.878) 3.309 12.020 ( 0.497 -3.975 2.715) 4.839 13.089 ( 6.427 8.278 -8.535) 13.516 13.247 ( 5.014 -8.108 -5.197) 10.858 13.448 ( 10.049 3.379 8.874) 13.825 13.506 ( 7.970 -2.925 7.735) 11.485 17.763 ( 0.253 1.904 -0.802) 2.081 17.797 ( -0.878 -1.499 -0.435) 1.790 18.041 ( 12.192 3.043 3.882) 13.152 18.069 ( 9.846 -0.163 4.292) 10.742 18.712 ( 0.384 1.385 3.215) 3.522 18.741 ( 0.799 -1.854 4.325) 4.773 18.959 ( 2.171 -0.242 0.815) 2.331 18.967 ( 2.730 -1.123 0.781) 3.053 21.134 ( -11.305 3.162 -7.156) 13.747 21.188 ( -9.955 -2.693 -5.431) 11.655 21.301 ( -1.533 1.848 -1.464) 2.812 21.340 ( -3.319 -2.079 -0.708) 3.980 ======================= Grid point 349 (168/170) ======================= q-point: ( 0.27 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( -1.359 8.629 -3.526) 9.420 2.453 ( -0.375 -3.492 2.622) 4.383 2.624 ( 1.178 2.363 -5.320) 5.939 2.697 ( 0.931 -1.860 1.360) 2.486 2.746 ( -0.813 1.431 2.319) 2.844 2.828 ( 2.016 -7.028 6.842) 10.014 2.946 ( 0.285 6.517 1.899) 6.794 3.040 ( -5.420 -3.367 1.235) 6.499 3.138 ( 2.858 4.533 2.606) 5.959 3.299 ( 2.602 -10.748 -0.612) 11.076 3.365 ( 0.345 3.779 2.021) 4.299 3.463 ( 0.309 -6.580 3.530) 7.473 4.309 ( 0.506 4.273 -17.980) 18.488 4.385 ( -3.200 -3.364 -15.914) 16.577 4.624 ( -7.495 15.696 -3.076) 17.664 4.772 ( -3.460 5.155 2.686) 6.764 4.814 ( -2.044 0.152 0.426) 2.094 4.943 ( -11.366 -8.101 -4.134) 14.557 4.976 ( -1.992 10.403 1.232) 10.663 5.222 ( -0.929 -10.869 3.336) 11.407 5.547 ( 1.423 6.710 2.545) 7.316 5.657 ( -0.223 -4.634 4.219) 6.270 6.692 ( 3.284 2.133 0.057) 3.916 6.763 ( 7.311 -4.773 -0.901) 8.778 7.306 ( -6.034 5.190 -3.161) 8.564 7.395 ( -7.743 -2.210 -0.807) 8.092 7.510 ( -4.669 -2.545 -6.074) 8.072 7.548 ( -8.756 -5.236 -2.938) 10.617 7.824 ( -0.507 1.106 -0.207) 1.234 7.869 ( -3.723 -3.453 -0.672) 5.122 8.591 ( -0.835 8.399 -1.218) 8.528 8.712 ( 3.742 -3.014 -3.456) 5.919 8.877 ( 1.723 4.054 1.839) 4.773 8.950 ( 6.306 -2.622 -1.613) 7.017 9.631 ( 1.855 1.702 1.615) 2.991 9.655 ( 1.253 -0.658 1.807) 2.296 10.953 ( -2.697 2.613 -4.896) 6.170 11.008 ( -3.568 -3.207 -4.442) 6.538 11.447 ( 0.618 4.189 6.007) 7.349 11.525 ( 0.218 -3.865 6.719) 7.754 11.796 ( 1.726 6.887 0.823) 7.147 11.874 ( 0.364 -0.192 1.066) 1.142 12.035 ( 1.269 -0.564 4.718) 4.918 12.069 ( 1.610 -3.299 3.093) 4.800 13.080 ( 4.252 7.926 -8.198) 12.170 13.240 ( 1.355 -8.715 -5.191) 10.234 13.716 ( 10.938 2.342 8.240) 13.894 13.743 ( 10.046 -0.725 7.884) 12.791 17.734 ( -1.106 1.408 -2.373) 2.972 17.760 ( -1.784 -1.211 -1.885) 2.864 18.305 ( 12.485 4.105 5.040) 14.076 18.320 ( 15.286 2.647 5.444) 16.441 18.755 ( -0.200 2.888 4.196) 5.098 18.818 ( 1.789 -3.522 6.067) 7.240 19.010 ( 2.576 0.834 1.507) 3.099 19.029 ( 3.391 -1.216 1.423) 3.874 20.828 ( -14.476 2.119 -9.767) 17.591 20.898 ( -15.001 -5.344 -8.874) 18.230 21.277 ( -0.634 1.092 -0.416) 1.329 21.305 ( -1.513 -1.756 0.128) 2.322 ======================= Grid point 350 (169/170) ======================= q-point: ( 0.36 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -3.660 8.764 -3.484) 10.117 2.400 ( -7.873 -8.714 -1.709) 11.867 2.595 ( 4.224 5.726 -3.182) 7.795 2.701 ( 2.381 -5.510 -2.900) 6.666 2.801 ( 3.403 4.988 0.126) 6.039 2.890 ( 1.880 -2.686 -0.349) 3.297 2.953 ( -0.696 3.999 2.415) 4.723 3.026 ( -3.279 -3.481 5.158) 7.033 3.249 ( 3.987 6.518 6.020) 9.728 3.376 ( -2.532 1.928 1.777) 3.645 3.445 ( 8.258 -8.242 9.806) 15.241 3.495 ( -1.521 -6.028 5.770) 8.482 4.114 ( 0.087 2.933 -18.756) 18.984 4.155 ( -2.313 -2.009 -16.780) 17.058 4.423 ( -9.600 11.322 -4.592) 15.538 4.675 ( -13.771 -11.615 -3.066) 18.275 4.791 ( -0.584 4.084 2.149) 4.652 4.834 ( 1.334 -0.075 1.840) 2.274 4.976 ( -0.844 9.842 2.906) 10.297 5.206 ( -5.453 -12.140 2.288) 13.504 5.606 ( 2.016 6.135 2.975) 7.110 5.693 ( -0.430 -2.936 2.927) 4.168 6.785 ( 7.875 6.018 1.320) 9.999 6.893 ( 9.862 -4.647 -0.628) 10.920 7.187 ( -6.227 3.992 -0.497) 7.413 7.279 ( -7.188 -2.851 0.716) 7.766 7.362 ( -4.487 -1.359 -6.259) 7.820 7.426 ( -3.964 -5.775 -3.011) 7.624 7.801 ( -2.039 -0.736 -0.832) 2.322 7.812 ( -1.638 -2.044 -1.236) 2.896 8.547 ( -2.063 6.595 -1.152) 7.006 8.667 ( -2.980 -5.618 -3.530) 7.273 8.936 ( 3.530 5.855 -0.132) 6.839 9.001 ( 3.130 -0.774 -2.594) 4.139 9.678 ( 1.735 1.053 1.701) 2.648 9.691 ( 0.919 -0.204 1.801) 2.032 10.874 ( -1.816 1.432 -2.891) 3.702 10.914 ( -2.994 -2.839 -3.088) 5.153 11.545 ( 3.030 4.730 6.036) 8.245 11.620 ( 2.699 -2.882 5.406) 6.695 11.816 ( 0.231 5.676 -0.220) 5.685 11.872 ( -0.561 0.466 -0.703) 1.013 12.121 ( 2.327 -0.088 4.764) 5.302 12.137 ( 2.298 -1.199 3.320) 4.212 13.051 ( 2.677 5.734 -6.294) 8.926 13.180 ( -1.755 -7.551 -4.754) 9.094 13.947 ( 7.904 2.185 5.965) 10.141 13.963 ( 7.485 0.462 5.692) 9.414 17.689 ( -1.063 1.009 -2.164) 2.614 17.709 ( -1.847 -0.989 -1.864) 2.804 18.532 ( 10.251 7.688 2.607) 13.076 18.611 ( 13.748 0.149 3.264) 14.131 18.799 ( -0.218 7.991 5.480) 9.692 18.930 ( 3.088 -4.844 6.660) 8.795 19.067 ( 2.201 2.482 1.680) 3.718 19.098 ( 2.608 -0.598 1.944) 3.307 20.497 ( -12.898 -1.464 -9.346) 15.996 20.560 ( -14.449 -7.906 -8.698) 18.626 21.268 ( -0.233 0.367 -0.077) 0.441 21.287 ( -1.074 -1.571 0.169) 1.911 ======================= Grid point 351 (170/170) ======================= q-point: ( 0.45 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 2.84e-04 2.84e-04 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -0.141 3.213 -0.526) 3.259 2.237 ( -6.651 -3.723 -3.251) 8.286 2.663 ( 4.601 1.001 0.268) 4.716 2.706 ( 0.514 -3.432 -1.475) 3.771 2.862 ( 5.536 4.358 -2.584) 7.504 2.899 ( -2.399 1.448 2.258) 3.598 2.980 ( 2.300 -0.043 -0.030) 2.300 3.012 ( -3.178 -2.886 2.264) 4.853 3.316 ( 0.445 4.311 -0.563) 4.370 3.331 ( -3.694 2.419 1.108) 4.553 3.624 ( 3.938 1.818 14.859) 15.479 3.709 ( 4.684 -5.136 16.019) 17.462 3.885 ( -2.981 4.226 -18.154) 18.876 3.945 ( -1.350 -2.013 -16.608) 16.784 4.310 ( 1.805 -0.589 -2.385) 3.048 4.428 ( -12.579 -11.044 -1.312) 16.791 4.825 ( 1.485 3.341 1.785) 4.069 4.858 ( -0.880 0.118 0.441) 0.992 5.024 ( 2.517 3.089 3.293) 5.169 5.116 ( -5.618 -6.277 -1.243) 8.515 5.669 ( 2.037 3.874 2.031) 4.825 5.702 ( -0.857 0.428 0.337) 1.016 6.952 ( 10.075 5.795 1.482) 11.717 7.028 ( 7.025 -3.038 -1.769) 7.856 7.105 ( -5.683 4.879 2.962) 8.054 7.169 ( -7.873 3.674 -0.552) 8.706 7.270 ( 0.099 -6.203 -1.080) 6.297 7.330 ( -3.672 -7.179 -3.532) 8.803 7.770 ( -0.626 -1.504 -0.069) 1.630 7.780 ( -0.854 -2.438 -1.059) 2.791 8.527 ( 0.239 1.790 0.861) 2.001 8.577 ( -2.985 -3.262 -3.089) 5.394 8.978 ( 1.737 4.220 0.372) 4.579 9.001 ( 0.293 1.839 -1.712) 2.529 9.715 ( 0.962 0.631 0.675) 1.334 9.718 ( 0.329 0.258 0.911) 1.002 10.836 ( -0.179 -0.102 -0.872) 0.896 10.851 ( -1.742 -1.668 -1.286) 2.733 11.654 ( 2.594 4.315 4.551) 6.787 11.695 ( 1.384 0.737 0.279) 1.593 11.812 ( -0.406 2.599 1.413) 2.986 11.844 ( -0.859 0.207 -2.270) 2.435 12.191 ( 1.231 0.982 2.121) 2.641 12.196 ( 1.071 0.610 1.496) 1.938 13.044 ( 2.774 1.075 -2.062) 3.620 13.096 ( -3.156 -4.233 -2.528) 5.854 14.081 ( 2.942 1.951 2.328) 4.229 14.086 ( 2.575 1.349 1.910) 3.478 17.662 ( -0.129 0.348 -0.854) 0.932 17.669 ( -1.100 -0.431 -0.774) 1.413 18.674 ( 5.817 6.443 0.380) 8.689 18.727 ( -0.402 0.837 0.180) 0.946 18.929 ( 6.586 9.143 5.488) 12.533 19.016 ( 0.465 0.203 0.300) 0.589 19.116 ( 1.386 3.295 2.495) 4.359 19.140 ( 0.240 1.257 0.854) 1.538 20.269 ( -4.385 -7.153 -4.496) 9.518 20.298 ( -8.101 -9.941 -3.950) 13.418 21.268 ( 0.210 -0.427 0.020) 0.476 21.275 ( -0.659 -1.123 0.061) 1.303 =================== 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 3/35640 10.0 1373.334 1576.474 1737.444 0.000 0.734 0.000 3/35640 20.0 243.044 261.693 277.268 0.000 -3.445 0.000 3/35640 30.0 80.481 80.204 93.034 0.000 -3.200 0.000 3/35640 40.0 41.284 39.870 47.906 0.000 -2.265 0.000 3/35640 50.0 26.224 25.022 30.550 0.000 -1.637 0.000 3/35640 60.0 18.711 17.771 21.867 0.000 -1.235 0.000 3/35640 70.0 14.350 13.604 16.799 0.000 -0.971 0.000 3/35640 80.0 11.559 10.952 13.539 0.000 -0.790 0.000 3/35640 90.0 9.647 9.140 11.296 0.000 -0.661 0.000 3/35640 100.0 8.268 7.835 9.674 0.000 -0.567 0.000 3/35640 110.0 7.233 6.857 8.454 0.000 -0.494 0.000 3/35640 120.0 6.430 6.098 7.506 0.000 -0.438 0.000 3/35640 130.0 5.791 5.494 6.751 0.000 -0.393 0.000 3/35640 140.0 5.271 5.002 6.136 0.000 -0.356 0.000 3/35640 150.0 4.840 4.593 5.625 0.000 -0.325 0.000 3/35640 160.0 4.476 4.249 5.195 0.000 -0.299 0.000 3/35640 170.0 4.165 3.954 4.828 0.000 -0.277 0.000 3/35640 180.0 3.896 3.700 4.511 0.000 -0.258 0.000 3/35640 190.0 3.661 3.477 4.234 0.000 -0.241 0.000 3/35640 200.0 3.454 3.281 3.990 0.000 -0.227 0.000 3/35640 210.0 3.270 3.106 3.773 0.000 -0.214 0.000 3/35640 220.0 3.105 2.950 3.580 0.000 -0.202 0.000 3/35640 230.0 2.957 2.810 3.406 0.000 -0.192 0.000 3/35640 240.0 2.823 2.682 3.248 0.000 -0.182 0.000 3/35640 250.0 2.700 2.566 3.105 0.000 -0.174 0.000 3/35640 260.0 2.589 2.460 2.975 0.000 -0.166 0.000 3/35640 270.0 2.486 2.363 2.855 0.000 -0.159 0.000 3/35640 280.0 2.392 2.273 2.745 0.000 -0.153 0.000 3/35640 290.0 2.304 2.190 2.643 0.000 -0.147 0.000 3/35640 300.0 2.223 2.113 2.548 0.000 -0.141 0.000 3/35640 310.0 2.148 2.042 2.461 0.000 -0.136 0.000 3/35640 320.0 2.077 1.975 2.379 0.000 -0.131 0.000 3/35640 330.0 2.011 1.913 2.303 0.000 -0.127 0.000 3/35640 340.0 1.950 1.854 2.231 0.000 -0.123 0.000 3/35640 350.0 1.892 1.799 2.164 0.000 -0.119 0.000 3/35640 360.0 1.837 1.747 2.101 0.000 -0.115 0.000 3/35640 370.0 1.786 1.699 2.042 0.000 -0.112 0.000 3/35640 380.0 1.737 1.653 1.986 0.000 -0.109 0.000 3/35640 390.0 1.692 1.609 1.933 0.000 -0.106 0.000 3/35640 400.0 1.648 1.568 1.882 0.000 -0.103 0.000 3/35640 410.0 1.607 1.528 1.835 0.000 -0.100 0.000 3/35640 420.0 1.567 1.491 1.789 0.000 -0.097 0.000 3/35640 430.0 1.530 1.456 1.746 0.000 -0.095 0.000 3/35640 440.0 1.495 1.422 1.705 0.000 -0.093 0.000 3/35640 450.0 1.461 1.390 1.666 0.000 -0.090 0.000 3/35640 460.0 1.428 1.359 1.629 0.000 -0.088 0.000 3/35640 470.0 1.397 1.329 1.593 0.000 -0.086 0.000 3/35640 480.0 1.367 1.301 1.559 0.000 -0.084 0.000 3/35640 490.0 1.339 1.274 1.527 0.000 -0.083 0.000 3/35640 500.0 1.312 1.248 1.495 0.000 -0.081 0.000 3/35640 510.0 1.286 1.223 1.465 0.000 -0.079 0.000 3/35640 520.0 1.261 1.199 1.437 0.000 -0.078 0.000 3/35640 530.0 1.236 1.177 1.409 0.000 -0.076 0.000 3/35640 540.0 1.213 1.154 1.382 0.000 -0.075 0.000 3/35640 550.0 1.191 1.133 1.357 0.000 -0.073 0.000 3/35640 560.0 1.169 1.113 1.332 0.000 -0.072 0.000 3/35640 570.0 1.148 1.093 1.308 0.000 -0.070 0.000 3/35640 580.0 1.128 1.074 1.285 0.000 -0.069 0.000 3/35640 590.0 1.109 1.056 1.263 0.000 -0.068 0.000 3/35640 600.0 1.090 1.038 1.242 0.000 -0.067 0.000 3/35640 610.0 1.072 1.021 1.221 0.000 -0.066 0.000 3/35640 620.0 1.055 1.004 1.201 0.000 -0.065 0.000 3/35640 630.0 1.038 0.988 1.182 0.000 -0.064 0.000 3/35640 640.0 1.021 0.972 1.163 0.000 -0.062 0.000 3/35640 650.0 1.006 0.957 1.145 0.000 -0.061 0.000 3/35640 660.0 0.990 0.943 1.127 0.000 -0.061 0.000 3/35640 670.0 0.975 0.928 1.110 0.000 -0.060 0.000 3/35640 680.0 0.961 0.915 1.094 0.000 -0.059 0.000 3/35640 690.0 0.947 0.901 1.077 0.000 -0.058 0.000 3/35640 700.0 0.933 0.888 1.062 0.000 -0.057 0.000 3/35640 710.0 0.920 0.876 1.047 0.000 -0.056 0.000 3/35640 720.0 0.907 0.863 1.032 0.000 -0.055 0.000 3/35640 730.0 0.895 0.852 1.018 0.000 -0.055 0.000 3/35640 740.0 0.882 0.840 1.004 0.000 -0.054 0.000 3/35640 750.0 0.871 0.829 0.990 0.000 -0.053 0.000 3/35640 760.0 0.859 0.818 0.977 0.000 -0.052 0.000 3/35640 770.0 0.848 0.807 0.964 0.000 -0.052 0.000 3/35640 780.0 0.837 0.797 0.952 0.000 -0.051 0.000 3/35640 790.0 0.826 0.787 0.940 0.000 -0.050 0.000 3/35640 800.0 0.816 0.777 0.928 0.000 -0.050 0.000 3/35640 810.0 0.806 0.767 0.916 0.000 -0.049 0.000 3/35640 820.0 0.796 0.758 0.905 0.000 -0.048 0.000 3/35640 830.0 0.786 0.748 0.894 0.000 -0.048 0.000 3/35640 840.0 0.777 0.739 0.883 0.000 -0.047 0.000 3/35640 850.0 0.768 0.731 0.873 0.000 -0.047 0.000 3/35640 860.0 0.759 0.722 0.863 0.000 -0.046 0.000 3/35640 870.0 0.750 0.714 0.853 0.000 -0.046 0.000 3/35640 880.0 0.741 0.706 0.843 0.000 -0.045 0.000 3/35640 890.0 0.733 0.698 0.833 0.000 -0.045 0.000 3/35640 900.0 0.725 0.690 0.824 0.000 -0.044 0.000 3/35640 910.0 0.717 0.682 0.815 0.000 -0.044 0.000 3/35640 920.0 0.709 0.675 0.806 0.000 -0.043 0.000 3/35640 930.0 0.701 0.668 0.797 0.000 -0.043 0.000 3/35640 940.0 0.694 0.661 0.789 0.000 -0.042 0.000 3/35640 950.0 0.686 0.654 0.780 0.000 -0.042 0.000 3/35640 960.0 0.679 0.647 0.772 0.000 -0.041 0.000 3/35640 970.0 0.672 0.640 0.764 0.000 -0.041 0.000 3/35640 980.0 0.665 0.633 0.756 0.000 -0.040 0.000 3/35640 990.0 0.659 0.627 0.749 0.000 -0.040 0.000 3/35640 1000.0 0.652 0.621 0.741 0.000 -0.040 0.000 3/35640 Thermal conductivity related properties were written into "kappa-m1196.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:04:49]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|