----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 04:02:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.723427410000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.048438280000001 0.000000000000000 c 0.000000000000000 0.000000000000000 8.137730280000000 Atomic positions (fractional): *1 Pr 0.75721899124242 0.75000000000000 0.08463527804995 140.908 2 Pr 0.74278100875758 0.25000000000000 0.58463527804995 140.908 3 Pr 0.25721899124242 0.75000000000000 0.41536472195005 140.908 4 Pr 0.24278100875758 0.25000000000000 0.91536472195005 140.908 *5 B 0.91544774787366 0.75000000000000 0.73868868548193 10.811 6 B 0.58455225212634 0.25000000000000 0.23868868548193 10.811 7 B 0.41544774787366 0.75000000000000 0.76131131451807 10.811 8 B 0.08455225212634 0.25000000000000 0.26131131451807 10.811 *9 O 0.91084583897854 0.98548878788508 0.82444143437571 15.999 10 O 0.58915416102146 0.01451121211492 0.32444143437571 15.999 11 O 0.41084583897854 0.51451121211492 0.67555856562429 15.999 12 O 0.08915416102146 0.48548878788508 0.17555856562429 15.999 13 O 0.08915416102146 0.01451121211492 0.17555856562429 15.999 14 O 0.41084583897854 0.98548878788508 0.67555856562429 15.999 15 O 0.58915416102146 0.48548878788508 0.32444143437571 15.999 16 O 0.91084583897854 0.51451121211492 0.82444143437571 15.999 *17 O 0.89949684307508 0.75000000000000 0.57032637970601 15.999 18 O 0.60050315692492 0.25000000000000 0.07032637970601 15.999 19 O 0.39949684307507 0.75000000000000 0.92967362029399 15.999 20 O 0.10050315692492 0.25000000000000 0.42967362029399 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.723427410000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.048438280000001 0.000000000000000 c 0.000000000000000 0.000000000000000 8.137730280000000 Atomic positions (fractional): *1 Pr 0.75721899124242 0.75000000000000 0.08463527804995 140.908 > 1 2 Pr 0.74278100875758 0.25000000000000 0.58463527804995 140.908 > 2 3 Pr 0.25721899124242 0.75000000000000 0.41536472195005 140.908 > 3 4 Pr 0.24278100875758 0.25000000000000 0.91536472195005 140.908 > 4 *5 B 0.91544774787366 0.75000000000000 0.73868868548193 10.811 > 5 6 B 0.58455225212634 0.25000000000000 0.23868868548193 10.811 > 6 7 B 0.41544774787366 0.75000000000000 0.76131131451807 10.811 > 7 8 B 0.08455225212634 0.25000000000000 0.26131131451807 10.811 > 8 *9 O 0.91084583897854 0.98548878788508 0.82444143437571 15.999 > 9 10 O 0.58915416102146 0.01451121211492 0.32444143437571 15.999 > 10 11 O 0.41084583897854 0.51451121211492 0.67555856562429 15.999 > 11 12 O 0.08915416102146 0.48548878788508 0.17555856562429 15.999 > 12 13 O 0.08915416102146 0.01451121211492 0.17555856562429 15.999 > 13 14 O 0.41084583897854 0.98548878788508 0.67555856562429 15.999 > 14 15 O 0.58915416102146 0.48548878788508 0.32444143437571 15.999 > 15 16 O 0.91084583897854 0.51451121211492 0.82444143437571 15.999 > 16 *17 O 0.89949684307508 0.75000000000000 0.57032637970601 15.999 > 17 18 O 0.60050315692492 0.25000000000000 0.07032637970601 15.999 > 18 19 O 0.39949684307507 0.75000000000000 0.92967362029399 15.999 > 19 20 O 0.10050315692492 0.25000000000000 0.42967362029399 15.999 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.446854820000000 0.000000000000000 0.000000000000000 b 0.000000000000000 10.096876560000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.137730280000000 Atomic positions (fractional): *1 Pr 0.37860949562121 0.37500000000000 0.08463527804995 140.908 > 1 2 Pr 0.87860949562121 0.37500000000000 0.08463527804995 140.908 > 1 3 Pr 0.37860949562121 0.87500000000000 0.08463527804995 140.908 > 1 4 Pr 0.87860949562121 0.87500000000000 0.08463527804995 140.908 > 1 5 Pr 0.37139050437879 0.12500000000000 0.58463527804995 140.908 > 2 6 Pr 0.87139050437879 0.12500000000000 0.58463527804995 140.908 > 2 7 Pr 0.37139050437879 0.62500000000000 0.58463527804995 140.908 > 2 8 Pr 0.87139050437879 0.62500000000000 0.58463527804995 140.908 > 2 9 Pr 0.12860949562121 0.37500000000000 0.41536472195005 140.908 > 3 10 Pr 0.62860949562121 0.37500000000000 0.41536472195005 140.908 > 3 11 Pr 0.12860949562121 0.87500000000000 0.41536472195005 140.908 > 3 12 Pr 0.62860949562121 0.87500000000000 0.41536472195005 140.908 > 3 13 Pr 0.12139050437879 0.12500000000000 0.91536472195005 140.908 > 4 14 Pr 0.62139050437879 0.12500000000000 0.91536472195005 140.908 > 4 15 Pr 0.12139050437879 0.62500000000000 0.91536472195005 140.908 > 4 16 Pr 0.62139050437879 0.62500000000000 0.91536472195005 140.908 > 4 *17 B 0.45772387393683 0.37500000000000 0.73868868548193 10.811 > 5 18 B 0.95772387393683 0.37500000000000 0.73868868548193 10.811 > 5 19 B 0.45772387393683 0.87500000000000 0.73868868548193 10.811 > 5 20 B 0.95772387393683 0.87500000000000 0.73868868548193 10.811 > 5 21 B 0.29227612606317 0.12500000000000 0.23868868548193 10.811 > 6 22 B 0.79227612606317 0.12500000000000 0.23868868548193 10.811 > 6 23 B 0.29227612606317 0.62500000000000 0.23868868548193 10.811 > 6 24 B 0.79227612606317 0.62500000000000 0.23868868548193 10.811 > 6 25 B 0.20772387393683 0.37500000000000 0.76131131451807 10.811 > 7 26 B 0.70772387393683 0.37500000000000 0.76131131451807 10.811 > 7 27 B 0.20772387393683 0.87500000000000 0.76131131451807 10.811 > 7 28 B 0.70772387393683 0.87500000000000 0.76131131451807 10.811 > 7 29 B 0.04227612606317 0.12500000000000 0.26131131451807 10.811 > 8 30 B 0.54227612606317 0.12500000000000 0.26131131451807 10.811 > 8 31 B 0.04227612606317 0.62500000000000 0.26131131451807 10.811 > 8 32 B 0.54227612606317 0.62500000000000 0.26131131451807 10.811 > 8 *33 O 0.45542291948927 0.49274439394254 0.82444143437571 15.999 > 9 34 O 0.95542291948927 0.49274439394254 0.82444143437571 15.999 > 9 35 O 0.45542291948927 0.99274439394254 0.82444143437571 15.999 > 9 36 O 0.95542291948927 0.99274439394254 0.82444143437571 15.999 > 9 37 O 0.29457708051073 0.00725560605746 0.32444143437571 15.999 > 10 38 O 0.79457708051073 0.00725560605746 0.32444143437571 15.999 > 10 39 O 0.29457708051073 0.50725560605746 0.32444143437571 15.999 > 10 40 O 0.79457708051073 0.50725560605746 0.32444143437571 15.999 > 10 41 O 0.20542291948927 0.25725560605746 0.67555856562429 15.999 > 11 42 O 0.70542291948927 0.25725560605746 0.67555856562429 15.999 > 11 43 O 0.20542291948927 0.75725560605746 0.67555856562429 15.999 > 11 44 O 0.70542291948927 0.75725560605746 0.67555856562429 15.999 > 11 45 O 0.04457708051073 0.24274439394254 0.17555856562429 15.999 > 12 46 O 0.54457708051073 0.24274439394254 0.17555856562429 15.999 > 12 47 O 0.04457708051073 0.74274439394254 0.17555856562429 15.999 > 12 48 O 0.54457708051073 0.74274439394254 0.17555856562429 15.999 > 12 49 O 0.04457708051073 0.00725560605746 0.17555856562429 15.999 > 13 50 O 0.54457708051073 0.00725560605746 0.17555856562429 15.999 > 13 51 O 0.04457708051073 0.50725560605746 0.17555856562429 15.999 > 13 52 O 0.54457708051073 0.50725560605746 0.17555856562429 15.999 > 13 53 O 0.20542291948927 0.49274439394254 0.67555856562429 15.999 > 14 54 O 0.70542291948927 0.49274439394254 0.67555856562429 15.999 > 14 55 O 0.20542291948927 0.99274439394254 0.67555856562429 15.999 > 14 56 O 0.70542291948927 0.99274439394254 0.67555856562429 15.999 > 14 57 O 0.29457708051073 0.24274439394254 0.32444143437571 15.999 > 15 58 O 0.79457708051073 0.24274439394254 0.32444143437571 15.999 > 15 59 O 0.29457708051073 0.74274439394254 0.32444143437571 15.999 > 15 60 O 0.79457708051073 0.74274439394254 0.32444143437571 15.999 > 15 61 O 0.45542291948927 0.25725560605746 0.82444143437571 15.999 > 16 62 O 0.95542291948927 0.25725560605746 0.82444143437571 15.999 > 16 63 O 0.45542291948927 0.75725560605746 0.82444143437571 15.999 > 16 64 O 0.95542291948927 0.75725560605746 0.82444143437571 15.999 > 16 *65 O 0.44974842153754 0.37500000000000 0.57032637970601 15.999 > 17 66 O 0.94974842153754 0.37500000000000 0.57032637970601 15.999 > 17 67 O 0.44974842153754 0.87500000000000 0.57032637970601 15.999 > 17 68 O 0.94974842153754 0.87500000000000 0.57032637970601 15.999 > 17 69 O 0.30025157846246 0.12500000000000 0.07032637970601 15.999 > 18 70 O 0.80025157846246 0.12500000000000 0.07032637970601 15.999 > 18 71 O 0.30025157846246 0.62500000000000 0.07032637970601 15.999 > 18 72 O 0.80025157846246 0.62500000000000 0.07032637970601 15.999 > 18 73 O 0.19974842153754 0.37500000000000 0.92967362029399 15.999 > 19 74 O 0.69974842153754 0.37500000000000 0.92967362029399 15.999 > 19 75 O 0.19974842153754 0.87500000000000 0.92967362029399 15.999 > 19 76 O 0.69974842153754 0.87500000000000 0.92967362029399 15.999 > 19 77 O 0.05025157846246 0.12500000000000 0.42967362029399 15.999 > 20 78 O 0.55025157846246 0.12500000000000 0.42967362029399 15.999 > 20 79 O 0.05025157846246 0.62500000000000 0.42967362029399 15.999 > 20 80 O 0.55025157846246 0.62500000000000 0.42967362029399 15.999 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5812238 0.0000000 0.0000000 0.0000000 4.0200365 0.0000000 0.0000000 0.0000000 3.9825050 -------------------------- Born effective charges -------------------------- 1 Pr 4.0405943 0.0000000 -0.1664145 0.0000000 4.1374777 0.0000000 0.1357126 0.0000000 4.1339988 2 Pr 4.0405943 0.0000000 0.1664145 0.0000000 4.1374777 0.0000000 -0.1357126 0.0000000 4.1339988 3 Pr 4.0405943 0.0000000 0.1664145 0.0000000 4.1374777 0.0000000 -0.1357126 0.0000000 4.1339988 4 Pr 4.0405943 0.0000000 -0.1664145 0.0000000 4.1374777 0.0000000 0.1357126 0.0000000 4.1339988 5 B 0.7025547 0.0000000 -0.0359322 0.0000000 2.5933494 0.0000000 0.0287507 0.0000000 2.5918712 6 B 0.7025547 0.0000000 0.0359322 0.0000000 2.5933494 0.0000000 -0.0287507 0.0000000 2.5918712 7 B 0.7025547 0.0000000 0.0359322 0.0000000 2.5933494 0.0000000 -0.0287507 0.0000000 2.5918712 8 B 0.7025547 0.0000000 -0.0359322 0.0000000 2.5933494 0.0000000 0.0287507 0.0000000 2.5918712 9 O -1.5678962 -0.2249155 -0.1223807 -0.3374440 -2.4149462 -0.1222110 -0.2103518 -0.1805094 -2.1509264 10 O -1.5678962 -0.2249155 0.1223807 -0.3374440 -2.4149462 0.1222110 0.2103518 0.1805094 -2.1509264 11 O -1.5678962 0.2249155 0.1223807 0.3374440 -2.4149462 -0.1222110 0.2103518 -0.1805094 -2.1509264 12 O -1.5678962 0.2249155 -0.1223807 0.3374440 -2.4149462 0.1222110 -0.2103518 0.1805094 -2.1509264 13 O -1.5678962 -0.2249155 -0.1223807 -0.3374440 -2.4149462 -0.1222110 -0.2103518 -0.1805094 -2.1509264 14 O -1.5678962 -0.2249155 0.1223807 -0.3374440 -2.4149462 0.1222110 0.2103518 0.1805094 -2.1509264 15 O -1.5678962 0.2249155 0.1223807 0.3374440 -2.4149462 -0.1222110 0.2103518 -0.1805094 -2.1509264 16 O -1.5678962 0.2249155 -0.1223807 0.3374440 -2.4149462 0.1222110 -0.2103518 0.1805094 -2.1509264 17 O -1.6073565 0.0000000 0.3147663 0.0000000 -1.9009347 0.0000000 0.3947169 0.0000000 -2.4240172 18 O -1.6073565 0.0000000 -0.3147663 0.0000000 -1.9009347 0.0000000 -0.3947169 0.0000000 -2.4240172 19 O -1.6073565 0.0000000 -0.3147663 0.0000000 -1.9009347 0.0000000 -0.3947169 0.0000000 -2.4240172 20 O -1.6073565 0.0000000 0.3147663 0.0000000 -1.9009347 0.0000000 0.3947169 0.0000000 -2.4240172 ---------------------------------------------------------------------------- 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: 978 Number of blocks in projector: 978 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: 236 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 164 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 164 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (978, 954), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (164, 162), data: True |-- (164, 162), data: True |-- (236, 228), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 320 - Time: 0.742 Solver_block: 200 / 320 - Time: 0.737 Solver_block: 300 / 320 - Time: 0.733 Solver_block: 320 / 320 - Time: 0.186 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.414 --------------------------------- 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: 978 Number of blocks in projector: 978 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: 236 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 164 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 164 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (978, 954), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (164, 162), data: True |-- (164, 162), data: True |-- (236, 228), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 04:02:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:02:31]------------------------- 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: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.723427410000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.048438280000001 0.000000000000000 c 0.000000000000000 0.000000000000000 8.137730280000000 Atomic positions (fractional): 1 Pr 0.75721899124242 0.75000000000000 0.08463527804995 140.908 2 Pr 0.74278100875758 0.25000000000000 0.58463527804995 140.908 3 Pr 0.25721899124242 0.75000000000000 0.41536472195005 140.908 4 Pr 0.24278100875758 0.25000000000000 0.91536472195005 140.908 5 B 0.91544774787366 0.75000000000000 0.73868868548193 10.811 6 B 0.58455225212634 0.25000000000000 0.23868868548193 10.811 7 B 0.41544774787366 0.75000000000000 0.76131131451807 10.811 8 B 0.08455225212634 0.25000000000000 0.26131131451807 10.811 9 O 0.91084583897854 0.98548878788508 0.82444143437571 15.999 10 O 0.58915416102146 0.01451121211492 0.32444143437571 15.999 11 O 0.41084583897854 0.51451121211492 0.67555856562429 15.999 12 O 0.08915416102146 0.48548878788508 0.17555856562429 15.999 13 O 0.08915416102146 0.01451121211492 0.17555856562429 15.999 14 O 0.41084583897854 0.98548878788508 0.67555856562429 15.999 15 O 0.58915416102146 0.48548878788508 0.32444143437571 15.999 16 O 0.91084583897854 0.51451121211492 0.82444143437571 15.999 17 O 0.89949684307508 0.75000000000000 0.57032637970601 15.999 18 O 0.60050315692492 0.25000000000000 0.07032637970601 15.999 19 O 0.39949684307507 0.75000000000000 0.92967362029399 15.999 20 O 0.10050315692492 0.25000000000000 0.42967362029399 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.446854820000000 0.000000000000000 0.000000000000000 b 0.000000000000000 10.096876560000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.137730280000000 Atomic positions (fractional): 1 Pr 0.37860949562121 0.37500000000000 0.08463527804995 140.908 > 1 2 Pr 0.87860949562121 0.37500000000000 0.08463527804995 140.908 > 1 3 Pr 0.37860949562121 0.87500000000000 0.08463527804995 140.908 > 1 4 Pr 0.87860949562121 0.87500000000000 0.08463527804995 140.908 > 1 5 Pr 0.37139050437879 0.12500000000000 0.58463527804995 140.908 > 5 6 Pr 0.87139050437879 0.12500000000000 0.58463527804995 140.908 > 5 7 Pr 0.37139050437879 0.62500000000000 0.58463527804995 140.908 > 5 8 Pr 0.87139050437879 0.62500000000000 0.58463527804995 140.908 > 5 9 Pr 0.12860949562121 0.37500000000000 0.41536472195005 140.908 > 9 10 Pr 0.62860949562121 0.37500000000000 0.41536472195005 140.908 > 9 11 Pr 0.12860949562121 0.87500000000000 0.41536472195005 140.908 > 9 12 Pr 0.62860949562121 0.87500000000000 0.41536472195005 140.908 > 9 13 Pr 0.12139050437879 0.12500000000000 0.91536472195005 140.908 > 13 14 Pr 0.62139050437879 0.12500000000000 0.91536472195005 140.908 > 13 15 Pr 0.12139050437879 0.62500000000000 0.91536472195005 140.908 > 13 16 Pr 0.62139050437879 0.62500000000000 0.91536472195005 140.908 > 13 17 B 0.45772387393683 0.37500000000000 0.73868868548193 10.811 > 17 18 B 0.95772387393683 0.37500000000000 0.73868868548193 10.811 > 17 19 B 0.45772387393683 0.87500000000000 0.73868868548193 10.811 > 17 20 B 0.95772387393683 0.87500000000000 0.73868868548193 10.811 > 17 21 B 0.29227612606317 0.12500000000000 0.23868868548193 10.811 > 21 22 B 0.79227612606317 0.12500000000000 0.23868868548193 10.811 > 21 23 B 0.29227612606317 0.62500000000000 0.23868868548193 10.811 > 21 24 B 0.79227612606317 0.62500000000000 0.23868868548193 10.811 > 21 25 B 0.20772387393683 0.37500000000000 0.76131131451807 10.811 > 25 26 B 0.70772387393683 0.37500000000000 0.76131131451807 10.811 > 25 27 B 0.20772387393683 0.87500000000000 0.76131131451807 10.811 > 25 28 B 0.70772387393683 0.87500000000000 0.76131131451807 10.811 > 25 29 B 0.04227612606317 0.12500000000000 0.26131131451807 10.811 > 29 30 B 0.54227612606317 0.12500000000000 0.26131131451807 10.811 > 29 31 B 0.04227612606317 0.62500000000000 0.26131131451807 10.811 > 29 32 B 0.54227612606317 0.62500000000000 0.26131131451807 10.811 > 29 33 O 0.45542291948927 0.49274439394254 0.82444143437571 15.999 > 33 34 O 0.95542291948927 0.49274439394254 0.82444143437571 15.999 > 33 35 O 0.45542291948927 0.99274439394254 0.82444143437571 15.999 > 33 36 O 0.95542291948927 0.99274439394254 0.82444143437571 15.999 > 33 37 O 0.29457708051073 0.00725560605746 0.32444143437571 15.999 > 37 38 O 0.79457708051073 0.00725560605746 0.32444143437571 15.999 > 37 39 O 0.29457708051073 0.50725560605746 0.32444143437571 15.999 > 37 40 O 0.79457708051073 0.50725560605746 0.32444143437571 15.999 > 37 41 O 0.20542291948927 0.25725560605746 0.67555856562429 15.999 > 41 42 O 0.70542291948927 0.25725560605746 0.67555856562429 15.999 > 41 43 O 0.20542291948927 0.75725560605746 0.67555856562429 15.999 > 41 44 O 0.70542291948927 0.75725560605746 0.67555856562429 15.999 > 41 45 O 0.04457708051073 0.24274439394254 0.17555856562429 15.999 > 45 46 O 0.54457708051073 0.24274439394254 0.17555856562429 15.999 > 45 47 O 0.04457708051073 0.74274439394254 0.17555856562429 15.999 > 45 48 O 0.54457708051073 0.74274439394254 0.17555856562429 15.999 > 45 49 O 0.04457708051073 0.00725560605746 0.17555856562429 15.999 > 49 50 O 0.54457708051073 0.00725560605746 0.17555856562429 15.999 > 49 51 O 0.04457708051073 0.50725560605746 0.17555856562429 15.999 > 49 52 O 0.54457708051073 0.50725560605746 0.17555856562429 15.999 > 49 53 O 0.20542291948927 0.49274439394254 0.67555856562429 15.999 > 53 54 O 0.70542291948927 0.49274439394254 0.67555856562429 15.999 > 53 55 O 0.20542291948927 0.99274439394254 0.67555856562429 15.999 > 53 56 O 0.70542291948927 0.99274439394254 0.67555856562429 15.999 > 53 57 O 0.29457708051073 0.24274439394254 0.32444143437571 15.999 > 57 58 O 0.79457708051073 0.24274439394254 0.32444143437571 15.999 > 57 59 O 0.29457708051073 0.74274439394254 0.32444143437571 15.999 > 57 60 O 0.79457708051073 0.74274439394254 0.32444143437571 15.999 > 57 61 O 0.45542291948927 0.25725560605746 0.82444143437571 15.999 > 61 62 O 0.95542291948927 0.25725560605746 0.82444143437571 15.999 > 61 63 O 0.45542291948927 0.75725560605746 0.82444143437571 15.999 > 61 64 O 0.95542291948927 0.75725560605746 0.82444143437571 15.999 > 61 65 O 0.44974842153754 0.37500000000000 0.57032637970601 15.999 > 65 66 O 0.94974842153754 0.37500000000000 0.57032637970601 15.999 > 65 67 O 0.44974842153754 0.87500000000000 0.57032637970601 15.999 > 65 68 O 0.94974842153754 0.87500000000000 0.57032637970601 15.999 > 65 69 O 0.30025157846246 0.12500000000000 0.07032637970601 15.999 > 69 70 O 0.80025157846246 0.12500000000000 0.07032637970601 15.999 > 69 71 O 0.30025157846246 0.62500000000000 0.07032637970601 15.999 > 69 72 O 0.80025157846246 0.62500000000000 0.07032637970601 15.999 > 69 73 O 0.19974842153754 0.37500000000000 0.92967362029399 15.999 > 73 74 O 0.69974842153754 0.37500000000000 0.92967362029399 15.999 > 73 75 O 0.19974842153754 0.87500000000000 0.92967362029399 15.999 > 73 76 O 0.69974842153754 0.87500000000000 0.92967362029399 15.999 > 73 77 O 0.05025157846246 0.12500000000000 0.42967362029399 15.999 > 77 78 O 0.55025157846246 0.12500000000000 0.42967362029399 15.999 > 77 79 O 0.05025157846246 0.62500000000000 0.42967362029399 15.999 > 77 80 O 0.55025157846246 0.62500000000000 0.42967362029399 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5812238 0.0000000 0.0000000 0.0000000 4.0200365 0.0000000 0.0000000 0.0000000 3.9825050 -------------------------- Born effective charges -------------------------- 1 Pr 4.0405943 0.0000000 -0.1664145 0.0000000 4.1374777 0.0000000 0.1357126 0.0000000 4.1339988 2 Pr 4.0405943 0.0000000 0.1664145 0.0000000 4.1374777 0.0000000 -0.1357126 0.0000000 4.1339988 3 Pr 4.0405943 0.0000000 0.1664145 0.0000000 4.1374777 0.0000000 -0.1357126 0.0000000 4.1339988 4 Pr 4.0405943 0.0000000 -0.1664145 0.0000000 4.1374777 0.0000000 0.1357126 0.0000000 4.1339988 5 B 0.7025547 0.0000000 -0.0359322 0.0000000 2.5933494 0.0000000 0.0287507 0.0000000 2.5918712 6 B 0.7025547 0.0000000 0.0359322 0.0000000 2.5933494 0.0000000 -0.0287507 0.0000000 2.5918712 7 B 0.7025547 0.0000000 0.0359322 0.0000000 2.5933494 0.0000000 -0.0287507 0.0000000 2.5918712 8 B 0.7025547 0.0000000 -0.0359322 0.0000000 2.5933494 0.0000000 0.0287507 0.0000000 2.5918712 9 O -1.5678962 -0.2249155 -0.1223807 -0.3374440 -2.4149462 -0.1222110 -0.2103518 -0.1805094 -2.1509264 10 O -1.5678962 -0.2249155 0.1223807 -0.3374440 -2.4149462 0.1222110 0.2103518 0.1805094 -2.1509264 11 O -1.5678962 0.2249155 0.1223807 0.3374440 -2.4149462 -0.1222110 0.2103518 -0.1805094 -2.1509264 12 O -1.5678962 0.2249155 -0.1223807 0.3374440 -2.4149462 0.1222110 -0.2103518 0.1805094 -2.1509264 13 O -1.5678962 -0.2249155 -0.1223807 -0.3374440 -2.4149462 -0.1222110 -0.2103518 -0.1805094 -2.1509264 14 O -1.5678962 -0.2249155 0.1223807 -0.3374440 -2.4149462 0.1222110 0.2103518 0.1805094 -2.1509264 15 O -1.5678962 0.2249155 0.1223807 0.3374440 -2.4149462 -0.1222110 0.2103518 -0.1805094 -2.1509264 16 O -1.5678962 0.2249155 -0.1223807 0.3374440 -2.4149462 0.1222110 -0.2103518 0.1805094 -2.1509264 17 O -1.6073565 0.0000000 0.3147663 0.0000000 -1.9009347 0.0000000 0.3947169 0.0000000 -2.4240172 18 O -1.6073565 0.0000000 -0.3147663 0.0000000 -1.9009347 0.0000000 -0.3947169 0.0000000 -2.4240172 19 O -1.6073565 0.0000000 -0.3147663 0.0000000 -1.9009347 0.0000000 -0.3947169 0.0000000 -2.4240172 20 O -1.6073565 0.0000000 0.3147663 0.0000000 -1.9009347 0.0000000 0.3947169 0.0000000 -2.4240172 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000017 (xzx) -0.00000017 (xzx) -0.00000017 (xxz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000002 (zx) -0.00000002 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 04:02:41]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:02:41]------------------------- 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: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.723427410000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.048438280000001 0.000000000000000 c 0.000000000000000 0.000000000000000 8.137730280000000 Atomic positions (fractional): 1 Pr 0.75721899124242 0.75000000000000 0.08463527804995 140.908 2 Pr 0.74278100875758 0.25000000000000 0.58463527804995 140.908 3 Pr 0.25721899124242 0.75000000000000 0.41536472195005 140.908 4 Pr 0.24278100875758 0.25000000000000 0.91536472195005 140.908 5 B 0.91544774787366 0.75000000000000 0.73868868548193 10.811 6 B 0.58455225212634 0.25000000000000 0.23868868548193 10.811 7 B 0.41544774787366 0.75000000000000 0.76131131451807 10.811 8 B 0.08455225212634 0.25000000000000 0.26131131451807 10.811 9 O 0.91084583897854 0.98548878788508 0.82444143437571 15.999 10 O 0.58915416102146 0.01451121211492 0.32444143437571 15.999 11 O 0.41084583897854 0.51451121211492 0.67555856562429 15.999 12 O 0.08915416102146 0.48548878788508 0.17555856562429 15.999 13 O 0.08915416102146 0.01451121211492 0.17555856562429 15.999 14 O 0.41084583897854 0.98548878788508 0.67555856562429 15.999 15 O 0.58915416102146 0.48548878788508 0.32444143437571 15.999 16 O 0.91084583897854 0.51451121211492 0.82444143437571 15.999 17 O 0.89949684307508 0.75000000000000 0.57032637970601 15.999 18 O 0.60050315692492 0.25000000000000 0.07032637970601 15.999 19 O 0.39949684307507 0.75000000000000 0.92967362029399 15.999 20 O 0.10050315692492 0.25000000000000 0.42967362029399 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.446854820000000 0.000000000000000 0.000000000000000 b 0.000000000000000 10.096876560000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.137730280000000 Atomic positions (fractional): 1 Pr 0.37860949562121 0.37500000000000 0.08463527804995 140.908 > 1 2 Pr 0.87860949562121 0.37500000000000 0.08463527804995 140.908 > 1 3 Pr 0.37860949562121 0.87500000000000 0.08463527804995 140.908 > 1 4 Pr 0.87860949562121 0.87500000000000 0.08463527804995 140.908 > 1 5 Pr 0.37139050437879 0.12500000000000 0.58463527804995 140.908 > 5 6 Pr 0.87139050437879 0.12500000000000 0.58463527804995 140.908 > 5 7 Pr 0.37139050437879 0.62500000000000 0.58463527804995 140.908 > 5 8 Pr 0.87139050437879 0.62500000000000 0.58463527804995 140.908 > 5 9 Pr 0.12860949562121 0.37500000000000 0.41536472195005 140.908 > 9 10 Pr 0.62860949562121 0.37500000000000 0.41536472195005 140.908 > 9 11 Pr 0.12860949562121 0.87500000000000 0.41536472195005 140.908 > 9 12 Pr 0.62860949562121 0.87500000000000 0.41536472195005 140.908 > 9 13 Pr 0.12139050437879 0.12500000000000 0.91536472195005 140.908 > 13 14 Pr 0.62139050437879 0.12500000000000 0.91536472195005 140.908 > 13 15 Pr 0.12139050437879 0.62500000000000 0.91536472195005 140.908 > 13 16 Pr 0.62139050437879 0.62500000000000 0.91536472195005 140.908 > 13 17 B 0.45772387393683 0.37500000000000 0.73868868548193 10.811 > 17 18 B 0.95772387393683 0.37500000000000 0.73868868548193 10.811 > 17 19 B 0.45772387393683 0.87500000000000 0.73868868548193 10.811 > 17 20 B 0.95772387393683 0.87500000000000 0.73868868548193 10.811 > 17 21 B 0.29227612606317 0.12500000000000 0.23868868548193 10.811 > 21 22 B 0.79227612606317 0.12500000000000 0.23868868548193 10.811 > 21 23 B 0.29227612606317 0.62500000000000 0.23868868548193 10.811 > 21 24 B 0.79227612606317 0.62500000000000 0.23868868548193 10.811 > 21 25 B 0.20772387393683 0.37500000000000 0.76131131451807 10.811 > 25 26 B 0.70772387393683 0.37500000000000 0.76131131451807 10.811 > 25 27 B 0.20772387393683 0.87500000000000 0.76131131451807 10.811 > 25 28 B 0.70772387393683 0.87500000000000 0.76131131451807 10.811 > 25 29 B 0.04227612606317 0.12500000000000 0.26131131451807 10.811 > 29 30 B 0.54227612606317 0.12500000000000 0.26131131451807 10.811 > 29 31 B 0.04227612606317 0.62500000000000 0.26131131451807 10.811 > 29 32 B 0.54227612606317 0.62500000000000 0.26131131451807 10.811 > 29 33 O 0.45542291948927 0.49274439394254 0.82444143437571 15.999 > 33 34 O 0.95542291948927 0.49274439394254 0.82444143437571 15.999 > 33 35 O 0.45542291948927 0.99274439394254 0.82444143437571 15.999 > 33 36 O 0.95542291948927 0.99274439394254 0.82444143437571 15.999 > 33 37 O 0.29457708051073 0.00725560605746 0.32444143437571 15.999 > 37 38 O 0.79457708051073 0.00725560605746 0.32444143437571 15.999 > 37 39 O 0.29457708051073 0.50725560605746 0.32444143437571 15.999 > 37 40 O 0.79457708051073 0.50725560605746 0.32444143437571 15.999 > 37 41 O 0.20542291948927 0.25725560605746 0.67555856562429 15.999 > 41 42 O 0.70542291948927 0.25725560605746 0.67555856562429 15.999 > 41 43 O 0.20542291948927 0.75725560605746 0.67555856562429 15.999 > 41 44 O 0.70542291948927 0.75725560605746 0.67555856562429 15.999 > 41 45 O 0.04457708051073 0.24274439394254 0.17555856562429 15.999 > 45 46 O 0.54457708051073 0.24274439394254 0.17555856562429 15.999 > 45 47 O 0.04457708051073 0.74274439394254 0.17555856562429 15.999 > 45 48 O 0.54457708051073 0.74274439394254 0.17555856562429 15.999 > 45 49 O 0.04457708051073 0.00725560605746 0.17555856562429 15.999 > 49 50 O 0.54457708051073 0.00725560605746 0.17555856562429 15.999 > 49 51 O 0.04457708051073 0.50725560605746 0.17555856562429 15.999 > 49 52 O 0.54457708051073 0.50725560605746 0.17555856562429 15.999 > 49 53 O 0.20542291948927 0.49274439394254 0.67555856562429 15.999 > 53 54 O 0.70542291948927 0.49274439394254 0.67555856562429 15.999 > 53 55 O 0.20542291948927 0.99274439394254 0.67555856562429 15.999 > 53 56 O 0.70542291948927 0.99274439394254 0.67555856562429 15.999 > 53 57 O 0.29457708051073 0.24274439394254 0.32444143437571 15.999 > 57 58 O 0.79457708051073 0.24274439394254 0.32444143437571 15.999 > 57 59 O 0.29457708051073 0.74274439394254 0.32444143437571 15.999 > 57 60 O 0.79457708051073 0.74274439394254 0.32444143437571 15.999 > 57 61 O 0.45542291948927 0.25725560605746 0.82444143437571 15.999 > 61 62 O 0.95542291948927 0.25725560605746 0.82444143437571 15.999 > 61 63 O 0.45542291948927 0.75725560605746 0.82444143437571 15.999 > 61 64 O 0.95542291948927 0.75725560605746 0.82444143437571 15.999 > 61 65 O 0.44974842153754 0.37500000000000 0.57032637970601 15.999 > 65 66 O 0.94974842153754 0.37500000000000 0.57032637970601 15.999 > 65 67 O 0.44974842153754 0.87500000000000 0.57032637970601 15.999 > 65 68 O 0.94974842153754 0.87500000000000 0.57032637970601 15.999 > 65 69 O 0.30025157846246 0.12500000000000 0.07032637970601 15.999 > 69 70 O 0.80025157846246 0.12500000000000 0.07032637970601 15.999 > 69 71 O 0.30025157846246 0.62500000000000 0.07032637970601 15.999 > 69 72 O 0.80025157846246 0.62500000000000 0.07032637970601 15.999 > 69 73 O 0.19974842153754 0.37500000000000 0.92967362029399 15.999 > 73 74 O 0.69974842153754 0.37500000000000 0.92967362029399 15.999 > 73 75 O 0.19974842153754 0.87500000000000 0.92967362029399 15.999 > 73 76 O 0.69974842153754 0.87500000000000 0.92967362029399 15.999 > 73 77 O 0.05025157846246 0.12500000000000 0.42967362029399 15.999 > 77 78 O 0.55025157846246 0.12500000000000 0.42967362029399 15.999 > 77 79 O 0.05025157846246 0.62500000000000 0.42967362029399 15.999 > 77 80 O 0.55025157846246 0.62500000000000 0.42967362029399 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5812238 0.0000000 0.0000000 0.0000000 4.0200365 0.0000000 0.0000000 0.0000000 3.9825050 -------------------------- Born effective charges -------------------------- 1 Pr 4.0405943 0.0000000 -0.1664145 0.0000000 4.1374777 0.0000000 0.1357126 0.0000000 4.1339988 2 Pr 4.0405943 0.0000000 0.1664145 0.0000000 4.1374777 0.0000000 -0.1357126 0.0000000 4.1339988 3 Pr 4.0405943 0.0000000 0.1664145 0.0000000 4.1374777 0.0000000 -0.1357126 0.0000000 4.1339988 4 Pr 4.0405943 0.0000000 -0.1664145 0.0000000 4.1374777 0.0000000 0.1357126 0.0000000 4.1339988 5 B 0.7025547 0.0000000 -0.0359322 0.0000000 2.5933494 0.0000000 0.0287507 0.0000000 2.5918712 6 B 0.7025547 0.0000000 0.0359322 0.0000000 2.5933494 0.0000000 -0.0287507 0.0000000 2.5918712 7 B 0.7025547 0.0000000 0.0359322 0.0000000 2.5933494 0.0000000 -0.0287507 0.0000000 2.5918712 8 B 0.7025547 0.0000000 -0.0359322 0.0000000 2.5933494 0.0000000 0.0287507 0.0000000 2.5918712 9 O -1.5678962 -0.2249155 -0.1223807 -0.3374440 -2.4149462 -0.1222110 -0.2103518 -0.1805094 -2.1509264 10 O -1.5678962 -0.2249155 0.1223807 -0.3374440 -2.4149462 0.1222110 0.2103518 0.1805094 -2.1509264 11 O -1.5678962 0.2249155 0.1223807 0.3374440 -2.4149462 -0.1222110 0.2103518 -0.1805094 -2.1509264 12 O -1.5678962 0.2249155 -0.1223807 0.3374440 -2.4149462 0.1222110 -0.2103518 0.1805094 -2.1509264 13 O -1.5678962 -0.2249155 -0.1223807 -0.3374440 -2.4149462 -0.1222110 -0.2103518 -0.1805094 -2.1509264 14 O -1.5678962 -0.2249155 0.1223807 -0.3374440 -2.4149462 0.1222110 0.2103518 0.1805094 -2.1509264 15 O -1.5678962 0.2249155 0.1223807 0.3374440 -2.4149462 -0.1222110 0.2103518 -0.1805094 -2.1509264 16 O -1.5678962 0.2249155 -0.1223807 0.3374440 -2.4149462 0.1222110 -0.2103518 0.1805094 -2.1509264 17 O -1.6073565 0.0000000 0.3147663 0.0000000 -1.9009347 0.0000000 0.3947169 0.0000000 -2.4240172 18 O -1.6073565 0.0000000 -0.3147663 0.0000000 -1.9009347 0.0000000 -0.3947169 0.0000000 -2.4240172 19 O -1.6073565 0.0000000 -0.3147663 0.0000000 -1.9009347 0.0000000 -0.3947169 0.0000000 -2.4240172 20 O -1.6073565 0.0000000 0.3147663 0.0000000 -1.9009347 0.0000000 0.3947169 0.0000000 -2.4240172 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000017 (xzx) -0.00000017 (xzx) -0.00000017 (xxz) 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 ... [ 9 10 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: 0.67, Number of G-points: 319, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/120) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 3.149 ( 0.000 0.000 0.000) 0.000 3.203 ( 0.000 0.000 0.000) 0.000 3.241 ( 0.000 0.000 0.000) 0.000 3.401 ( 0.000 0.000 0.000) 0.000 3.541 ( 0.000 0.000 0.000) 0.000 3.634 ( 0.000 0.000 0.000) 0.000 3.679 ( 0.000 0.000 0.000) 0.000 4.309 ( 0.000 0.000 0.000) 0.000 4.593 ( 0.000 0.000 0.000) 0.000 5.118 ( 0.000 0.000 0.000) 0.000 5.221 ( 0.000 0.000 0.000) 0.000 5.475 ( 0.000 0.000 0.000) 0.000 5.581 ( 0.000 0.000 0.000) 0.000 5.709 ( 0.000 0.000 0.000) 0.000 5.739 ( 0.000 0.000 0.000) 0.000 5.763 ( 0.000 0.000 0.000) 0.000 6.109 ( 0.000 0.000 0.000) 0.000 6.646 ( 0.000 0.000 0.000) 0.000 6.750 ( 0.000 0.000 0.000) 0.000 6.891 ( 0.000 0.000 0.000) 0.000 7.065 ( 0.000 0.000 0.000) 0.000 7.186 ( 0.000 0.000 0.000) 0.000 7.500 ( 0.000 0.000 0.000) 0.000 7.762 ( 0.000 0.000 0.000) 0.000 8.098 ( 0.000 0.000 0.000) 0.000 8.267 ( 0.000 0.000 0.000) 0.000 8.641 ( 0.000 0.000 0.000) 0.000 8.769 ( 0.000 0.000 0.000) 0.000 9.650 ( 0.000 0.000 0.000) 0.000 10.067 ( 0.000 0.000 0.000) 0.000 10.149 ( 0.000 0.000 0.000) 0.000 10.504 ( 0.000 0.000 0.000) 0.000 10.657 ( 0.000 0.000 0.000) 0.000 16.578 ( 0.000 0.000 0.000) 0.000 16.918 ( 0.000 0.000 0.000) 0.000 17.017 ( 0.000 0.000 0.000) 0.000 17.175 ( 0.000 0.000 0.000) 0.000 17.469 ( 0.000 0.000 0.000) 0.000 17.591 ( 0.000 0.000 0.000) 0.000 18.299 ( 0.000 0.000 0.000) 0.000 18.360 ( 0.000 0.000 0.000) 0.000 19.867 ( 0.000 0.000 0.000) 0.000 19.898 ( 0.000 0.000 0.000) 0.000 21.918 ( 0.000 0.000 0.000) 0.000 22.029 ( 0.000 0.000 0.000) 0.000 27.709 ( 0.000 0.000 0.000) 0.000 27.905 ( 0.000 0.000 0.000) 0.000 28.016 ( 0.000 0.000 0.000) 0.000 28.054 ( 0.000 0.000 0.000) 0.000 37.128 ( 0.000 0.000 0.000) 0.000 37.563 ( 0.000 0.000 0.000) 0.000 38.059 ( 0.000 0.000 0.000) 0.000 38.212 ( 0.000 0.000 0.000) 0.000 38.365 ( 0.000 0.000 0.000) 0.000 38.539 ( 0.000 0.000 0.000) 0.000 38.663 ( 0.000 0.000 0.000) 0.000 41.211 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/120) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.514 ( 26.422 0.000 0.000) 26.422 0.675 ( 34.226 0.000 0.000) 34.226 0.966 ( 49.415 0.000 0.000) 49.415 3.098 ( -5.136 0.000 0.000) 5.136 3.172 ( -2.684 0.000 0.000) 2.684 3.193 ( -4.884 0.000 0.000) 4.884 3.196 ( -13.807 0.000 0.000) 13.807 3.582 ( -5.335 0.000 0.000) 5.335 3.596 ( 5.054 0.000 0.000) 5.054 3.911 ( 16.866 0.000 0.000) 16.866 4.201 ( -10.575 0.000 0.000) 10.575 4.518 ( -6.477 0.000 0.000) 6.477 5.205 ( 7.645 0.000 0.000) 7.645 5.497 ( 2.150 0.000 0.000) 2.150 5.593 ( 2.236 0.000 0.000) 2.236 5.659 ( -1.594 0.000 0.000) 1.594 5.671 ( -9.372 0.000 0.000) 9.372 5.766 ( 2.351 0.000 0.000) 2.351 5.805 ( 8.101 0.000 0.000) 8.101 6.139 ( 2.906 0.000 0.000) 2.906 6.788 ( 3.954 0.000 0.000) 3.954 6.920 ( 3.599 0.000 0.000) 3.599 7.114 ( 4.893 0.000 0.000) 4.893 7.221 ( 3.504 0.000 0.000) 3.504 7.497 ( 0.680 0.000 0.000) 0.680 7.705 ( -4.562 0.000 0.000) 4.562 8.181 ( 6.847 0.000 0.000) 6.847 8.229 ( -3.840 0.000 0.000) 3.840 8.584 ( -5.826 0.000 0.000) 5.826 8.747 ( -1.841 0.000 0.000) 1.841 9.575 ( -7.636 0.000 0.000) 7.636 9.971 ( -8.511 0.000 0.000) 8.511 10.142 ( -0.593 0.000 0.000) 0.593 10.179 ( 2.399 0.000 0.000) 2.399 10.576 ( 0.035 0.000 0.000) 0.035 10.654 ( -0.305 0.000 0.000) 0.305 16.591 ( 1.307 0.000 0.000) 1.307 16.934 ( 1.652 0.000 0.000) 1.652 17.003 ( -1.417 0.000 0.000) 1.417 17.193 ( 1.788 0.000 0.000) 1.788 17.451 ( -1.785 0.000 0.000) 1.785 17.592 ( 0.067 0.000 0.000) 0.067 18.292 ( -0.689 0.000 0.000) 0.689 18.359 ( -0.447 0.000 0.000) 0.447 19.988 ( 9.075 0.000 0.000) 9.075 21.455 ( 1.506 0.000 0.000) 1.506 21.882 ( -3.706 0.000 0.000) 3.706 22.006 ( -2.378 0.000 0.000) 2.378 27.720 ( 1.119 0.000 0.000) 1.119 27.992 ( -0.857 0.000 0.000) 0.857 28.012 ( -0.436 0.000 0.000) 0.436 28.048 ( -0.668 0.000 0.000) 0.668 37.151 ( 2.291 0.000 0.000) 2.291 37.584 ( 2.138 0.000 0.000) 2.138 38.019 ( -3.934 0.000 0.000) 3.934 38.199 ( -1.377 0.000 0.000) 1.377 38.433 ( 6.970 0.000 0.000) 6.970 38.540 ( 0.125 0.000 0.000) 0.125 38.655 ( -0.734 0.000 0.000) 0.734 41.100 ( -11.208 0.000 0.000) 11.208 ======================= Grid point 2 (3/120) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.024 ( 26.133 0.000 0.000) 26.133 1.318 ( 31.723 0.000 0.000) 31.723 1.911 ( 47.792 0.000 0.000) 47.792 2.952 ( -10.591 0.000 0.000) 10.591 2.959 ( -9.040 0.000 0.000) 9.040 3.055 ( -9.135 0.000 0.000) 9.135 3.117 ( -2.690 0.000 0.000) 2.690 3.434 ( -9.441 0.000 0.000) 9.441 3.714 ( 6.691 0.000 0.000) 6.691 3.926 ( -16.997 0.000 0.000) 16.997 4.257 ( 18.358 0.000 0.000) 18.358 4.382 ( -7.129 0.000 0.000) 7.129 5.370 ( 8.687 0.000 0.000) 8.687 5.399 ( -18.325 0.000 0.000) 18.325 5.558 ( 3.750 0.000 0.000) 3.750 5.604 ( -4.409 0.000 0.000) 4.409 5.669 ( 4.951 0.000 0.000) 4.951 5.811 ( 1.862 0.000 0.000) 1.862 5.968 ( 7.751 0.000 0.000) 7.751 6.207 ( 3.660 0.000 0.000) 3.660 6.906 ( 8.140 0.000 0.000) 8.140 7.056 ( 10.472 0.000 0.000) 10.472 7.253 ( 9.673 0.000 0.000) 9.673 7.314 ( 5.627 0.000 0.000) 5.627 7.523 ( 2.313 0.000 0.000) 2.313 7.616 ( -4.287 0.000 0.000) 4.287 8.123 ( -6.847 0.000 0.000) 6.847 8.287 ( 1.993 0.000 0.000) 1.993 8.420 ( -10.866 0.000 0.000) 10.866 8.736 ( 2.317 0.000 0.000) 2.317 9.357 ( -14.671 0.000 0.000) 14.671 9.768 ( -11.815 0.000 0.000) 11.815 10.133 ( -0.103 0.000 0.000) 0.103 10.232 ( 2.910 0.000 0.000) 2.910 10.561 ( -1.585 0.000 0.000) 1.585 10.642 ( -0.987 0.000 0.000) 0.987 16.628 ( 2.460 0.000 0.000) 2.460 16.963 ( -2.631 0.000 0.000) 2.631 16.981 ( 3.095 0.000 0.000) 3.095 17.243 ( 3.329 0.000 0.000) 3.329 17.401 ( -3.312 0.000 0.000) 3.312 17.587 ( -0.744 0.000 0.000) 0.744 18.277 ( -0.617 0.000 0.000) 0.617 18.347 ( -0.770 0.000 0.000) 0.770 20.235 ( 15.797 0.000 0.000) 15.797 21.498 ( 2.872 0.000 0.000) 2.872 21.771 ( -7.766 0.000 0.000) 7.766 21.940 ( -4.203 0.000 0.000) 4.203 27.752 ( 2.124 0.000 0.000) 2.124 27.973 ( -1.007 0.000 0.000) 1.007 28.000 ( -0.770 0.000 0.000) 0.770 28.026 ( -1.606 0.000 0.000) 1.606 37.216 ( 4.446 0.000 0.000) 4.446 37.645 ( 4.017 0.000 0.000) 4.017 37.915 ( -6.557 0.000 0.000) 6.557 38.155 ( -3.257 0.000 0.000) 3.257 38.544 ( 0.292 0.000 0.000) 0.292 38.631 ( 9.728 0.000 0.000) 9.728 38.637 ( 2.592 0.000 0.000) 2.592 40.792 ( -19.924 0.000 0.000) 19.924 ======================= Grid point 3 (4/120) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( 25.249 0.000 0.000) 25.249 1.892 ( 26.948 0.000 0.000) 26.948 2.741 ( -13.771 0.000 0.000) 13.771 2.811 ( 44.302 0.000 0.000) 44.302 2.813 ( -2.882 0.000 0.000) 2.882 2.850 ( -11.276 0.000 0.000) 11.276 3.075 ( -1.531 0.000 0.000) 1.531 3.246 ( -8.942 0.000 0.000) 8.942 3.566 ( -19.585 0.000 0.000) 19.585 3.848 ( 6.963 0.000 0.000) 6.963 4.247 ( -6.797 0.000 0.000) 6.797 4.612 ( 17.597 0.000 0.000) 17.597 4.962 ( -25.980 0.000 0.000) 25.980 5.477 ( -8.803 0.000 0.000) 8.803 5.529 ( 7.513 0.000 0.000) 7.513 5.642 ( 4.622 0.000 0.000) 4.622 5.747 ( 2.174 0.000 0.000) 2.174 5.828 ( -0.262 0.000 0.000) 0.262 6.099 ( 6.092 0.000 0.000) 6.092 6.264 ( 1.777 0.000 0.000) 1.777 7.100 ( 11.603 0.000 0.000) 11.603 7.296 ( 13.225 0.000 0.000) 13.225 7.409 ( 3.449 0.000 0.000) 3.449 7.494 ( 13.610 0.000 0.000) 13.610 7.544 ( -3.203 0.000 0.000) 3.203 7.613 ( 7.521 0.000 0.000) 7.521 7.992 ( -4.463 0.000 0.000) 4.463 8.172 ( -14.356 0.000 0.000) 14.356 8.222 ( -7.828 0.000 0.000) 7.828 8.863 ( 9.767 0.000 0.000) 9.767 9.014 ( -20.413 0.000 0.000) 20.413 9.531 ( -12.275 0.000 0.000) 12.275 10.146 ( 1.620 0.000 0.000) 1.620 10.279 ( 1.348 0.000 0.000) 1.348 10.524 ( -1.654 0.000 0.000) 1.654 10.614 ( -1.960 0.000 0.000) 1.960 16.685 ( 3.331 0.000 0.000) 3.331 16.903 ( -3.484 0.000 0.000) 3.484 17.052 ( 4.177 0.000 0.000) 4.177 17.319 ( 4.375 0.000 0.000) 4.375 17.326 ( -4.381 0.000 0.000) 4.381 17.557 ( -2.424 0.000 0.000) 2.424 18.273 ( 0.213 0.000 0.000) 0.213 18.330 ( -1.040 0.000 0.000) 1.040 20.579 ( 19.055 0.000 0.000) 19.055 21.565 ( 3.989 0.000 0.000) 3.989 21.577 ( -12.242 0.000 0.000) 12.242 21.849 ( -5.066 0.000 0.000) 5.066 27.801 ( 2.877 0.000 0.000) 2.877 27.956 ( -0.831 0.000 0.000) 0.831 27.983 ( -0.881 0.000 0.000) 0.881 27.987 ( -2.242 0.000 0.000) 2.242 37.321 ( 6.300 0.000 0.000) 6.300 37.737 ( 5.398 0.000 0.000) 5.398 37.773 ( -7.952 0.000 0.000) 7.952 38.074 ( -4.934 0.000 0.000) 4.934 38.552 ( 0.537 0.000 0.000) 0.537 38.610 ( -1.346 0.000 0.000) 1.346 38.953 ( 19.269 0.000 0.000) 19.269 40.352 ( -24.778 0.000 0.000) 24.778 ======================= Grid point 4 (5/120) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( 23.283 0.000 0.000) 23.283 2.336 ( 18.054 0.000 0.000) 18.054 2.417 ( -19.489 0.000 0.000) 19.489 2.616 ( -12.410 0.000 0.000) 12.410 2.877 ( 10.217 0.000 0.000) 10.217 3.065 ( 0.740 0.000 0.000) 0.740 3.113 ( -4.536 0.000 0.000) 4.536 3.180 ( -18.919 0.000 0.000) 18.919 3.640 ( 39.891 0.000 0.000) 39.891 3.982 ( 6.911 0.000 0.000) 6.911 4.115 ( -6.787 0.000 0.000) 6.787 4.360 ( -33.780 0.000 0.000) 33.780 4.967 ( 16.514 0.000 0.000) 16.514 5.261 ( -13.364 0.000 0.000) 13.364 5.658 ( 5.637 0.000 0.000) 5.637 5.730 ( 4.267 0.000 0.000) 4.267 5.741 ( -2.641 0.000 0.000) 2.641 5.799 ( -2.667 0.000 0.000) 2.667 6.206 ( 4.645 0.000 0.000) 4.645 6.267 ( -1.490 0.000 0.000) 1.490 7.339 ( 12.468 0.000 0.000) 12.468 7.454 ( 1.795 0.000 0.000) 1.795 7.491 ( -2.209 0.000 0.000) 2.209 7.522 ( 1.426 0.000 0.000) 1.426 7.611 ( 5.871 0.000 0.000) 5.871 7.802 ( 11.264 0.000 0.000) 11.264 7.878 ( -15.535 0.000 0.000) 15.535 8.027 ( -11.398 0.000 0.000) 11.398 8.137 ( 19.633 0.000 0.000) 19.633 8.580 ( -23.683 0.000 0.000) 23.683 9.074 ( 11.387 0.000 0.000) 11.387 9.298 ( -11.715 0.000 0.000) 11.715 10.197 ( 3.431 0.000 0.000) 3.431 10.264 ( -2.782 0.000 0.000) 2.782 10.522 ( 1.584 0.000 0.000) 1.584 10.568 ( -2.634 0.000 0.000) 2.634 16.755 ( 3.827 0.000 0.000) 3.827 16.830 ( -3.888 0.000 0.000) 3.888 17.140 ( 4.798 0.000 0.000) 4.798 17.235 ( -4.881 0.000 0.000) 4.881 17.408 ( 4.671 0.000 0.000) 4.671 17.494 ( -3.994 0.000 0.000) 3.994 18.285 ( 0.990 0.000 0.000) 0.990 18.307 ( -1.209 0.000 0.000) 1.209 20.953 ( 18.961 0.000 0.000) 18.961 21.299 ( -16.334 0.000 0.000) 16.334 21.651 ( 4.782 0.000 0.000) 4.782 21.748 ( -5.179 0.000 0.000) 5.179 27.861 ( 3.221 0.000 0.000) 3.221 27.922 ( -2.847 0.000 0.000) 2.847 27.961 ( -0.145 0.000 0.000) 0.145 27.968 ( -0.647 0.000 0.000) 0.647 37.458 ( 7.649 0.000 0.000) 7.649 37.614 ( -8.267 0.000 0.000) 8.267 37.850 ( 6.080 0.000 0.000) 6.080 37.968 ( -5.931 0.000 0.000) 5.931 38.566 ( 0.856 0.000 0.000) 0.856 38.585 ( -1.174 0.000 0.000) 1.174 39.372 ( 23.595 0.000 0.000) 23.595 39.855 ( -25.745 0.000 0.000) 25.745 ======================= Grid point 9 (6/120) ======================= q-point: ( 0.00 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.544 ( 0.000 27.453 0.000) 27.453 0.712 ( 0.000 36.183 0.000) 36.183 1.339 ( 0.000 64.308 0.000) 64.308 3.125 ( 0.000 -1.954 0.000) 1.954 3.242 ( 0.000 0.682 0.000) 0.682 3.347 ( 0.000 -3.685 0.000) 3.685 3.392 ( 0.000 16.885 0.000) 16.885 3.688 ( 0.000 4.179 0.000) 4.179 3.715 ( 0.000 3.093 0.000) 3.093 4.024 ( 0.000 18.397 0.000) 18.397 4.275 ( 0.000 -2.487 0.000) 2.487 4.688 ( 0.000 8.443 0.000) 8.443 5.158 ( 0.000 -5.625 0.000) 5.625 5.414 ( 0.000 15.037 0.000) 15.037 5.534 ( 0.000 16.114 0.000) 16.114 5.640 ( 0.000 5.634 0.000) 5.634 5.674 ( 0.000 -8.375 0.000) 8.375 5.747 ( 0.000 0.937 0.000) 0.937 5.990 ( 0.000 3.010 0.000) 3.010 6.194 ( 0.000 10.197 0.000) 10.197 6.584 ( 0.000 -5.395 0.000) 5.395 6.963 ( 0.000 20.077 0.000) 20.077 7.222 ( 0.000 3.675 0.000) 3.675 7.231 ( 0.000 15.116 0.000) 15.116 7.472 ( 0.000 -2.683 0.000) 2.683 7.688 ( 0.000 -6.636 0.000) 6.636 8.102 ( 0.000 0.460 0.000) 0.460 8.327 ( 0.000 5.840 0.000) 5.840 8.671 ( 0.000 1.792 0.000) 1.792 8.787 ( 0.000 2.104 0.000) 2.104 9.606 ( 0.000 -4.199 0.000) 4.199 10.010 ( 0.000 -5.649 0.000) 5.649 10.075 ( 0.000 -6.451 0.000) 6.451 10.474 ( 0.000 -2.749 0.000) 2.749 10.635 ( 0.000 -2.107 0.000) 2.107 11.104 ( 0.000 -0.575 0.000) 0.575 16.693 ( 0.000 10.987 0.000) 10.987 16.974 ( 0.000 5.476 0.000) 5.476 17.076 ( 0.000 -4.034 0.000) 4.034 17.322 ( 0.000 7.430 0.000) 7.430 17.486 ( 0.000 1.567 0.000) 1.567 17.576 ( 0.000 -1.398 0.000) 1.398 18.253 ( 0.000 -4.536 0.000) 4.536 18.272 ( 0.000 -8.571 0.000) 8.571 19.868 ( 0.000 0.071 0.000) 0.071 19.897 ( 0.000 -0.062 0.000) 0.062 21.916 ( 0.000 -0.109 0.000) 0.109 22.023 ( 0.000 -0.618 0.000) 0.618 27.668 ( 0.000 -3.961 0.000) 3.961 27.880 ( 0.000 -2.491 0.000) 2.491 27.970 ( 0.000 -4.513 0.000) 4.513 28.022 ( 0.000 -3.145 0.000) 3.145 37.181 ( 0.000 5.150 0.000) 5.150 37.606 ( 0.000 4.032 0.000) 4.032 38.178 ( 0.000 -2.839 0.000) 2.839 38.339 ( 0.000 -2.535 0.000) 2.535 38.541 ( 0.000 0.381 0.000) 0.381 38.808 ( 0.000 13.659 0.000) 13.659 41.005 ( 0.000 -1.475 0.000) 1.475 41.080 ( 0.000 -12.880 0.000) 12.880 ======================= Grid point 10 (7/120) ======================= q-point: ( 0.11 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.894 ( 25.167 18.755 0.000) 31.387 0.971 ( 22.732 25.575 0.000) 34.217 1.557 ( 22.779 52.103 0.000) 56.865 3.059 ( -6.113 -1.595 0.000) 6.318 3.155 ( -6.845 0.954 0.000) 6.911 3.255 ( -7.730 3.323 0.000) 8.414 3.395 ( -0.524 17.154 0.000) 17.162 3.583 ( -5.509 0.307 0.000) 5.518 3.860 ( -8.222 16.431 0.000) 18.373 3.920 ( 13.712 1.133 0.000) 13.758 4.213 ( -5.286 3.503 0.000) 6.341 4.626 ( -5.468 9.586 0.000) 11.036 5.412 ( 12.366 -10.786 0.000) 16.409 5.457 ( 3.484 7.921 0.000) 8.654 5.583 ( -3.149 3.007 0.000) 4.354 5.603 ( 0.739 12.731 0.000) 12.753 5.666 ( 3.389 4.565 0.000) 5.686 5.787 ( 3.185 3.955 0.000) 5.078 6.047 ( 4.819 8.409 0.000) 9.692 6.219 ( 2.495 9.145 0.000) 9.479 6.622 ( 4.999 -11.415 0.000) 12.462 6.989 ( 2.720 19.081 0.000) 19.274 7.197 ( 2.938 7.766 0.000) 8.303 7.366 ( 3.766 6.807 0.000) 7.779 7.520 ( 6.274 0.652 0.000) 6.307 7.643 ( -3.770 -5.622 0.000) 6.768 8.175 ( 6.098 -0.301 0.000) 6.105 8.288 ( -3.866 5.794 0.000) 6.966 8.620 ( -5.057 2.317 0.000) 5.563 8.762 ( -2.263 1.864 0.000) 2.932 9.532 ( -7.532 -4.166 0.000) 8.608 9.925 ( -7.854 -4.592 0.000) 9.098 10.070 ( -0.467 -6.365 0.000) 6.382 10.463 ( -2.580 0.956 0.000) 2.752 10.628 ( -0.809 -2.578 0.000) 2.702 10.697 ( -21.454 15.627 0.000) 26.542 16.702 ( 0.919 10.602 0.000) 10.641 16.991 ( 1.645 5.484 0.000) 5.726 17.059 ( -1.725 0.068 0.000) 1.726 17.232 ( -2.661 6.760 0.000) 7.265 17.472 ( -1.553 1.943 0.000) 2.488 17.577 ( 0.039 -1.417 0.000) 1.418 18.246 ( -0.657 -4.498 0.000) 4.546 18.273 ( -0.027 -8.318 0.000) 8.318 19.986 ( 9.035 -0.176 0.000) 9.037 20.592 ( 41.404 -38.270 0.000) 56.381 21.881 ( -3.721 -0.124 0.000) 3.723 21.998 ( -2.509 -0.729 0.000) 2.612 27.679 ( 1.093 -3.981 0.000) 4.129 27.907 ( 1.754 -4.914 0.000) 5.218 27.966 ( -0.363 -4.442 0.000) 4.457 28.002 ( -1.720 -3.293 0.000) 3.716 37.207 ( 2.687 5.515 0.000) 6.135 37.630 ( 2.439 4.329 0.000) 4.969 38.165 ( -1.406 -1.782 0.000) 2.270 38.405 ( 6.732 -2.754 0.000) 7.274 38.540 ( -0.083 0.161 0.000) 0.181 38.783 ( -2.522 12.383 0.000) 12.638 39.686 ( -76.863 72.070 0.000) 105.366 40.974 ( -10.715 -12.399 0.000) 16.387 ======================= Grid point 11 (8/120) ======================= q-point: ( 0.22 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.350 ( 22.121 20.623 0.000) 30.243 1.471 ( 27.014 14.994 0.000) 30.896 2.168 ( 37.225 27.376 0.000) 46.208 2.926 ( -6.601 1.405 0.000) 6.749 3.008 ( -8.302 -0.127 0.000) 8.303 3.085 ( -9.639 7.640 0.000) 12.300 3.361 ( -2.836 18.313 0.000) 18.531 3.453 ( -7.731 1.394 0.000) 7.856 3.719 ( -8.532 1.414 0.000) 8.648 4.121 ( -2.709 17.442 0.000) 17.651 4.206 ( 14.656 -2.940 0.000) 14.948 4.515 ( -4.808 10.874 0.000) 11.890 5.346 ( -16.453 -5.147 0.000) 17.239 5.507 ( -1.257 -7.133 0.000) 7.243 5.533 ( 4.334 2.481 0.000) 4.994 5.741 ( 7.833 29.753 0.000) 30.767 5.768 ( 5.440 1.508 0.000) 5.645 5.860 ( 4.812 10.138 0.000) 11.222 6.146 ( 4.965 14.067 0.000) 14.918 6.283 ( 3.810 7.312 0.000) 8.245 6.791 ( 12.118 -15.044 0.000) 19.317 7.072 ( 5.893 16.061 0.000) 17.108 7.324 ( 10.004 5.794 0.000) 11.561 7.387 ( 0.335 2.118 0.000) 2.144 7.569 ( -3.499 -4.055 0.000) 5.356 7.666 ( 7.478 10.100 0.000) 12.567 8.182 ( -6.881 5.895 0.000) 9.061 8.251 ( -1.439 -1.980 0.000) 2.447 8.499 ( -6.394 5.635 0.000) 8.523 8.734 ( 1.133 0.055 0.000) 1.134 9.319 ( -14.280 -3.764 0.000) 14.767 9.739 ( -10.868 -2.986 0.000) 11.271 10.063 ( 0.031 -6.265 0.000) 6.265 10.341 ( -6.078 8.435 0.000) 10.397 10.514 ( -3.161 -3.754 0.000) 4.908 10.603 ( -1.736 -3.748 0.000) 4.131 16.729 ( 1.834 9.618 0.000) 9.791 17.015 ( -2.662 3.781 0.000) 4.624 17.036 ( 3.009 5.413 0.000) 6.193 17.238 ( 2.362 0.740 0.000) 2.475 17.427 ( -3.008 2.487 0.000) 3.903 17.571 ( -0.806 -1.489 0.000) 1.693 18.232 ( -0.604 -4.435 0.000) 4.476 18.270 ( -0.239 -7.464 0.000) 7.468 20.232 ( 15.773 -0.236 0.000) 15.774 21.135 ( 17.814 -27.462 0.000) 32.734 21.770 ( -7.776 -0.151 0.000) 7.777 21.928 ( -4.586 -1.175 0.000) 4.734 27.710 ( 2.051 -4.062 0.000) 4.551 27.927 ( 0.314 -4.828 0.000) 4.839 27.956 ( -0.639 -4.243 0.000) 4.291 27.964 ( -2.069 -4.194 0.000) 4.677 37.285 ( 5.288 6.650 0.000) 8.497 37.699 ( 4.590 5.193 0.000) 6.931 38.117 ( -3.804 2.148 0.000) 4.369 38.539 ( -0.017 -0.403 0.000) 0.403 38.598 ( 13.064 -3.397 0.000) 13.499 38.651 ( -23.995 37.964 0.000) 44.911 38.752 ( -11.635 23.547 0.000) 26.265 40.679 ( -19.088 -11.104 0.000) 22.083 ======================= Grid point 12 (9/120) ======================= q-point: ( 0.33 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.774 ( 21.705 18.637 0.000) 28.608 1.977 ( 24.304 8.944 0.000) 25.898 2.827 ( -7.119 -0.051 0.000) 7.119 2.837 ( -1.783 3.557 0.000) 3.979 2.869 ( -13.096 9.608 0.000) 16.243 2.910 ( 33.358 10.838 0.000) 35.075 3.300 ( -2.218 17.858 0.000) 17.995 3.309 ( -6.226 5.424 0.000) 8.257 3.500 ( -13.009 0.185 0.000) 13.010 4.129 ( 3.069 22.043 0.000) 22.256 4.326 ( -4.276 6.926 0.000) 8.140 4.594 ( 14.432 -1.229 0.000) 14.484 4.958 ( -23.130 -0.124 0.000) 23.130 5.407 ( -8.485 -6.750 0.000) 10.842 5.625 ( 5.048 1.111 0.000) 5.169 5.823 ( 0.406 0.467 0.000) 0.619 5.878 ( 6.064 30.668 0.000) 31.261 5.974 ( 5.394 18.066 0.000) 18.854 6.231 ( 3.981 13.119 0.000) 13.709 6.350 ( 2.552 7.333 0.000) 7.765 7.069 ( 15.859 -13.198 0.000) 20.633 7.215 ( 8.505 10.586 0.000) 13.579 7.388 ( 0.673 -3.559 0.000) 3.622 7.516 ( -1.660 -1.456 0.000) 2.208 7.594 ( 15.709 8.867 0.000) 18.039 7.803 ( 6.511 10.944 0.000) 12.734 8.045 ( -5.479 6.493 0.000) 8.496 8.083 ( -13.741 -3.870 0.000) 14.276 8.363 ( -8.478 9.076 0.000) 12.420 8.845 ( 8.530 -1.911 0.000) 8.741 8.990 ( -18.587 -2.242 0.000) 18.721 9.516 ( -11.800 -1.548 0.000) 11.901 10.079 ( 1.776 -6.171 0.000) 6.421 10.271 ( -2.305 -0.313 0.000) 2.326 10.464 ( -1.915 -5.590 0.000) 5.909 10.560 ( -2.622 -5.067 0.000) 5.705 16.773 ( 2.636 8.366 0.000) 8.772 16.958 ( -3.178 4.982 0.000) 5.909 17.105 ( 3.962 5.122 0.000) 6.476 17.303 ( 4.081 -1.087 0.000) 4.223 17.359 ( -3.973 3.190 0.000) 5.095 17.540 ( -2.493 -1.599 0.000) 2.961 18.227 ( 0.112 -4.492 0.000) 4.493 18.263 ( -0.498 -6.455 0.000) 6.474 20.576 ( 19.066 -0.244 0.000) 19.068 21.391 ( 10.128 -15.159 0.000) 18.231 21.576 ( -12.245 -0.160 0.000) 12.246 21.825 ( -5.903 -2.257 0.000) 6.320 27.757 ( 2.731 -4.246 0.000) 5.048 27.922 ( -2.391 -4.819 0.000) 5.379 27.926 ( -0.218 -3.907 0.000) 3.913 27.943 ( -0.720 -3.955 0.000) 4.020 37.411 ( 7.705 8.676 0.000) 11.603 37.804 ( 6.170 6.522 0.000) 8.978 37.997 ( -9.048 11.665 0.000) 14.763 38.259 ( -13.244 23.593 0.000) 27.056 38.541 ( 0.362 -0.982 0.000) 1.047 38.654 ( -3.824 5.103 0.000) 6.377 38.908 ( 18.626 -4.427 0.000) 19.145 40.256 ( -23.806 -9.350 0.000) 25.577 ======================= Grid point 13 (10/120) ======================= q-point: ( 0.44 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 20.733 15.065 0.000) 25.628 2.382 ( 16.634 5.387 0.000) 17.484 2.567 ( -17.885 11.977 0.000) 21.524 2.635 ( -10.700 2.710 0.000) 11.038 2.891 ( 7.941 1.423 0.000) 8.067 3.106 ( -10.646 -2.118 0.000) 10.855 3.236 ( -1.043 11.267 0.000) 11.315 3.273 ( -5.636 14.946 0.000) 15.973 3.682 ( 32.281 6.691 0.000) 32.967 4.168 ( -13.919 5.235 0.000) 14.871 4.225 ( 7.067 20.606 0.000) 21.784 4.483 ( -22.137 12.011 0.000) 25.185 4.907 ( 15.861 -6.006 0.000) 16.960 5.193 ( -13.215 -6.812 0.000) 14.867 5.722 ( 4.704 0.796 0.000) 4.771 5.798 ( -2.842 0.743 0.000) 2.938 5.975 ( 3.953 28.799 0.000) 29.069 6.023 ( -0.454 25.195 0.000) 25.199 6.312 ( 4.099 9.877 0.000) 10.694 6.366 ( -1.074 8.620 0.000) 8.687 7.351 ( 7.215 -7.809 0.000) 10.632 7.357 ( 4.113 -0.885 0.000) 4.207 7.443 ( 10.144 -6.045 0.000) 11.809 7.533 ( 4.424 6.616 0.000) 7.959 7.705 ( -6.205 10.943 0.000) 12.580 7.779 ( -16.343 -5.066 0.000) 17.111 7.972 ( 11.117 9.528 0.000) 14.641 8.147 ( 17.614 2.796 0.000) 17.834 8.176 ( -10.272 10.489 0.000) 14.681 8.565 ( -22.605 -1.346 0.000) 22.645 9.064 ( 11.387 -0.947 0.000) 11.426 9.288 ( -11.631 -0.981 0.000) 11.673 10.134 ( 3.757 -5.828 0.000) 6.934 10.213 ( -3.896 -4.565 0.000) 6.001 10.458 ( 1.440 -5.974 0.000) 6.145 10.505 ( -2.917 -5.937 0.000) 6.615 16.830 ( 3.181 7.101 0.000) 7.781 16.894 ( -3.373 5.963 0.000) 6.851 17.187 ( 4.467 4.584 0.000) 6.401 17.275 ( -4.485 3.859 0.000) 5.917 17.390 ( 4.602 -1.517 0.000) 4.846 17.476 ( -4.019 -1.652 0.000) 4.346 18.236 ( 0.708 -4.837 0.000) 4.888 18.251 ( -0.760 -5.521 0.000) 5.573 20.950 ( 18.985 -0.208 0.000) 18.987 21.297 ( -16.348 -0.172 0.000) 16.349 21.561 ( 7.784 -8.246 0.000) 11.340 21.702 ( -6.777 -4.390 0.000) 8.074 27.813 ( 3.008 -4.549 0.000) 5.453 27.871 ( -2.843 -4.881 0.000) 5.649 27.924 ( 0.097 -3.503 0.000) 3.505 27.930 ( -0.524 -3.656 0.000) 3.693 37.582 ( 9.818 11.715 0.000) 15.285 37.789 ( -11.259 15.058 0.000) 18.802 37.933 ( 6.985 8.161 0.000) 10.742 38.073 ( -7.617 10.944 0.000) 13.334 38.556 ( 1.212 -0.905 0.000) 1.513 38.592 ( -2.535 0.878 0.000) 2.683 39.313 ( 22.789 -5.820 0.000) 23.520 39.779 ( -24.807 -7.503 0.000) 25.917 ======================= Grid point 18 (11/120) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 0.000 27.329 0.000) 27.329 1.424 ( 0.000 35.253 0.000) 35.253 2.478 ( 0.000 48.194 0.000) 48.194 3.092 ( 0.000 -1.034 0.000) 1.034 3.290 ( 0.000 5.319 0.000) 5.319 3.300 ( 0.000 -0.575 0.000) 0.575 3.753 ( 0.000 16.751 0.000) 16.751 3.773 ( 0.000 4.220 0.000) 4.220 3.773 ( 0.000 2.148 0.000) 2.148 4.134 ( 0.000 -5.828 0.000) 5.828 4.568 ( 0.000 28.920 0.000) 28.920 4.863 ( 0.000 7.091 0.000) 7.091 5.031 ( 0.000 -6.553 0.000) 6.553 5.469 ( 0.000 -10.701 0.000) 10.701 5.501 ( 0.000 3.114 0.000) 3.114 5.779 ( 0.000 7.447 0.000) 7.447 5.782 ( 0.000 2.807 0.000) 2.807 5.963 ( 0.000 12.047 0.000) 12.047 6.079 ( 0.000 6.074 0.000) 6.074 6.462 ( 0.000 -6.150 0.000) 6.150 6.707 ( 0.000 42.990 0.000) 42.990 7.322 ( 0.000 0.289 0.000) 0.289 7.335 ( 0.000 7.861 0.000) 7.861 7.370 ( 0.000 -6.011 0.000) 6.011 7.611 ( 0.000 19.433 0.000) 19.433 7.665 ( 0.000 17.835 0.000) 17.835 8.118 ( 0.000 1.226 0.000) 1.226 8.489 ( 0.000 10.381 0.000) 10.381 8.679 ( 0.000 -0.977 0.000) 0.977 8.840 ( 0.000 2.515 0.000) 2.515 9.496 ( 0.000 -6.474 0.000) 6.474 9.851 ( 0.000 -10.224 0.000) 10.224 9.960 ( 0.000 -3.312 0.000) 3.312 10.417 ( 0.000 -2.244 0.000) 2.244 10.577 ( 0.000 -3.711 0.000) 3.711 11.084 ( 0.000 -1.599 0.000) 1.599 16.971 ( 0.000 15.698 0.000) 15.698 17.026 ( 0.000 -0.975 0.000) 0.975 17.119 ( 0.000 8.538 0.000) 8.538 17.466 ( 0.000 6.872 0.000) 6.872 17.522 ( 0.000 1.725 0.000) 1.725 17.544 ( 0.000 -1.379 0.000) 1.379 18.049 ( 0.000 -12.941 0.000) 12.941 18.127 ( 0.000 -7.870 0.000) 7.870 19.870 ( 0.000 0.135 0.000) 0.135 19.895 ( 0.000 -0.131 0.000) 0.131 21.914 ( 0.000 -0.110 0.000) 0.110 22.005 ( 0.000 -1.102 0.000) 1.102 27.566 ( 0.000 -5.943 0.000) 5.943 27.813 ( 0.000 -3.971 0.000) 3.971 27.846 ( 0.000 -7.729 0.000) 7.729 27.936 ( 0.000 -5.284 0.000) 5.284 37.319 ( 0.000 8.276 0.000) 8.276 37.704 ( 0.000 5.186 0.000) 5.186 38.117 ( 0.000 -3.069 0.000) 3.069 38.270 ( 0.000 -4.248 0.000) 4.248 38.570 ( 0.000 3.153 0.000) 3.153 39.162 ( 0.000 21.107 0.000) 21.107 40.726 ( 0.000 -22.003 0.000) 22.003 40.957 ( 0.000 -3.609 0.000) 3.609 ======================= Grid point 19 (12/120) ======================= q-point: ( 0.11 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.292 ( 18.215 21.742 0.000) 28.364 1.554 ( 12.594 31.349 0.000) 33.784 2.564 ( 8.912 43.625 0.000) 44.526 3.062 ( -2.687 1.777 0.000) 3.222 3.221 ( -6.039 7.164 0.000) 9.370 3.294 ( -1.434 0.938 0.000) 1.714 3.604 ( -8.159 1.728 0.000) 8.340 3.738 ( -2.550 13.730 0.000) 13.965 3.950 ( 9.517 1.402 0.000) 9.620 4.023 ( -8.897 2.317 0.000) 9.194 4.507 ( -0.947 23.737 0.000) 23.756 4.829 ( -3.224 8.572 0.000) 9.158 5.237 ( 12.231 -6.473 0.000) 13.838 5.399 ( -6.680 -9.518 0.000) 11.629 5.519 ( 1.913 3.019 0.000) 3.574 5.754 ( 0.965 4.314 0.000) 4.421 5.922 ( 9.569 8.155 0.000) 12.572 6.054 ( 8.431 11.008 0.000) 13.865 6.121 ( 5.264 1.526 0.000) 5.481 6.519 ( 5.754 -1.088 0.000) 5.856 6.708 ( 0.058 42.788 0.000) 42.788 7.268 ( -1.742 -0.113 0.000) 1.746 7.310 ( -1.076 -1.677 0.000) 1.993 7.460 ( 3.434 0.010 0.000) 3.434 7.661 ( -0.227 19.926 0.000) 19.927 7.688 ( 8.252 17.582 0.000) 19.422 8.178 ( 5.187 0.736 0.000) 5.239 8.452 ( -3.777 10.661 0.000) 11.310 8.634 ( -4.137 -0.857 0.000) 4.225 8.821 ( -1.956 3.489 0.000) 4.000 9.421 ( -7.518 -6.585 0.000) 9.993 9.793 ( -5.598 -8.654 0.000) 10.306 9.953 ( -0.750 -3.753 0.000) 3.827 10.405 ( -1.384 -3.432 0.000) 3.701 10.559 ( -1.837 -4.205 0.000) 4.589 10.895 ( -16.462 4.856 0.000) 17.164 16.968 ( -0.171 14.888 0.000) 14.889 17.034 ( 0.770 -0.967 0.000) 1.236 17.137 ( 1.699 8.702 0.000) 8.866 17.394 ( -5.089 7.872 0.000) 9.374 17.520 ( -0.803 2.600 0.000) 2.721 17.546 ( 0.033 -1.336 0.000) 1.337 18.057 ( 0.737 -12.580 0.000) 12.602 18.121 ( -0.538 -7.773 0.000) 7.792 19.982 ( 8.994 -0.261 0.000) 8.997 20.169 ( 25.319 -10.479 0.000) 27.401 21.878 ( -3.757 -0.130 0.000) 3.759 21.978 ( -2.822 -1.263 0.000) 3.091 27.576 ( 1.043 -5.966 0.000) 6.057 27.816 ( 0.162 -4.565 0.000) 4.568 27.844 ( -0.163 -7.604 0.000) 7.606 27.916 ( -1.840 -5.202 0.000) 5.518 37.354 ( 3.653 8.809 0.000) 9.537 37.736 ( 3.320 5.734 0.000) 6.626 38.121 ( 0.415 -2.388 0.000) 2.423 38.329 ( 6.099 -4.637 0.000) 7.662 38.562 ( -0.788 2.667 0.000) 2.781 39.112 ( -5.007 19.952 0.000) 20.571 40.452 ( -43.779 16.773 0.000) 46.882 40.633 ( -9.408 -21.203 0.000) 23.197 ======================= Grid point 20 (13/120) ======================= q-point: ( 0.22 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 20.861 15.314 0.000) 25.878 1.869 ( 18.722 23.782 0.000) 30.268 2.800 ( 12.666 23.789 0.000) 26.951 2.999 ( -3.822 5.581 0.000) 6.764 3.108 ( -3.228 16.113 0.000) 16.433 3.223 ( -5.807 5.779 0.000) 8.193 3.471 ( -5.162 0.318 0.000) 5.172 3.628 ( -7.722 5.617 0.000) 9.549 3.886 ( -5.273 16.223 0.000) 17.059 4.154 ( 11.688 -2.559 0.000) 11.965 4.541 ( 3.373 23.173 0.000) 23.417 4.747 ( -5.127 9.868 0.000) 11.120 5.227 ( -10.740 -4.613 0.000) 11.689 5.346 ( -1.310 -7.832 0.000) 7.941 5.574 ( 3.726 2.998 0.000) 4.782 5.806 ( 3.673 3.107 0.000) 4.811 6.102 ( 9.344 12.806 0.000) 15.852 6.248 ( 10.556 8.870 0.000) 13.788 6.309 ( 12.651 -1.289 0.000) 12.716 6.675 ( 10.107 5.352 0.000) 11.436 6.708 ( -0.075 42.294 0.000) 42.294 7.272 ( 1.272 -5.725 0.000) 5.865 7.289 ( -0.917 -5.104 0.000) 5.186 7.527 ( 5.369 3.753 0.000) 6.551 7.667 ( 1.009 22.408 0.000) 22.431 7.886 ( 10.706 14.254 0.000) 17.827 8.233 ( -2.872 0.362 0.000) 2.895 8.349 ( -6.501 11.234 0.000) 12.979 8.575 ( 0.262 1.041 0.000) 1.074 8.767 ( -3.019 4.124 0.000) 5.111 9.216 ( -13.242 -6.211 0.000) 14.626 9.651 ( -8.603 -5.775 0.000) 10.362 9.938 ( -0.528 -4.936 0.000) 4.964 10.358 ( -3.545 -5.297 0.000) 6.374 10.508 ( -3.302 -5.459 0.000) 6.380 10.570 ( -14.871 7.830 0.000) 16.806 16.968 ( 0.243 13.195 0.000) 13.198 17.051 ( 0.805 0.096 0.000) 0.810 17.181 ( 2.749 8.618 0.000) 9.046 17.318 ( -2.276 6.634 0.000) 7.014 17.491 ( -2.057 3.679 0.000) 4.215 17.539 ( -0.858 -1.267 0.000) 1.530 18.074 ( 0.989 -11.520 0.000) 11.563 18.110 ( -0.507 -7.567 0.000) 7.584 20.227 ( 15.741 -0.273 0.000) 15.744 20.672 ( 24.016 -17.618 0.000) 29.785 21.766 ( -7.804 -0.171 0.000) 7.806 21.897 ( -5.487 -1.890 0.000) 5.803 27.605 ( 1.916 -6.050 0.000) 6.346 27.816 ( -0.300 -5.699 0.000) 5.707 27.840 ( -0.275 -7.252 0.000) 7.257 27.874 ( -2.242 -5.130 0.000) 5.599 37.460 ( 7.299 10.442 0.000) 12.740 37.830 ( 6.298 7.386 0.000) 9.707 38.131 ( 0.503 -0.210 0.000) 0.545 38.504 ( 11.811 -5.796 0.000) 13.157 38.542 ( -1.191 1.297 0.000) 1.761 38.973 ( -9.120 16.725 0.000) 19.049 39.578 ( -41.435 32.727 0.000) 52.800 40.373 ( -16.853 -19.036 0.000) 25.424 ======================= Grid point 21 (14/120) ======================= q-point: ( 0.33 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( 19.351 11.698 0.000) 22.612 2.240 ( 18.457 16.776 0.000) 24.942 2.847 ( -5.194 1.170 0.000) 5.324 2.919 ( -3.776 5.044 0.000) 6.300 3.067 ( -10.375 8.568 0.000) 13.456 3.205 ( 3.823 14.905 0.000) 15.388 3.427 ( 1.111 6.226 0.000) 6.324 3.555 ( 6.602 14.460 0.000) 15.896 3.781 ( -5.821 21.179 0.000) 21.965 4.389 ( 10.661 -3.306 0.000) 11.162 4.616 ( 4.087 25.275 0.000) 25.603 4.629 ( -6.231 3.996 0.000) 7.403 5.003 ( -11.435 7.191 0.000) 13.508 5.228 ( -9.682 -10.053 0.000) 13.957 5.660 ( 4.959 3.091 0.000) 5.843 5.856 ( 0.868 3.058 0.000) 3.179 6.302 ( 10.557 13.640 0.000) 17.248 6.430 ( 7.375 6.726 0.000) 9.981 6.527 ( 8.584 10.426 0.000) 13.504 6.706 ( -0.131 41.266 0.000) 41.266 6.921 ( 15.340 1.625 0.000) 15.426 7.275 ( -0.566 -7.329 0.000) 7.351 7.288 ( 0.526 -6.121 0.000) 6.144 7.704 ( 2.715 20.774 0.000) 20.950 7.713 ( 13.503 -0.105 0.000) 13.503 8.046 ( -14.116 0.775 0.000) 14.137 8.061 ( 5.293 18.707 0.000) 19.441 8.229 ( -3.424 10.222 0.000) 10.781 8.557 ( -5.867 10.489 0.000) 12.019 8.781 ( 2.679 -4.657 0.000) 5.373 8.940 ( -11.289 -2.100 0.000) 11.482 9.467 ( -10.213 -3.291 0.000) 10.730 9.945 ( 1.554 -6.084 0.000) 6.279 10.259 ( -6.905 -3.436 0.000) 7.713 10.365 ( -5.635 -0.490 0.000) 5.656 10.435 ( -3.960 -6.832 0.000) 7.897 16.979 ( 0.912 11.270 0.000) 11.307 17.055 ( -0.571 3.461 0.000) 3.508 17.240 ( 3.284 7.925 0.000) 8.578 17.311 ( 1.356 2.688 0.000) 3.011 17.443 ( -2.767 5.075 0.000) 5.780 17.507 ( -2.467 -1.109 0.000) 2.705 18.092 ( 0.797 -10.150 0.000) 10.181 18.104 ( -0.075 -7.511 0.000) 7.511 20.571 ( 19.096 -0.254 0.000) 19.098 21.074 ( 17.620 -14.956 0.000) 23.112 21.572 ( -12.247 -0.184 0.000) 12.249 21.767 ( -7.813 -3.358 0.000) 8.504 27.648 ( 2.482 -6.216 0.000) 6.693 27.796 ( -1.862 -6.572 0.000) 6.831 27.834 ( -0.268 -6.739 0.000) 6.745 27.841 ( -0.959 -5.133 0.000) 5.222 37.637 ( 10.789 13.190 0.000) 17.041 37.975 ( 8.450 10.040 0.000) 13.123 38.133 ( -0.665 4.120 0.000) 4.173 38.523 ( -0.568 -0.535 0.000) 0.780 38.735 ( -9.243 10.199 0.000) 13.764 38.798 ( 10.180 -2.038 0.000) 10.382 38.926 ( -23.519 25.340 0.000) 34.573 39.999 ( -21.176 -16.052 0.000) 26.573 ======================= Grid point 22 (15/120) ======================= q-point: ( 0.44 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( 16.131 7.935 0.000) 17.977 2.532 ( 9.125 8.771 0.000) 12.657 2.745 ( -4.133 7.008 0.000) 8.136 2.810 ( -11.478 12.084 0.000) 16.667 2.928 ( 3.061 2.079 0.000) 3.700 3.089 ( -10.483 2.857 0.000) 10.865 3.503 ( 6.055 14.493 0.000) 15.706 3.636 ( -6.935 19.301 0.000) 20.509 3.910 ( 21.596 14.852 0.000) 26.210 4.302 ( -16.795 7.191 0.000) 18.270 4.700 ( 4.805 25.611 0.000) 26.058 4.729 ( 12.939 -9.005 0.000) 15.764 4.819 ( -6.845 18.558 0.000) 19.780 5.000 ( -13.245 -11.827 0.000) 17.757 5.758 ( 4.840 3.316 0.000) 5.867 5.836 ( -2.802 3.409 0.000) 4.413 6.470 ( 5.878 11.230 0.000) 12.675 6.515 ( 1.189 7.211 0.000) 7.308 6.643 ( 3.989 25.378 0.000) 25.689 6.695 ( -1.367 36.663 0.000) 36.689 7.209 ( 8.765 -6.218 0.000) 10.747 7.263 ( -0.824 -7.986 0.000) 8.028 7.350 ( 10.775 -2.211 0.000) 10.999 7.661 ( -14.427 1.198 0.000) 14.477 7.850 ( 1.832 15.734 0.000) 15.841 7.935 ( -0.375 4.168 0.000) 4.184 8.094 ( 10.979 13.087 0.000) 17.082 8.320 ( 9.442 11.416 0.000) 14.815 8.375 ( -12.598 7.789 0.000) 14.811 8.558 ( -15.417 2.862 0.000) 15.680 9.038 ( 11.193 -1.511 0.000) 11.295 9.259 ( -11.189 -1.908 0.000) 11.351 10.004 ( 4.594 -6.046 0.000) 7.593 10.118 ( -6.907 -4.278 0.000) 8.125 10.323 ( 0.446 -6.196 0.000) 6.212 10.363 ( -3.238 -7.404 0.000) 8.081 17.003 ( 1.451 9.218 0.000) 9.332 17.033 ( -1.510 6.819 0.000) 6.984 17.305 ( 3.325 6.495 0.000) 7.296 17.349 ( 0.753 0.987 0.000) 1.242 17.397 ( -0.516 5.165 0.000) 5.191 17.447 ( -3.537 -0.313 0.000) 3.551 18.103 ( 0.316 -8.851 0.000) 8.857 18.105 ( 0.052 -7.915 0.000) 7.915 20.946 ( 19.033 -0.209 0.000) 19.034 21.293 ( -16.369 -0.183 0.000) 16.370 21.369 ( 13.127 -10.085 0.000) 16.554 21.594 ( -10.148 -6.036 0.000) 11.808 27.699 ( 2.691 -6.436 0.000) 6.976 27.751 ( -2.584 -6.604 0.000) 7.091 27.830 ( -0.097 -6.170 0.000) 6.171 27.831 ( -0.218 -5.634 0.000) 5.639 37.871 ( 12.802 16.176 0.000) 20.629 38.076 ( -6.477 12.149 0.000) 13.768 38.151 ( 9.634 12.972 0.000) 16.158 38.388 ( -16.455 18.257 0.000) 24.578 38.536 ( 2.587 -0.834 0.000) 2.718 38.645 ( -8.846 5.648 0.000) 10.495 39.154 ( 20.496 -9.777 0.000) 22.709 39.573 ( -22.228 -12.840 0.000) 25.670 ======================= Grid point 27 (16/120) ======================= q-point: ( 0.00 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( 0.000 26.595 0.000) 26.595 2.088 ( 0.000 31.200 0.000) 31.200 3.019 ( 0.000 4.439 0.000) 4.439 3.086 ( 0.000 0.220 0.000) 0.220 3.330 ( 0.000 3.496 0.000) 3.496 3.635 ( 0.000 30.072 0.000) 30.072 3.780 ( 0.000 -1.747 0.000) 1.747 3.858 ( 0.000 4.788 0.000) 4.788 3.988 ( 0.000 6.548 0.000) 6.548 4.019 ( 0.000 -4.240 0.000) 4.240 4.847 ( 0.000 -10.505 0.000) 10.505 4.917 ( 0.000 -4.879 0.000) 4.879 5.128 ( 0.000 24.910 0.000) 24.910 5.373 ( 0.000 3.095 0.000) 3.095 5.581 ( 0.000 4.897 0.000) 4.897 5.866 ( 0.000 5.911 0.000) 5.911 5.887 ( 0.000 2.121 0.000) 2.121 6.090 ( 0.000 3.320 0.000) 3.320 6.243 ( 0.000 10.734 0.000) 10.734 6.372 ( 0.000 -2.327 0.000) 2.327 7.075 ( 0.000 -17.922 0.000) 17.922 7.199 ( 0.000 -11.096 0.000) 11.096 7.535 ( 0.000 12.236 0.000) 12.236 7.622 ( 0.000 43.787 0.000) 43.787 7.955 ( 0.000 13.893 0.000) 13.893 8.153 ( 0.000 2.429 0.000) 2.429 8.163 ( 0.000 21.163 0.000) 21.163 8.636 ( 0.000 -2.889 0.000) 2.889 8.715 ( 0.000 11.367 0.000) 11.367 8.916 ( 0.000 7.437 0.000) 7.437 9.372 ( 0.000 -5.351 0.000) 5.351 9.617 ( 0.000 -13.014 0.000) 13.014 9.977 ( 0.000 4.551 0.000) 4.551 10.422 ( 0.000 3.566 0.000) 3.566 10.492 ( 0.000 -4.837 0.000) 4.837 11.036 ( 0.000 -3.457 0.000) 3.457 17.037 ( 0.000 1.978 0.000) 1.978 17.262 ( 0.000 12.479 0.000) 12.479 17.276 ( 0.000 6.156 0.000) 6.156 17.524 ( 0.000 -2.927 0.000) 2.927 17.548 ( 0.000 2.608 0.000) 2.608 17.586 ( 0.000 5.153 0.000) 5.153 17.813 ( 0.000 -8.975 0.000) 8.975 17.959 ( 0.000 -8.473 0.000) 8.473 19.873 ( 0.000 0.190 0.000) 0.190 19.892 ( 0.000 -0.199 0.000) 0.199 21.913 ( 0.000 0.074 0.000) 0.074 21.981 ( 0.000 -1.344 0.000) 1.344 27.453 ( 0.000 -4.925 0.000) 4.925 27.678 ( 0.000 -8.738 0.000) 8.738 27.734 ( 0.000 -3.764 0.000) 3.764 27.824 ( 0.000 -5.673 0.000) 5.673 37.490 ( 0.000 8.576 0.000) 8.576 37.785 ( 0.000 2.554 0.000) 2.554 38.063 ( 0.000 -2.255 0.000) 2.255 38.180 ( 0.000 -4.615 0.000) 4.615 38.688 ( 0.000 9.097 0.000) 9.097 39.606 ( 0.000 22.951 0.000) 22.951 40.245 ( 0.000 -25.640 0.000) 25.640 40.855 ( 0.000 -6.828 0.000) 6.828 ======================= Grid point 28 (17/120) ======================= q-point: ( 0.11 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( 11.046 23.092 0.000) 25.598 2.164 ( 7.549 29.366 0.000) 30.321 2.999 ( -2.208 1.864 0.000) 2.890 3.113 ( 2.402 2.676 0.000) 3.596 3.322 ( -0.918 2.561 0.000) 2.721 3.631 ( -0.037 30.310 0.000) 30.310 3.634 ( -9.532 0.797 0.000) 9.565 3.868 ( -7.597 2.783 0.000) 8.091 3.969 ( 6.517 0.852 0.000) 6.572 4.098 ( 4.170 4.003 0.000) 5.780 4.822 ( -2.616 -10.777 0.000) 11.090 4.864 ( -1.683 5.202 0.000) 5.467 5.269 ( 8.687 13.899 0.000) 16.391 5.350 ( -1.864 6.260 0.000) 6.532 5.603 ( 2.146 5.385 0.000) 5.797 5.852 ( 0.756 5.600 0.000) 5.651 5.996 ( 8.783 -0.269 0.000) 8.787 6.155 ( 6.242 1.828 0.000) 6.504 6.236 ( 1.669 9.368 0.000) 9.515 6.519 ( 12.793 0.643 0.000) 12.810 7.063 ( -1.096 -17.319 0.000) 17.353 7.172 ( -2.334 -9.501 0.000) 9.784 7.542 ( 0.765 9.247 0.000) 9.279 7.614 ( -0.947 42.580 0.000) 42.590 8.005 ( 4.931 12.416 0.000) 13.359 8.148 ( -0.482 16.895 0.000) 16.902 8.218 ( 4.989 6.397 0.000) 8.113 8.599 ( -3.499 -2.177 0.000) 4.121 8.694 ( -2.178 12.603 0.000) 12.789 8.915 ( -0.176 7.682 0.000) 7.684 9.298 ( -7.435 -5.076 0.000) 9.003 9.589 ( -2.858 -11.729 0.000) 12.072 9.956 ( -2.036 3.887 0.000) 4.387 10.388 ( -3.442 2.738 0.000) 4.399 10.467 ( -2.455 -4.935 0.000) 5.512 10.932 ( -9.921 -0.601 0.000) 9.939 17.040 ( 0.469 1.705 0.000) 1.768 17.230 ( -1.924 9.628 0.000) 9.818 17.309 ( 1.931 8.146 0.000) 8.372 17.492 ( -3.022 -0.255 0.000) 3.033 17.551 ( 0.260 2.791 0.000) 2.803 17.579 ( -0.515 4.161 0.000) 4.193 17.826 ( 1.256 -8.994 0.000) 9.081 17.957 ( -0.232 -8.231 0.000) 8.234 19.977 ( 9.080 -0.178 0.000) 9.081 20.046 ( 15.837 -3.444 0.000) 16.207 21.877 ( -3.785 0.070 0.000) 3.786 21.950 ( -3.167 -1.495 0.000) 3.502 27.463 ( 0.991 -4.956 0.000) 5.054 27.680 ( 0.121 -8.585 0.000) 8.586 27.728 ( -0.540 -4.003 0.000) 4.039 27.807 ( -1.669 -5.544 0.000) 5.790 37.536 ( 4.703 9.031 0.000) 10.182 37.829 ( 4.480 3.066 0.000) 5.429 38.078 ( 1.549 -1.796 0.000) 2.372 38.231 ( 5.204 -5.090 0.000) 7.280 38.669 ( -1.921 8.513 0.000) 8.727 39.536 ( -7.161 21.926 0.000) 23.065 40.169 ( -7.678 -24.736 0.000) 25.900 40.595 ( -24.787 0.336 0.000) 24.790 ======================= Grid point 29 (18/120) ======================= q-point: ( 0.22 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( 14.454 16.222 0.000) 21.727 2.362 ( 12.160 24.884 0.000) 27.696 2.931 ( -4.587 -1.789 0.000) 4.924 3.130 ( -2.761 6.942 0.000) 7.471 3.307 ( -0.763 2.797 0.000) 2.899 3.474 ( -4.618 0.129 0.000) 4.620 3.600 ( -5.261 16.885 0.000) 17.686 3.792 ( 2.832 18.487 0.000) 18.702 4.101 ( 7.427 -2.589 0.000) 7.866 4.158 ( 1.478 9.047 0.000) 9.167 4.743 ( -5.539 -10.022 0.000) 11.451 4.866 ( 0.787 3.202 0.000) 3.297 5.315 ( -1.604 13.083 0.000) 13.181 5.350 ( -0.801 14.040 0.000) 14.062 5.663 ( 4.014 5.970 0.000) 7.194 5.893 ( 3.129 5.550 0.000) 6.371 6.227 ( 14.866 -3.088 0.000) 15.183 6.306 ( 8.582 -0.458 0.000) 8.595 6.336 ( 8.388 8.863 0.000) 12.203 6.812 ( 15.960 4.146 0.000) 16.490 7.042 ( -0.914 -16.085 0.000) 16.111 7.130 ( -1.384 -9.153 0.000) 9.257 7.572 ( 2.832 4.932 0.000) 5.687 7.580 ( -2.802 38.654 0.000) 38.755 8.126 ( -2.351 15.625 0.000) 15.801 8.133 ( 7.920 8.165 0.000) 11.375 8.288 ( -0.775 7.536 0.000) 7.576 8.559 ( 2.482 -1.580 0.000) 2.942 8.636 ( -3.596 16.266 0.000) 16.659 8.897 ( -2.374 9.023 0.000) 9.330 9.103 ( -11.674 -4.146 0.000) 12.388 9.510 ( -5.124 -8.515 0.000) 9.938 9.909 ( -2.370 2.358 0.000) 3.343 10.295 ( -5.863 0.678 0.000) 5.902 10.401 ( -4.153 -5.076 0.000) 6.558 10.693 ( -13.608 3.937 0.000) 14.166 17.058 ( 1.372 1.164 0.000) 1.800 17.195 ( -1.588 8.425 0.000) 8.574 17.345 ( 1.810 6.894 0.000) 7.128 17.428 ( -3.057 2.235 0.000) 3.787 17.551 ( -0.400 3.379 0.000) 3.403 17.568 ( -0.683 4.320 0.000) 4.373 17.858 ( 1.980 -8.834 0.000) 9.053 17.953 ( -0.120 -7.648 0.000) 7.649 20.223 ( 15.809 -0.016 0.000) 15.809 20.423 ( 21.361 -8.414 0.000) 22.958 21.765 ( -7.828 0.061 0.000) 7.828 21.857 ( -6.434 -2.045 0.000) 6.751 27.490 ( 1.800 -5.047 0.000) 5.358 27.683 ( 0.242 -8.153 0.000) 8.157 27.712 ( -1.257 -4.606 0.000) 4.774 27.767 ( -2.135 -5.361 0.000) 5.771 37.673 ( 9.429 10.397 0.000) 14.036 37.957 ( 8.744 4.689 0.000) 9.922 38.122 ( 2.928 -0.406 0.000) 2.956 38.380 ( 10.055 -6.498 0.000) 11.971 38.616 ( -3.407 6.758 0.000) 7.568 39.338 ( -12.940 19.115 0.000) 23.083 39.957 ( -13.851 -22.254 0.000) 26.213 40.002 ( -33.656 11.627 0.000) 35.608 ======================= Grid point 30 (19/120) ======================= q-point: ( 0.33 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 14.484 9.633 0.000) 17.395 2.600 ( 10.894 18.412 0.000) 21.394 2.842 ( -3.780 -2.003 0.000) 4.278 3.026 ( -5.446 5.333 0.000) 7.623 3.193 ( -9.473 4.684 0.000) 10.568 3.454 ( -8.821 12.019 0.000) 14.909 3.553 ( 10.096 6.187 0.000) 11.841 3.942 ( 10.537 20.543 0.000) 23.088 4.140 ( -3.377 13.770 0.000) 14.178 4.265 ( 9.441 -7.323 0.000) 11.948 4.610 ( -7.944 -5.669 0.000) 9.760 4.844 ( -4.130 -8.564 0.000) 9.508 5.288 ( -1.262 19.401 0.000) 19.442 5.289 ( -3.484 22.944 0.000) 23.207 5.756 ( 5.386 6.575 0.000) 8.499 5.946 ( 1.574 5.965 0.000) 6.169 6.463 ( 7.148 -1.573 0.000) 7.319 6.469 ( 8.168 1.269 0.000) 8.266 6.608 ( 19.649 4.033 0.000) 20.059 7.031 ( 3.180 -2.173 0.000) 3.852 7.032 ( -0.092 -14.914 0.000) 14.915 7.197 ( 11.166 0.900 0.000) 11.203 7.495 ( -6.313 31.610 0.000) 32.234 7.677 ( 8.485 0.436 0.000) 8.496 8.005 ( -11.218 6.511 0.000) 12.971 8.217 ( -3.553 15.688 0.000) 16.085 8.297 ( 8.329 3.221 0.000) 8.930 8.567 ( -2.798 21.834 0.000) 22.013 8.666 ( 0.225 -5.914 0.000) 5.919 8.778 ( -5.525 11.239 0.000) 12.524 8.937 ( -3.328 2.495 0.000) 4.159 9.390 ( -7.315 -4.578 0.000) 8.629 9.885 ( 0.458 0.872 0.000) 0.985 10.174 ( -6.304 -1.614 0.000) 6.507 10.316 ( -4.233 -4.719 0.000) 6.340 10.441 ( -11.496 5.256 0.000) 12.641 17.091 ( 1.890 1.181 0.000) 2.229 17.169 ( -1.148 6.852 0.000) 6.948 17.376 ( 1.186 4.362 0.000) 4.521 17.384 ( -1.363 2.512 0.000) 2.858 17.536 ( -1.055 4.979 0.000) 5.089 17.551 ( -1.002 5.784 0.000) 5.870 17.898 ( 1.954 -8.341 0.000) 8.567 17.952 ( -0.039 -7.174 0.000) 7.174 20.569 ( 19.161 0.119 0.000) 19.162 20.832 ( 20.056 -9.481 0.000) 22.184 21.570 ( -12.226 0.083 0.000) 12.227 21.700 ( -9.718 -3.255 0.000) 10.248 27.531 ( 2.319 -5.181 0.000) 5.676 27.677 ( -2.265 -5.154 0.000) 5.630 27.689 ( 0.384 -7.523 0.000) 7.533 27.733 ( -1.362 -5.507 0.000) 5.673 37.900 ( 13.872 12.659 0.000) 18.780 38.164 ( 12.325 7.833 0.000) 14.603 38.188 ( 3.815 2.050 0.000) 4.331 38.544 ( -3.624 3.607 0.000) 5.113 38.614 ( 13.781 -8.672 0.000) 16.282 39.048 ( -16.471 15.206 0.000) 22.417 39.367 ( -30.419 16.286 0.000) 34.505 39.647 ( -17.554 -18.756 0.000) 25.689 ======================= Grid point 31 (20/120) ======================= q-point: ( 0.44 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( 11.903 4.906 0.000) 12.874 2.693 ( -2.423 7.030 0.000) 7.435 2.817 ( 2.110 0.194 0.000) 2.119 2.939 ( -8.117 0.436 0.000) 8.129 3.088 ( 5.143 14.872 0.000) 15.736 3.267 ( -10.293 13.912 0.000) 17.306 3.780 ( 12.215 12.834 0.000) 17.718 3.993 ( -8.707 16.229 0.000) 18.417 4.191 ( 11.451 11.467 0.000) 16.206 4.392 ( -5.610 -1.008 0.000) 5.700 4.505 ( 6.144 -9.360 0.000) 11.197 4.698 ( -10.061 -15.281 0.000) 18.296 5.255 ( -0.196 27.299 0.000) 27.300 5.266 ( -0.998 24.318 0.000) 24.339 5.861 ( 5.074 7.079 0.000) 8.710 5.938 ( -2.423 6.900 0.000) 7.313 6.566 ( 3.099 -1.282 0.000) 3.354 6.574 ( 2.500 -0.066 0.000) 2.501 7.000 ( 19.313 9.025 0.000) 21.318 7.036 ( 0.386 -13.639 0.000) 13.644 7.043 ( -0.230 -10.722 0.000) 10.724 7.316 ( -12.622 20.801 0.000) 24.331 7.452 ( 13.782 10.732 0.000) 17.468 7.734 ( -15.112 7.670 0.000) 16.947 7.899 ( 13.432 -2.339 0.000) 13.634 8.127 ( -7.939 6.985 0.000) 10.575 8.410 ( 2.414 7.396 0.000) 7.780 8.486 ( -8.279 6.511 0.000) 10.533 8.582 ( 5.602 18.827 0.000) 19.643 8.721 ( -6.618 11.063 0.000) 12.891 9.025 ( 10.093 1.183 0.000) 10.162 9.224 ( -9.706 -1.140 0.000) 9.773 9.936 ( 4.754 -0.103 0.000) 4.755 10.052 ( -6.431 -1.688 0.000) 6.648 10.254 ( -1.674 -2.809 0.000) 3.270 10.277 ( -4.755 1.844 0.000) 5.100 17.125 ( 1.486 2.569 0.000) 2.968 17.148 ( -1.020 4.821 0.000) 4.928 17.375 ( 0.357 1.462 0.000) 1.505 17.385 ( -0.252 1.442 0.000) 1.464 17.522 ( -0.124 7.398 0.000) 7.399 17.531 ( -0.936 7.364 0.000) 7.424 17.930 ( 1.312 -7.696 0.000) 7.807 17.947 ( -0.497 -7.208 0.000) 7.225 20.945 ( 19.059 0.173 0.000) 19.060 21.190 ( 16.708 -7.733 0.000) 18.411 21.292 ( -16.349 0.143 0.000) 16.350 21.479 ( -13.122 -5.267 0.000) 14.140 27.578 ( 2.561 -5.301 0.000) 5.887 27.629 ( -2.602 -5.325 0.000) 5.926 27.698 ( 0.575 -6.803 0.000) 6.827 27.712 ( -0.842 -6.092 0.000) 6.150 38.186 ( 13.085 14.986 0.000) 19.895 38.259 ( 2.685 6.647 0.000) 7.169 38.404 ( 10.099 11.518 0.000) 15.318 38.533 ( 7.197 0.767 0.000) 7.238 38.677 ( -17.337 10.539 0.000) 20.289 38.834 ( -17.336 9.275 0.000) 19.662 38.961 ( 11.357 -6.663 0.000) 13.167 39.293 ( -18.483 -14.791 0.000) 23.673 ======================= Grid point 36 (21/120) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( 0.000 24.570 0.000) 24.570 2.634 ( 0.000 23.131 0.000) 23.131 2.912 ( 0.000 -12.284 0.000) 12.284 3.081 ( 0.000 -1.597 0.000) 1.597 3.425 ( 0.000 5.646 0.000) 5.646 3.698 ( 0.000 -6.447 0.000) 6.447 3.938 ( 0.000 0.757 0.000) 0.757 3.986 ( 0.000 8.835 0.000) 8.835 4.029 ( 0.000 -1.379 0.000) 1.379 4.252 ( 0.000 24.526 0.000) 24.526 4.545 ( 0.000 -17.205 0.000) 17.205 4.818 ( 0.000 -6.099 0.000) 6.099 5.506 ( 0.000 13.672 0.000) 13.672 5.508 ( 0.000 8.191 0.000) 8.191 5.668 ( 0.000 2.633 0.000) 2.633 5.849 ( 0.000 -5.132 0.000) 5.132 6.024 ( 0.000 10.046 0.000) 10.046 6.158 ( 0.000 5.204 0.000) 5.204 6.349 ( 0.000 -1.863 0.000) 1.863 6.484 ( 0.000 12.379 0.000) 12.379 6.694 ( 0.000 -19.464 0.000) 19.464 6.948 ( 0.000 -13.324 0.000) 13.324 7.808 ( 0.000 14.598 0.000) 14.598 8.131 ( 0.000 3.135 0.000) 3.135 8.205 ( 0.000 4.671 0.000) 4.671 8.317 ( 0.000 22.507 0.000) 22.507 8.350 ( 0.000 -0.230 0.000) 0.230 8.604 ( 0.000 -0.245 0.000) 0.245 8.910 ( 0.000 8.644 0.000) 8.644 9.150 ( 0.000 12.944 0.000) 12.944 9.311 ( 0.000 -0.446 0.000) 0.446 9.350 ( 0.000 -13.530 0.000) 13.530 10.105 ( 0.000 7.507 0.000) 7.507 10.385 ( 0.000 -6.001 0.000) 6.001 10.564 ( 0.000 10.059 0.000) 10.059 10.939 ( 0.000 -6.505 0.000) 6.505 17.102 ( 0.000 4.596 0.000) 4.596 17.353 ( 0.000 2.592 0.000) 2.592 17.387 ( 0.000 -9.120 0.000) 9.120 17.422 ( 0.000 2.971 0.000) 2.971 17.647 ( 0.000 6.136 0.000) 6.136 17.667 ( 0.000 3.038 0.000) 3.038 17.727 ( 0.000 -1.226 0.000) 1.226 17.821 ( 0.000 -4.850 0.000) 4.850 19.878 ( 0.000 0.234 0.000) 0.234 19.888 ( 0.000 -0.246 0.000) 0.246 21.918 ( 0.000 0.456 0.000) 0.456 21.954 ( 0.000 -1.278 0.000) 1.278 27.388 ( 0.000 -1.280 0.000) 1.280 27.517 ( 0.000 -7.176 0.000) 7.176 27.676 ( 0.000 -1.801 0.000) 1.801 27.724 ( 0.000 -4.130 0.000) 4.130 37.644 ( 0.000 6.697 0.000) 6.697 37.799 ( 0.000 -0.997 0.000) 0.997 38.033 ( 0.000 -0.563 0.000) 0.563 38.096 ( 0.000 -3.594 0.000) 3.594 38.933 ( 0.000 15.453 0.000) 15.453 39.742 ( 0.000 -24.509 0.000) 24.509 40.043 ( 0.000 20.613 0.000) 20.613 40.679 ( 0.000 -11.157 0.000) 11.157 ======================= Grid point 37 (22/120) ======================= q-point: ( 0.11 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( 5.503 21.937 0.000) 22.616 2.686 ( 5.213 22.563 0.000) 23.157 2.888 ( -2.402 -11.120 0.000) 11.376 3.135 ( 5.341 -1.210 0.000) 5.476 3.400 ( -2.650 4.877 0.000) 5.550 3.611 ( -7.632 -3.631 0.000) 8.452 3.883 ( -4.298 3.651 0.000) 5.640 4.020 ( 2.821 5.674 0.000) 6.336 4.055 ( 2.033 -0.397 0.000) 2.072 4.279 ( 2.580 21.300 0.000) 21.455 4.524 ( -1.955 -16.675 0.000) 16.790 4.820 ( -0.078 -6.051 0.000) 6.051 5.534 ( 2.725 9.950 0.000) 10.316 5.601 ( 8.413 14.766 0.000) 16.994 5.709 ( 3.742 3.840 0.000) 5.362 5.910 ( 5.872 -1.971 0.000) 6.194 6.050 ( 2.853 8.460 0.000) 8.928 6.187 ( 3.062 3.251 0.000) 4.465 6.360 ( 1.903 0.678 0.000) 2.020 6.570 ( 8.542 5.400 0.000) 10.106 6.691 ( -0.210 -19.106 0.000) 19.107 6.936 ( -1.189 -12.977 0.000) 13.031 7.793 ( -1.165 14.693 0.000) 14.739 8.149 ( 1.775 1.611 0.000) 2.397 8.211 ( -1.763 10.304 0.000) 10.453 8.267 ( -0.990 7.758 0.000) 7.821 8.414 ( 4.047 7.985 0.000) 8.952 8.576 ( -2.636 -0.008 0.000) 2.636 8.911 ( 0.089 9.433 0.000) 9.433 9.134 ( -1.597 11.515 0.000) 11.625 9.251 ( -6.022 0.681 0.000) 6.061 9.342 ( -0.812 -12.699 0.000) 12.725 10.078 ( -2.540 7.650 0.000) 8.060 10.362 ( -2.224 -5.784 0.000) 6.197 10.522 ( -4.296 9.914 0.000) 10.805 10.876 ( -6.261 -5.161 0.000) 8.114 17.101 ( 0.027 4.448 0.000) 4.448 17.336 ( -1.570 3.020 0.000) 3.404 17.381 ( -0.618 -8.626 0.000) 8.648 17.422 ( -0.048 1.883 0.000) 1.884 17.653 ( 0.551 6.207 0.000) 6.231 17.663 ( -0.284 3.577 0.000) 3.588 17.736 ( 0.863 -1.409 0.000) 1.652 17.825 ( 0.403 -4.501 0.000) 4.519 19.976 ( 9.357 0.128 0.000) 9.358 20.002 ( 11.771 -1.381 0.000) 11.852 21.882 ( -3.760 0.490 0.000) 3.792 21.921 ( -3.451 -1.395 0.000) 3.722 27.397 ( 0.896 -1.349 0.000) 1.619 27.521 ( 0.432 -7.024 0.000) 7.037 27.667 ( -0.906 -1.960 0.000) 2.159 27.709 ( -1.433 -3.990 0.000) 4.240 37.696 ( 5.402 6.917 0.000) 8.776 37.851 ( 5.276 -0.738 0.000) 5.327 38.057 ( 2.415 -0.151 0.000) 2.420 38.138 ( 4.220 -4.076 0.000) 5.867 38.902 ( -3.080 14.873 0.000) 15.189 39.684 ( -5.910 -23.663 0.000) 24.390 39.952 ( -9.255 19.472 0.000) 21.560 40.514 ( -16.244 -8.000 0.000) 18.107 ======================= Grid point 38 (23/120) ======================= q-point: ( 0.22 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( 7.293 15.830 0.000) 17.429 2.820 ( 7.780 20.572 0.000) 21.994 2.825 ( -3.646 -8.417 0.000) 9.173 3.231 ( -0.979 1.733 0.000) 1.991 3.346 ( 0.076 1.826 0.000) 1.828 3.466 ( -3.925 -1.587 0.000) 4.233 3.800 ( -4.152 8.921 0.000) 9.840 4.084 ( 3.754 2.240 0.000) 4.372 4.109 ( 3.602 0.973 0.000) 3.731 4.334 ( 2.556 15.396 0.000) 15.607 4.482 ( -2.080 -14.355 0.000) 14.505 4.788 ( -4.037 -6.678 0.000) 7.804 5.607 ( 4.365 14.224 0.000) 14.879 5.754 ( 5.650 20.999 0.000) 21.746 5.797 ( 5.210 6.461 0.000) 8.300 6.019 ( 4.087 6.697 0.000) 7.846 6.188 ( 12.044 -0.696 0.000) 12.064 6.274 ( 5.630 -1.188 0.000) 5.754 6.445 ( 7.247 0.869 0.000) 7.299 6.689 ( 0.071 -18.400 0.000) 18.400 6.796 ( 12.744 -4.360 0.000) 13.469 6.915 ( 0.840 -10.783 0.000) 10.815 7.783 ( 0.690 14.662 0.000) 14.678 8.107 ( -7.821 13.943 0.000) 15.986 8.197 ( 3.255 -1.723 0.000) 3.683 8.254 ( -3.591 2.357 0.000) 4.296 8.479 ( 0.998 6.731 0.000) 6.805 8.540 ( 0.900 -0.141 0.000) 0.911 8.912 ( 0.039 11.176 0.000) 11.176 9.088 ( -3.891 6.057 0.000) 7.199 9.102 ( -7.453 6.264 0.000) 9.735 9.318 ( -1.700 -10.512 0.000) 10.649 10.020 ( -2.932 8.102 0.000) 8.616 10.305 ( -3.354 -4.940 0.000) 5.971 10.406 ( -7.299 9.539 0.000) 12.011 10.712 ( -10.030 -2.202 0.000) 10.269 17.108 ( 0.748 3.976 0.000) 4.045 17.299 ( -2.110 3.344 0.000) 3.954 17.365 ( -0.906 -7.127 0.000) 7.184 17.416 ( -0.645 -0.154 0.000) 0.663 17.661 ( 0.129 4.447 0.000) 4.449 17.664 ( 0.480 6.565 0.000) 6.582 17.760 ( 1.550 -1.939 0.000) 2.482 17.836 ( 0.631 -3.845 0.000) 3.897 20.229 ( 16.130 0.636 0.000) 16.142 20.307 ( 18.596 -3.950 0.000) 19.011 21.771 ( -7.779 0.576 0.000) 7.801 21.819 ( -7.142 -1.779 0.000) 7.360 27.422 ( 1.631 -1.537 0.000) 2.241 27.533 ( 0.805 -6.599 0.000) 6.648 27.641 ( -1.742 -2.297 0.000) 2.883 27.674 ( -2.048 -3.783 0.000) 4.302 37.854 ( 10.794 7.541 0.000) 13.167 38.003 ( 10.433 0.053 0.000) 10.433 38.126 ( 4.644 1.061 0.000) 4.763 38.258 ( 8.134 -5.497 0.000) 9.817 38.817 ( -5.643 13.241 0.000) 14.393 39.520 ( -10.722 -21.312 0.000) 23.857 39.697 ( -16.450 16.519 0.000) 23.313 40.092 ( -25.863 -1.504 0.000) 25.907 ======================= Grid point 39 (24/120) ======================= q-point: ( 0.33 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( 8.255 9.240 0.000) 12.391 2.769 ( -1.515 -5.236 0.000) 5.450 2.919 ( -0.489 12.531 0.000) 12.541 3.102 ( -8.245 1.510 0.000) 8.382 3.302 ( -0.377 7.802 0.000) 7.811 3.624 ( 14.932 -0.913 0.000) 14.960 3.712 ( -5.360 13.977 0.000) 14.969 4.166 ( 4.568 -0.700 0.000) 4.621 4.189 ( 4.280 -1.350 0.000) 4.488 4.357 ( -0.755 11.637 0.000) 11.662 4.450 ( -1.259 -9.677 0.000) 9.758 4.649 ( -9.886 -7.015 0.000) 12.122 5.688 ( 3.695 19.457 0.000) 19.805 5.806 ( 0.295 26.355 0.000) 26.357 5.910 ( 6.263 8.182 0.000) 10.304 6.088 ( 2.822 8.253 0.000) 8.722 6.390 ( 5.852 -4.918 0.000) 7.644 6.404 ( 7.739 -6.034 0.000) 9.814 6.658 ( 12.206 -6.564 0.000) 13.859 6.695 ( 0.502 -18.048 0.000) 18.055 6.877 ( 4.410 -2.869 0.000) 5.261 7.165 ( 18.552 -6.718 0.000) 19.731 7.837 ( 5.192 13.919 0.000) 14.856 7.904 ( -13.492 11.563 0.000) 17.769 8.105 ( -10.792 2.548 0.000) 11.088 8.281 ( 5.469 -4.646 0.000) 7.176 8.424 ( -7.166 5.294 0.000) 8.909 8.575 ( 0.344 -3.096 0.000) 3.115 8.911 ( -0.166 12.509 0.000) 12.510 8.984 ( -2.771 8.540 0.000) 8.978 9.034 ( -1.645 5.451 0.000) 5.694 9.274 ( -2.980 -7.338 0.000) 7.920 9.985 ( -0.261 8.407 0.000) 8.411 10.247 ( -2.204 -3.033 0.000) 3.749 10.254 ( -7.959 8.896 0.000) 11.937 10.509 ( -10.385 0.480 0.000) 10.396 17.132 ( 1.692 3.313 0.000) 3.720 17.257 ( -2.195 3.202 0.000) 3.882 17.351 ( -0.376 -5.349 0.000) 5.362 17.397 ( -1.231 -1.958 0.000) 2.313 17.666 ( 0.302 5.356 0.000) 5.365 17.671 ( 0.220 7.035 0.000) 7.038 17.793 ( 1.801 -2.613 0.000) 3.173 17.846 ( 0.295 -3.455 0.000) 3.468 20.579 ( 19.328 1.026 0.000) 19.355 20.689 ( 20.095 -5.216 0.000) 20.761 21.578 ( -12.114 0.728 0.000) 12.136 21.642 ( -11.041 -2.542 0.000) 11.330 27.459 ( 2.124 -1.798 0.000) 2.783 27.552 ( 1.098 -5.982 0.000) 6.082 27.600 ( -2.420 -2.435 0.000) 3.434 27.636 ( -1.813 -3.966 0.000) 4.361 38.114 ( 15.889 8.487 0.000) 18.013 38.235 ( 6.453 3.003 0.000) 7.118 38.254 ( 15.244 1.313 0.000) 15.300 38.449 ( 11.276 -7.741 0.000) 13.677 38.690 ( -7.189 10.846 0.000) 13.012 39.280 ( -13.634 -17.904 0.000) 22.504 39.334 ( -20.458 12.841 0.000) 24.154 39.560 ( -27.892 3.604 0.000) 28.124 ======================= Grid point 40 (25/120) ======================= q-point: ( 0.44 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( 9.085 4.626 0.000) 10.195 2.789 ( 4.051 -2.493 0.000) 4.756 2.808 ( -8.156 4.720 0.000) 9.423 2.927 ( -9.293 -1.438 0.000) 9.404 3.409 ( 8.875 16.887 0.000) 19.078 3.581 ( -8.123 17.037 0.000) 18.875 3.946 ( 17.231 -0.496 0.000) 17.238 4.231 ( -6.386 -6.284 0.000) 8.959 4.247 ( 3.217 -3.647 0.000) 4.863 4.278 ( -3.367 6.862 0.000) 7.643 4.433 ( -0.220 -3.319 0.000) 3.326 4.472 ( -5.593 -3.194 0.000) 6.441 5.748 ( 2.596 23.661 0.000) 23.803 5.789 ( -1.625 26.260 0.000) 26.311 6.028 ( 5.498 9.215 0.000) 10.731 6.103 ( -1.688 9.426 0.000) 9.576 6.481 ( 3.003 -6.674 0.000) 7.319 6.493 ( 1.864 -7.158 0.000) 7.397 6.709 ( 0.982 -18.468 0.000) 18.494 6.731 ( -0.952 -18.846 0.000) 18.870 7.176 ( 21.309 8.894 0.000) 23.091 7.530 ( 18.319 -4.788 0.000) 18.934 7.582 ( -19.373 9.351 0.000) 21.512 7.856 ( -14.889 -0.047 0.000) 14.889 7.987 ( 10.087 11.478 0.000) 15.280 8.215 ( -12.631 6.894 0.000) 14.390 8.407 ( 7.187 -5.421 0.000) 9.002 8.532 ( -4.767 -3.542 0.000) 5.939 8.909 ( 0.188 12.039 0.000) 12.040 8.931 ( -2.287 9.021 0.000) 9.307 9.089 ( 5.661 2.832 0.000) 6.330 9.198 ( -4.934 -2.877 0.000) 5.711 10.017 ( 3.464 7.955 0.000) 8.677 10.113 ( -6.274 7.998 0.000) 10.166 10.240 ( 1.943 -0.181 0.000) 1.951 10.331 ( -7.348 1.498 0.000) 7.499 17.170 ( 2.199 2.856 0.000) 3.605 17.214 ( -2.242 2.888 0.000) 3.656 17.353 ( 0.570 -4.009 0.000) 4.050 17.372 ( -1.259 -3.089 0.000) 3.335 17.671 ( 0.182 6.325 0.000) 6.328 17.673 ( 0.013 7.001 0.000) 7.001 17.825 ( 1.392 -3.100 0.000) 3.398 17.844 ( -0.538 -3.314 0.000) 3.357 20.956 ( 19.035 1.105 0.000) 19.067 21.066 ( 18.308 -4.856 0.000) 18.941 21.302 ( -16.220 0.946 0.000) 16.247 21.390 ( -14.938 -3.695 0.000) 15.388 27.503 ( 2.407 -2.069 0.000) 3.174 27.551 ( -2.546 -2.300 0.000) 3.432 27.575 ( 1.334 -5.271 0.000) 5.437 27.603 ( -1.551 -4.557 0.000) 4.813 38.372 ( 7.446 5.613 0.000) 9.325 38.445 ( 13.282 10.530 0.000) 16.950 38.546 ( 2.822 2.530 0.000) 3.790 38.608 ( 15.138 6.976 0.000) 16.668 38.675 ( 9.800 -9.002 0.000) 13.307 38.932 ( -18.910 8.436 0.000) 20.707 39.008 ( -13.554 -13.525 0.000) 19.148 39.047 ( -23.736 4.897 0.000) 24.236 ======================= Grid point 45 (26/120) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( 0.000 -20.304 0.000) 20.304 2.581 ( 0.000 20.304 0.000) 20.304 2.973 ( 0.000 -10.698 0.000) 10.698 2.973 ( 0.000 10.698 0.000) 10.698 3.551 ( 0.000 -7.333 0.000) 7.333 3.551 ( 0.000 7.333 0.000) 7.333 3.977 ( 0.000 -3.011 0.000) 3.011 3.977 ( 0.000 3.011 0.000) 3.011 4.221 ( 0.000 -14.686 0.000) 14.686 4.221 ( 0.000 14.686 0.000) 14.686 4.632 ( 0.000 -13.638 0.000) 13.638 4.632 ( 0.000 13.638 0.000) 13.638 5.646 ( 0.000 -4.812 0.000) 4.812 5.646 ( 0.000 4.812 0.000) 4.812 5.713 ( 0.000 -8.290 0.000) 8.290 5.713 ( 0.000 8.290 0.000) 8.290 6.235 ( 0.000 -9.643 0.000) 9.643 6.235 ( 0.000 9.643 0.000) 9.643 6.349 ( 0.000 -14.287 0.000) 14.287 6.349 ( 0.000 14.287 0.000) 14.287 6.708 ( 0.000 -10.836 0.000) 10.836 6.708 ( 0.000 10.836 0.000) 10.836 8.063 ( 0.000 -9.510 0.000) 9.510 8.063 ( 0.000 9.510 0.000) 9.510 8.288 ( 0.000 -4.261 0.000) 4.261 8.288 ( 0.000 4.261 0.000) 4.261 8.572 ( 0.000 -4.877 0.000) 4.877 8.572 ( 0.000 4.877 0.000) 4.877 9.100 ( 0.000 -11.229 0.000) 11.229 9.100 ( 0.000 11.229 0.000) 11.229 9.309 ( 0.000 -2.429 0.000) 2.429 9.309 ( 0.000 2.429 0.000) 2.429 10.253 ( 0.000 -7.225 0.000) 7.225 10.253 ( 0.000 7.225 0.000) 7.225 10.774 ( 0.000 -10.027 0.000) 10.027 10.774 ( 0.000 10.027 0.000) 10.027 17.219 ( 0.000 -7.306 0.000) 7.306 17.219 ( 0.000 7.306 0.000) 7.306 17.407 ( 0.000 -2.779 0.000) 2.779 17.407 ( 0.000 2.779 0.000) 2.779 17.709 ( 0.000 -1.239 0.000) 1.239 17.709 ( 0.000 1.239 0.000) 1.239 17.748 ( 0.000 -3.790 0.000) 3.790 17.748 ( 0.000 3.790 0.000) 3.790 19.883 ( 0.000 -0.257 0.000) 0.257 19.883 ( 0.000 0.257 0.000) 0.257 21.932 ( 0.000 -0.928 0.000) 0.928 21.932 ( 0.000 0.928 0.000) 0.928 27.409 ( 0.000 -3.401 0.000) 3.401 27.409 ( 0.000 3.401 0.000) 3.401 27.670 ( 0.000 -1.240 0.000) 1.240 27.670 ( 0.000 1.240 0.000) 1.240 37.750 ( 0.000 -3.952 0.000) 3.952 37.750 ( 0.000 3.952 0.000) 3.952 38.044 ( 0.000 -1.625 0.000) 1.625 38.044 ( 0.000 1.625 0.000) 1.625 39.292 ( 0.000 -20.627 0.000) 20.627 39.292 ( 0.000 20.627 0.000) 20.627 40.409 ( 0.000 -16.112 0.000) 16.112 40.409 ( 0.000 16.112 0.000) 16.112 ======================= Grid point 47 (27/120) ======================= q-point: ( 0.11 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( 0.925 -18.140 0.000) 18.164 2.592 ( 0.925 18.140 0.000) 18.164 3.025 ( 5.137 -11.035 0.000) 12.172 3.025 ( 5.137 11.035 0.000) 12.172 3.505 ( -4.554 -5.877 0.000) 7.435 3.505 ( -4.554 5.877 0.000) 7.435 3.974 ( 0.038 -5.262 0.000) 5.262 3.974 ( 0.038 5.262 0.000) 5.262 4.216 ( -0.342 -13.560 0.000) 13.564 4.216 ( -0.342 13.560 0.000) 13.564 4.636 ( 0.099 -13.293 0.000) 13.293 4.636 ( 0.099 13.293 0.000) 13.293 5.696 ( 4.861 -5.324 0.000) 7.209 5.696 ( 4.861 5.324 0.000) 7.209 5.815 ( 9.775 -7.385 0.000) 12.251 5.815 ( 9.775 7.385 0.000) 12.251 6.256 ( 2.057 -9.926 0.000) 10.137 6.256 ( 2.057 9.926 0.000) 10.137 6.353 ( 0.454 -13.754 0.000) 13.762 6.353 ( 0.454 13.754 0.000) 13.762 6.713 ( 0.840 -8.896 0.000) 8.936 6.713 ( 0.840 8.896 0.000) 8.936 8.058 ( -0.319 -10.313 0.000) 10.318 8.058 ( -0.319 10.313 0.000) 10.318 8.293 ( -0.027 -2.659 0.000) 2.659 8.293 ( -0.027 2.659 0.000) 2.659 8.558 ( -1.200 -3.308 0.000) 3.519 8.558 ( -1.200 3.308 0.000) 3.519 9.105 ( 0.417 -10.876 0.000) 10.884 9.105 ( 0.417 10.876 0.000) 10.884 9.269 ( -3.923 -1.644 0.000) 4.254 9.269 ( -3.923 1.644 0.000) 4.254 10.232 ( -2.024 -7.404 0.000) 7.676 10.232 ( -2.024 7.404 0.000) 7.676 10.727 ( -4.669 -9.624 0.000) 10.696 10.727 ( -4.669 9.624 0.000) 10.696 17.217 ( -0.168 -7.259 0.000) 7.261 17.217 ( -0.168 7.259 0.000) 7.261 17.396 ( -1.126 -3.068 0.000) 3.268 17.396 ( -1.126 3.068 0.000) 3.268 17.713 ( 0.479 -1.545 0.000) 1.617 17.713 ( 0.479 1.545 0.000) 1.617 17.755 ( 0.671 -3.792 0.000) 3.851 17.755 ( 0.671 3.792 0.000) 3.851 19.983 ( 10.051 -0.598 0.000) 10.069 19.983 ( 10.051 0.598 0.000) 10.069 21.897 ( -3.650 -1.006 0.000) 3.786 21.897 ( -3.650 1.006 0.000) 3.786 27.416 ( 0.708 -3.282 0.000) 3.358 27.416 ( 0.708 3.282 0.000) 3.358 27.658 ( -1.181 -1.098 0.000) 1.612 27.658 ( -1.181 1.098 0.000) 1.612 37.804 ( 5.579 -3.918 0.000) 6.817 37.804 ( 5.579 3.918 0.000) 6.817 38.076 ( 3.276 -2.068 0.000) 3.875 38.076 ( 3.276 2.068 0.000) 3.875 39.249 ( -4.351 -19.923 0.000) 20.393 39.249 ( -4.351 19.923 0.000) 20.393 40.290 ( -11.905 -14.425 0.000) 18.703 40.290 ( -11.905 14.425 0.000) 18.703 ======================= Grid point 49 (28/120) ======================= q-point: ( 0.22 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( 0.896 -13.093 0.000) 13.123 2.609 ( 0.896 13.093 0.000) 13.123 3.143 ( 4.590 -10.986 0.000) 11.906 3.143 ( 4.590 10.986 0.000) 11.906 3.404 ( -3.515 -3.781 0.000) 5.163 3.404 ( -3.515 3.781 0.000) 5.163 3.986 ( 1.020 -9.324 0.000) 9.379 3.986 ( 1.020 9.324 0.000) 9.379 4.220 ( 1.036 -11.067 0.000) 11.116 4.220 ( 1.036 11.067 0.000) 11.116 4.620 ( -2.186 -11.181 0.000) 11.393 4.620 ( -2.186 11.181 0.000) 11.393 5.820 ( 7.589 -5.846 0.000) 9.580 5.820 ( 7.589 5.846 0.000) 9.580 6.045 ( 12.299 -6.716 0.000) 14.014 6.045 ( 12.299 6.716 0.000) 14.014 6.305 ( 2.400 -12.692 0.000) 12.917 6.305 ( 2.400 12.692 0.000) 12.917 6.367 ( 0.987 -12.113 0.000) 12.153 6.367 ( 0.987 12.113 0.000) 12.153 6.769 ( 6.193 -3.596 0.000) 7.161 6.769 ( 6.193 3.596 0.000) 7.161 8.062 ( 1.066 -11.606 0.000) 11.655 8.062 ( 1.066 11.606 0.000) 11.655 8.248 ( -5.627 -2.999 0.000) 6.376 8.248 ( -5.627 2.999 0.000) 6.376 8.540 ( -0.550 -0.573 0.000) 0.794 8.540 ( -0.550 0.573 0.000) 0.794 9.112 ( 0.256 -9.972 0.000) 9.975 9.112 ( 0.256 9.972 0.000) 9.975 9.171 ( -5.551 -1.428 0.000) 5.732 9.171 ( -5.551 1.428 0.000) 5.732 10.185 ( -2.430 -7.541 0.000) 7.923 10.185 ( -2.430 7.541 0.000) 7.923 10.602 ( -7.859 -8.643 0.000) 11.682 10.602 ( -7.859 8.643 0.000) 11.682 17.216 ( 0.177 -6.898 0.000) 6.900 17.216 ( 0.177 6.898 0.000) 6.900 17.366 ( -1.831 -3.609 0.000) 4.047 17.366 ( -1.831 3.609 0.000) 4.047 17.727 ( 0.949 -2.155 0.000) 2.355 17.727 ( 0.949 2.155 0.000) 2.355 17.771 ( 0.776 -3.889 0.000) 3.966 17.771 ( 0.776 3.889 0.000) 3.966 20.252 ( 16.946 -1.810 0.000) 17.042 20.252 ( 16.946 1.810 0.000) 17.042 21.788 ( -7.573 -1.230 0.000) 7.672 21.788 ( -7.573 1.230 0.000) 7.672 27.436 ( 1.299 -2.952 0.000) 3.226 27.436 ( 1.299 2.952 0.000) 3.226 27.626 ( -1.949 -0.862 0.000) 2.131 27.626 ( -1.949 0.862 0.000) 2.131 37.966 ( 11.070 -3.782 0.000) 11.698 37.966 ( 11.070 3.782 0.000) 11.698 38.169 ( 6.307 -3.368 0.000) 7.150 38.169 ( 6.307 3.368 0.000) 7.150 39.128 ( -7.926 -17.959 0.000) 19.631 39.128 ( -7.926 17.959 0.000) 19.631 39.969 ( -20.421 -10.430 0.000) 22.931 39.969 ( -20.421 10.430 0.000) 22.931 ======================= Grid point 51 (29/120) ======================= q-point: ( 0.33 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( 2.631 -7.728 0.000) 8.164 2.639 ( 2.631 7.728 0.000) 8.164 3.078 ( -9.228 -4.044 0.000) 10.075 3.078 ( -9.228 4.044 0.000) 10.075 3.498 ( 11.207 -10.210 0.000) 15.161 3.498 ( 11.207 10.210 0.000) 15.161 3.995 ( -0.778 -13.975 0.000) 13.996 3.995 ( -0.778 13.975 0.000) 13.996 4.259 ( 2.860 -8.615 0.000) 9.078 4.259 ( 2.860 8.615 0.000) 9.078 4.543 ( -5.523 -6.270 0.000) 8.356 4.543 ( -5.523 6.270 0.000) 8.356 5.976 ( 8.095 -6.191 0.000) 10.191 5.976 ( 8.095 6.191 0.000) 10.191 6.244 ( 7.563 -8.027 0.000) 11.029 6.244 ( 7.563 8.027 0.000) 11.029 6.319 ( -1.183 -19.301 0.000) 19.337 6.319 ( -1.183 19.301 0.000) 19.337 6.388 ( 0.964 -9.316 0.000) 9.366 6.388 ( 0.964 9.316 0.000) 9.366 6.993 ( 16.571 -9.286 0.000) 18.996 6.993 ( 16.571 9.286 0.000) 18.996 8.064 ( -13.118 -5.660 0.000) 14.287 8.064 ( -13.118 5.660 0.000) 14.287 8.112 ( 4.393 -12.086 0.000) 12.860 8.112 ( 4.393 12.086 0.000) 12.860 8.510 ( -3.484 -3.886 0.000) 5.219 8.510 ( -3.484 3.886 0.000) 5.219 9.083 ( -2.816 -1.171 0.000) 3.049 9.083 ( -2.816 1.171 0.000) 3.049 9.111 ( -0.504 -8.818 0.000) 8.833 9.111 ( -0.504 8.818 0.000) 8.833 10.154 ( -0.388 -7.069 0.000) 7.079 10.154 ( -0.388 7.069 0.000) 7.079 10.438 ( -8.651 -7.528 0.000) 11.468 10.438 ( -8.651 7.528 0.000) 11.468 17.227 ( 0.908 -6.110 0.000) 6.178 17.227 ( 0.908 6.110 0.000) 6.178 17.328 ( -2.099 -4.062 0.000) 4.572 17.328 ( -2.099 4.062 0.000) 4.572 17.748 ( 1.147 -2.837 0.000) 3.060 17.748 ( 1.147 2.837 0.000) 3.060 17.782 ( 0.327 -4.014 0.000) 4.027 17.782 ( 0.327 4.014 0.000) 4.027 20.614 ( 19.663 -2.616 0.000) 19.837 20.614 ( 19.663 2.616 0.000) 19.837 21.601 ( -11.777 -1.628 0.000) 11.889 21.601 ( -11.777 1.628 0.000) 11.889 27.465 ( 1.720 -2.480 0.000) 3.018 27.465 ( 1.720 2.480 0.000) 3.018 27.585 ( -2.221 -0.968 0.000) 2.422 27.585 ( -2.221 0.968 0.000) 2.422 38.231 ( 16.112 -3.453 0.000) 16.477 38.231 ( 16.112 3.453 0.000) 16.477 38.317 ( 8.773 -5.416 0.000) 10.310 38.317 ( 8.773 5.416 0.000) 10.310 38.951 ( -10.026 -15.103 0.000) 18.128 38.951 ( -10.026 15.103 0.000) 18.128 39.529 ( -24.167 -6.246 0.000) 24.961 39.529 ( -24.167 6.246 0.000) 24.961 ======================= Grid point 53 (30/120) ======================= q-point: ( 0.44 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.725 ( 6.376 -3.854 0.000) 7.450 2.725 ( 6.376 3.854 0.000) 7.450 2.884 ( -9.659 -2.969 0.000) 10.105 2.884 ( -9.659 2.969 0.000) 10.105 3.737 ( 12.042 -15.619 0.000) 19.723 3.737 ( 12.042 15.619 0.000) 19.723 3.927 ( -6.796 -17.564 0.000) 18.833 3.927 ( -6.796 17.564 0.000) 18.833 4.328 ( 4.256 -6.787 0.000) 8.011 4.328 ( 4.256 6.787 0.000) 8.011 4.426 ( -5.875 -4.540 0.000) 7.425 4.426 ( -5.875 4.540 0.000) 7.425 6.125 ( 7.119 -7.734 0.000) 10.512 6.125 ( 7.119 7.734 0.000) 10.512 6.245 ( -4.956 -8.739 0.000) 10.047 6.245 ( -4.956 8.739 0.000) 10.047 6.360 ( 3.411 -5.034 0.000) 6.081 6.360 ( 3.411 5.034 0.000) 6.081 6.396 ( -0.447 -5.834 0.000) 5.851 6.396 ( -0.447 5.834 0.000) 5.851 7.366 ( 20.572 -9.859 0.000) 22.812 7.366 ( 20.572 9.859 0.000) 22.812 7.752 ( -18.521 -7.959 0.000) 20.159 7.752 ( -18.521 7.959 0.000) 20.159 8.233 ( 7.785 -11.517 0.000) 13.901 8.233 ( 7.785 11.517 0.000) 13.901 8.394 ( -7.969 -9.195 0.000) 12.168 8.394 ( -7.969 9.195 0.000) 12.168 9.068 ( 0.792 -4.612 0.000) 4.679 9.068 ( 0.792 4.612 0.000) 4.679 9.092 ( -1.321 -7.313 0.000) 7.431 9.092 ( -1.321 7.313 0.000) 7.431 10.181 ( 3.357 -6.453 0.000) 7.274 10.181 ( 3.357 6.453 0.000) 7.274 10.283 ( -6.912 -6.648 0.000) 9.590 10.283 ( -6.912 6.648 0.000) 9.590 17.251 ( 1.606 -5.200 0.000) 5.442 17.251 ( 1.606 5.200 0.000) 5.442 17.287 ( -2.018 -4.511 0.000) 4.942 17.287 ( -2.018 4.511 0.000) 4.942 17.769 ( 0.922 -3.487 0.000) 3.606 17.769 ( 0.922 3.487 0.000) 3.606 17.782 ( -0.352 -3.915 0.000) 3.931 17.782 ( -0.352 3.915 0.000) 3.931 20.993 ( 18.874 -2.649 0.000) 19.059 20.993 ( 18.874 2.649 0.000) 19.059 21.332 ( -15.838 -2.182 0.000) 15.988 21.332 ( -15.838 2.182 0.000) 15.988 27.502 ( 1.996 -1.945 0.000) 2.787 27.502 ( 1.996 1.945 0.000) 2.787 27.542 ( -2.177 -1.411 0.000) 2.594 27.542 ( -2.177 1.411 0.000) 2.594 38.502 ( 9.895 -7.772 0.000) 12.582 38.502 ( 9.895 7.772 0.000) 12.582 38.565 ( 14.560 -1.485 0.000) 14.636 38.565 ( 14.560 1.485 0.000) 14.636 38.770 ( -4.752 -10.227 0.000) 11.277 38.770 ( -4.752 10.227 0.000) 11.277 39.060 ( -23.298 -3.412 0.000) 23.546 39.060 ( -23.298 3.412 0.000) 23.546 ======================= Grid point 99 (31/120) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.564 ( 0.000 0.000 28.121) 28.121 0.687 ( 0.000 0.000 33.178) 33.178 1.127 ( 0.000 0.000 55.049) 55.049 2.883 ( 0.000 0.000 -19.161) 19.161 3.007 ( 0.000 0.000 -18.353) 18.353 3.306 ( 0.000 0.000 3.675) 3.675 3.527 ( 0.000 0.000 -2.067) 2.067 3.554 ( 0.000 0.000 5.791) 5.791 3.660 ( 0.000 0.000 -1.794) 1.794 3.776 ( 0.000 0.000 12.908) 12.908 4.394 ( 0.000 0.000 8.231) 8.231 4.505 ( 0.000 0.000 -6.646) 6.646 5.037 ( 0.000 0.000 -18.706) 18.706 5.244 ( 0.000 0.000 11.828) 11.828 5.657 ( 0.000 0.000 -10.036) 10.036 5.723 ( 0.000 0.000 11.607) 11.607 5.797 ( 0.000 0.000 9.006) 9.006 5.872 ( 0.000 0.000 11.684) 11.684 6.176 ( 0.000 0.000 6.248) 6.248 6.511 ( 0.000 0.000 -10.224) 10.224 6.603 ( 0.000 0.000 -1.683) 1.683 6.657 ( 0.000 0.000 -9.033) 9.033 6.884 ( 0.000 0.000 -0.534) 0.534 7.035 ( 0.000 0.000 -2.845) 2.845 7.267 ( 0.000 0.000 7.233) 7.233 7.360 ( 0.000 0.000 -10.904) 10.904 7.821 ( 0.000 0.000 2.426) 2.426 8.081 ( 0.000 0.000 -17.138) 17.138 8.724 ( 0.000 0.000 7.257) 7.257 8.910 ( 0.000 0.000 12.482) 12.482 9.587 ( 0.000 0.000 -6.020) 6.020 10.001 ( 0.000 0.000 -6.322) 6.322 10.232 ( 0.000 0.000 7.311) 7.311 10.542 ( 0.000 0.000 4.011) 4.011 10.549 ( 0.000 0.000 -0.423) 0.423 11.410 ( 0.000 0.000 -6.153) 6.153 16.606 ( 0.000 0.000 2.575) 2.575 16.895 ( 0.000 0.000 -2.053) 2.053 17.052 ( 0.000 0.000 3.195) 3.195 17.250 ( 0.000 0.000 7.069) 7.069 17.440 ( 0.000 0.000 -2.808) 2.808 17.928 ( 0.000 0.000 2.895) 2.895 18.208 ( 0.000 0.000 -7.922) 7.922 18.343 ( 0.000 0.000 -2.452) 2.452 19.870 ( 0.000 0.000 0.208) 0.208 19.896 ( 0.000 0.000 -0.180) 0.180 21.924 ( 0.000 0.000 0.639) 0.639 22.022 ( 0.000 0.000 -0.829) 0.829 27.729 ( 0.000 0.000 1.927) 1.927 27.917 ( 0.000 0.000 1.080) 1.080 27.995 ( 0.000 0.000 -2.019) 2.019 28.045 ( 0.000 0.000 -0.819) 0.819 37.156 ( 0.000 0.000 2.660) 2.660 37.531 ( 0.000 0.000 -2.998) 2.998 38.072 ( 0.000 0.000 1.183) 1.183 38.203 ( 0.000 0.000 -0.864) 0.864 38.389 ( 0.000 0.000 2.230) 2.230 38.646 ( 0.000 0.000 -1.585) 1.585 41.228 ( 0.000 0.000 1.640) 1.640 41.441 ( 0.000 0.000 -1.509) 1.509 ======================= Grid point 100 (32/120) ======================= q-point: ( 0.11 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.758 ( 17.446 0.000 20.462) 26.890 0.789 ( 16.263 0.000 20.401) 26.090 1.547 ( 33.790 0.000 40.618) 52.835 2.879 ( -0.431 0.000 -17.608) 17.613 2.941 ( -6.266 0.000 -16.900) 18.024 3.242 ( -6.112 0.000 3.105) 6.855 3.335 ( -13.229 0.000 6.214) 14.615 3.487 ( -4.441 0.000 -3.331) 5.551 3.811 ( 3.501 0.000 13.856) 14.292 3.814 ( 6.946 0.000 -6.795) 9.717 4.325 ( -4.369 0.000 8.972) 9.979 4.473 ( -2.931 0.000 -3.657) 4.687 5.187 ( 9.620 0.000 -21.371) 23.436 5.309 ( 6.130 0.000 10.439) 12.106 5.580 ( -7.832 0.000 -8.363) 11.458 5.719 ( 1.196 0.000 10.777) 10.843 5.874 ( -0.250 0.000 11.828) 11.831 5.894 ( 7.540 0.000 8.655) 11.479 6.080 ( -11.744 0.000 19.000) 22.336 6.200 ( 2.327 0.000 5.619) 6.082 6.694 ( 3.873 0.000 -9.057) 9.850 6.914 ( 3.619 0.000 -0.542) 3.660 6.974 ( 9.040 0.000 -19.339) 21.347 7.084 ( 4.903 0.000 -2.854) 5.673 7.377 ( 1.780 0.000 -10.077) 10.233 7.584 ( 14.970 0.000 -4.433) 15.613 7.927 ( 15.058 0.000 -3.502) 15.460 8.046 ( -3.592 0.000 -16.918) 17.295 8.665 ( -5.997 0.000 7.106) 9.298 8.884 ( -2.381 0.000 12.345) 12.573 9.513 ( -7.559 0.000 -5.946) 9.618 9.924 ( -7.392 0.000 -5.003) 8.926 10.220 ( -1.348 0.000 7.025) 7.153 10.465 ( -6.509 0.000 4.909) 8.153 10.561 ( -0.298 0.000 0.517) 0.597 10.993 ( -23.694 0.000 15.232) 28.167 16.619 ( 1.307 0.000 2.578) 2.890 16.909 ( 1.485 0.000 -2.096) 2.569 17.039 ( -1.301 0.000 3.189) 3.445 17.258 ( 1.186 0.000 6.701) 6.805 17.422 ( -1.747 0.000 -2.774) 3.278 17.746 ( -7.873 0.000 9.564) 12.387 18.207 ( -0.082 0.000 -7.581) 7.582 18.330 ( -1.367 0.000 -3.234) 3.511 19.991 ( 9.551 0.000 0.321) 9.556 20.586 ( 40.640 0.000 -36.865) 54.869 21.889 ( -3.685 0.000 0.660) 3.744 21.997 ( -2.571 0.000 -0.950) 2.741 27.739 ( 1.007 0.000 1.825) 2.084 27.940 ( 1.453 0.000 -1.400) 2.017 27.992 ( -0.321 0.000 -1.866) 1.893 28.027 ( -1.538 0.000 -0.922) 1.793 37.178 ( 2.278 0.000 2.648) 3.493 37.552 ( 2.120 0.000 -3.006) 3.678 38.034 ( -3.733 0.000 1.376) 3.979 38.189 ( -1.542 0.000 -1.035) 1.857 38.452 ( 6.480 0.000 1.852) 6.739 38.645 ( -0.087 0.000 -0.999) 1.003 40.199 ( -72.655 0.000 67.641) 99.268 41.114 ( -12.093 0.000 1.266) 12.159 ======================= Grid point 101 (33/120) ======================= q-point: ( 0.22 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( 22.489 0.000 12.478) 25.719 1.248 ( 27.603 0.000 0.156) 27.604 2.261 ( 37.358 0.000 25.789) 45.395 2.809 ( -5.386 0.000 -11.027) 12.272 2.867 ( -1.044 0.000 -12.200) 12.244 3.084 ( -13.066 0.000 2.644) 13.331 3.087 ( -9.514 0.000 -0.555) 9.530 3.358 ( -8.359 0.000 -3.607) 9.104 3.772 ( -11.733 0.000 -11.086) 16.142 3.901 ( 5.499 0.000 14.193) 15.221 4.379 ( 10.741 0.000 7.585) 13.150 4.405 ( -3.873 0.000 1.820) 4.279 5.275 ( -6.026 0.000 -15.693) 16.810 5.392 ( -6.495 0.000 -7.185) 9.686 5.452 ( 8.000 0.000 8.590) 11.738 5.774 ( 3.887 0.000 9.560) 10.320 5.858 ( -0.584 0.000 15.716) 15.727 5.996 ( -0.199 0.000 17.945) 17.946 6.039 ( 6.633 0.000 7.002) 9.646 6.255 ( 2.886 0.000 4.169) 5.070 6.808 ( 7.916 0.000 -9.274) 12.193 7.049 ( 10.471 0.000 -0.603) 10.488 7.114 ( 6.457 0.000 -14.733) 16.086 7.225 ( 9.884 0.000 -2.606) 10.221 7.420 ( 2.203 0.000 -9.087) 9.351 7.692 ( 2.461 0.000 5.074) 5.639 7.946 ( -6.343 0.000 -16.252) 17.446 8.246 ( 11.350 0.000 -4.046) 12.050 8.496 ( -11.214 0.000 6.635) 13.030 8.845 ( -0.275 0.000 10.454) 10.458 9.297 ( -14.522 0.000 -5.725) 15.610 9.742 ( -10.655 0.000 -2.766) 11.008 10.186 ( -1.781 0.000 5.326) 5.616 10.337 ( -4.938 0.000 5.329) 7.265 10.538 ( -2.085 0.000 -1.089) 2.352 10.720 ( -7.565 0.000 5.458) 9.329 16.655 ( 2.461 0.000 2.584) 3.569 16.946 ( 1.703 0.000 -1.740) 2.434 17.008 ( -1.331 0.000 2.698) 3.009 17.299 ( 2.943 0.000 5.710) 6.424 17.373 ( -3.240 0.000 -2.672) 4.200 17.656 ( -2.872 0.000 5.937) 6.595 18.205 ( -0.036 0.000 -6.799) 6.799 18.298 ( -1.750 0.000 -4.722) 5.036 20.247 ( 16.238 0.000 1.295) 16.290 21.122 ( 17.729 0.000 -27.288) 32.542 21.779 ( -7.686 0.000 0.754) 7.723 21.925 ( -4.669 0.000 -1.454) 4.890 27.768 ( 1.869 0.000 1.493) 2.392 27.954 ( 0.060 0.000 -1.779) 1.780 27.979 ( -1.110 0.000 -1.509) 1.873 27.998 ( -1.231 0.000 -1.522) 1.957 37.244 ( 4.408 0.000 2.603) 5.119 37.612 ( 3.928 0.000 -3.044) 4.969 37.935 ( -6.214 0.000 1.831) 6.478 38.140 ( -3.467 0.000 -1.397) 3.738 38.638 ( 12.167 0.000 0.877) 12.199 38.645 ( 0.626 0.000 0.798) 1.014 39.270 ( -27.985 0.000 51.882) 58.948 40.787 ( -20.927 0.000 -0.699) 20.939 ======================= Grid point 102 (34/120) ======================= q-point: ( 0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 23.278 0.000 7.817) 24.555 1.782 ( 26.233 0.000 -7.051) 27.164 2.658 ( 1.505 0.000 -12.205) 12.298 2.773 ( -11.815 0.000 2.687) 12.117 2.821 ( -13.746 0.000 -1.478) 13.825 2.941 ( -2.191 0.000 -13.033) 13.216 3.078 ( 35.224 0.000 20.173) 40.592 3.190 ( -8.305 0.000 -3.310) 8.940 3.461 ( -18.130 0.000 -9.053) 20.265 4.014 ( 5.901 0.000 13.588) 14.814 4.324 ( -4.468 0.000 6.525) 7.909 4.648 ( 15.138 0.000 2.312) 15.313 4.943 ( -22.724 0.000 -2.170) 22.827 5.334 ( -4.554 0.000 -11.067) 11.967 5.604 ( 7.413 0.000 7.777) 10.744 5.835 ( 1.564 0.000 8.525) 8.667 5.873 ( 2.125 0.000 17.658) 17.785 5.999 ( -0.145 0.000 16.365) 16.366 6.147 ( 4.883 0.000 4.685) 6.767 6.297 ( 1.133 0.000 2.811) 3.031 6.997 ( 11.197 0.000 -9.892) 14.941 7.227 ( 5.116 0.000 -12.459) 13.468 7.292 ( 13.536 0.000 -0.336) 13.541 7.435 ( -1.087 0.000 -8.950) 9.015 7.462 ( 12.057 0.000 -3.204) 12.475 7.780 ( 7.219 0.000 10.605) 12.829 7.835 ( -2.218 0.000 -14.076) 14.250 8.240 ( -14.700 0.000 5.801) 15.803 8.307 ( -4.017 0.000 6.125) 7.325 8.920 ( 7.785 0.000 5.312) 9.424 8.957 ( -20.217 0.000 -5.371) 20.918 9.528 ( -11.200 0.000 -0.706) 11.222 10.168 ( 0.261 0.000 2.191) 2.207 10.283 ( -1.299 0.000 0.319) 1.337 10.490 ( -2.340 0.000 -2.596) 3.495 10.610 ( -4.616 0.000 -0.874) 4.698 16.712 ( 3.331 0.000 2.592) 4.221 16.926 ( -3.059 0.000 2.049) 3.682 17.037 ( 3.635 0.000 -1.288) 3.856 17.300 ( -4.279 0.000 -2.512) 4.962 17.368 ( 4.047 0.000 4.896) 6.352 17.602 ( -3.005 0.000 4.223) 5.183 18.208 ( 0.367 0.000 -6.193) 6.204 18.267 ( -1.445 0.000 -5.873) 6.048 20.597 ( 19.181 0.000 1.850) 19.270 21.378 ( 10.176 0.000 -15.644) 18.662 21.588 ( -12.021 0.000 1.014) 12.064 21.820 ( -6.016 0.000 -2.639) 6.570 27.810 ( 2.445 0.000 0.874) 2.596 27.949 ( -1.727 0.000 -1.218) 2.113 27.951 ( -0.339 0.000 -1.651) 1.686 27.978 ( -0.980 0.000 -1.049) 1.435 37.347 ( 6.216 0.000 2.492) 6.697 37.696 ( 3.935 0.000 -3.123) 5.024 37.806 ( -6.222 0.000 2.394) 6.667 38.056 ( -5.111 0.000 -1.761) 5.405 38.654 ( 0.920 0.000 4.030) 4.134 38.886 ( -2.186 0.000 19.702) 19.823 38.973 ( 9.275 0.000 9.672) 13.401 40.331 ( -25.338 0.000 -2.245) 25.437 ======================= Grid point 103 (35/120) ======================= q-point: ( 0.44 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( 22.187 0.000 4.946) 22.731 2.228 ( 19.074 0.000 -8.128) 20.733 2.456 ( -19.286 0.000 3.560) 19.612 2.539 ( -14.134 0.000 -5.909) 15.319 2.771 ( 10.886 0.000 -9.798) 14.646 2.962 ( 3.109 0.000 -9.431) 9.930 3.050 ( -5.917 0.000 -5.251) 7.911 3.078 ( -18.864 0.000 -9.372) 21.063 3.790 ( 34.933 0.000 13.209) 37.347 4.126 ( 5.649 0.000 12.201) 13.445 4.231 ( -5.122 0.000 9.913) 11.158 4.423 ( -29.814 0.000 5.745) 30.362 4.945 ( 14.141 0.000 -2.559) 14.371 5.187 ( -10.382 0.000 -6.752) 12.385 5.734 ( 5.767 0.000 7.724) 9.639 5.821 ( -2.915 0.000 8.010) 8.524 5.928 ( 3.082 0.000 17.134) 17.409 5.979 ( -1.980 0.000 16.441) 16.560 6.235 ( 4.022 0.000 2.724) 4.858 6.292 ( -1.662 0.000 2.151) 2.718 7.228 ( 12.131 0.000 -10.759) 16.215 7.315 ( 4.091 0.000 -10.412) 11.187 7.388 ( -3.316 0.000 -9.042) 9.630 7.435 ( -6.831 0.000 -9.756) 11.910 7.611 ( 13.489 0.000 1.063) 13.531 7.902 ( -12.419 0.000 1.765) 12.544 7.957 ( 10.395 0.000 11.977) 15.859 8.086 ( 17.622 0.000 -3.737) 18.014 8.160 ( -9.843 0.000 10.698) 14.537 8.527 ( -23.575 0.000 -4.975) 24.094 9.105 ( 10.437 0.000 2.612) 10.759 9.313 ( -10.900 0.000 1.050) 10.950 10.197 ( 2.515 0.000 -0.045) 2.515 10.251 ( -2.517 0.000 -1.123) 2.756 10.475 ( 1.251 0.000 -4.024) 4.214 10.528 ( -3.772 0.000 -3.671) 5.263 16.782 ( 3.818 0.000 2.591) 4.614 16.857 ( -3.830 0.000 2.530) 4.590 17.119 ( 4.613 0.000 -2.001) 5.028 17.211 ( -4.751 0.000 -2.298) 5.278 17.451 ( 4.418 0.000 4.244) 6.126 17.534 ( -3.985 0.000 3.892) 5.570 18.220 ( 0.896 0.000 -6.117) 6.182 18.241 ( -1.197 0.000 -6.206) 6.321 20.971 ( 18.819 0.000 1.798) 18.905 21.312 ( -16.068 0.000 1.360) 16.126 21.551 ( 7.889 0.000 -8.790) 11.810 21.695 ( -6.916 0.000 -4.898) 8.475 27.860 ( 2.618 0.000 -0.046) 2.619 27.909 ( -2.356 0.000 -1.102) 2.601 27.950 ( 0.255 0.000 -0.835) 0.873 27.961 ( -0.770 0.000 -0.740) 1.068 37.481 ( 7.470 0.000 2.252) 7.802 37.631 ( -7.654 0.000 1.578) 7.815 37.830 ( 5.730 0.000 -1.816) 6.011 37.947 ( -6.013 0.000 -2.004) 6.338 38.685 ( 2.436 0.000 9.066) 9.388 38.757 ( -5.166 0.000 16.836) 17.611 39.355 ( 22.917 0.000 -1.806) 22.989 39.830 ( -25.651 0.000 -2.630) 25.786 ======================= Grid point 108 (36/120) ======================= q-point: ( 0.00 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.873 ( 0.000 16.777 25.815) 30.788 1.030 ( 0.000 24.816 23.005) 33.839 1.647 ( 0.000 49.064 29.504) 57.252 2.975 ( 0.000 5.213 -14.159) 15.088 3.020 ( 0.000 1.889 -16.848) 16.954 3.367 ( 0.000 -6.274 1.873) 6.548 3.392 ( 0.000 10.838 -0.228) 10.840 3.632 ( 0.000 3.852 -3.343) 5.101 3.695 ( 0.000 2.895 -1.792) 3.405 4.047 ( 0.000 19.320 8.301) 21.028 4.346 ( 0.000 -4.282 7.175) 8.356 4.601 ( 0.000 8.807 -6.668) 11.046 4.984 ( 0.000 -4.766 -17.764) 18.392 5.545 ( 0.000 23.547 8.695) 25.101 5.546 ( 0.000 -9.330 -9.217) 13.115 5.799 ( 0.000 5.863 10.492) 12.019 5.855 ( 0.000 5.485 13.527) 14.597 5.976 ( 0.000 9.479 15.797) 18.422 6.080 ( 0.000 -13.324 14.755) 19.881 6.267 ( 0.000 8.398 7.114) 11.007 6.448 ( 0.000 -5.174 -10.356) 11.576 6.886 ( 0.000 21.586 -7.606) 22.887 7.196 ( 0.000 13.876 -3.465) 14.302 7.230 ( 0.000 3.575 0.354) 3.592 7.344 ( 0.000 -0.649 -9.594) 9.616 7.718 ( 0.000 28.772 -19.325) 34.660 7.749 ( 0.000 -6.744 2.755) 7.285 8.158 ( 0.000 7.609 -15.561) 17.321 8.750 ( 0.000 1.661 6.835) 7.034 8.919 ( 0.000 1.171 11.859) 11.917 9.538 ( 0.000 -4.669 -6.004) 7.606 9.961 ( 0.000 -4.285 -5.278) 6.798 10.144 ( 0.000 -7.896 6.196) 10.037 10.510 ( 0.000 -2.954 3.613) 4.667 10.531 ( 0.000 -1.472 -4.222) 4.471 11.184 ( 0.000 -12.832 -0.392) 12.838 16.726 ( 0.000 11.445 3.079) 11.852 17.013 ( 0.000 6.176 1.808) 6.435 17.118 ( 0.000 0.616 2.720) 2.789 17.235 ( 0.000 5.730 0.763) 5.780 17.458 ( 0.000 1.725 -2.655) 3.166 17.779 ( 0.000 -8.502 9.265) 12.575 18.151 ( 0.000 -5.952 -8.124) 10.072 18.264 ( 0.000 -7.169 -2.307) 7.531 19.870 ( 0.000 0.063 0.201) 0.210 19.896 ( 0.000 -0.053 -0.171) 0.179 21.923 ( 0.000 -0.139 0.609) 0.625 22.015 ( 0.000 -0.623 -0.754) 0.978 27.688 ( 0.000 -3.957 1.931) 4.403 27.891 ( 0.000 -2.548 1.027) 2.747 27.950 ( 0.000 -4.427 -1.946) 4.836 28.014 ( 0.000 -3.124 -0.797) 3.224 37.209 ( 0.000 5.166 2.673) 5.816 37.585 ( 0.000 4.692 -2.489) 5.311 38.178 ( 0.000 -2.180 0.016) 2.180 38.288 ( 0.000 9.529 -8.824) 12.987 38.382 ( 0.000 0.875 1.617) 1.839 38.776 ( 0.000 12.298 -3.004) 12.660 41.101 ( 0.000 -12.337 2.035) 12.504 41.208 ( 0.000 -13.415 7.820) 15.528 ======================= Grid point 109 (37/120) ======================= q-point: ( 0.11 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( 13.012 16.921 14.893) 26.027 1.221 ( 14.831 26.540 16.694) 34.684 1.884 ( 22.929 36.083 28.511) 51.387 2.916 ( -4.915 2.392 -13.478) 14.544 3.015 ( -1.148 4.735 -13.882) 14.712 3.222 ( -9.221 0.937 0.579) 9.287 3.406 ( -3.586 10.025 -0.137) 10.648 3.570 ( -4.853 3.146 -0.896) 5.853 3.734 ( 1.168 0.310 -5.964) 6.085 4.054 ( 2.774 15.192 9.356) 18.056 4.296 ( -3.174 -1.170 6.717) 7.521 4.581 ( -1.681 9.626 -3.433) 10.357 5.121 ( 9.400 -5.459 -19.575) 22.391 5.487 ( -6.090 -7.975 -8.230) 12.977 5.602 ( 4.982 21.187 7.369) 22.978 5.814 ( 2.666 8.438 10.694) 13.881 5.878 ( 0.986 3.383 15.271) 15.673 5.986 ( 0.284 3.718 20.157) 20.499 6.084 ( 3.561 5.214 4.867) 7.972 6.283 ( 1.844 8.659 5.704) 10.532 6.558 ( 8.984 -11.596 -5.030) 15.508 6.910 ( 2.515 20.568 -7.613) 22.075 7.172 ( 2.261 6.776 -2.659) 7.623 7.286 ( -1.219 7.948 -7.406) 10.932 7.421 ( 8.844 4.547 -6.973) 12.146 7.647 ( -1.902 0.965 -1.430) 2.568 7.981 ( 15.662 7.548 -9.765) 19.940 8.122 ( -3.640 7.529 -15.365) 17.494 8.696 ( -5.447 2.072 6.567) 8.780 8.891 ( -2.651 1.014 11.691) 12.031 9.467 ( -7.266 -4.460 -5.863) 10.347 9.887 ( -7.079 -3.863 -4.232) 9.107 10.133 ( -1.097 -7.753 5.762) 9.722 10.464 ( -4.843 -0.244 -0.769) 4.910 10.522 ( -1.041 -3.493 -0.421) 3.669 10.938 ( -17.505 -3.841 7.771) 19.534 16.735 ( 0.861 10.999 3.029) 11.441 17.010 ( 0.076 6.466 0.967) 6.538 17.093 ( -2.065 3.017 2.709) 4.550 17.242 ( 1.114 2.358 3.195) 4.124 17.443 ( -1.548 1.898 -2.667) 3.621 17.699 ( -4.659 -3.677 8.490) 10.359 18.153 ( 0.148 -5.675 -7.838) 9.678 18.253 ( -1.113 -7.043 -2.912) 7.702 19.989 ( 9.462 -0.209 0.279) 9.468 20.346 ( 34.656 -15.554 -15.317) 40.958 21.887 ( -3.702 -0.156 0.629) 3.758 21.989 ( -2.668 -0.713 -0.886) 2.900 27.698 ( 0.990 -3.970 1.838) 4.485 27.901 ( 0.776 -3.380 -0.033) 3.468 27.947 ( -0.237 -4.368 -1.810) 4.734 27.994 ( -1.760 -3.161 -0.742) 3.693 37.235 ( 2.648 5.509 2.640) 6.658 37.607 ( 2.307 4.948 -2.528) 6.016 38.161 ( -1.807 -0.110 -0.348) 1.844 38.278 ( -1.449 11.470 -9.412) 14.908 38.434 ( 5.807 -1.437 2.171) 6.364 38.758 ( -1.720 10.968 -2.421) 11.363 40.395 ( -60.017 14.153 37.105) 71.966 40.992 ( -11.564 -11.859 1.668) 16.647 ======================= Grid point 110 (38/120) ======================= q-point: ( 0.22 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( 22.537 11.829 1.534) 25.498 1.548 ( 18.776 25.646 9.316) 33.122 2.429 ( 29.322 18.189 18.592) 39.196 2.827 ( -2.085 3.957 -7.234) 8.505 2.962 ( -5.263 1.679 -5.152) 7.554 3.044 ( -8.012 6.084 -3.599) 10.685 3.272 ( -9.076 12.068 -4.720) 15.821 3.458 ( -6.522 8.923 -0.443) 11.061 3.669 ( -8.307 -4.389 -5.783) 11.033 4.135 ( 3.454 16.812 6.041) 18.195 4.311 ( 5.715 -2.081 5.474) 8.182 4.556 ( 0.043 10.779 3.476) 11.326 5.214 ( -4.363 -5.348 -15.378) 16.856 5.334 ( -5.872 -5.536 -7.229) 10.835 5.711 ( 5.646 14.796 7.940) 17.716 5.894 ( 1.761 8.264 15.863) 17.973 5.907 ( 5.865 10.980 9.793) 15.838 6.009 ( 1.994 5.919 15.327) 16.551 6.188 ( 5.475 12.613 5.341) 14.750 6.335 ( 3.179 7.333 4.221) 9.038 6.770 ( 12.885 -12.849 -2.440) 18.359 6.989 ( 5.801 17.562 -7.668) 20.021 7.259 ( 1.155 0.057 -8.555) 8.633 7.298 ( 8.725 9.235 -3.345) 13.138 7.529 ( 0.290 5.591 -7.607) 9.445 7.683 ( 6.933 2.292 4.434) 8.542 8.021 ( -6.388 7.234 -14.806) 17.673 8.228 ( 6.197 -0.558 -2.678) 6.774 8.560 ( -7.306 4.844 5.169) 10.176 8.840 ( -1.315 -0.231 10.009) 10.098 9.261 ( -13.849 -3.630 -5.398) 15.301 9.714 ( -10.111 -2.877 -2.636) 10.838 10.108 ( -1.201 -7.125 4.161) 8.338 10.341 ( -6.412 0.683 -0.343) 6.458 10.487 ( -2.626 -4.738 -0.750) 5.469 10.689 ( -8.271 -2.600 4.701) 9.862 16.760 ( 1.710 9.828 2.866) 10.379 17.021 ( 0.250 5.678 -0.115) 5.685 17.055 ( -0.884 4.557 2.364) 5.209 17.282 ( 2.917 -0.146 4.436) 5.311 17.399 ( -2.910 2.366 -2.569) 4.546 17.634 ( -2.486 -1.920 5.497) 6.331 18.156 ( 0.219 -5.071 -7.072) 8.705 18.227 ( -1.370 -6.570 -4.222) 7.929 20.243 ( 16.178 -0.356 1.160) 16.223 20.909 ( 22.341 -17.218 -17.567) 33.229 21.777 ( -7.705 -0.191 0.714) 7.740 21.914 ( -4.989 -1.090 -1.355) 5.283 27.726 ( 1.823 -4.022 1.537) 4.675 27.911 ( 0.167 -4.057 -1.160) 4.223 27.940 ( -0.570 -4.024 -1.406) 4.301 27.956 ( -1.970 -3.625 -0.773) 4.198 37.311 ( 5.171 6.555 2.508) 8.718 37.673 ( 4.369 5.667 -2.681) 7.642 38.100 ( -4.735 6.304 -1.424) 8.012 38.228 ( -3.501 10.934 -7.416) 13.668 38.610 ( 12.213 -2.860 1.103) 12.591 38.717 ( -2.290 7.348 -0.510) 7.713 39.443 ( -35.378 17.039 42.401) 57.790 40.679 ( -20.081 -10.564 -0.244) 22.692 ======================= Grid point 111 (39/120) ======================= q-point: ( 0.33 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( 22.608 9.986 -1.290) 24.749 1.937 ( 20.566 18.031 1.780) 27.409 2.677 ( -0.301 1.967 -12.036) 12.200 2.793 ( -9.367 1.123 -2.770) 9.832 2.894 ( -10.919 9.019 1.493) 14.241 3.059 ( 4.919 6.205 -1.050) 7.988 3.203 ( 18.559 14.699 5.370) 24.277 3.329 ( -5.768 12.870 -0.766) 14.124 3.447 ( -11.974 0.420 -5.091) 13.018 4.196 ( 3.167 16.123 7.306) 17.982 4.391 ( -0.012 4.983 4.779) 6.904 4.656 ( 10.798 2.190 4.737) 11.993 4.939 ( -19.290 0.037 -2.068) 19.401 5.272 ( -4.674 -6.020 -10.630) 13.080 5.810 ( 4.618 5.964 12.296) 14.425 5.954 ( 3.410 10.135 12.587) 16.516 5.990 ( 2.225 14.301 11.316) 18.372 6.066 ( 3.687 15.660 9.834) 18.856 6.272 ( 3.407 12.438 4.548) 13.674 6.389 ( 1.868 7.728 3.112) 8.538 7.039 ( 13.442 -9.102 -4.243) 16.779 7.140 ( 10.040 11.677 -6.528) 16.726 7.286 ( 2.466 -1.632 -7.435) 8.001 7.480 ( 0.302 0.330 -4.638) 4.660 7.574 ( 13.106 8.809 -2.786) 16.035 7.811 ( 0.928 4.836 -3.298) 5.927 7.932 ( 2.942 8.775 -5.260) 10.645 8.144 ( -12.439 -4.649 5.068) 14.214 8.438 ( -6.950 8.287 5.871) 12.306 8.878 ( -1.654 -3.688 0.708) 4.103 8.959 ( -10.081 -0.323 -0.681) 10.109 9.510 ( -10.779 -1.854 -0.959) 10.979 10.099 ( 0.564 -6.428 1.831) 6.707 10.252 ( -2.891 -2.381 -1.529) 4.045 10.430 ( -2.663 -5.571 -2.231) 6.566 10.566 ( -5.327 -4.178 -0.401) 6.782 16.801 ( 2.525 8.360 2.653) 9.127 16.982 ( -3.036 4.988 2.159) 6.226 17.092 ( 3.359 5.162 -0.960) 6.233 17.330 ( -3.434 2.862 -2.402) 5.075 17.352 ( 3.584 -0.794 4.460) 5.776 17.584 ( -2.956 -1.622 4.097) 5.306 18.162 ( 0.412 -4.616 -6.289) 7.812 18.204 ( -0.992 -5.932 -5.415) 8.093 20.593 ( 19.190 -0.401 1.680) 19.268 21.249 ( 13.834 -11.486 -12.157) 21.705 21.585 ( -12.068 -0.232 0.951) 12.107 21.799 ( -6.722 -2.014 -2.400) 7.417 27.767 ( 2.360 -4.132 0.995) 4.861 27.903 ( -1.456 -4.524 -1.547) 4.998 27.919 ( -0.772 -3.058 -0.539) 3.200 27.933 ( -0.649 -4.208 -0.996) 4.373 37.434 ( 7.400 8.325 2.159) 11.345 37.771 ( 5.427 6.790 -3.154) 9.247 37.975 ( -7.784 12.644 -1.022) 14.883 38.146 ( -4.918 9.275 -4.294) 11.342 38.681 ( -1.069 2.927 3.053) 4.363 38.897 ( 14.421 -2.036 2.280) 14.741 38.974 ( -12.386 4.263 26.844) 29.869 40.240 ( -24.401 -8.863 -1.807) 26.023 ======================= Grid point 112 (40/120) ======================= q-point: ( 0.44 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 20.659 9.197 -0.901) 22.631 2.301 ( 15.870 10.597 -3.046) 19.324 2.545 ( -11.770 1.653 -7.148) 13.869 2.595 ( -17.169 10.652 2.360) 20.342 2.800 ( 8.463 3.256 -7.903) 12.028 3.010 ( -8.168 0.858 -7.460) 11.095 3.182 ( -4.873 13.654 -8.635) 16.874 3.213 ( -5.255 13.850 -3.851) 15.306 3.807 ( 28.808 3.991 11.269) 31.190 4.204 ( -7.181 4.863 5.830) 10.450 4.372 ( 1.347 15.005 10.133) 18.156 4.545 ( -17.928 11.449 5.674) 22.015 4.900 ( 12.896 -4.013 -0.840) 13.532 5.127 ( -9.963 -5.816 -5.932) 12.972 5.895 ( 4.072 1.954 14.123) 14.828 5.959 ( -2.213 0.721 14.115) 14.305 6.054 ( 3.629 25.342 8.572) 26.998 6.101 ( -0.685 23.170 8.247) 24.604 6.340 ( 3.660 9.826 2.806) 10.854 6.394 ( -1.412 8.852 2.402) 9.280 7.231 ( 6.352 -3.440 -8.399) 11.078 7.294 ( 0.683 -0.733 -7.861) 7.925 7.400 ( 9.951 4.878 -7.358) 13.302 7.515 ( 4.904 1.513 -1.194) 5.269 7.625 ( -3.683 8.612 -6.249) 11.260 7.840 ( -15.496 -4.365 4.758) 16.787 7.996 ( 15.675 -0.080 -0.294) 15.678 8.120 ( 12.688 7.430 1.676) 14.799 8.271 ( -8.448 7.656 7.460) 13.625 8.522 ( -21.617 -0.152 -3.701) 21.933 9.093 ( 10.379 -1.136 2.393) 10.711 9.300 ( -10.766 -1.279 0.764) 10.869 10.133 ( 2.874 -5.853 -0.116) 6.522 10.198 ( -3.270 -4.777 -1.407) 5.958 10.413 ( 1.333 -5.803 -3.718) 7.020 10.472 ( -4.255 -5.316 -3.156) 7.505 16.856 ( 3.114 6.956 2.491) 8.019 16.919 ( -3.328 5.796 2.383) 7.096 17.167 ( 4.195 4.509 -1.801) 6.417 17.251 ( -4.325 3.780 -2.243) 6.166 17.434 ( 4.394 -1.310 4.200) 6.218 17.517 ( -3.966 -1.495 3.872) 5.741 18.173 ( 0.677 -4.683 -5.990) 7.633 18.187 ( -0.794 -5.209 -5.909) 7.917 20.967 ( 18.863 -0.349 1.648) 18.938 21.309 ( -16.069 -0.287 1.235) 16.119 21.478 ( 10.074 -6.800 -7.404) 14.232 21.654 ( -8.216 -3.793 -4.326) 10.030 27.815 ( 2.521 -4.291 0.226) 4.982 27.863 ( -2.340 -4.416 -0.646) 5.039 27.915 ( 0.125 -3.417 -0.794) 3.511 27.921 ( -0.508 -3.759 -0.836) 3.884 37.595 ( 9.021 10.677 1.296) 14.037 37.772 ( -8.371 12.222 -1.093) 14.854 37.919 ( 5.296 8.967 -1.305) 10.496 38.038 ( -6.150 8.929 -2.661) 11.164 38.685 ( 1.749 0.098 8.617) 8.793 38.760 ( -6.407 0.687 17.046) 18.224 39.297 ( 22.214 -5.617 -1.634) 22.971 39.757 ( -24.780 -7.138 -2.292) 25.889 ======================= Grid point 117 (41/120) ======================= q-point: ( 0.00 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( 0.000 22.769 16.977) 28.401 1.533 ( 0.000 26.716 11.397) 29.045 2.633 ( 0.000 42.023 12.709) 43.903 3.018 ( 0.000 0.390 -7.521) 7.531 3.116 ( 0.000 10.602 -11.069) 15.328 3.294 ( 0.000 -1.044 -2.068) 2.317 3.699 ( 0.000 15.669 -4.865) 16.407 3.707 ( 0.000 3.506 -4.928) 6.048 3.744 ( 0.000 1.902 -2.586) 3.210 4.201 ( 0.000 -6.567 7.968) 10.326 4.513 ( 0.000 23.724 -0.367) 23.727 4.806 ( 0.000 9.921 -5.195) 11.199 4.877 ( 0.000 -4.863 -15.046) 15.812 5.316 ( 0.000 -12.696 -11.350) 17.030 5.753 ( 0.000 1.939 7.148) 7.407 5.923 ( 0.000 5.273 9.740) 11.076 5.930 ( 0.000 -2.173 14.637) 14.798 6.098 ( 0.000 9.719 13.201) 16.392 6.197 ( 0.000 11.373 15.796) 19.465 6.344 ( 0.000 -4.095 -8.838) 9.740 6.777 ( 0.000 42.679 6.721) 43.205 7.232 ( 0.000 -2.775 -7.664) 8.151 7.318 ( 0.000 6.003 -1.337) 6.150 7.387 ( 0.000 10.825 -1.651) 10.950 7.577 ( 0.000 15.287 -2.262) 15.454 7.636 ( 0.000 9.919 -2.819) 10.312 8.067 ( 0.000 10.170 -4.165) 10.989 8.380 ( 0.000 14.609 -9.982) 17.694 8.749 ( 0.000 -1.990 6.077) 6.394 8.953 ( 0.000 1.742 10.398) 10.543 9.415 ( 0.000 -7.318 -6.830) 10.010 9.831 ( 0.000 -8.531 -2.542) 8.901 9.993 ( 0.000 -5.161 3.154) 6.048 10.447 ( 0.000 -2.671 2.964) 3.990 10.500 ( 0.000 -1.790 -6.626) 6.864 11.017 ( 0.000 -5.050 -5.779) 7.675 17.010 ( 0.000 15.681 3.643) 16.098 17.012 ( 0.000 -3.892 1.552) 4.190 17.176 ( 0.000 7.043 3.695) 7.953 17.439 ( 0.000 10.259 -1.048) 10.312 17.498 ( 0.000 1.972 -2.245) 2.989 17.665 ( 0.000 -3.126 8.016) 8.604 17.967 ( 0.000 -11.783 -7.520) 13.979 18.104 ( 0.000 -8.339 -2.423) 8.684 19.872 ( 0.000 0.118 0.177) 0.213 19.894 ( 0.000 -0.112 -0.144) 0.182 21.920 ( 0.000 -0.170 0.523) 0.550 21.999 ( 0.000 -1.033 -0.658) 1.225 27.586 ( 0.000 -5.983 1.900) 6.277 27.823 ( 0.000 -4.079 0.873) 4.171 27.828 ( 0.000 -7.518 -1.688) 7.705 27.929 ( 0.000 -5.216 -0.708) 5.264 37.347 ( 0.000 8.323 2.731) 8.759 37.698 ( 0.000 6.077 -1.108) 6.177 38.128 ( 0.000 -2.689 1.025) 2.877 38.294 ( 0.000 -3.402 1.597) 3.759 38.476 ( 0.000 5.034 -5.665) 7.578 39.089 ( 0.000 17.877 -6.788) 19.122 40.774 ( 0.000 -19.483 4.347) 19.963 41.020 ( 0.000 -6.825 3.983) 7.902 ======================= Grid point 118 (42/120) ======================= q-point: ( 0.11 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 9.942 22.135 8.898) 25.845 1.679 ( 13.328 22.865 12.218) 29.150 2.701 ( 6.307 33.782 9.154) 35.564 2.994 ( -1.393 4.691 -5.638) 7.466 3.102 ( -1.642 11.967 -7.057) 13.989 3.266 ( -2.590 1.883 -3.062) 4.430 3.596 ( -7.577 2.471 -1.272) 8.071 3.675 ( -3.168 9.897 -5.454) 11.736 3.781 ( 0.247 4.427 -7.782) 8.956 4.184 ( 0.481 -1.304 9.674) 9.773 4.504 ( 0.915 20.430 0.933) 20.472 4.802 ( -0.494 10.856 -2.352) 11.119 5.008 ( 8.959 -4.710 -17.438) 20.163 5.280 ( -3.705 -11.238 -9.737) 15.324 5.772 ( 1.467 2.051 8.577) 8.940 5.882 ( 0.504 1.427 13.671) 13.755 6.064 ( 8.088 3.811 10.481) 13.777 6.146 ( 4.225 10.016 11.322) 15.696 6.195 ( 3.996 3.666 6.272) 8.291 6.473 ( 10.032 2.325 -0.705) 10.322 6.776 ( -0.029 42.491 6.416) 42.973 7.190 ( -1.653 -2.473 -6.305) 6.972 7.320 ( -0.468 8.034 -1.425) 8.172 7.435 ( 2.568 2.148 -2.349) 4.090 7.622 ( -0.881 15.891 -4.030) 16.418 7.652 ( 8.169 13.985 -2.153) 16.339 8.145 ( 6.746 6.966 -3.018) 10.156 8.345 ( -3.512 15.014 -9.691) 18.212 8.703 ( -4.364 -1.605 5.865) 7.485 8.929 ( -2.476 2.486 9.953) 10.554 9.347 ( -6.855 -7.205 -6.355) 11.802 9.772 ( -5.716 -7.542 -2.441) 9.773 9.982 ( -1.071 -5.472 2.836) 6.255 10.429 ( -1.889 -3.203 2.326) 4.386 10.467 ( -3.433 -1.577 -7.243) 8.169 10.882 ( -11.989 -1.788 -2.127) 12.307 16.995 ( -0.593 9.054 2.476) 9.405 17.037 ( 1.574 2.434 2.320) 3.713 17.178 ( 0.161 7.247 3.034) 7.858 17.413 ( -2.334 10.744 0.882) 11.030 17.487 ( -1.150 2.149 -2.384) 3.409 17.634 ( -2.217 -2.220 6.776) 7.467 17.976 ( 0.882 -11.380 -7.365) 13.584 18.096 ( -0.774 -8.161 -2.656) 8.617 19.984 ( 9.309 -0.290 0.205) 9.316 20.126 ( 22.186 -6.985 -3.469) 23.517 21.883 ( -3.741 -0.191 0.540) 3.785 21.970 ( -2.938 -1.173 -0.759) 3.253 27.595 ( 0.959 -5.997 1.821) 6.341 27.821 ( -0.192 -4.640 0.358) 4.657 27.828 ( -0.041 -7.218 -1.382) 7.349 27.910 ( -1.771 -5.136 -0.628) 5.469 37.382 ( 3.556 8.829 2.650) 9.880 37.728 ( 3.124 6.619 -1.228) 7.422 38.133 ( 0.555 -1.972 1.145) 2.347 38.345 ( 5.101 -3.224 0.316) 6.043 38.467 ( -0.756 4.490 -5.042) 6.794 39.046 ( -4.265 16.844 -6.140) 18.429 40.598 ( -33.933 3.685 9.860) 35.528 40.684 ( -13.008 -16.183 5.028) 21.363 ======================= Grid point 119 (43/120) ======================= q-point: ( 0.22 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( 16.839 17.660 -1.193) 24.431 1.978 ( 16.313 18.632 9.719) 26.603 2.780 ( -0.692 8.550 -7.937) 11.686 2.980 ( -3.149 3.027 -2.398) 4.983 3.131 ( 8.860 28.618 9.047) 31.294 3.200 ( -4.135 6.956 -3.299) 8.739 3.439 ( -7.456 4.455 -2.964) 9.177 3.579 ( -5.634 0.810 -3.843) 6.868 3.756 ( -2.625 13.039 -8.125) 15.586 4.263 ( 7.174 0.410 7.262) 10.217 4.542 ( 1.971 19.497 0.682) 19.608 4.791 ( -0.382 10.675 3.615) 11.277 5.101 ( -1.700 -4.334 -14.777) 15.493 5.196 ( -3.287 -6.374 -6.990) 10.015 5.798 ( 1.421 1.659 12.661) 12.848 5.931 ( 3.791 1.697 12.120) 12.812 6.201 ( 6.546 10.605 8.918) 15.324 6.279 ( 9.335 6.938 5.634) 12.924 6.370 ( 11.610 0.141 3.758) 12.204 6.668 ( 8.820 9.623 0.921) 13.086 6.785 ( 1.965 38.331 6.097) 38.862 7.195 ( 1.700 -4.197 -5.675) 7.260 7.312 ( -0.278 2.098 0.374) 2.150 7.484 ( 4.124 0.788 -4.066) 5.844 7.618 ( 0.727 22.007 -4.972) 22.573 7.862 ( 12.121 12.237 -1.392) 17.280 8.223 ( -3.448 8.100 -5.526) 10.394 8.265 ( -3.153 9.941 -3.163) 10.898 8.627 ( -1.336 1.018 4.022) 4.359 8.859 ( -4.481 2.713 8.289) 9.806 9.160 ( -11.989 -6.137 -4.797) 14.297 9.630 ( -8.491 -5.528 -2.242) 10.377 9.959 ( -0.989 -6.166 2.052) 6.573 10.359 ( -6.337 0.262 -5.660) 8.500 10.379 ( -4.271 -4.928 -1.170) 6.626 10.643 ( -10.939 -1.295 1.895) 11.177 16.989 ( 0.045 9.973 2.093) 10.190 17.068 ( 1.353 1.141 2.016) 2.683 17.183 ( 0.475 7.618 1.103) 7.713 17.377 ( -0.796 8.960 3.775) 9.755 17.455 ( -2.159 2.900 -2.663) 4.491 17.597 ( -1.745 -1.194 4.751) 5.200 17.998 ( 1.289 -10.315 -6.926) 12.491 18.079 ( -0.896 -7.726 -3.231) 8.422 20.235 ( 16.055 -0.424 0.867) 16.084 20.592 ( 23.492 -13.113 -6.773) 27.744 21.773 ( -7.753 -0.243 0.605) 7.780 21.885 ( -5.770 -1.721 -1.101) 6.121 27.622 ( 1.740 -6.048 1.582) 6.490 27.814 ( -0.580 -5.363 -0.204) 5.399 27.826 ( -0.145 -7.012 -1.165) 7.109 27.869 ( -2.179 -5.054 -0.492) 5.526 37.485 ( 6.989 10.337 2.315) 12.691 37.816 ( 5.803 8.127 -1.685) 10.128 38.147 ( 0.815 0.481 1.506) 1.779 38.408 ( -1.530 5.450 -8.296) 10.043 38.529 ( 10.017 -4.920 1.774) 11.301 38.931 ( -7.248 13.630 -4.066) 15.964 39.833 ( -38.425 18.569 19.228) 46.808 40.397 ( -18.037 -16.934 1.910) 24.815 ======================= Grid point 120 (44/120) ======================= q-point: ( 0.33 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( 19.219 12.192 -6.156) 23.578 2.286 ( 14.840 14.640 5.360) 21.524 2.719 ( -4.106 2.094 -10.767) 11.712 2.883 ( -4.923 7.026 -3.714) 9.349 3.073 ( -10.530 7.689 -0.391) 13.044 3.192 ( -4.950 6.961 -3.116) 9.092 3.430 ( -0.070 4.640 -0.958) 4.739 3.598 ( 15.201 18.906 6.606) 25.142 3.680 ( -4.859 18.290 -7.694) 20.429 4.425 ( 7.250 -0.552 2.507) 7.691 4.543 ( -1.464 13.309 -0.723) 13.409 4.803 ( 1.970 12.089 9.765) 15.664 4.977 ( -8.160 4.364 -3.886) 10.036 5.132 ( -5.017 -4.658 -6.295) 9.301 5.842 ( 3.185 1.487 13.940) 14.376 5.989 ( 1.360 1.942 11.901) 12.135 6.346 ( 8.058 11.401 4.235) 14.589 6.445 ( 6.751 7.039 3.219) 10.271 6.580 ( 8.788 9.261 4.057) 13.396 6.749 ( 1.061 36.030 3.976) 36.264 6.936 ( 12.190 5.368 0.627) 13.335 7.229 ( 1.452 -3.546 -4.893) 6.215 7.306 ( 0.307 -2.812 2.751) 3.946 7.643 ( 9.099 3.988 -6.505) 11.875 7.659 ( 6.546 17.014 -4.987) 18.900 8.057 ( -4.140 10.970 1.446) 11.814 8.113 ( -6.683 9.894 4.097) 12.623 8.120 ( 1.457 9.523 -8.905) 13.119 8.607 ( -5.814 8.688 3.957) 11.178 8.784 ( -5.772 -5.635 -1.248) 8.163 8.946 ( -3.960 -0.537 1.964) 4.453 9.454 ( -9.475 -3.634 -1.479) 10.255 9.956 ( 0.989 -6.576 1.043) 6.731 10.225 ( -6.697 -0.078 -4.942) 8.324 10.300 ( -3.331 -6.437 -1.391) 7.380 10.469 ( -7.396 -4.598 0.558) 8.726 16.997 ( 0.816 9.480 1.782) 9.681 17.076 ( -0.637 3.369 1.941) 3.940 17.207 ( 2.278 6.097 -0.969) 6.581 17.385 ( 0.767 4.333 4.168) 6.061 17.407 ( -1.998 5.048 -1.964) 5.774 17.558 ( -2.432 -0.206 4.036) 4.717 18.023 ( 1.215 -9.035 -6.286) 11.073 18.064 ( -0.553 -7.392 -3.966) 8.407 20.583 ( 19.204 -0.471 1.284) 19.253 21.001 ( 18.525 -12.054 -6.458) 23.026 21.580 ( -12.126 -0.291 0.775) 12.154 21.748 ( -8.357 -2.994 -1.821) 9.062 27.661 ( 2.222 -6.140 1.184) 6.636 27.793 ( -1.733 -6.025 -0.244) 6.274 27.823 ( -0.173 -6.680 -1.076) 6.768 27.836 ( -1.055 -5.076 -0.499) 5.208 37.650 ( 9.924 12.671 1.368) 16.152 37.944 ( 6.890 9.967 -2.900) 12.459 38.158 ( 0.070 6.181 1.957) 6.484 38.350 ( -4.035 7.959 -8.613) 12.403 38.773 ( 2.218 0.596 0.551) 2.362 38.799 ( 6.634 -0.306 -0.173) 6.643 39.195 ( -26.563 15.746 20.356) 36.985 40.001 ( -22.041 -14.469 -0.024) 26.366 ======================= Grid point 121 (45/120) ======================= q-point: ( 0.44 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( 16.349 7.789 -7.762) 19.703 2.511 ( 5.369 6.451 -0.225) 8.396 2.642 ( -1.766 7.108 -8.479) 11.204 2.797 ( -11.808 10.024 -1.603) 15.572 2.890 ( 2.847 4.786 -2.991) 6.321 3.047 ( -9.480 4.322 -2.549) 10.725 3.454 ( 3.928 13.036 -5.493) 14.681 3.561 ( -6.337 17.686 -6.911) 20.018 3.983 ( 20.113 12.911 7.021) 24.911 4.324 ( -13.919 6.730 2.302) 15.631 4.658 ( 9.225 3.588 -1.134) 9.963 4.817 ( -6.691 12.989 -0.136) 14.611 4.880 ( 4.287 7.634 8.764) 12.388 5.004 ( -7.355 -0.061 1.976) 7.616 5.914 ( 3.858 1.749 13.126) 13.793 5.977 ( -2.292 2.041 12.347) 12.723 6.481 ( 4.910 9.336 1.302) 10.629 6.521 ( 0.883 7.316 1.370) 7.495 6.702 ( 4.231 24.419 5.255) 25.334 6.752 ( -0.985 34.586 5.289) 35.002 7.143 ( 6.746 -4.699 -5.077) 9.662 7.221 ( -2.341 -5.826 -5.209) 8.158 7.423 ( 13.174 -0.269 6.616) 14.744 7.695 ( -5.464 9.168 0.063) 10.672 7.811 ( -5.668 8.588 -2.070) 10.495 7.863 ( -0.677 5.235 -6.653) 8.493 8.049 ( 10.172 12.853 -4.321) 16.951 8.295 ( 1.781 8.178 -1.727) 8.546 8.407 ( -6.825 5.865 2.701) 9.396 8.566 ( -12.004 6.195 1.813) 13.630 9.063 ( 10.005 -1.819 1.860) 10.338 9.263 ( -10.220 -2.393 0.036) 10.496 10.004 ( 3.904 -5.994 -0.164) 7.156 10.102 ( -5.938 -3.859 -1.808) 7.309 10.279 ( 1.420 -6.556 -3.019) 7.357 10.347 ( -5.199 -6.318 -1.920) 8.404 17.020 ( 1.466 8.163 1.644) 8.455 17.051 ( -1.650 6.274 1.713) 6.709 17.266 ( 3.496 4.427 -1.966) 5.974 17.336 ( -3.549 3.645 -2.245) 5.560 17.441 ( 3.042 3.506 4.510) 6.472 17.502 ( -3.155 1.248 4.223) 5.417 18.043 ( 0.823 -7.996 -5.544) 9.764 18.055 ( -0.479 -7.447 -4.761) 8.852 20.959 ( 18.948 -0.418 1.284) 18.996 21.300 ( -11.091 -1.657 -0.225) 11.216 21.320 ( 9.089 -7.222 -3.478) 12.119 21.560 ( -11.001 -5.267 -3.046) 12.571 27.706 ( 2.387 -6.234 0.670) 6.709 27.752 ( -2.309 -6.239 0.147) 6.654 27.821 ( 0.011 -6.082 -0.898) 6.148 27.824 ( -0.328 -5.577 -0.703) 5.631 37.858 ( 10.838 14.593 -0.896) 18.199 38.017 ( -2.881 11.434 -4.147) 12.499 38.169 ( 3.276 14.977 0.302) 15.334 38.261 ( -4.827 11.647 -5.346) 13.694 38.696 ( -0.484 1.107 7.279) 7.378 38.808 ( -12.627 4.816 15.665) 20.689 39.146 ( 20.089 -9.011 -0.814) 22.032 39.564 ( -22.490 -11.789 -1.027) 25.414 ======================= Grid point 126 (46/120) ======================= q-point: ( 0.00 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.746 ( 0.000 24.090 11.457) 26.676 2.067 ( 0.000 26.404 0.114) 26.404 3.008 ( 0.000 3.239 -3.642) 4.874 3.024 ( 0.000 0.367 -6.172) 6.183 3.287 ( 0.000 2.383 -4.302) 4.917 3.649 ( 0.000 29.316 4.016) 29.590 3.728 ( 0.000 -2.814 -4.633) 5.421 3.769 ( 0.000 3.185 -5.795) 6.612 3.929 ( 0.000 5.595 -5.918) 8.144 4.094 ( 0.000 -0.474 6.949) 6.965 4.748 ( 0.000 -8.855 -10.746) 13.925 4.899 ( 0.000 -4.805 -0.618) 4.844 4.984 ( 0.000 22.185 -5.867) 22.948 5.206 ( 0.000 6.773 -13.143) 14.786 5.806 ( 0.000 4.606 3.921) 6.049 5.913 ( 0.000 -0.677 10.982) 11.003 5.938 ( 0.000 -4.275 1.876) 4.669 6.223 ( 0.000 4.983 12.105) 13.091 6.347 ( 0.000 4.431 -0.327) 4.443 6.421 ( 0.000 10.722 17.472) 20.500 7.097 ( 0.000 -10.365 -2.086) 10.573 7.202 ( 0.000 -16.279 2.892) 16.533 7.477 ( 0.000 9.978 -4.782) 11.065 7.676 ( 0.000 42.806 4.946) 43.091 7.829 ( 0.000 10.377 -10.896) 15.047 8.170 ( 0.000 25.928 -0.633) 25.936 8.218 ( 0.000 6.477 5.669) 8.608 8.659 ( 0.000 1.923 0.299) 1.946 8.715 ( 0.000 8.758 1.420) 8.872 9.000 ( 0.000 4.783 8.311) 9.589 9.269 ( 0.000 -6.855 -8.351) 10.804 9.640 ( 0.000 -10.303 0.869) 10.340 9.986 ( 0.000 4.213 1.011) 4.332 10.436 ( 0.000 2.280 1.447) 2.700 10.455 ( 0.000 -2.892 -3.871) 4.832 10.941 ( 0.000 -3.365 -8.288) 8.945 16.963 ( 0.000 -0.727 -3.736) 3.806 17.273 ( 0.000 8.092 0.290) 8.098 17.310 ( 0.000 5.573 2.314) 6.034 17.507 ( 0.000 -1.648 -1.364) 2.140 17.561 ( 0.000 2.075 1.285) 2.441 17.696 ( 0.000 6.343 8.002) 10.211 17.765 ( 0.000 -5.973 -4.165) 7.282 17.944 ( 0.000 -7.215 -1.349) 7.340 19.875 ( 0.000 0.165 0.138) 0.215 19.891 ( 0.000 -0.172 -0.100) 0.199 21.917 ( 0.000 -0.016 0.382) 0.382 21.976 ( 0.000 -1.240 -0.490) 1.333 27.471 ( 0.000 -5.087 1.708) 5.366 27.666 ( 0.000 -8.388 -1.174) 8.469 27.740 ( 0.000 -3.914 0.630) 3.965 27.819 ( 0.000 -5.564 -0.538) 5.590 37.520 ( 0.000 8.656 2.849) 9.113 37.797 ( 0.000 3.410 0.693) 3.480 38.079 ( 0.000 -2.066 1.542) 2.578 38.213 ( 0.000 -4.440 3.242) 5.498 38.594 ( 0.000 7.962 -7.433) 10.893 39.409 ( 0.000 11.552 -15.736) 19.521 40.404 ( 0.000 -14.848 12.063) 19.131 40.894 ( 0.000 -6.572 2.712) 7.110 ======================= Grid point 127 (47/120) ======================= q-point: ( 0.11 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( 7.065 22.312 6.979) 24.423 2.150 ( 8.069 24.026 1.209) 25.374 2.965 ( -4.288 2.181 -5.391) 7.226 3.043 ( 1.732 1.879 -6.399) 6.891 3.292 ( 0.317 2.144 -3.685) 4.275 3.606 ( -5.118 6.797 0.608) 8.531 3.674 ( -5.548 13.655 0.097) 14.739 3.758 ( 0.056 9.580 -5.527) 11.060 3.905 ( 0.085 5.686 -4.080) 6.999 4.169 ( 5.947 0.526 5.264) 7.959 4.769 ( 2.169 -4.393 -7.349) 8.833 4.842 ( -4.264 -3.771 -1.160) 5.809 5.087 ( 7.508 15.750 -8.667) 19.482 5.223 ( 1.779 9.015 -10.141) 13.685 5.829 ( 1.887 4.759 5.714) 7.672 5.897 ( 1.442 -0.772 8.374) 8.532 6.058 ( 8.954 -2.733 4.636) 10.447 6.254 ( 3.360 3.273 9.730) 10.802 6.334 ( 1.599 8.661 7.312) 11.448 6.562 ( 11.032 4.889 7.619) 14.271 7.079 ( -1.224 -9.111 -2.385) 9.497 7.187 ( -1.358 -15.470 3.772) 15.981 7.481 ( 0.433 8.300 -5.055) 9.728 7.662 ( -1.309 40.818 4.176) 41.052 7.893 ( 6.108 9.940 -9.099) 14.796 8.166 ( -0.376 24.996 -0.197) 25.000 8.263 ( 3.822 6.029 4.420) 8.396 8.630 ( -2.604 0.547 1.364) 2.990 8.692 ( -2.259 12.179 0.899) 12.419 8.993 ( -0.870 5.185 7.627) 9.263 9.207 ( -6.275 -6.228 -7.620) 11.672 9.600 ( -3.887 -9.475 0.295) 10.245 9.964 ( -2.149 3.623 0.884) 4.304 10.403 ( -3.290 1.613 1.547) 3.977 10.427 ( -2.809 -2.679 -4.147) 5.680 10.854 ( -8.436 -1.484 -6.902) 11.000 16.975 ( 1.242 -0.807 -3.417) 3.724 17.245 ( -2.023 6.446 0.599) 6.783 17.326 ( 0.899 7.027 1.535) 7.249 17.489 ( -1.608 -2.125 -1.141) 2.899 17.570 ( 0.624 3.345 1.472) 3.707 17.667 ( -2.422 6.821 7.390) 10.344 17.779 ( 1.317 -6.180 -4.136) 7.552 17.941 ( -0.339 -6.920 -1.457) 7.079 19.979 ( 9.272 -0.192 0.156) 9.276 20.036 ( 14.926 -2.750 -0.865) 15.202 21.881 ( -3.773 -0.021 0.395) 3.794 21.944 ( -3.240 -1.372 -0.555) 3.562 27.480 ( 0.925 -5.109 1.647) 5.446 27.668 ( 0.168 -8.248 -1.127) 8.327 27.734 ( -0.641 -4.092 0.532) 4.176 27.802 ( -1.601 -5.442 -0.467) 5.691 37.564 ( 4.555 9.098 2.734) 10.536 37.840 ( 4.316 3.970 0.610) 5.896 38.095 ( 1.699 -1.643 1.636) 2.875 38.259 ( 4.725 -4.885 2.732) 7.324 38.577 ( -1.768 7.514 -7.233) 10.578 39.353 ( -5.670 11.318 -14.670) 19.377 40.314 ( -9.164 -14.580 10.977) 20.422 40.659 ( -22.660 -1.012 4.779) 23.181 ======================= Grid point 128 (48/120) ======================= q-point: ( 0.22 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( 11.181 17.707 -0.346) 20.944 2.347 ( 11.205 18.905 1.236) 22.011 2.856 ( -6.309 0.395 -7.872) 10.096 3.068 ( -0.293 5.380 -5.731) 7.866 3.297 ( -0.083 3.210 -2.256) 3.925 3.480 ( -6.860 1.374 0.918) 7.056 3.514 ( -8.473 4.602 -7.727) 12.357 3.835 ( 7.193 24.205 4.690) 25.683 3.932 ( 1.871 5.263 -7.369) 9.247 4.291 ( 6.259 1.207 6.138) 8.849 4.743 ( -5.822 -4.386 -1.841) 7.518 4.814 ( 1.726 -4.798 -4.645) 6.897 5.207 ( 3.963 17.449 -7.173) 19.278 5.270 ( 2.887 13.313 -3.830) 14.150 5.860 ( 1.537 5.214 10.137) 11.503 5.966 ( 4.865 1.257 7.551) 9.070 6.278 ( 13.098 -0.950 5.247) 14.142 6.354 ( 7.091 -0.713 4.570) 8.467 6.420 ( 6.866 8.277 7.253) 12.972 6.784 ( 10.028 0.599 -0.700) 10.070 7.079 ( 1.359 -7.386 -3.309) 8.207 7.169 ( 0.935 -12.807 7.899) 15.076 7.502 ( 2.261 6.084 -5.642) 8.600 7.625 ( -2.646 36.851 4.099) 37.172 8.045 ( 8.885 6.639 -6.835) 13.028 8.153 ( -1.273 22.479 0.431) 22.520 8.298 ( -2.664 4.956 1.697) 5.877 8.609 ( 2.482 1.138 2.867) 3.959 8.636 ( -3.129 16.825 0.881) 17.136 8.944 ( -6.122 5.322 2.731) 8.559 9.052 ( -7.524 -3.057 -2.583) 8.522 9.502 ( -5.944 -7.244 -0.938) 9.417 9.915 ( -2.455 2.234 0.670) 3.386 10.314 ( -5.665 0.093 1.761) 5.933 10.350 ( -4.946 -1.847 -4.977) 7.256 10.648 ( -11.781 1.208 -3.970) 12.491 17.010 ( 2.302 -0.834 -2.713) 3.655 17.206 ( -1.869 5.264 0.420) 5.602 17.336 ( 0.043 7.000 0.354) 7.009 17.453 ( -2.026 -1.981 -0.552) 2.887 17.575 ( -0.221 6.492 2.429) 6.936 17.626 ( -1.550 5.728 5.447) 8.055 17.813 ( 2.150 -6.399 -3.968) 7.831 17.934 ( -0.326 -6.225 -1.757) 6.476 20.229 ( 16.010 -0.150 0.574) 16.021 20.398 ( 20.766 -6.924 -2.318) 22.012 21.769 ( -7.797 -0.042 0.437) 7.810 21.849 ( -6.598 -1.854 -0.762) 6.896 27.506 ( 1.672 -5.169 1.467) 5.628 27.673 ( 0.321 -7.852 -1.003) 7.922 27.715 ( -1.346 -4.566 0.340) 4.772 27.764 ( -2.084 -5.264 -0.340) 5.672 37.695 ( 8.895 10.370 2.200) 13.838 37.961 ( 7.944 5.594 0.043) 9.716 38.147 ( 3.719 -0.165 2.215) 4.332 38.395 ( 9.153 -5.945 1.197) 10.980 38.529 ( -2.976 5.972 -6.419) 9.259 39.196 ( -10.277 10.534 -11.627) 18.755 40.060 ( -17.535 -11.350 8.004) 22.368 40.109 ( -30.491 5.516 8.502) 32.132 ======================= Grid point 129 (49/120) ======================= q-point: ( 0.33 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( 13.714 11.737 -4.392) 18.577 2.549 ( 8.550 12.851 -1.843) 15.545 2.748 ( -4.091 0.415 -8.714) 9.636 3.015 ( -4.039 5.222 -2.010) 6.901 3.204 ( -10.132 6.149 -0.238) 11.854 3.332 ( -7.212 7.895 -7.991) 13.350 3.498 ( 6.323 2.509 -5.674) 8.859 3.927 ( -1.320 7.795 -11.116) 13.640 4.032 ( 10.660 19.210 6.584) 22.935 4.407 ( 5.472 -0.667 6.427) 8.467 4.625 ( -5.950 -1.968 0.730) 6.310 4.809 ( -2.652 -9.157 -3.392) 10.119 5.253 ( 1.578 23.307 -0.578) 23.367 5.314 ( 1.159 17.433 1.746) 17.559 5.907 ( 3.446 5.468 10.794) 12.581 6.046 ( 2.498 3.535 8.649) 9.672 6.450 ( 6.181 -0.256 1.691) 6.414 6.523 ( 5.822 0.238 2.837) 6.481 6.658 ( 18.682 3.955 4.513) 19.622 6.913 ( 4.217 -5.576 -4.825) 8.494 7.076 ( -1.578 -10.946 -2.267) 11.289 7.297 ( 10.268 0.790 8.452) 13.323 7.542 ( -4.070 28.511 3.726) 29.040 7.605 ( 7.254 4.021 -4.896) 9.631 8.058 ( -10.134 8.186 4.646) 13.831 8.173 ( -1.663 12.501 -4.488) 13.386 8.248 ( 5.858 6.811 -4.021) 9.843 8.579 ( -2.059 22.618 1.047) 22.736 8.668 ( -6.597 -4.597 -0.697) 8.071 8.780 ( -0.753 8.641 0.266) 8.678 8.965 ( -2.203 3.321 3.392) 5.233 9.374 ( -7.197 -4.288 -1.497) 8.510 9.890 ( 0.372 0.871 0.487) 1.065 10.194 ( -6.619 -1.512 1.523) 6.958 10.250 ( -4.581 -0.081 -5.469) 7.134 10.429 ( -10.235 1.100 -1.582) 10.415 17.060 ( 2.739 -0.297 -1.928) 3.363 17.174 ( -1.487 4.228 0.114) 4.484 17.332 ( -0.129 5.363 -0.821) 5.427 17.413 ( -2.070 -1.321 -0.940) 2.629 17.568 ( -0.240 8.678 3.716) 9.443 17.604 ( -0.914 4.969 4.060) 6.482 17.857 ( 2.201 -6.250 -3.641) 7.561 17.928 ( -0.323 -5.646 -2.203) 6.069 20.577 ( 19.233 -0.096 0.845) 19.251 20.800 ( 20.080 -8.034 -2.823) 21.811 21.576 ( -12.155 -0.052 0.539) 12.167 21.688 ( -10.007 -2.912 -1.164) 10.487 27.543 ( 2.145 -5.245 1.189) 5.791 27.680 ( -1.113 -5.808 -0.197) 5.917 27.681 ( -0.609 -6.498 -0.324) 6.534 27.729 ( -1.420 -5.392 -0.346) 5.586 37.902 ( 11.999 11.998 0.394) 16.973 38.126 ( 7.976 7.200 -1.874) 10.907 38.255 ( 8.297 4.428 4.059) 10.243 38.456 ( -3.269 4.498 -6.360) 8.448 38.623 ( 13.223 -8.454 0.767) 15.713 38.968 ( -12.615 8.663 -6.816) 16.752 39.491 ( -29.892 12.173 10.069) 33.810 39.711 ( -19.772 -13.210 4.998) 24.298 ======================= Grid point 130 (50/120) ======================= q-point: ( 0.44 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.506 ( 11.625 6.571 -5.337) 14.380 2.627 ( -1.115 6.210 -5.252) 8.209 2.730 ( 3.425 1.927 -7.350) 8.334 2.901 ( -10.853 0.799 -4.229) 11.675 3.073 ( 2.117 12.884 -0.757) 13.078 3.191 ( -7.489 9.850 -4.188) 13.063 3.668 ( 9.766 7.670 -9.963) 15.921 3.840 ( -7.231 9.359 -12.248) 17.026 4.248 ( 10.748 11.840 5.686) 16.972 4.424 ( -6.266 2.460 2.902) 7.331 4.591 ( 4.855 -3.854 5.322) 8.170 4.715 ( -6.432 -9.479 0.636) 11.473 5.285 ( 1.791 24.193 3.690) 24.539 5.314 ( -0.963 21.387 4.580) 21.893 5.985 ( 4.151 5.682 9.871) 12.122 6.049 ( -1.965 5.264 9.297) 10.863 6.550 ( 3.734 -1.363 -0.335) 3.989 6.583 ( 0.511 -0.752 0.325) 0.966 6.980 ( 3.634 -9.784 -3.818) 11.114 7.024 ( 6.446 0.990 -0.846) 6.576 7.052 ( 9.513 -3.331 2.325) 10.343 7.339 ( -10.527 17.006 2.786) 20.193 7.559 ( 10.232 11.930 9.122) 18.172 7.788 ( -6.704 2.439 2.104) 7.437 7.846 ( 6.975 3.795 -1.824) 8.147 8.079 ( -8.929 7.122 -4.760) 12.374 8.357 ( 3.449 9.635 -4.852) 11.326 8.447 ( -8.275 7.834 -3.719) 11.987 8.617 ( 5.280 17.736 3.427) 18.820 8.749 ( -6.276 10.935 2.836) 12.923 9.039 ( 8.803 0.350 1.136) 8.883 9.219 ( -8.879 -1.588 -0.683) 9.046 9.939 ( 4.606 0.198 0.064) 4.611 10.057 ( -7.106 -0.661 -0.113) 7.137 10.205 ( 0.425 -0.321 -3.160) 3.205 10.268 ( -5.960 -0.506 -1.405) 6.144 17.110 ( 2.240 1.191 -1.067) 2.752 17.146 ( -1.530 2.948 -0.325) 3.338 17.340 ( 1.035 2.721 -1.587) 3.316 17.372 ( -2.091 0.096 -1.722) 2.710 17.571 ( 0.555 8.062 4.171) 9.094 17.586 ( -0.914 6.365 4.038) 7.593 17.894 ( 1.602 -5.863 -3.213) 6.875 17.918 ( -0.805 -5.557 -2.719) 6.239 20.953 ( 19.007 -0.050 0.851) 19.026 21.163 ( 17.002 -6.686 -2.478) 18.437 21.299 ( -16.201 -0.062 0.721) 16.217 21.460 ( -13.509 -4.648 -1.776) 14.396 27.587 ( 2.372 -5.285 0.857) 5.856 27.634 ( -2.440 -5.230 0.535) 5.795 27.692 ( 0.663 -6.604 -0.662) 6.670 27.707 ( -0.930 -5.931 -0.494) 6.024 38.126 ( 9.506 11.278 -3.824) 15.237 38.224 ( 0.449 9.918 -3.796) 10.629 38.425 ( 4.418 6.607 -1.594) 8.106 38.468 ( 7.965 12.383 -0.367) 14.728 38.729 ( -5.500 1.643 2.476) 6.251 38.892 ( -0.650 -2.909 3.204) 4.376 39.021 ( -5.175 2.470 6.981) 9.034 39.322 ( -19.777 -11.636 2.266) 23.058 ======================= Grid point 135 (51/120) ======================= q-point: ( 0.00 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( 0.000 22.760 7.691) 24.024 2.543 ( 0.000 20.377 -6.304) 21.330 2.948 ( 0.000 -8.582 1.686) 8.746 3.018 ( 0.000 -1.859 -6.092) 6.369 3.365 ( 0.000 5.203 -6.083) 8.005 3.629 ( 0.000 -6.841 -6.044) 9.128 3.800 ( 0.000 1.839 -8.815) 9.004 3.940 ( 0.000 -3.143 -8.637) 9.191 3.954 ( 0.000 7.293 -2.341) 7.660 4.373 ( 0.000 20.927 9.451) 22.963 4.472 ( 0.000 -16.580 -7.036) 18.011 4.815 ( 0.000 -3.760 0.145) 3.763 5.355 ( 0.000 15.140 -6.479) 16.468 5.429 ( 0.000 12.552 -6.227) 14.012 5.803 ( 0.000 -8.118 -3.446) 8.819 5.852 ( 0.000 -5.225 0.648) 5.265 5.974 ( 0.000 11.843 7.740) 14.148 6.341 ( 0.000 7.518 13.086) 15.092 6.439 ( 0.000 2.162 7.041) 7.366 6.606 ( 0.000 7.596 10.288) 12.788 6.777 ( 0.000 -19.377 6.608) 20.472 6.926 ( 0.000 -11.742 -1.888) 11.892 7.692 ( 0.000 11.043 -8.696) 14.056 7.948 ( 0.000 1.242 -13.792) 13.848 8.333 ( 0.000 15.936 7.701) 17.699 8.358 ( 0.000 13.216 6.067) 14.542 8.462 ( 0.000 3.636 6.437) 7.393 8.628 ( 0.000 0.100 2.579) 2.581 8.924 ( 0.000 8.135 0.589) 8.156 9.161 ( 0.000 -4.142 -8.932) 9.846 9.183 ( 0.000 11.499 3.896) 12.141 9.451 ( 0.000 -7.692 4.530) 8.927 10.117 ( 0.000 7.804 1.147) 7.888 10.380 ( 0.000 -4.742 -0.725) 4.797 10.547 ( 0.000 8.380 -1.524) 8.517 10.861 ( 0.000 -5.212 -7.208) 8.895 16.986 ( 0.000 3.099 -7.708) 8.307 17.242 ( 0.000 -8.022 -8.977) 12.039 17.383 ( 0.000 2.413 1.652) 2.924 17.487 ( 0.000 -1.180 1.543) 1.942 17.613 ( 0.000 3.468 0.028) 3.468 17.721 ( 0.000 -1.471 -0.653) 1.610 17.820 ( 0.000 5.016 9.318) 10.582 17.864 ( 0.000 -0.062 4.014) 4.015 19.879 ( 0.000 0.202 0.084) 0.219 19.887 ( 0.000 -0.214 -0.043) 0.218 21.920 ( 0.000 0.341 0.189) 0.390 21.951 ( 0.000 -1.156 -0.275) 1.189 27.401 ( 0.000 -1.612 1.230) 2.028 27.513 ( 0.000 -6.720 -0.411) 6.733 27.679 ( 0.000 -1.974 0.325) 2.000 27.721 ( 0.000 -3.987 -0.296) 3.998 37.675 ( 0.000 6.736 2.943) 7.351 37.824 ( 0.000 -0.579 2.034) 2.115 38.053 ( 0.000 -0.361 1.932) 1.966 38.128 ( 0.000 -3.863 3.324) 5.096 38.808 ( 0.000 13.441 -10.754) 17.213 39.414 ( 0.000 -11.043 -21.238) 23.938 40.321 ( 0.000 6.621 16.498) 17.777 40.741 ( 0.000 -9.173 4.838) 10.370 ======================= Grid point 136 (52/120) ======================= q-point: ( 0.11 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( 3.217 20.597 5.058) 21.451 2.590 ( 4.534 18.781 -6.172) 20.283 2.905 ( -3.882 -6.949 -0.347) 7.967 3.061 ( 3.987 -1.433 -7.099) 8.267 3.360 ( -0.671 4.594 -4.642) 6.565 3.577 ( -4.964 -4.934 -3.412) 7.787 3.739 ( -5.056 3.503 -9.818) 11.585 3.965 ( 1.006 6.022 -3.856) 7.221 3.986 ( 4.030 -3.624 -5.859) 7.981 4.369 ( 0.184 13.775 5.811) 14.952 4.504 ( 2.360 -11.031 -1.845) 11.431 4.807 ( -0.727 -2.663 -0.572) 2.819 5.434 ( 7.227 15.232 -7.052) 18.275 5.466 ( 3.919 13.609 -5.298) 15.121 5.831 ( 4.098 -5.282 -0.553) 6.708 5.952 ( 6.692 -1.284 -5.962) 9.054 6.012 ( 5.457 6.490 12.513) 15.116 6.345 ( 0.621 6.878 11.798) 13.671 6.458 ( 2.106 2.197 8.258) 8.801 6.640 ( 2.909 1.891 6.325) 7.214 6.791 ( 2.327 -16.494 7.402) 18.228 6.917 ( -0.943 -11.458 -1.640) 11.613 7.691 ( 0.066 11.613 -7.673) 13.919 7.971 ( 2.168 0.457 -12.611) 12.804 8.300 ( -3.479 17.880 4.726) 18.819 8.368 ( 0.952 5.942 8.697) 10.576 8.486 ( 1.817 6.892 4.651) 8.511 8.607 ( -1.726 0.507 3.270) 3.732 8.922 ( -0.127 8.463 0.492) 8.478 9.122 ( -3.954 -1.701 -8.413) 9.450 9.169 ( -1.465 10.009 3.738) 10.785 9.421 ( -2.870 -7.641 4.157) 9.160 10.091 ( -2.550 7.971 1.134) 8.445 10.357 ( -2.308 -4.494 -0.765) 5.110 10.506 ( -4.033 8.217 -1.300) 9.246 10.803 ( -5.756 -4.122 -6.729) 9.767 16.996 ( 0.972 2.942 -7.188) 7.827 17.235 ( -0.625 -6.529 -8.067) 10.397 17.384 ( -0.122 0.653 0.915) 1.130 17.463 ( -2.179 -0.695 1.026) 2.507 17.630 ( 1.394 3.285 0.478) 3.601 17.729 ( 0.863 -1.393 -0.606) 1.747 17.805 ( -1.418 5.632 8.667) 10.433 17.865 ( 0.106 -0.123 3.686) 3.690 19.977 ( 9.444 0.097 0.110) 9.445 20.000 ( 11.530 -1.193 -0.213) 11.593 21.884 ( -3.756 0.370 0.193) 3.779 21.918 ( -3.489 -1.259 -0.310) 3.722 27.410 ( 0.851 -1.668 1.189) 2.219 27.517 ( 0.449 -6.585 -0.394) 6.612 27.670 ( -0.925 -2.100 0.304) 2.315 27.707 ( -1.379 -3.857 -0.243) 4.103 37.726 ( 5.252 6.971 2.845) 9.180 37.875 ( 5.173 -0.310 2.018) 5.562 38.077 ( 2.447 -0.041 1.888) 3.091 38.166 ( 3.831 -4.278 2.902) 6.434 38.781 ( -2.714 12.956 -10.397) 16.832 39.364 ( -5.052 -10.406 -20.356) 23.413 40.224 ( -9.879 5.801 15.820) 19.532 40.582 ( -15.684 -6.513 5.379) 17.814 ======================= Grid point 137 (53/120) ======================= q-point: ( 0.22 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( 5.148 15.381 0.387) 16.224 2.689 ( 4.246 11.104 -6.846) 13.719 2.823 ( -3.265 0.182 -4.149) 5.283 3.136 ( 1.555 -0.279 -8.962) 9.100 3.347 ( 0.217 2.537 -1.257) 2.840 3.466 ( -5.108 -2.213 -0.404) 5.581 3.633 ( -5.506 8.217 -11.401) 15.094 3.984 ( 0.681 1.394 -7.795) 7.948 4.089 ( 6.566 -1.632 -0.731) 6.805 4.390 ( 1.916 4.805 3.045) 6.003 4.540 ( 1.219 -4.188 3.999) 5.917 4.781 ( -2.301 -1.425 -0.061) 2.707 5.563 ( 6.142 14.274 -3.418) 15.911 5.599 ( 7.893 18.874 -6.103) 21.349 5.952 ( 7.512 -1.890 2.396) 8.108 6.023 ( 2.590 10.175 1.342) 10.585 6.225 ( 13.204 -6.068 4.692) 15.270 6.375 ( 2.698 4.876 9.462) 10.982 6.527 ( 5.510 0.720 7.309) 9.182 6.681 ( 1.157 -9.315 1.787) 9.555 6.886 ( -0.427 -11.471 0.999) 11.522 6.923 ( 9.975 -8.770 4.170) 13.922 7.708 ( 2.036 12.588 -5.319) 13.817 8.014 ( 1.059 1.476 -8.398) 8.592 8.215 ( -4.439 10.700 2.781) 11.913 8.342 ( -4.744 3.444 6.314) 8.616 8.505 ( -0.573 8.383 2.234) 8.695 8.599 ( 1.243 0.339 4.738) 4.910 8.919 ( -0.220 9.158 0.253) 9.164 9.019 ( -5.841 3.829 -6.543) 9.570 9.128 ( -2.662 7.560 4.029) 8.971 9.355 ( -3.656 -6.951 2.538) 8.254 10.033 ( -2.919 8.459 1.110) 9.017 10.296 ( -3.732 -3.535 -1.006) 5.238 10.399 ( -6.690 7.779 -0.621) 10.279 10.652 ( -9.253 -1.679 -5.525) 10.907 17.025 ( 2.022 2.533 -5.933) 6.760 17.222 ( -0.663 -3.560 -6.251) 7.224 17.371 ( -1.290 -2.636 -0.291) 2.949 17.416 ( -2.413 -0.375 -0.187) 2.449 17.659 ( 1.485 3.708 1.268) 4.191 17.755 ( 1.663 -1.221 -0.420) 2.105 17.774 ( -1.478 6.536 7.196) 9.833 17.868 ( 0.105 -0.380 2.821) 2.848 20.232 ( 16.217 0.491 0.301) 16.227 20.299 ( 18.336 -3.420 -0.707) 18.666 21.773 ( -7.771 0.438 0.207) 7.786 21.814 ( -7.220 -1.595 -0.413) 7.405 27.433 ( 1.549 -1.820 1.073) 2.620 27.530 ( 0.833 -6.204 -0.348) 6.270 27.644 ( -1.738 -2.371 0.278) 2.953 27.673 ( -1.997 -3.665 -0.136) 4.176 37.877 ( 10.096 7.598 2.260) 12.836 38.020 ( 9.496 0.537 1.550) 9.637 38.152 ( 5.599 0.888 2.297) 6.117 38.277 ( 7.667 -5.466 1.880) 9.602 38.705 ( -4.962 11.598 -9.378) 15.719 39.224 ( -9.222 -8.568 -17.819) 21.817 39.953 ( -17.421 3.580 13.957) 22.607 40.172 ( -25.345 -0.988 6.390) 26.156 ======================= Grid point 138 (54/120) ======================= q-point: ( 0.33 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.452 ( 7.536 9.197 -2.288) 12.108 2.701 ( -0.996 -2.235 -6.018) 6.497 2.819 ( 0.134 10.807 -8.339) 13.651 3.066 ( -7.309 -0.258 -4.550) 8.613 3.317 ( -3.116 5.359 1.515) 6.382 3.500 ( 5.890 -0.373 -11.837) 13.227 3.540 ( -1.636 10.671 -10.121) 14.797 3.976 ( -1.980 -2.734 -13.707) 14.116 4.234 ( 7.965 0.438 4.043) 8.943 4.439 ( 2.922 0.745 4.700) 5.585 4.549 ( -0.409 -0.061 6.762) 6.775 4.709 ( -5.075 -0.946 4.394) 6.779 5.676 ( 4.957 17.711 -0.700) 18.404 5.716 ( 3.990 21.835 -3.815) 22.522 6.064 ( 3.611 9.780 8.359) 13.363 6.106 ( 5.749 2.120 0.318) 6.135 6.404 ( 4.423 -5.752 1.120) 7.342 6.453 ( 4.092 -3.512 5.544) 7.734 6.703 ( 1.299 -11.684 1.954) 11.917 6.706 ( 10.417 -7.701 3.887) 13.525 6.888 ( 4.970 -1.150 0.521) 5.128 7.198 ( 16.659 -8.696 1.780) 18.877 7.780 ( 5.061 12.118 -3.338) 13.550 7.920 ( -10.897 9.096 1.197) 14.245 8.143 ( -7.420 1.157 1.077) 7.586 8.262 ( 2.120 -0.651 0.402) 2.254 8.428 ( -8.145 7.043 0.394) 10.774 8.606 ( -1.645 -1.209 2.152) 2.966 8.922 ( 0.669 10.401 0.991) 10.470 8.952 ( -0.233 7.995 -2.535) 8.390 9.073 ( -2.434 6.169 3.642) 7.566 9.281 ( -4.079 -5.230 0.531) 6.654 9.998 ( -0.263 8.787 1.065) 8.855 10.218 ( -4.538 0.407 -1.617) 4.834 10.269 ( -5.496 5.210 0.422) 7.585 10.465 ( -9.565 0.617 -4.036) 10.400 17.073 ( 2.866 2.080 -4.469) 5.702 17.208 ( -0.821 -0.347 -4.198) 4.292 17.339 ( -1.693 -4.666 -1.602) 5.215 17.372 ( -2.136 -1.560 -1.807) 3.203 17.686 ( 1.296 4.736 2.190) 5.376 17.748 ( -1.141 6.939 5.479) 8.915 17.793 ( 2.032 -1.284 0.075) 2.405 17.867 ( -0.245 -0.811 1.821) 2.009 20.583 ( 19.347 0.790 0.407) 19.367 20.678 ( 20.006 -4.547 -1.031) 20.542 21.580 ( -12.088 0.555 0.243) 12.103 21.636 ( -11.163 -2.265 -0.593) 11.406 27.468 ( 2.018 -2.023 0.902) 2.996 27.549 ( 1.131 -5.647 -0.285) 5.766 27.604 ( -2.348 -2.485 0.346) 3.436 27.635 ( -1.821 -3.822 -0.101) 4.235 38.101 ( 11.946 7.785 -0.600) 14.272 38.217 ( 10.422 2.469 0.071) 10.711 38.325 ( 12.981 2.088 4.454) 13.882 38.464 ( 11.620 -6.770 1.315) 13.512 38.595 ( -6.016 9.584 -7.683) 13.678 39.016 ( -11.893 -5.659 -13.838) 19.104 39.571 ( -21.268 0.449 11.299) 24.088 39.646 ( -27.792 3.383 6.896) 28.834 ======================= Grid point 139 (55/120) ======================= q-point: ( 0.44 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( 8.402 4.584 -3.106) 10.062 2.727 ( 3.523 0.257 -6.399) 7.309 2.757 ( -4.583 4.298 -4.856) 7.941 2.892 ( -10.004 -1.452 -3.950) 10.853 3.327 ( 4.043 12.545 -4.973) 14.088 3.429 ( -5.527 13.584 -11.161) 18.429 3.717 ( 10.677 -3.253 -15.423) 19.038 3.892 ( -6.814 -4.418 -17.980) 19.729 4.382 ( 6.907 2.068 7.526) 10.422 4.476 ( -1.252 4.632 8.801) 10.024 4.536 ( 1.003 -3.164 7.048) 7.790 4.604 ( -4.995 -1.224 8.679) 10.088 5.744 ( 2.067 21.125 0.238) 21.227 5.758 ( 0.579 22.833 -1.187) 22.871 6.136 ( 3.472 9.038 6.753) 11.805 6.172 ( 0.511 5.931 4.458) 7.438 6.465 ( 2.276 -6.310 -0.133) 6.709 6.489 ( -0.024 -7.724 0.292) 7.730 6.730 ( 1.510 -13.988 2.040) 14.216 6.758 ( -1.108 -16.255 1.641) 16.375 7.194 ( 20.870 8.273 1.860) 22.527 7.510 ( 7.153 -0.485 -1.055) 7.247 7.635 ( -8.347 1.217 3.209) 9.025 7.845 ( -8.415 0.053 -0.916) 8.465 8.017 ( 3.932 10.304 3.109) 11.459 8.211 ( -12.137 10.067 0.440) 15.774 8.385 ( 7.868 -4.315 -2.015) 9.197 8.529 ( -6.127 -1.730 -0.575) 6.393 8.931 ( 0.694 11.088 2.020) 11.292 8.954 ( -1.287 8.688 2.152) 9.042 9.090 ( 4.584 3.033 0.171) 5.499 9.192 ( -5.103 -2.133 -0.523) 5.555 10.027 ( 3.183 8.126 0.807) 8.764 10.113 ( -5.404 6.600 -0.068) 8.530 10.227 ( 0.967 1.186 -1.059) 1.861 10.302 ( -6.570 1.653 -2.559) 7.242 17.131 ( 3.012 1.900 -3.151) 4.755 17.182 ( -2.033 1.737 -2.709) 3.806 17.319 ( -0.090 -4.959 -3.030) 5.813 17.335 ( -1.539 -3.369 -2.929) 4.722 17.709 ( 1.060 5.849 3.189) 6.745 17.728 ( -0.961 6.680 4.261) 7.981 17.830 ( 1.695 -1.374 0.432) 2.224 17.856 ( -0.955 -1.206 1.001) 1.836 20.960 ( 19.001 0.850 0.389) 19.024 21.054 ( 18.375 -4.263 -1.038) 18.891 21.305 ( -16.172 0.720 0.316) 16.192 21.381 ( -15.073 -3.272 -0.832) 15.447 27.510 ( 2.295 -2.223 0.704) 3.272 27.557 ( -2.437 -2.393 0.506) 3.452 27.573 ( 1.362 -4.995 -0.213) 5.182 27.602 ( -1.582 -4.350 -0.149) 4.631 38.293 ( 8.059 6.631 -4.575) 11.395 38.416 ( 0.223 8.619 -4.848) 9.891 38.497 ( 7.354 0.852 -3.108) 8.030 38.655 ( 17.897 3.151 5.138) 18.885 38.701 ( 3.207 -1.734 -1.751) 4.045 38.807 ( -0.357 -3.104 -3.250) 4.508 39.126 ( -23.606 3.678 6.958) 24.884 39.163 ( -20.408 -2.750 7.674) 21.976 ======================= Grid point 144 (56/120) ======================= q-point: ( 0.00 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.620 ( 0.000 -16.538 3.124) 16.831 2.620 ( 0.000 16.538 3.124) 16.831 2.911 ( 0.000 -9.021 -5.038) 10.332 2.911 ( 0.000 9.021 -5.038) 10.332 3.484 ( 0.000 -6.931 -6.469) 9.481 3.484 ( 0.000 6.931 -6.469) 9.481 3.858 ( 0.000 -4.107 -9.621) 10.461 3.858 ( 0.000 4.107 -9.621) 10.461 4.162 ( 0.000 -13.731 -5.488) 14.787 4.162 ( 0.000 13.731 -5.488) 14.787 4.687 ( 0.000 -10.398 5.154) 11.605 4.687 ( 0.000 10.398 5.154) 11.605 5.583 ( 0.000 -5.801 -2.757) 6.423 5.583 ( 0.000 5.801 -2.757) 6.423 5.705 ( 0.000 -6.273 -3.989) 7.434 5.705 ( 0.000 6.273 -3.989) 7.434 6.280 ( 0.000 -17.045 7.163) 18.489 6.280 ( 0.000 17.045 7.163) 18.489 6.507 ( 0.000 -8.364 11.193) 13.972 6.507 ( 0.000 8.364 11.193) 13.972 6.735 ( 0.000 -6.896 2.000) 7.180 6.735 ( 0.000 6.896 2.000) 7.180 7.882 ( 0.000 -7.277 -12.441) 14.413 7.882 ( 0.000 7.277 -12.441) 14.413 8.453 ( 0.000 -3.298 9.857) 10.394 8.453 ( 0.000 3.298 9.857) 10.394 8.592 ( 0.000 -5.176 2.674) 5.826 8.592 ( 0.000 5.176 2.674) 5.826 9.063 ( 0.000 -6.301 -3.117) 7.030 9.063 ( 0.000 6.301 -3.117) 7.030 9.348 ( 0.000 -4.734 3.617) 5.958 9.348 ( 0.000 4.734 3.617) 5.958 10.265 ( 0.000 -6.793 0.966) 6.861 10.265 ( 0.000 6.793 0.966) 6.861 10.725 ( 0.000 -8.506 -4.572) 9.657 10.725 ( 0.000 8.506 -4.572) 9.657 17.085 ( 0.000 -6.783 -9.558) 11.720 17.085 ( 0.000 6.783 -9.558) 11.720 17.436 ( 0.000 -3.116 0.954) 3.259 17.436 ( 0.000 3.116 0.954) 3.259 17.678 ( 0.000 -2.737 -0.714) 2.828 17.678 ( 0.000 2.737 -0.714) 2.828 17.876 ( 0.000 -0.540 8.526) 8.543 17.876 ( 0.000 0.540 8.526) 8.543 19.883 ( 0.000 -0.223 0.021) 0.224 19.883 ( 0.000 0.223 0.021) 0.224 21.932 ( 0.000 -0.802 -0.041) 0.803 21.932 ( 0.000 0.802 -0.041) 0.803 27.414 ( 0.000 -2.947 0.467) 2.983 27.414 ( 0.000 2.947 0.467) 2.983 27.670 ( 0.000 -1.072 0.001) 1.072 27.670 ( 0.000 1.072 0.001) 1.072 37.780 ( 0.000 -3.802 2.731) 4.681 37.780 ( 0.000 3.802 2.731) 4.681 38.069 ( 0.000 -1.974 2.584) 3.252 38.069 ( 0.000 1.974 2.584) 3.252 39.112 ( 0.000 -16.648 -15.111) 22.484 39.112 ( 0.000 16.648 -15.111) 22.484 40.530 ( 0.000 -11.746 9.504) 15.110 40.530 ( 0.000 11.746 9.504) 15.110 ======================= Grid point 146 (57/120) ======================= q-point: ( 0.11 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.613 ( -0.697 -15.102 1.508) 15.193 2.613 ( -0.697 15.102 1.508) 15.193 2.951 ( 3.661 -9.911 -6.394) 12.350 2.951 ( 3.661 9.911 -6.394) 12.350 3.462 ( -2.281 -5.755 -4.628) 7.730 3.462 ( -2.281 5.755 -4.628) 7.730 3.848 ( -0.692 -7.053 -9.429) 11.796 3.848 ( -0.692 7.053 -9.429) 11.796 4.170 ( 0.884 -13.352 -4.287) 14.051 4.170 ( 0.884 13.352 -4.287) 14.051 4.694 ( 0.578 -9.686 5.017) 10.923 4.694 ( 0.578 9.686 5.017) 10.923 5.641 ( 5.582 -4.720 -2.511) 7.730 5.641 ( 5.582 4.720 -2.511) 7.730 5.792 ( 8.511 -8.348 -5.036) 12.942 5.792 ( 8.511 8.348 -5.036) 12.942 6.295 ( 1.470 -16.610 7.182) 18.156 6.295 ( 1.470 16.610 7.182) 18.156 6.510 ( 0.380 -8.348 10.874) 13.715 6.510 ( 0.380 8.348 10.874) 13.715 6.742 ( 1.024 -5.097 2.062) 5.593 6.742 ( 1.024 5.097 2.062) 5.593 7.892 ( 1.136 -7.762 -11.392) 13.832 7.892 ( 1.136 7.762 -11.392) 13.832 8.435 ( -2.346 -1.201 7.936) 8.362 8.435 ( -2.346 1.201 7.936) 8.362 8.590 ( 0.008 -3.279 3.973) 5.151 8.590 ( 0.008 3.279 3.973) 5.151 9.058 ( -0.560 -5.485 -3.623) 6.597 9.058 ( -0.560 5.485 -3.623) 6.597 9.317 ( -2.961 -4.474 4.067) 6.733 9.317 ( -2.961 4.474 4.067) 6.733 10.244 ( -2.064 -6.949 0.953) 7.312 10.244 ( -2.064 6.949 0.953) 7.312 10.681 ( -4.403 -8.148 -4.330) 10.224 10.681 ( -4.403 8.148 -4.330) 10.224 17.091 ( 0.625 -6.544 -9.072) 11.204 17.091 ( 0.625 6.544 -9.072) 11.204 17.419 ( -1.645 -2.720 0.640) 3.242 17.419 ( -1.645 2.720 0.640) 3.242 17.690 ( 1.237 -2.533 -0.382) 2.845 17.690 ( 1.237 2.533 -0.382) 2.845 17.871 ( -0.503 -0.986 7.887) 7.964 17.871 ( -0.503 0.986 7.887) 7.964 19.983 ( 10.032 -0.523 0.009) 10.046 19.983 ( 10.032 0.523 0.009) 10.046 21.896 ( -3.663 -0.870 -0.051) 3.765 21.896 ( -3.663 0.870 -0.051) 3.765 27.421 ( 0.692 -2.843 0.453) 2.961 27.421 ( 0.692 2.843 0.453) 2.961 27.658 ( -1.153 -0.949 0.027) 1.493 27.658 ( -1.153 0.949 0.027) 1.493 37.834 ( 5.470 -3.787 2.693) 7.177 37.834 ( 5.470 3.787 2.693) 7.177 38.099 ( 3.079 -2.310 2.330) 4.500 38.099 ( 3.079 2.310 2.330) 4.500 39.074 ( -3.782 -16.057 -14.564) 22.006 39.074 ( -3.782 16.057 -14.564) 22.006 40.411 ( -12.003 -10.332 9.402) 18.418 40.411 ( -12.003 10.332 9.402) 18.418 ======================= Grid point 148 (58/120) ======================= q-point: ( 0.22 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( -0.570 -11.242 -1.384) 11.341 2.598 ( -0.570 11.242 -1.384) 11.341 3.026 ( 2.847 -10.504 -10.107) 14.853 3.026 ( 2.847 10.504 -10.107) 14.853 3.406 ( -2.519 -3.331 -0.847) 4.262 3.406 ( -2.519 3.331 -0.847) 4.262 3.836 ( -0.862 -11.423 -10.414) 15.481 3.836 ( -0.862 11.423 -10.414) 15.481 4.207 ( 3.382 -11.278 -1.397) 11.857 4.207 ( 3.382 11.278 -1.397) 11.857 4.699 ( -0.411 -7.701 5.957) 9.744 4.699 ( -0.411 7.701 5.957) 9.744 5.782 ( 8.456 -5.774 -1.915) 10.417 5.782 ( 8.456 5.774 -1.915) 10.417 5.994 ( 10.805 -11.042 -7.031) 16.974 5.994 ( 10.805 11.042 -7.031) 16.974 6.332 ( 2.218 -15.574 7.081) 17.252 6.332 ( 2.218 15.574 7.081) 17.252 6.521 ( 0.530 -8.122 9.996) 12.891 6.521 ( 0.530 8.122 9.996) 12.891 6.801 ( 6.143 -2.683 2.228) 7.064 6.801 ( 6.143 2.683 2.228) 7.064 7.928 ( 2.551 -8.534 -8.829) 12.542 7.928 ( 2.551 8.534 -8.829) 12.542 8.342 ( -7.324 -3.188 4.811) 9.324 8.342 ( -7.324 3.188 4.811) 9.324 8.593 ( -0.159 -1.801 5.225) 5.530 8.593 ( -0.159 1.801 5.225) 5.530 9.040 ( -1.121 -3.317 -4.120) 5.407 9.040 ( -1.121 3.317 -4.120) 5.407 9.247 ( -3.840 -4.656 4.754) 7.683 9.247 ( -3.840 4.656 4.754) 7.683 10.195 ( -2.566 -6.944 0.853) 7.452 10.195 ( -2.566 6.944 0.853) 7.452 10.563 ( -7.347 -7.247 -3.623) 10.938 10.563 ( -7.347 7.247 -3.623) 10.938 17.110 ( 1.399 -5.850 -7.819) 9.865 17.110 ( 1.399 5.850 -7.819) 9.865 17.376 ( -2.700 -2.289 -0.182) 3.544 17.376 ( -2.700 2.289 -0.182) 3.544 17.722 ( 1.889 -2.378 0.397) 3.063 17.722 ( 1.889 2.378 0.397) 3.063 17.859 ( -0.690 -1.873 6.391) 6.696 17.859 ( -0.690 1.873 6.391) 6.696 20.251 ( 16.897 -1.575 -0.050) 16.971 20.251 ( 16.897 1.575 -0.050) 16.971 21.788 ( -7.597 -1.064 -0.083) 7.671 21.788 ( -7.597 1.064 -0.083) 7.671 27.440 ( 1.271 -2.557 0.414) 2.885 27.440 ( 1.271 2.557 0.414) 2.885 27.627 ( -1.907 -0.746 0.089) 2.050 27.627 ( -1.907 0.746 0.089) 2.050 37.989 ( 10.331 -3.656 2.237) 11.185 37.989 ( 10.331 3.656 2.237) 11.185 38.190 ( 6.469 -3.148 1.948) 7.454 38.190 ( 6.469 3.148 1.948) 7.454 38.969 ( -6.870 -14.403 -13.004) 20.585 38.969 ( -6.870 14.403 -13.004) 20.585 40.086 ( -20.698 -6.971 9.012) 23.626 40.086 ( -20.698 6.971 9.012) 23.626 ======================= Grid point 150 (59/120) ======================= q-point: ( 0.33 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( 2.105 -6.477 -3.204) 7.526 2.608 ( 2.105 6.477 -3.204) 7.526 3.001 ( -5.871 -6.438 -8.222) 11.980 3.001 ( -5.871 6.438 -8.222) 11.980 3.424 ( 4.939 -5.270 -4.854) 8.703 3.424 ( 4.939 5.270 -4.854) 8.703 3.798 ( -3.258 -13.017 -13.898) 19.318 3.798 ( -3.258 13.017 -13.898) 19.318 4.306 ( 6.546 -7.438 3.590) 10.539 4.306 ( 6.546 7.438 3.590) 10.539 4.665 ( -3.240 -4.809 8.306) 10.130 4.665 ( -3.240 4.809 8.306) 10.130 5.950 ( 8.378 -6.453 -1.493) 10.680 5.950 ( 8.378 6.453 -1.493) 10.680 6.153 ( 4.707 -10.372 -7.699) 13.748 6.153 ( 4.707 10.372 -7.699) 13.748 6.377 ( 2.510 -13.523 6.821) 15.352 6.377 ( 2.510 13.523 6.821) 15.352 6.522 ( -0.543 -5.345 8.866) 10.366 6.522 ( -0.543 5.345 8.866) 10.366 7.014 ( 15.684 -9.184 1.517) 18.238 7.014 ( 15.684 9.184 1.517) 18.238 7.966 ( -1.651 -4.927 -5.287) 7.413 7.966 ( -1.651 4.927 -5.287) 7.413 8.182 ( -5.907 -4.898 2.961) 8.225 8.182 ( -5.907 4.898 2.961) 8.225 8.552 ( -4.704 -4.741 3.663) 7.617 8.552 ( -4.704 4.741 3.663) 7.617 9.030 ( 0.501 -0.965 -2.349) 2.588 9.030 ( 0.501 0.965 -2.349) 2.588 9.178 ( -3.225 -4.852 3.851) 6.984 9.178 ( -3.225 4.852 3.851) 6.984 10.160 ( -0.674 -6.060 0.535) 6.121 10.160 ( -0.674 6.060 0.535) 6.121 10.411 ( -7.960 -6.126 -2.521) 10.356 10.411 ( -7.960 6.126 -2.521) 10.356 17.145 ( 2.225 -4.821 -6.199) 8.162 17.145 ( 2.225 4.821 -6.198) 8.162 17.318 ( -3.179 -2.368 -1.384) 4.198 17.318 ( -3.179 2.368 -1.384) 4.198 17.760 ( 1.975 -2.524 1.334) 3.472 17.760 ( 1.975 2.524 1.334) 3.472 17.844 ( -0.863 -2.589 4.773) 5.498 17.844 ( -0.863 2.589 4.773) 5.498 20.612 ( 19.620 -2.266 -0.135) 19.751 20.612 ( 19.620 2.266 -0.135) 19.751 21.599 ( -11.806 -1.407 -0.129) 11.890 21.599 ( -11.806 1.407 -0.129) 11.890 27.469 ( 1.684 -2.149 0.359) 2.754 27.469 ( 1.684 2.149 0.359) 2.754 27.587 ( -2.178 -0.840 0.162) 2.341 27.587 ( -2.178 0.840 0.162) 2.341 38.212 ( 11.577 -3.305 -0.667) 12.058 38.212 ( 11.577 3.305 -0.667) 12.058 38.366 ( 12.392 -3.042 3.497) 13.230 38.366 ( 12.392 3.042 3.497) 13.230 38.817 ( -8.503 -11.928 -10.566) 18.062 38.817 ( -8.503 11.928 -10.566) 18.062 39.638 ( -24.639 -3.405 8.229) 26.199 39.638 ( -24.639 3.405 8.229) 26.199 ======================= Grid point 152 (60/120) ======================= q-point: ( 0.44 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.690 ( 6.335 -3.006 -3.711) 7.933 2.690 ( 6.335 3.006 -3.711) 7.933 2.844 ( -8.931 -3.486 -4.507) 10.594 2.844 ( -8.931 3.486 -4.507) 10.594 3.561 ( 8.014 -10.312 -12.369) 17.988 3.561 ( 8.014 10.312 -12.369) 17.988 3.705 ( -6.354 -12.539 -15.446) 20.885 3.705 ( -6.354 12.539 -15.446) 20.885 4.444 ( 7.244 -4.246 8.049) 11.631 4.444 ( 7.244 4.246 8.049) 11.631 4.575 ( -5.921 -2.969 9.701) 11.747 4.575 ( -5.921 2.969 9.701) 11.747 6.093 ( 6.017 -6.404 -2.399) 9.108 6.093 ( 6.017 6.404 -2.399) 9.108 6.174 ( -2.060 -6.966 -5.064) 8.855 6.174 ( -2.060 6.966 -5.064) 8.855 6.435 ( 3.358 -8.865 6.136) 11.292 6.435 ( 3.358 8.865 6.136) 11.292 6.494 ( -2.395 -5.492 7.144) 9.324 6.494 ( -2.395 5.492 7.144) 9.324 7.373 ( 20.018 -9.311 0.445) 22.082 7.373 ( 20.018 9.311 0.445) 22.082 7.747 ( -17.511 -7.079 -0.421) 18.892 7.747 ( -17.511 7.079 -0.421) 18.892 8.236 ( 8.163 -10.090 0.400) 12.984 8.236 ( 8.163 10.090 0.400) 12.984 8.413 ( -8.996 -8.870 1.774) 12.757 8.413 ( -8.996 8.870 1.774) 12.757 9.062 ( 2.572 -1.704 0.014) 3.086 9.062 ( 2.572 1.704 0.014) 3.086 9.118 ( -3.022 -3.758 1.887) 5.178 9.118 ( -3.022 3.758 1.887) 5.178 10.180 ( 2.850 -4.934 -0.142) 5.700 10.180 ( 2.850 4.934 -0.142) 5.700 10.270 ( -6.213 -5.091 -1.239) 8.128 10.270 ( -6.213 5.091 -1.239) 8.128 17.195 ( 2.882 -3.720 -4.500) 6.511 17.195 ( 2.882 3.720 -4.500) 6.511 17.255 ( -3.219 -2.852 -2.862) 5.166 17.255 ( -3.219 2.852 -2.862) 5.166 17.796 ( 1.682 -2.784 2.320) 3.995 17.796 ( 1.682 2.784 2.320) 3.995 17.824 ( -1.232 -2.879 3.417) 4.636 17.824 ( -1.232 2.879 3.417) 4.636 20.990 ( 18.864 -2.291 -0.182) 19.004 20.990 ( 18.864 2.291 -0.182) 19.004 21.330 ( -15.857 -1.886 -0.173) 15.970 21.330 ( -15.857 1.886 -0.173) 15.970 27.505 ( 1.959 -1.686 0.296) 2.601 27.505 ( 1.959 1.686 0.296) 2.601 27.545 ( -2.138 -1.224 0.231) 2.474 27.545 ( -2.138 1.224 0.231) 2.474 38.417 ( 9.864 -5.889 -4.573) 12.365 38.417 ( 9.864 5.889 -4.573) 12.365 38.581 ( -2.940 -6.299 -3.846) 7.944 38.581 ( -2.940 6.299 -3.846) 7.944 38.748 ( 13.614 -2.307 2.042) 13.958 38.748 ( 13.614 2.307 2.042) 13.958 39.159 ( -24.089 -0.998 7.024) 25.112 39.159 ( -24.089 0.998 7.024) 25.112 ======================= Grid point 198 (61/120) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.159 ( 0.000 0.000 30.066) 30.066 1.352 ( 0.000 0.000 31.500) 31.500 2.216 ( 0.000 0.000 44.164) 44.164 2.396 ( 0.000 0.000 -27.682) 27.682 2.587 ( 0.000 0.000 -15.520) 15.520 3.360 ( 0.000 0.000 2.077) 2.077 3.469 ( 0.000 0.000 -3.259) 3.259 3.599 ( 0.000 0.000 -4.891) 4.891 3.657 ( 0.000 0.000 4.578) 4.578 4.059 ( 0.000 0.000 12.548) 12.548 4.378 ( 0.000 0.000 -5.581) 5.581 4.455 ( 0.000 0.000 -36.236) 36.236 4.640 ( 0.000 0.000 15.433) 15.433 5.374 ( 0.000 0.000 -16.880) 16.880 5.572 ( 0.000 0.000 19.236) 19.236 5.964 ( 0.000 0.000 10.281) 10.281 6.042 ( 0.000 0.000 10.960) 10.960 6.128 ( 0.000 0.000 10.667) 10.667 6.338 ( 0.000 0.000 -5.694) 5.694 6.383 ( 0.000 0.000 16.230) 16.230 6.391 ( 0.000 0.000 -16.406) 16.406 6.616 ( 0.000 0.000 4.620) 4.620 6.886 ( 0.000 0.000 1.473) 1.473 6.953 ( 0.000 0.000 -5.050) 5.050 7.104 ( 0.000 0.000 -13.658) 13.658 7.451 ( 0.000 0.000 10.102) 10.102 7.606 ( 0.000 0.000 -28.048) 28.048 7.801 ( 0.000 0.000 -4.448) 4.448 8.918 ( 0.000 0.000 11.351) 11.351 9.217 ( 0.000 0.000 16.317) 16.317 9.413 ( 0.000 0.000 -10.631) 10.631 9.817 ( 0.000 0.000 -11.400) 11.400 10.386 ( 0.000 0.000 6.295) 6.295 10.530 ( 0.000 0.000 -1.609) 1.609 10.694 ( 0.000 0.000 11.129) 11.129 11.229 ( 0.000 0.000 -11.275) 11.275 16.676 ( 0.000 0.000 4.048) 4.048 16.839 ( 0.000 0.000 -3.301) 3.301 17.138 ( 0.000 0.000 5.006) 5.006 17.359 ( 0.000 0.000 -4.859) 4.859 17.451 ( 0.000 0.000 12.101) 12.101 17.996 ( 0.000 0.000 -12.293) 12.293 18.013 ( 0.000 0.000 5.234) 5.234 18.259 ( 0.000 0.000 -5.456) 5.456 19.876 ( 0.000 0.000 0.352) 0.352 19.891 ( 0.000 0.000 -0.323) 0.323 21.943 ( 0.000 0.000 1.151) 1.151 21.999 ( 0.000 0.000 -1.344) 1.344 27.785 ( 0.000 0.000 3.356) 3.356 27.938 ( 0.000 0.000 -3.424) 3.424 27.947 ( 0.000 0.000 1.765) 1.765 28.021 ( 0.000 0.000 -1.529) 1.529 37.233 ( 0.000 0.000 4.652) 4.652 37.448 ( 0.000 0.000 -4.938) 4.938 38.104 ( 0.000 0.000 1.802) 1.802 38.178 ( 0.000 0.000 -1.536) 1.536 38.450 ( 0.000 0.000 3.618) 3.618 38.599 ( 0.000 0.000 -2.974) 2.974 41.275 ( 0.000 0.000 2.788) 2.788 41.398 ( 0.000 0.000 -2.657) 2.657 ======================= Grid point 199 (62/120) ======================= q-point: ( 0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( 9.523 0.000 27.039) 28.667 1.338 ( 0.457 0.000 29.488) 29.491 2.340 ( 6.679 0.000 12.183) 13.893 2.416 ( 2.127 0.000 -26.499) 26.584 2.628 ( 8.987 0.000 9.920) 13.386 3.295 ( -6.403 0.000 2.429) 6.848 3.420 ( -4.876 0.000 -3.417) 5.954 3.453 ( -11.927 0.000 5.017) 12.939 3.681 ( -1.110 0.000 -5.821) 5.926 4.099 ( 3.884 0.000 12.559) 13.145 4.348 ( -4.794 0.000 -20.518) 21.071 4.394 ( 1.570 0.000 -3.967) 4.267 4.800 ( 10.514 0.000 -1.721) 10.654 5.341 ( -3.520 0.000 -14.381) 14.805 5.616 ( 4.281 0.000 18.497) 18.986 5.968 ( 1.210 0.000 11.413) 11.477 6.110 ( 5.699 0.000 8.912) 10.578 6.136 ( 1.558 0.000 12.071) 12.171 6.387 ( 3.002 0.000 9.534) 9.996 6.390 ( 0.609 0.000 15.051) 15.063 6.431 ( 3.969 0.000 -15.408) 15.911 6.675 ( 5.903 0.000 -6.273) 8.614 6.910 ( 3.226 0.000 0.632) 3.288 7.005 ( 5.190 0.000 -4.508) 6.874 7.129 ( 2.403 0.000 -13.663) 13.872 7.576 ( -3.020 0.000 -27.743) 27.907 7.606 ( 12.468 0.000 4.807) 13.363 7.862 ( 7.761 0.000 -4.660) 9.053 8.855 ( -6.408 0.000 11.128) 12.841 9.188 ( -2.848 0.000 16.115) 16.364 9.341 ( -7.316 0.000 -10.474) 12.776 9.766 ( -5.003 0.000 -10.336) 11.483 10.368 ( -2.004 0.000 5.903) 6.234 10.494 ( -3.742 0.000 -0.944) 3.859 10.650 ( -4.099 0.000 8.881) 9.782 11.061 ( -14.640 0.000 -5.145) 15.518 16.689 ( 1.327 0.000 4.067) 4.278 16.854 ( 1.447 0.000 -3.329) 3.629 17.124 ( -1.403 0.000 4.950) 5.145 17.343 ( -1.650 0.000 -4.804) 5.079 17.455 ( 0.557 0.000 12.017) 12.030 17.916 ( -6.960 0.000 6.616) 9.603 18.005 ( 0.392 0.000 -10.896) 10.903 18.228 ( -2.854 0.000 -6.403) 7.010 20.004 ( 11.229 0.000 1.095) 11.283 20.165 ( 24.513 0.000 -10.034) 26.487 21.908 ( -3.586 0.000 1.225) 3.790 21.970 ( -2.950 0.000 -1.536) 3.326 27.792 ( 0.696 0.000 3.172) 3.248 27.931 ( -0.513 0.000 -1.955) 2.022 27.950 ( 0.139 0.000 -0.210) 0.252 28.004 ( -1.561 0.000 -1.370) 2.077 37.254 ( 2.239 0.000 4.630) 5.143 37.469 ( 2.129 0.000 -4.922) 5.362 38.071 ( -3.243 0.000 2.108) 3.868 38.159 ( -1.995 0.000 -1.833) 2.709 38.502 ( 5.337 0.000 2.902) 6.075 38.614 ( 1.570 0.000 -2.050) 2.582 40.931 ( -38.850 0.000 15.851) 41.959 41.137 ( -15.462 0.000 0.421) 15.468 ======================= Grid point 200 (63/120) ======================= q-point: ( 0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( 10.846 0.000 17.664) 20.728 1.505 ( 15.513 0.000 20.719) 25.884 2.344 ( -2.604 0.000 -19.135) 19.312 2.478 ( 4.211 0.000 -23.288) 23.666 3.011 ( 24.770 0.000 30.173) 39.038 3.122 ( -11.152 0.000 3.220) 11.608 3.180 ( -14.552 0.000 7.972) 16.593 3.288 ( -8.464 0.000 -3.856) 9.301 3.549 ( -12.323 0.000 -9.714) 15.692 4.194 ( 5.502 0.000 12.590) 13.739 4.373 ( 7.375 0.000 -15.561) 17.220 4.429 ( 1.719 0.000 -0.106) 1.722 4.957 ( 4.404 0.000 -5.792) 7.276 5.237 ( -6.822 0.000 -8.689) 11.047 5.724 ( 6.480 0.000 17.161) 18.344 6.014 ( 3.239 0.000 11.667) 12.108 6.187 ( 3.332 0.000 16.141) 16.482 6.219 ( 4.725 0.000 6.837) 8.311 6.396 ( -0.160 0.000 13.400) 13.400 6.423 ( 0.801 0.000 20.685) 20.700 6.542 ( 7.369 0.000 -15.888) 17.514 6.816 ( 7.710 0.000 -13.431) 15.487 7.039 ( 10.315 0.000 -0.123) 10.315 7.156 ( 10.529 0.000 -3.730) 11.170 7.181 ( 2.279 0.000 -13.924) 14.109 7.494 ( -4.934 0.000 -26.702) 27.154 7.808 ( 9.169 0.000 6.498) 11.238 8.126 ( 16.205 0.000 -7.400) 17.815 8.674 ( -12.093 0.000 10.424) 15.966 9.120 ( -3.640 0.000 15.039) 15.473 9.132 ( -14.025 0.000 -9.989) 17.219 9.637 ( -7.859 0.000 -7.865) 11.118 10.307 ( -4.081 0.000 5.075) 6.513 10.390 ( -6.264 0.000 0.513) 6.285 10.555 ( -5.363 0.000 3.715) 6.524 10.774 ( -13.157 0.000 -1.267) 13.218 16.726 ( 2.493 0.000 4.116) 4.813 16.893 ( 2.572 0.000 -3.316) 4.197 17.086 ( -2.455 0.000 4.702) 5.304 17.297 ( -3.052 0.000 -4.643) 5.556 17.476 ( 1.682 0.000 11.230) 11.356 17.799 ( -4.867 0.000 7.262) 8.742 18.016 ( 0.737 0.000 -10.851) 10.876 18.165 ( -3.289 0.000 -7.873) 8.532 20.294 ( 17.678 0.000 3.453) 18.012 20.651 ( 23.257 0.000 -17.115) 28.875 21.802 ( -7.379 0.000 1.506) 7.531 21.886 ( -5.691 0.000 -2.231) 6.113 27.810 ( 1.197 0.000 2.601) 2.863 27.920 ( -0.591 0.000 -1.778) 1.873 27.949 ( -0.242 0.000 -1.037) 1.065 27.970 ( -1.628 0.000 -1.212) 2.030 37.318 ( 4.299 0.000 4.544) 6.255 37.529 ( 3.962 0.000 -4.850) 6.263 37.984 ( -5.560 0.000 2.757) 6.206 38.100 ( -4.033 0.000 -2.458) 4.723 38.658 ( 10.643 0.000 0.903) 10.681 38.663 ( 3.595 0.000 0.724) 3.667 40.149 ( -36.999 0.000 30.980) 48.257 40.744 ( -24.141 0.000 -4.201) 24.503 ======================= Grid point 201 (64/120) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( 18.579 0.000 4.496) 19.115 1.836 ( 18.113 0.000 14.411) 23.147 2.333 ( 2.594 0.000 -18.345) 18.528 2.578 ( 5.776 0.000 -19.136) 19.989 2.838 ( -17.649 0.000 3.808) 18.055 2.872 ( -14.152 0.000 5.011) 15.013 3.106 ( -9.920 0.000 -5.128) 11.167 3.211 ( -17.667 0.000 -11.670) 21.173 3.589 ( 27.393 0.000 25.723) 37.577 4.299 ( 5.080 0.000 12.213) 13.228 4.451 ( 0.302 0.000 4.341) 4.352 4.573 ( 11.306 0.000 -14.025) 18.014 4.909 ( -9.819 0.000 1.641) 9.956 5.122 ( -4.328 0.000 -7.853) 8.967 5.856 ( 6.887 0.000 16.326) 17.719 6.071 ( 1.906 0.000 12.104) 12.253 6.258 ( 3.910 0.000 19.130) 19.526 6.281 ( 1.916 0.000 6.275) 6.561 6.381 ( -1.315 0.000 8.720) 8.819 6.424 ( -0.643 0.000 22.375) 22.384 6.711 ( 9.833 0.000 -17.288) 19.889 6.955 ( 6.513 0.000 -14.091) 15.524 7.197 ( -0.800 0.000 -14.068) 14.091 7.243 ( 2.344 0.000 -11.173) 11.416 7.357 ( 9.942 0.000 -4.323) 10.842 7.511 ( 14.350 0.000 -12.138) 18.795 8.006 ( 11.175 0.000 11.416) 15.975 8.366 ( 6.715 0.000 -1.980) 7.001 8.396 ( -16.227 0.000 9.117) 18.613 8.805 ( -19.475 0.000 -9.146) 21.515 9.081 ( 0.717 0.000 10.387) 10.412 9.476 ( -8.503 0.000 -5.019) 9.874 10.228 ( -3.358 0.000 3.024) 4.519 10.285 ( -4.141 0.000 -0.258) 4.149 10.452 ( -4.833 0.000 -0.274) 4.841 10.567 ( -8.439 0.000 -3.292) 9.058 16.784 ( 3.357 0.000 4.172) 5.355 16.944 ( 1.857 0.000 -1.890) 2.650 17.039 ( -1.611 0.000 2.926) 3.340 17.227 ( -4.006 0.000 -4.377) 5.933 17.520 ( 2.755 0.000 9.742) 10.124 17.718 ( -3.719 0.000 6.609) 7.584 18.032 ( 0.905 0.000 -10.268) 10.308 18.110 ( -2.294 0.000 -8.819) 9.112 20.661 ( 19.492 0.000 4.573) 20.021 21.044 ( 17.418 0.000 -15.016) 22.997 21.620 ( -11.398 0.000 2.166) 11.602 21.751 ( -8.107 0.000 -3.780) 8.945 27.836 ( 1.381 0.000 1.618) 2.127 27.907 ( -0.859 0.000 -1.745) 1.945 27.937 ( -0.678 0.000 -0.599) 0.905 27.951 ( -0.539 0.000 -1.394) 1.495 37.419 ( 5.962 0.000 4.328) 7.367 37.617 ( 4.827 0.000 -4.526) 6.617 37.864 ( -6.391 0.000 3.267) 7.178 38.005 ( -5.569 0.000 -3.066) 6.357 38.756 ( 6.232 0.000 5.367) 8.224 38.917 ( 15.855 0.000 -1.870) 15.964 39.553 ( -24.530 0.000 28.104) 37.304 40.241 ( -26.741 0.000 -7.154) 27.681 ======================= Grid point 202 (65/120) ======================= q-point: ( 0.44 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 18.723 0.000 -1.429) 18.778 2.194 ( 18.394 0.000 8.954) 20.458 2.416 ( -4.984 0.000 -8.211) 9.605 2.534 ( -15.654 0.000 2.035) 15.786 2.558 ( 0.109 0.000 -6.177) 6.178 2.747 ( 6.726 0.000 -8.752) 11.038 2.837 ( -19.222 0.000 -12.875) 23.135 2.914 ( -9.583 0.000 -7.635) 12.253 4.116 ( 25.631 0.000 17.318) 30.933 4.385 ( 3.622 0.000 10.841) 11.430 4.437 ( -1.715 0.000 8.184) 8.362 4.555 ( -18.297 0.000 5.035) 18.977 4.848 ( 9.184 0.000 -6.145) 11.050 5.018 ( -7.156 0.000 -8.666) 11.239 5.981 ( 5.773 0.000 15.910) 16.925 6.066 ( -2.571 0.000 14.529) 14.755 6.314 ( 1.759 0.000 4.805) 5.117 6.334 ( 3.746 0.000 20.931) 21.264 6.350 ( -1.824 0.000 4.641) 4.986 6.395 ( -2.381 0.000 21.991) 22.119 6.914 ( 10.754 0.000 -19.232) 22.034 7.068 ( 5.151 0.000 -13.774) 14.706 7.116 ( -9.746 0.000 -20.639) 22.824 7.153 ( -3.486 0.000 -13.751) 14.186 7.662 ( 17.884 0.000 3.788) 18.281 7.877 ( 14.314 0.000 -4.917) 15.135 8.084 ( -9.736 0.000 4.672) 10.799 8.219 ( 10.106 0.000 12.464) 16.046 8.374 ( -4.965 0.000 8.047) 9.455 8.391 ( -22.568 0.000 -7.847) 23.894 9.161 ( 6.779 0.000 2.753) 7.317 9.312 ( -8.320 0.000 -1.833) 8.520 10.198 ( 0.294 0.000 0.291) 0.414 10.226 ( -2.249 0.000 -1.070) 2.490 10.392 ( -0.595 0.000 -3.195) 3.250 10.437 ( -4.846 0.000 -4.568) 6.659 16.854 ( 3.767 0.000 4.153) 5.607 16.924 ( -3.174 0.000 3.473) 4.705 17.065 ( 3.596 0.000 -2.851) 4.589 17.145 ( -4.352 0.000 -3.961) 5.884 17.580 ( 3.372 0.000 8.134) 8.806 17.648 ( -3.569 0.000 6.924) 7.789 18.051 ( 1.056 0.000 -9.748) 9.805 18.075 ( -1.429 0.000 -9.341) 9.450 21.031 ( 18.237 0.000 4.213) 18.717 21.328 ( 4.942 0.000 -6.911) 8.496 21.372 ( -6.896 0.000 -0.394) 6.907 21.571 ( -10.452 0.000 -6.494) 12.305 27.862 ( 1.307 0.000 0.332) 1.349 27.886 ( -1.180 0.000 -0.900) 1.484 27.933 ( 0.188 0.000 -0.726) 0.750 27.941 ( -0.509 0.000 -1.030) 1.149 37.545 ( 6.835 0.000 3.774) 7.808 37.662 ( -3.278 0.000 0.548) 3.323 37.792 ( 2.072 0.000 -0.963) 2.284 37.890 ( -6.092 0.000 -3.350) 6.952 38.911 ( 9.992 0.000 11.813) 15.472 39.145 ( -11.769 0.000 17.214) 20.853 39.299 ( 17.001 0.000 -2.316) 17.158 39.734 ( -24.919 0.000 -7.145) 25.923 ======================= Grid point 207 (66/120) ======================= q-point: ( 0.00 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 0.000 9.488 28.951) 30.466 1.522 ( 0.000 24.274 25.079) 34.902 2.369 ( 0.000 16.361 23.852) 28.924 2.578 ( 0.000 13.998 -23.534) 27.382 2.664 ( 0.000 10.116 -4.126) 10.925 3.378 ( 0.000 4.450 -1.341) 4.648 3.423 ( 0.000 -5.375 2.859) 6.088 3.617 ( 0.000 -0.300 1.923) 1.946 3.644 ( 0.000 3.063 -3.276) 4.485 4.234 ( 0.000 14.209 7.869) 16.243 4.429 ( 0.000 -2.130 -34.601) 34.667 4.472 ( 0.000 8.872 -5.794) 10.596 4.582 ( 0.000 -5.521 15.472) 16.427 5.285 ( 0.000 -8.549 -15.667) 17.848 5.796 ( 0.000 14.752 14.879) 20.952 6.015 ( 0.000 4.566 8.981) 10.075 6.122 ( 0.000 2.857 5.988) 6.634 6.154 ( 0.000 8.860 12.252) 15.120 6.262 ( 0.000 -5.189 -7.092) 8.788 6.396 ( 0.000 2.596 12.847) 13.107 6.578 ( 0.000 8.115 21.634) 23.106 6.662 ( 0.000 24.554 -13.574) 28.056 7.044 ( 0.000 2.240 -12.551) 12.749 7.171 ( 0.000 11.342 -6.026) 12.844 7.210 ( 0.000 14.093 -1.599) 14.184 7.549 ( 0.000 14.851 1.144) 14.895 7.732 ( 0.000 12.128 -24.562) 27.393 7.747 ( 0.000 -4.424 -3.093) 5.398 8.927 ( 0.000 0.308 10.088) 10.093 9.216 ( 0.000 -0.004 15.898) 15.898 9.373 ( 0.000 -4.054 -9.880) 10.679 9.796 ( 0.000 -2.234 -10.683) 10.914 10.288 ( 0.000 -9.446 6.703) 11.583 10.466 ( 0.000 -5.977 -2.886) 6.638 10.636 ( 0.000 -4.797 8.914) 10.122 11.076 ( 0.000 -11.907 -8.880) 14.853 16.810 ( 0.000 12.536 4.819) 13.430 16.996 ( 0.000 12.661 -3.104) 13.036 17.179 ( 0.000 3.980 4.166) 5.761 17.382 ( 0.000 2.169 -4.579) 5.066 17.387 ( 0.000 -5.335 11.636) 12.801 17.930 ( 0.000 -6.694 6.440) 9.289 17.936 ( 0.000 -6.229 -12.523) 13.987 18.183 ( 0.000 -6.859 -5.308) 8.673 19.876 ( 0.000 0.040 0.337) 0.340 19.891 ( 0.000 -0.027 -0.307) 0.309 21.941 ( 0.000 -0.227 1.096) 1.119 21.994 ( 0.000 -0.505 -1.267) 1.364 27.744 ( 0.000 -3.977 3.337) 5.192 27.894 ( 0.000 -4.247 -3.337) 5.401 27.919 ( 0.000 -2.694 1.680) 3.175 27.990 ( 0.000 -3.033 -1.465) 3.368 37.286 ( 0.000 5.218 4.688) 7.014 37.505 ( 0.000 5.378 -5.000) 7.343 38.178 ( 0.000 -0.345 -0.029) 0.346 38.192 ( 0.000 6.225 -1.697) 6.452 38.459 ( 0.000 1.156 5.035) 5.166 38.690 ( 0.000 8.840 -5.165) 10.238 41.157 ( 0.000 -11.138 3.232) 11.598 41.266 ( 0.000 -10.943 -0.571) 10.958 ======================= Grid point 208 (67/120) ======================= q-point: ( 0.11 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.427 ( 0.524 9.232 26.287) 27.866 1.624 ( 8.465 25.796 22.437) 35.221 2.409 ( 0.629 7.737 -4.290) 8.869 2.614 ( 3.436 14.954 -20.394) 25.521 2.740 ( 10.778 13.875 17.908) 25.088 3.271 ( -8.771 -1.417 2.971) 9.369 3.398 ( -4.749 2.258 -0.136) 5.261 3.565 ( -5.224 5.411 0.730) 7.557 3.634 ( -1.586 -2.090 -4.031) 4.809 4.251 ( 2.016 12.646 8.174) 15.192 4.323 ( -4.723 -0.663 -15.454) 16.174 4.502 ( 3.047 9.204 -6.983) 11.948 4.744 ( 10.245 -5.147 -1.980) 11.635 5.259 ( -2.664 -7.836 -13.508) 15.841 5.835 ( 3.828 14.247 14.419) 20.629 6.038 ( 2.706 6.100 9.727) 11.796 6.165 ( 1.973 7.395 12.217) 14.417 6.199 ( 6.807 4.817 5.415) 9.943 6.338 ( 4.224 -2.363 6.472) 8.081 6.431 ( 5.032 1.744 5.805) 7.878 6.566 ( -0.212 6.275 14.099) 15.433 6.701 ( 3.477 22.773 -10.371) 25.264 7.047 ( 1.087 0.297 -10.308) 10.369 7.151 ( -0.610 12.440 -4.600) 13.278 7.266 ( 4.279 13.865 -6.526) 15.911 7.646 ( 7.239 4.375 2.510) 8.823 7.701 ( -3.107 12.342 -24.285) 27.418 7.851 ( 11.570 1.579 -5.158) 12.766 8.866 ( -6.157 0.521 9.772) 11.561 9.181 ( -3.585 -0.621 14.683) 15.127 9.308 ( -6.491 -3.325 -8.716) 11.365 9.745 ( -5.032 -2.250 -9.665) 11.126 10.267 ( -2.161 -9.532 6.167) 11.557 10.426 ( -4.030 -6.223 -2.422) 7.800 10.600 ( -3.448 -4.254 7.210) 9.053 10.951 ( -11.188 -8.710 -5.073) 15.059 16.817 ( 0.693 11.924 4.695) 12.834 16.992 ( -0.193 11.457 -2.680) 11.768 17.164 ( -1.443 3.845 4.359) 5.989 17.364 ( -1.528 1.498 -3.331) 3.960 17.401 ( 1.225 -3.830 10.033) 10.809 17.860 ( -5.197 -4.789 6.211) 9.409 17.946 ( 0.642 -5.915 -10.925) 12.440 18.158 ( -2.297 -6.345 -6.016) 9.040 20.000 ( 10.947 -0.368 0.938) 10.993 20.123 ( 21.670 -3.494 -6.799) 22.979 21.906 ( -3.610 -0.249 1.164) 3.801 21.964 ( -3.025 -0.570 -1.445) 3.401 27.751 ( 0.705 -3.969 3.169) 5.128 27.892 ( -0.238 -3.993 -2.846) 4.909 27.917 ( -0.229 -3.033 0.833) 3.154 27.973 ( -1.593 -3.028 -1.295) 3.658 37.311 ( 2.546 5.508 4.634) 7.635 37.527 ( 2.313 5.578 -4.963) 7.817 38.155 ( -2.226 3.789 0.043) 4.395 38.187 ( -0.807 4.445 -1.627) 4.802 38.500 ( 4.480 0.031 4.122) 6.088 38.689 ( -0.009 7.486 -4.195) 8.582 40.872 ( -33.605 -5.074 12.303) 36.144 41.027 ( -14.853 -10.406 1.118) 18.169 ======================= Grid point 209 (68/120) ======================= q-point: ( 0.22 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( 9.530 7.882 15.963) 20.193 1.832 ( 12.762 25.133 17.604) 33.234 2.376 ( -2.402 4.008 -18.780) 19.353 2.678 ( 3.658 15.296 -19.654) 25.172 3.022 ( -2.541 0.486 8.769) 9.143 3.112 ( 5.935 5.540 15.438) 17.443 3.263 ( -4.251 7.068 7.682) 11.271 3.425 ( -8.600 9.933 -1.935) 13.281 3.536 ( -8.847 -0.674 -5.512) 10.446 4.314 ( 3.016 7.765 1.701) 8.502 4.319 ( 5.226 1.993 -2.322) 6.056 4.577 ( 4.371 10.792 -5.531) 12.890 4.901 ( 5.002 -5.127 -4.919) 8.689 5.182 ( -5.107 -5.191 -8.225) 10.985 5.934 ( 6.079 12.992 13.783) 19.893 6.119 ( 5.169 8.840 9.728) 14.125 6.224 ( 3.556 8.215 15.610) 17.994 6.333 ( 5.333 9.027 4.220) 11.302 6.381 ( 1.713 -0.108 16.436) 16.525 6.512 ( 0.646 8.333 17.445) 19.344 6.659 ( 10.236 -1.219 -8.565) 13.402 6.795 ( 6.722 17.024 -10.114) 20.911 7.077 ( 1.628 0.113 -8.924) 9.072 7.213 ( 7.881 6.802 -5.274) 11.671 7.336 ( 3.048 10.264 -8.813) 13.867 7.611 ( -5.841 12.790 -22.628) 26.641 7.812 ( 10.338 0.997 6.793) 12.410 8.131 ( 14.065 1.532 -6.628) 15.624 8.699 ( -10.458 1.892 8.332) 13.504 9.061 ( -10.252 -4.011 1.095) 11.063 9.151 ( -7.390 0.220 4.356) 8.581 9.615 ( -7.860 -2.257 -7.435) 11.052 10.208 ( -3.605 -9.086 4.705) 10.849 10.322 ( -6.054 -6.165 -1.456) 8.762 10.512 ( -5.338 -3.804 3.644) 7.500 10.719 ( -11.335 -4.584 -2.104) 12.407 16.837 ( 1.450 10.317 4.441) 11.326 16.998 ( 0.838 8.926 -2.328) 9.263 17.127 ( -2.246 3.944 4.364) 6.297 17.323 ( -2.705 2.388 -4.192) 5.531 17.436 ( 2.376 -3.019 10.023) 10.734 17.767 ( -4.132 -2.868 6.550) 8.258 17.963 ( 1.006 -5.394 -10.851) 12.159 18.107 ( -2.690 -5.305 -7.179) 9.323 20.285 ( 17.498 -0.828 3.043) 17.779 20.578 ( 22.994 -6.373 -13.091) 27.216 21.799 ( -7.429 -0.316 1.420) 7.570 21.877 ( -5.908 -0.828 -2.076) 6.317 27.770 ( 1.224 -3.939 2.657) 4.907 27.885 ( -0.497 -3.538 -1.998) 4.093 27.912 ( -0.263 -3.628 -0.591) 3.685 27.937 ( -1.901 -3.150 -0.996) 3.811 37.384 ( 4.879 6.343 4.426) 9.145 37.592 ( 4.292 6.118 -4.874) 8.922 38.089 ( -4.606 8.005 0.651) 9.258 38.154 ( -2.684 5.121 -1.987) 6.114 38.639 ( 9.905 -1.802 1.645) 10.201 38.700 ( 1.475 4.014 -1.091) 4.414 40.154 ( -35.850 0.785 25.556) 44.034 40.650 ( -23.201 -8.966 -3.228) 25.081 ======================= Grid point 210 (69/120) ======================= q-point: ( 0.33 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 16.684 5.141 4.495) 18.027 2.101 ( 14.159 20.460 11.429) 27.381 2.369 ( 2.879 4.256 -16.288) 17.079 2.762 ( 0.574 7.883 -9.075) 12.035 2.786 ( -9.053 5.873 -4.443) 11.670 2.961 ( -14.552 3.994 -1.004) 15.123 3.200 ( -12.801 9.334 -4.943) 16.596 3.308 ( -12.023 9.058 -5.420) 15.999 3.640 ( 24.416 5.956 22.948) 34.032 4.378 ( 2.647 6.356 7.360) 10.079 4.445 ( 6.442 0.778 -1.475) 6.654 4.663 ( 3.897 8.012 -7.572) 11.692 4.908 ( -4.220 0.499 2.550) 4.956 5.085 ( -4.158 -2.882 -5.651) 7.584 6.061 ( 6.678 11.608 13.537) 19.042 6.215 ( 4.070 11.055 9.484) 15.124 6.293 ( 3.513 8.514 17.827) 20.066 6.370 ( 0.230 4.135 11.228) 11.967 6.429 ( 1.562 10.959 10.310) 15.127 6.508 ( -0.796 7.607 14.730) 16.597 6.849 ( 8.803 8.650 -13.008) 17.931 6.959 ( 8.438 6.813 -11.706) 15.958 7.125 ( 2.862 -3.111 -9.802) 10.675 7.355 ( 3.798 5.274 -8.059) 10.353 7.482 ( 1.652 14.015 -9.819) 17.191 7.511 ( 10.326 0.021 -12.268) 16.035 8.038 ( 12.205 3.481 9.423) 15.807 8.251 ( -5.952 -5.066 3.897) 8.734 8.530 ( -4.280 7.160 2.560) 8.726 8.777 ( -17.494 -2.633 -7.839) 19.350 9.073 ( -0.445 -0.783 9.706) 9.748 9.454 ( -8.436 -2.155 -5.036) 10.058 10.145 ( -2.348 -7.519 2.347) 8.219 10.220 ( -4.009 -5.898 -1.566) 7.301 10.406 ( -5.118 -4.160 0.460) 6.612 10.528 ( -8.425 -3.599 -3.157) 9.690 16.874 ( 2.276 8.326 4.183) 9.591 17.015 ( 0.126 6.151 -0.615) 6.183 17.090 ( -0.673 5.034 2.154) 5.517 17.261 ( -3.533 3.204 -4.113) 6.298 17.491 ( 3.214 -2.207 8.970) 9.780 17.695 ( -3.482 -2.086 6.181) 7.395 17.984 ( 1.148 -4.807 -10.235) 11.366 18.061 ( -1.941 -4.518 -8.075) 9.454 20.650 ( 19.509 -0.979 4.104) 19.960 20.981 ( 18.373 -5.783 -12.441) 22.930 21.616 ( -11.492 -0.443 2.016) 11.676 21.737 ( -8.557 -1.431 -3.454) 9.338 27.796 ( 1.445 -3.864 1.801) 4.501 27.872 ( -0.870 -3.372 -1.432) 3.765 27.905 ( -0.667 -3.217 -0.772) 3.374 27.908 ( -0.727 -4.066 -1.145) 4.286 37.497 ( 6.702 7.564 3.919) 10.839 37.687 ( 5.206 6.779 -4.681) 9.745 37.981 ( -6.168 10.340 1.518) 12.135 38.082 ( -4.679 7.055 -2.726) 8.894 38.759 ( 4.846 0.417 4.163) 6.402 38.885 ( 15.319 -3.194 -1.484) 15.718 39.554 ( -25.571 0.508 25.225) 35.922 40.165 ( -25.911 -7.346 -6.174) 27.631 ======================= Grid point 211 (70/120) ======================= q-point: ( 0.44 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( 17.250 2.375 -2.014) 17.528 2.338 ( 7.097 7.806 -2.708) 10.892 2.440 ( -2.571 4.611 2.619) 5.893 2.589 ( -0.634 5.665 -4.147) 7.049 2.679 ( -8.307 7.843 -1.950) 11.590 2.868 ( -4.662 7.753 -4.322) 10.026 2.943 ( -3.490 16.284 -12.744) 20.970 3.090 ( -10.159 14.567 -7.568) 19.305 4.093 ( 20.751 0.077 15.533) 25.921 4.370 ( -5.863 -0.569 8.872) 10.649 4.538 ( 3.536 7.348 3.671) 8.943 4.633 ( -6.915 5.920 -0.742) 9.133 4.888 ( 4.818 5.501 1.195) 7.410 5.000 ( -5.314 -0.696 -4.702) 7.129 6.180 ( 5.270 9.308 13.496) 17.221 6.248 ( -1.143 9.148 11.741) 14.928 6.352 ( 2.181 10.403 17.584) 20.547 6.375 ( 0.069 10.597 13.579) 17.224 6.441 ( 0.999 10.870 8.350) 13.743 6.480 ( -2.122 7.504 10.471) 13.056 7.007 ( 6.938 4.031 -13.711) 15.886 7.074 ( 2.038 3.333 -13.333) 13.894 7.155 ( 2.333 5.169 -15.085) 16.116 7.279 ( -8.088 13.868 -18.779) 24.706 7.637 ( 15.804 -1.950 4.601) 16.575 7.870 ( 15.194 -0.215 -4.688) 15.902 8.002 ( -11.133 -5.951 5.573) 13.799 8.222 ( -0.251 -0.158 2.784) 2.800 8.399 ( -7.981 3.725 3.395) 9.439 8.492 ( -8.522 7.250 3.487) 11.719 9.141 ( 6.647 -1.903 2.233) 7.266 9.292 ( -8.282 -2.008 -2.241) 8.812 10.130 ( 0.808 -6.201 -0.042) 6.254 10.164 ( -2.232 -5.718 -1.634) 6.352 10.342 ( -0.576 -4.566 -2.390) 5.186 10.393 ( -5.263 -4.169 -3.971) 7.801 16.925 ( 2.904 6.541 3.924) 8.162 16.982 ( -2.830 5.308 3.266) 6.845 17.121 ( 3.065 5.203 -2.425) 6.507 17.189 ( -3.767 4.144 -3.617) 6.667 17.558 ( 3.564 -1.796 7.698) 8.672 17.627 ( -3.542 -1.778 6.616) 7.712 18.006 ( 1.164 -4.358 -9.520) 10.535 18.030 ( -1.334 -4.222 -8.811) 9.861 21.022 ( 18.359 -0.844 3.831) 18.773 21.291 ( 11.773 -3.697 -8.322) 14.884 21.359 ( -12.842 -1.002 2.135) 13.057 21.545 ( -11.197 -2.513 -5.812) 12.864 27.824 ( 1.413 -3.710 0.687) 4.029 27.851 ( -1.278 -3.497 -0.463) 3.752 27.896 ( -0.044 -3.564 -0.902) 3.676 27.900 ( -0.326 -3.901 -1.106) 4.068 37.637 ( 7.383 8.689 2.756) 11.731 37.749 ( -1.733 7.926 -1.523) 8.255 37.896 ( 0.326 10.182 -0.278) 10.191 37.978 ( -5.679 8.490 -3.067) 10.665 38.897 ( 9.708 -1.339 10.997) 14.730 39.141 ( -13.478 -0.274 16.851) 21.580 39.243 ( 17.441 -5.439 -2.703) 18.468 39.672 ( -24.284 -6.008 -6.429) 25.829 ======================= Grid point 216 (71/120) ======================= q-point: ( 0.00 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.706 ( 0.000 15.808 23.350) 28.198 1.885 ( 0.000 14.456 21.544) 25.944 2.645 ( 0.000 9.740 -16.303) 18.991 2.775 ( 0.000 5.042 -16.154) 16.922 3.175 ( 0.000 36.842 21.039) 42.426 3.305 ( 0.000 -5.046 4.424) 6.711 3.573 ( 0.000 11.239 -7.014) 13.248 3.648 ( 0.000 2.482 -0.800) 2.608 3.685 ( 0.000 1.531 -2.770) 3.165 4.405 ( 0.000 0.929 -28.912) 28.927 4.410 ( 0.000 -7.445 10.426) 12.811 4.579 ( 0.000 16.151 6.647) 17.466 4.698 ( 0.000 13.288 -5.735) 14.472 5.059 ( 0.000 -13.493 -13.361) 18.989 5.876 ( 0.000 -2.096 6.223) 6.567 6.063 ( 0.000 -3.770 1.279) 3.981 6.123 ( 0.000 0.158 6.465) 6.467 6.214 ( 0.000 4.190 -1.705) 4.523 6.384 ( 0.000 6.661 16.119) 17.441 6.689 ( 0.000 17.165 22.464) 28.271 6.983 ( 0.000 36.739 13.813) 39.250 7.032 ( 0.000 -0.819 -11.801) 11.829 7.247 ( 0.000 24.713 -10.525) 26.861 7.307 ( 0.000 1.399 1.235) 1.866 7.481 ( 0.000 22.197 -7.716) 23.500 7.587 ( 0.000 -9.886 -3.318) 10.429 7.987 ( 0.000 22.515 -2.912) 22.703 8.132 ( 0.000 25.435 -12.182) 28.202 8.898 ( 0.000 -3.737 8.073) 8.896 9.221 ( 0.000 0.414 14.588) 14.594 9.253 ( 0.000 -7.902 -8.616) 11.690 9.726 ( 0.000 -4.706 -7.895) 9.191 10.083 ( 0.000 -8.553 5.297) 10.060 10.347 ( 0.000 -4.271 -7.601) 8.718 10.542 ( 0.000 -4.149 6.310) 7.552 10.872 ( 0.000 -7.962 -8.120) 11.372 17.103 ( 0.000 14.561 4.831) 15.341 17.105 ( 0.000 -5.738 6.113) 8.384 17.261 ( 0.000 5.118 4.711) 6.956 17.428 ( 0.000 11.353 0.481) 11.363 17.435 ( 0.000 2.747 -3.779) 4.672 17.763 ( 0.000 -9.715 -11.752) 15.247 17.812 ( 0.000 -4.069 6.217) 7.430 18.031 ( 0.000 -7.589 -4.498) 8.822 19.877 ( 0.000 0.072 0.295) 0.304 19.890 ( 0.000 -0.061 -0.262) 0.269 21.935 ( 0.000 -0.336 0.940) 0.998 21.980 ( 0.000 -0.835 -1.080) 1.365 27.639 ( 0.000 -6.153 3.202) 6.936 27.779 ( 0.000 -7.030 -3.000) 7.643 27.847 ( 0.000 -4.358 1.434) 4.588 27.908 ( 0.000 -5.015 -1.276) 5.175 37.426 ( 0.000 8.448 4.797) 9.715 37.642 ( 0.000 7.844 -4.326) 8.958 38.157 ( 0.000 -1.624 1.799) 2.423 38.265 ( 0.000 1.161 -3.596) 3.779 38.494 ( 0.000 1.524 6.950) 7.116 38.906 ( 0.000 11.153 -10.462) 15.292 40.884 ( 0.000 -14.692 5.932) 15.844 41.056 ( 0.000 -8.999 -0.758) 9.030 ======================= Grid point 217 (72/120) ======================= q-point: ( 0.11 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -0.342 15.335 19.733) 24.993 2.017 ( 10.453 14.573 19.189) 26.266 2.585 ( -4.641 8.776 -17.363) 20.001 2.823 ( 3.537 5.230 -14.288) 15.621 3.239 ( -3.436 9.729 4.867) 11.408 3.266 ( 5.968 22.927 19.210) 30.501 3.499 ( -7.364 5.490 -7.129) 11.627 3.615 ( -2.886 1.465 -0.323) 3.252 3.680 ( -0.818 5.651 -2.594) 6.272 4.326 ( -1.732 2.388 -4.920) 5.736 4.512 ( 4.043 3.651 -3.448) 6.447 4.635 ( 5.325 6.450 -7.192) 11.031 4.757 ( 5.265 12.420 -1.203) 13.543 5.055 ( -0.059 -11.710 -11.442) 16.372 5.922 ( 4.154 -1.445 7.521) 8.712 6.095 ( 3.159 -1.073 5.903) 6.780 6.201 ( 8.292 -2.415 2.668) 9.039 6.292 ( 7.094 3.880 1.122) 8.164 6.397 ( 1.315 5.986 14.799) 16.017 6.705 ( 1.415 14.430 17.634) 22.830 6.958 ( -1.536 36.090 9.523) 37.357 7.031 ( -0.051 -0.059 -7.942) 7.943 7.235 ( 0.770 16.328 -5.904) 17.380 7.361 ( 2.516 13.021 -3.552) 13.729 7.494 ( -0.215 13.726 -7.025) 15.421 7.631 ( 6.564 -1.782 -2.160) 7.137 8.065 ( 6.133 18.198 -4.685) 19.767 8.115 ( -0.581 25.221 -10.018) 27.144 8.845 ( -5.310 -3.202 7.610) 9.816 9.155 ( -6.673 -3.661 1.899) 7.845 9.225 ( -2.826 -3.207 3.921) 5.801 9.676 ( -4.923 -4.534 -7.183) 9.818 10.062 ( -1.995 -8.597 4.707) 10.003 10.307 ( -3.925 -4.037 -7.491) 9.371 10.512 ( -3.036 -4.121 5.556) 7.554 10.795 ( -7.244 -6.432 -6.108) 11.452 17.079 ( -1.364 5.732 5.170) 7.839 17.119 ( 0.457 3.553 4.430) 5.697 17.253 ( -0.856 5.438 4.252) 6.956 17.420 ( -1.046 5.677 -2.743) 6.391 17.434 ( 0.268 7.573 0.793) 7.619 17.759 ( -1.533 -5.729 -3.025) 6.657 17.794 ( -0.165 -6.718 -1.809) 6.959 18.016 ( -1.375 -7.180 -4.880) 8.790 19.992 ( 10.370 -0.444 0.645) 10.400 20.057 ( 16.619 -2.781 -2.851) 17.089 21.899 ( -3.667 -0.366 0.996) 3.817 21.949 ( -3.210 -0.931 -1.219) 3.558 27.646 ( 0.727 -6.141 3.066) 6.903 27.780 ( 0.099 -6.919 -2.862) 7.488 27.840 ( -0.688 -4.492 1.141) 4.686 27.892 ( -1.555 -4.949 -1.120) 5.307 37.458 ( 3.319 8.897 4.681) 10.587 37.671 ( 2.970 8.320 -4.329) 9.837 38.165 ( 0.830 -0.870 1.927) 2.271 38.279 ( 1.054 2.321 -4.227) 4.936 38.507 ( 1.767 0.240 6.720) 6.952 38.881 ( -2.453 10.324 -9.462) 14.218 40.743 ( -16.549 -10.772 5.169) 20.412 40.803 ( -21.398 -7.078 4.099) 22.908 ======================= Grid point 218 (73/120) ======================= q-point: ( 0.22 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( 6.898 13.465 11.159) 18.799 2.230 ( 10.798 13.486 12.873) 21.545 2.502 ( -3.172 7.716 -15.794) 17.862 2.880 ( 1.454 4.203 -8.756) 9.821 3.102 ( -7.433 6.272 -3.058) 10.196 3.279 ( -11.216 5.980 -5.160) 13.718 3.509 ( 3.256 10.763 10.475) 15.368 3.540 ( 4.467 11.563 6.934) 14.203 3.645 ( -2.690 11.068 -1.705) 11.517 4.348 ( 3.762 5.072 -2.914) 6.955 4.563 ( 1.087 8.496 0.305) 8.570 4.735 ( 3.925 -0.288 -15.452) 15.946 4.875 ( 6.468 10.017 4.420) 12.716 5.069 ( 1.481 -3.689 -5.550) 6.827 6.015 ( 5.136 -0.788 9.937) 11.213 6.176 ( 4.649 -0.271 8.678) 9.849 6.418 ( 10.969 -0.045 1.133) 11.027 6.431 ( 2.783 5.309 13.434) 14.711 6.458 ( 10.531 2.135 6.189) 12.400 6.735 ( 1.741 8.860 6.511) 11.132 6.948 ( 0.697 38.798 9.258) 39.893 7.053 ( 2.359 -2.426 -8.152) 8.827 7.275 ( 3.394 12.083 -4.998) 13.509 7.400 ( 2.290 12.742 -2.417) 13.170 7.477 ( -0.570 14.886 -6.551) 16.274 7.808 ( 8.738 3.728 -7.551) 12.136 8.064 ( -0.404 25.338 -2.668) 25.482 8.234 ( 6.290 9.387 -2.942) 11.676 8.717 ( -6.410 -0.563 4.898) 8.087 8.969 ( -12.249 -5.426 -3.962) 13.971 9.147 ( -4.961 -0.081 9.413) 10.641 9.550 ( -7.637 -4.103 -5.849) 10.458 10.015 ( -2.438 -8.330 3.260) 9.272 10.208 ( -5.737 -3.606 -6.691) 9.523 10.427 ( -5.488 -4.220 3.879) 7.936 10.624 ( -9.536 -4.527 -3.386) 11.086 17.057 ( -0.806 6.484 4.191) 7.762 17.123 ( 0.045 3.247 2.434) 4.058 17.231 ( -1.227 6.379 3.334) 7.301 17.389 ( -2.107 4.070 -3.626) 5.844 17.452 ( 1.611 6.812 4.264) 8.197 17.710 ( -2.699 -1.989 4.855) 5.900 17.818 ( 1.901 -8.065 -9.041) 12.264 17.985 ( -1.715 -6.344 -5.638) 8.659 20.265 ( 17.069 -1.008 2.174) 17.236 20.444 ( 21.464 -6.344 -6.801) 23.393 21.791 ( -7.550 -0.461 1.191) 7.657 21.855 ( -6.431 -1.302 -1.688) 6.775 27.666 ( 1.281 -6.101 2.666) 6.780 27.782 ( 0.116 -6.548 -2.463) 6.997 27.822 ( -1.071 -4.971 0.494) 5.109 27.855 ( -1.991 -4.889 -0.829) 5.344 37.552 ( 6.261 10.132 4.207) 12.632 37.753 ( 5.281 9.493 -4.394) 11.718 38.186 ( 1.101 2.031 2.066) 3.099 38.282 ( -1.124 5.629 -3.856) 6.915 38.589 ( 7.215 -3.305 4.049) 8.909 38.821 ( -3.251 7.438 -6.242) 10.240 40.191 ( -32.466 2.860 13.839) 35.408 40.428 ( -21.300 -12.132 0.383) 24.515 ======================= Grid point 219 (74/120) ======================= q-point: ( 0.33 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 13.143 9.940 2.051) 16.606 2.385 ( 3.866 7.589 -7.281) 11.205 2.509 ( 4.229 6.578 2.179) 8.118 2.829 ( -5.110 7.802 -0.405) 9.335 2.988 ( -10.586 2.625 -8.430) 13.785 3.079 ( -2.580 10.886 -7.722) 13.593 3.375 ( -8.049 5.562 -0.797) 9.816 3.539 ( -6.403 12.391 -5.825) 15.115 3.861 ( 17.345 16.549 16.852) 29.303 4.446 ( 4.886 3.517 -2.012) 6.348 4.553 ( -1.458 5.228 0.601) 5.461 4.769 ( -0.541 -1.200 -12.977) 13.044 4.993 ( 5.397 10.414 8.022) 14.210 5.101 ( 1.422 7.740 1.449) 8.001 6.110 ( 4.477 -1.525 11.468) 12.405 6.248 ( 1.999 -1.031 9.900) 10.153 6.480 ( 3.336 6.404 8.572) 11.208 6.558 ( 3.909 3.332 6.498) 8.283 6.709 ( 11.547 7.492 8.785) 16.329 6.791 ( 4.472 8.115 -2.336) 9.556 6.982 ( 2.647 29.564 6.813) 30.454 7.088 ( 0.526 -1.224 -8.397) 8.502 7.374 ( 6.335 13.619 -1.535) 15.099 7.485 ( 5.271 2.027 -3.119) 6.451 7.502 ( 5.620 19.159 -10.079) 22.366 7.860 ( -1.705 18.549 -13.122) 22.785 8.160 ( 4.011 5.914 6.131) 9.415 8.217 ( -4.369 7.062 5.102) 9.746 8.652 ( -6.257 4.009 -0.757) 7.469 8.715 ( -7.903 -2.260 -4.363) 9.306 9.058 ( -2.862 -0.273 8.632) 9.098 9.395 ( -8.110 -3.577 -4.669) 10.018 9.982 ( -0.673 -7.404 1.447) 7.574 10.107 ( -4.183 -3.796 -5.260) 7.718 10.313 ( -5.735 -4.619 1.993) 7.629 10.443 ( -8.820 -4.367 -2.768) 10.224 17.051 ( 0.252 6.581 3.244) 7.341 17.118 ( -0.785 3.141 1.412) 3.532 17.216 ( 0.090 6.787 1.696) 6.996 17.341 ( -2.752 4.228 -3.349) 6.055 17.494 ( 2.646 4.357 5.817) 7.734 17.659 ( -2.587 -0.620 5.431) 6.048 17.857 ( 2.072 -6.999 -8.957) 11.554 17.954 ( -1.473 -5.720 -6.460) 8.753 20.627 ( 19.503 -1.259 3.037) 19.778 20.848 ( 19.667 -6.815 -7.578) 22.151 21.604 ( -11.702 -0.634 1.628) 11.832 21.700 ( -9.608 -2.142 -2.663) 10.198 27.694 ( 1.575 -6.006 2.039) 6.535 27.782 ( -0.437 -5.586 -1.396) 5.774 27.800 ( -0.940 -6.083 -0.368) 6.166 27.822 ( -1.258 -4.997 -0.779) 5.211 37.695 ( 8.125 11.614 2.992) 14.487 37.864 ( 5.736 10.432 -4.572) 12.753 38.193 ( -1.014 9.260 1.207) 9.393 38.241 ( -2.525 7.876 -2.513) 8.644 38.778 ( 2.762 -0.162 0.225) 2.776 38.794 ( 10.809 -4.097 -0.283) 11.563 39.594 ( -27.762 3.829 16.957) 32.755 39.978 ( -24.160 -10.430 -2.827) 26.467 ======================= Grid point 220 (75/120) ======================= q-point: ( 0.44 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( 14.152 6.295 -3.819) 15.952 2.422 ( -3.828 3.337 -9.472) 10.747 2.528 ( 2.344 3.482 -0.894) 4.292 2.717 ( -13.695 3.453 -6.756) 15.656 2.867 ( 8.569 12.049 2.820) 15.052 3.042 ( -6.565 8.551 1.526) 10.888 3.290 ( 1.924 14.097 -8.406) 16.525 3.400 ( -7.383 14.534 -8.124) 18.214 4.177 ( 14.486 8.639 11.290) 20.296 4.403 ( -8.399 3.972 5.182) 10.638 4.612 ( 6.087 1.502 -4.277) 7.590 4.719 ( -4.384 0.014 -7.981) 9.106 5.076 ( 3.071 12.939 8.673) 15.877 5.111 ( -0.563 13.686 6.446) 15.138 6.188 ( 3.570 -2.161 11.468) 12.203 6.245 ( -1.946 -1.876 10.742) 11.077 6.551 ( 3.286 5.472 6.236) 8.924 6.589 ( -0.412 3.798 5.916) 7.042 6.845 ( 3.926 18.719 6.327) 20.146 6.875 ( 1.594 20.647 3.688) 21.035 7.040 ( 2.804 8.160 -1.252) 8.719 7.079 ( -1.243 1.826 -6.668) 7.024 7.513 ( 6.544 19.858 -7.773) 22.306 7.574 ( 3.177 14.095 -7.980) 16.506 7.648 ( 7.637 4.987 -2.821) 9.547 7.908 ( -6.130 2.900 2.909) 7.379 7.939 ( 2.266 5.911 -2.191) 6.699 8.225 ( -12.226 1.435 -5.596) 13.522 8.507 ( 4.355 7.261 7.273) 11.162 8.648 ( -6.267 8.437 4.587) 11.467 9.092 ( 6.053 -2.653 1.094) 6.699 9.238 ( -8.056 -3.124 -2.956) 9.132 9.995 ( 1.938 -6.131 -0.521) 6.451 10.045 ( -2.749 -4.855 -3.178) 6.421 10.239 ( -0.760 -5.015 -0.540) 5.100 10.295 ( -5.928 -4.873 -2.614) 8.107 17.066 ( 1.185 5.842 2.577) 6.494 17.093 ( -1.529 4.505 1.986) 5.155 17.238 ( 1.971 5.695 -0.804) 6.080 17.286 ( -2.793 4.760 -2.485) 6.052 17.550 ( 2.977 2.350 6.134) 7.212 17.607 ( -2.834 0.749 5.835) 6.530 17.895 ( 1.772 -6.080 -8.236) 10.389 17.926 ( -1.452 -5.619 -7.350) 9.365 21.001 ( 18.609 -1.138 2.922) 18.872 21.197 ( 15.931 -5.276 -6.156) 17.875 21.339 ( -15.315 -0.973 2.271) 15.513 21.482 ( -12.841 -3.567 -4.235) 13.984 27.726 ( 1.659 -5.809 1.275) 6.175 27.758 ( -1.617 -5.464 0.452) 5.716 27.796 ( 0.247 -6.075 -1.348) 6.227 27.805 ( -0.621 -5.480 -1.079) 5.619 37.852 ( 7.390 11.896 0.518) 14.014 37.937 ( 0.072 10.229 -3.421) 10.786 38.158 ( -0.592 14.915 -0.662) 14.942 38.193 ( -2.789 12.072 -2.106) 12.568 38.862 ( 8.870 -2.238 8.375) 12.403 39.091 ( 8.506 -8.529 1.564) 12.147 39.152 ( -8.675 0.929 10.162) 13.393 39.517 ( -22.785 -8.891 -3.972) 24.778 ======================= Grid point 225 (76/120) ======================= q-point: ( 0.00 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 0.000 18.567 17.236) 25.334 2.171 ( 0.000 14.929 10.395) 18.192 2.825 ( 0.000 8.404 -13.404) 15.821 2.832 ( 0.000 1.837 -12.314) 12.450 3.222 ( 0.000 -2.629 0.754) 2.735 3.598 ( 0.000 -5.115 -8.932) 10.294 3.654 ( 0.000 2.713 -1.573) 3.136 3.763 ( 0.000 1.762 -8.376) 8.560 3.883 ( 0.000 21.612 13.307) 25.380 4.273 ( 0.000 0.323 10.395) 10.400 4.465 ( 0.000 0.934 -15.021) 15.050 4.806 ( 0.000 -8.228 -11.740) 14.336 4.934 ( 0.000 18.125 -0.006) 18.125 4.988 ( 0.000 15.520 -4.224) 16.084 5.831 ( 0.000 -1.816 1.387) 2.285 5.924 ( 0.000 -8.417 -2.264) 8.716 6.141 ( 0.000 1.791 9.825) 9.986 6.366 ( 0.000 9.199 0.375) 9.206 6.507 ( 0.000 6.231 14.708) 15.974 6.860 ( 0.000 1.503 21.364) 21.417 6.992 ( 0.000 -3.182 -7.005) 7.694 7.264 ( 0.000 -15.865 1.305) 15.918 7.375 ( 0.000 6.277 -4.412) 7.673 7.560 ( 0.000 5.981 -14.106) 15.322 7.811 ( 0.000 40.132 7.736) 40.870 8.110 ( 0.000 32.292 -5.186) 32.705 8.356 ( 0.000 14.850 7.295) 16.546 8.613 ( 0.000 19.225 -4.050) 19.647 8.791 ( 0.000 -5.355 4.985) 7.316 9.082 ( 0.000 -8.258 -9.129) 12.310 9.235 ( 0.000 1.876 13.418) 13.549 9.620 ( 0.000 -5.659 -3.249) 6.526 10.025 ( 0.000 2.992 3.159) 4.351 10.322 ( 0.000 1.064 -8.867) 8.931 10.488 ( 0.000 -0.818 3.839) 3.925 10.751 ( 0.000 -4.543 -9.017) 10.097 16.958 ( 0.000 -6.586 3.486) 7.451 17.230 ( 0.000 -4.836 -5.148) 7.063 17.364 ( 0.000 4.250 2.965) 5.182 17.479 ( 0.000 2.004 -1.580) 2.552 17.596 ( 0.000 3.055 1.924) 3.610 17.678 ( 0.000 2.391 -3.415) 4.169 17.831 ( 0.000 6.828 4.428) 8.138 17.912 ( 0.000 -3.005 -1.561) 3.386 19.879 ( 0.000 0.096 0.225) 0.245 19.888 ( 0.000 -0.098 -0.188) 0.212 21.928 ( 0.000 -0.260 0.690) 0.737 21.962 ( 0.000 -0.963 -0.799) 1.251 27.518 ( 0.000 -5.600 2.754) 6.241 27.631 ( 0.000 -7.502 -2.246) 7.831 27.758 ( 0.000 -4.306 1.044) 4.430 27.803 ( 0.000 -5.255 -0.956) 5.341 37.601 ( 0.000 8.754 4.882) 10.023 37.786 ( 0.000 5.929 -2.255) 6.343 38.124 ( 0.000 -1.382 2.861) 3.177 38.269 ( 0.000 -0.416 -0.733) 0.843 38.507 ( 0.000 0.689 3.058) 3.135 39.055 ( 0.000 2.345 -17.666) 17.820 40.650 ( 0.000 -7.271 11.049) 13.227 40.918 ( 0.000 -5.438 -1.166) 5.562 ======================= Grid point 226 (77/120) ======================= q-point: ( 0.11 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( -1.465 17.883 12.310) 21.760 2.282 ( 8.311 13.187 10.505) 18.797 2.749 ( -5.487 7.350 -14.198) 16.903 2.878 ( 2.534 1.301 -10.127) 10.520 3.209 ( -1.085 -1.243 -1.203) 2.041 3.520 ( -7.674 -2.947 -10.128) 13.044 3.623 ( -2.450 1.118 1.312) 2.995 3.770 ( 0.617 5.297 -4.659) 7.081 3.932 ( 4.167 22.084 11.929) 25.444 4.307 ( 3.629 -2.485 8.264) 9.362 4.525 ( 5.030 2.271 -14.574) 15.584 4.749 ( -4.137 -5.227 -8.920) 11.135 5.008 ( 6.050 15.229 -0.595) 16.398 5.049 ( 6.216 15.161 -4.752) 17.061 5.881 ( 4.685 -1.889 2.503) 5.638 5.989 ( 6.083 -7.760 -0.438) 9.870 6.203 ( 6.523 1.828 8.936) 11.214 6.414 ( 4.465 7.372 1.373) 8.728 6.518 ( 1.243 6.420 13.469) 14.972 6.845 ( -1.210 0.511 15.367) 15.423 6.980 ( -0.923 -3.199 -6.411) 7.224 7.232 ( -2.345 -13.275 -2.469) 13.705 7.402 ( 3.136 5.839 -0.247) 6.632 7.640 ( 6.031 7.059 -9.143) 13.031 7.823 ( 1.887 36.063 6.112) 36.626 8.108 ( -0.219 31.887 -5.166) 32.304 8.381 ( 2.007 13.121 6.439) 14.753 8.604 ( -0.696 19.208 -3.235) 19.491 8.756 ( -3.265 -3.418 4.375) 6.441 9.022 ( -6.051 -7.269 -8.588) 12.775 9.219 ( -1.683 1.872 12.399) 12.652 9.576 ( -4.311 -5.237 -3.046) 7.435 9.999 ( -2.491 2.656 2.933) 4.675 10.290 ( -3.270 1.523 -8.941) 9.642 10.457 ( -3.247 -1.018 3.721) 5.043 10.694 ( -5.605 -3.869 -7.705) 10.284 16.969 ( 1.161 -6.174 3.154) 7.030 17.215 ( -1.338 -3.813 -4.293) 5.896 17.366 ( -0.015 4.319 2.311) 4.898 17.461 ( -1.621 0.932 -1.491) 2.392 17.605 ( 0.773 4.037 1.791) 4.484 17.690 ( 1.226 1.629 -3.631) 4.165 17.801 ( -2.671 7.055 4.817) 8.951 17.904 ( -0.736 -2.720 -1.887) 3.391 19.984 ( 9.905 -0.296 0.415) 9.918 20.015 ( 12.955 -1.505 -1.052) 13.084 21.893 ( -3.720 -0.277 0.730) 3.801 21.929 ( -3.416 -1.051 -0.891) 3.683 27.526 ( 0.749 -5.594 2.652) 6.236 27.634 ( 0.309 -7.402 -2.157) 7.716 27.749 ( -0.880 -4.365 0.903) 4.543 27.788 ( -1.416 -5.157 -0.833) 5.412 37.643 ( 4.245 9.214 4.764) 11.208 37.827 ( 4.164 6.607 -2.296) 8.140 38.142 ( 1.859 -1.140 2.855) 3.593 38.294 ( 2.453 -0.293 -2.122) 3.256 38.501 ( -0.386 -0.062 3.882) 3.901 39.022 ( -3.328 2.311 -16.524) 17.014 40.535 ( -11.577 -6.837 9.727) 16.595 40.729 ( -18.439 -2.519 1.129) 18.644 ======================= Grid point 227 (78/120) ======================= q-point: ( 0.22 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( 3.703 15.518 5.457) 16.862 2.439 ( 7.046 9.241 4.467) 12.449 2.631 ( -5.816 4.558 -11.031) 13.277 2.928 ( 2.194 1.200 -8.348) 8.714 3.183 ( -1.865 2.559 -5.317) 6.188 3.348 ( -8.947 1.675 -7.360) 11.705 3.543 ( -5.818 1.677 4.310) 7.432 3.769 ( -1.187 5.181 -6.177) 8.149 4.044 ( 7.571 20.654 12.102) 25.107 4.405 ( 5.841 -3.297 5.377) 8.596 4.611 ( 2.942 6.256 -11.478) 13.400 4.683 ( -2.017 -7.066 -6.644) 9.906 5.149 ( 8.008 17.250 0.610) 19.028 5.203 ( 8.828 14.363 -2.176) 16.999 5.987 ( 5.494 -1.315 4.874) 7.461 6.122 ( 6.660 -5.237 3.670) 9.233 6.395 ( 12.553 -0.151 5.645) 13.765 6.500 ( 3.406 2.900 7.505) 8.737 6.574 ( 5.196 7.189 7.387) 11.543 6.827 ( -0.182 -0.390 5.290) 5.307 6.975 ( 0.589 -5.017 -6.405) 8.157 7.212 ( 1.285 -10.807 -7.035) 12.959 7.486 ( 5.155 7.069 6.900) 11.142 7.710 ( 0.574 23.592 2.019) 23.685 7.921 ( 7.926 14.422 -2.758) 16.686 8.100 ( -0.497 30.529 -5.078) 30.952 8.379 ( -4.119 7.070 5.814) 10.038 8.605 ( 0.714 21.303 -2.056) 21.414 8.697 ( -1.099 0.012 2.908) 3.109 8.858 ( -10.300 -4.127 -7.158) 13.205 9.168 ( -3.598 2.528 10.191) 11.099 9.465 ( -6.683 -4.141 -2.886) 8.375 9.943 ( -2.854 1.809 2.410) 4.151 10.204 ( -5.205 2.529 -8.670) 10.424 10.367 ( -5.761 -1.345 3.383) 6.815 10.551 ( -8.658 -2.706 -5.088) 10.401 17.002 ( 2.125 -5.023 2.282) 5.912 17.186 ( -1.488 -2.029 -2.948) 3.876 17.356 ( -1.009 4.476 1.359) 4.785 17.423 ( -2.196 -0.812 -1.666) 2.873 17.620 ( 0.810 5.723 2.063) 6.137 17.723 ( 2.006 0.081 -3.692) 4.203 17.747 ( -2.389 7.010 4.906) 8.884 17.887 ( -0.921 -2.098 -2.595) 3.462 20.248 ( 16.655 -0.649 1.346) 16.722 20.341 ( 19.339 -4.044 -2.955) 19.977 21.783 ( -7.672 -0.343 0.857) 7.727 21.828 ( -6.989 -1.377 -1.181) 7.221 27.546 ( 1.341 -5.567 2.360) 6.193 27.643 ( 0.560 -7.108 -1.915) 7.382 27.725 ( -1.548 -4.572 0.632) 4.868 27.754 ( -1.949 -5.020 -0.614) 5.420 37.761 ( 7.720 10.388 4.139) 13.588 37.939 ( 6.997 8.441 -2.597) 11.268 38.201 ( 4.492 0.103 2.906) 5.351 38.349 ( 2.317 1.635 -5.054) 5.795 38.513 ( 2.794 -3.743 5.477) 7.198 38.932 ( -5.752 1.998 -13.134) 14.477 40.220 ( -20.772 -4.562 6.663) 22.286 40.265 ( -27.111 1.180 5.360) 27.661 ======================= Grid point 228 (79/120) ======================= q-point: ( 0.33 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 9.096 11.621 -1.338) 14.818 2.505 ( -0.652 4.908 -12.661) 13.595 2.582 ( 0.997 2.542 3.026) 4.076 2.927 ( -3.721 0.140 -8.089) 8.905 3.101 ( -5.802 9.163 -4.228) 11.641 3.242 ( -1.671 5.457 -4.331) 7.164 3.433 ( -3.744 1.429 1.963) 4.463 3.711 ( -4.884 4.528 -9.501) 11.602 4.216 ( 9.532 15.387 10.529) 20.940 4.505 ( 3.551 0.199 3.965) 5.326 4.628 ( -0.052 4.683 -0.860) 4.761 4.681 ( 0.787 -3.661 -9.160) 9.896 5.296 ( 6.769 18.519 4.060) 20.131 5.359 ( 6.437 15.730 2.071) 17.122 6.081 ( 4.303 -0.673 6.305) 7.663 6.219 ( 2.781 -2.264 5.101) 6.236 6.538 ( 2.553 -0.795 5.484) 6.101 6.600 ( 3.482 0.485 6.215) 7.141 6.743 ( 12.255 1.965 0.667) 12.430 6.869 ( 5.896 1.101 2.375) 6.451 6.987 ( 0.523 -8.197 -4.934) 9.581 7.316 ( 9.191 -6.115 -9.227) 14.388 7.588 ( 4.476 10.818 7.844) 14.093 7.696 ( -0.576 23.689 7.740) 24.928 8.042 ( 0.340 15.019 -6.822) 16.499 8.115 ( 4.121 17.168 -4.321) 18.177 8.218 ( -10.770 4.612 5.793) 13.070 8.546 ( -9.475 7.810 -5.921) 13.632 8.670 ( -2.272 11.274 2.601) 11.791 8.784 ( 5.576 5.832 -0.618) 8.092 9.083 ( -4.704 3.074 7.559) 9.419 9.329 ( -7.183 -2.744 -3.062) 8.276 9.908 ( -0.387 1.011 1.497) 1.848 10.103 ( -4.904 2.992 -7.358) 9.335 10.248 ( -5.856 -1.314 2.765) 6.608 10.377 ( -8.742 -1.855 -3.114) 9.463 17.049 ( 2.632 -3.321 1.194) 4.403 17.160 ( -1.206 -0.595 -1.748) 2.206 17.332 ( -1.241 3.411 0.396) 3.651 17.378 ( -2.400 -1.503 -1.887) 3.403 17.637 ( 0.891 6.773 2.966) 7.448 17.705 ( -1.660 5.892 4.933) 7.861 17.771 ( 2.415 -0.303 -4.119) 4.784 17.869 ( -0.965 -1.529 -3.317) 3.778 20.605 ( 19.443 -0.840 1.914) 19.555 20.729 ( 20.006 -5.018 -3.792) 20.972 21.593 ( -11.902 -0.468 1.122) 11.964 21.657 ( -10.689 -2.084 -1.742) 11.029 27.576 ( 1.709 -5.491 1.925) 6.065 27.655 ( 0.744 -6.638 -1.584) 6.865 27.690 ( -2.015 -4.888 0.617) 5.323 27.719 ( -1.577 -5.129 -0.628) 5.403 37.926 ( 8.611 11.019 2.101) 14.142 38.074 ( 5.969 9.980 -3.646) 12.187 38.325 ( 7.882 4.828 2.237) 9.510 38.364 ( 0.410 4.241 -1.728) 4.598 38.647 ( 10.669 -7.771 1.626) 13.299 38.816 ( -5.192 0.219 -7.059) 8.765 39.694 ( -28.517 5.466 8.461) 30.244 39.802 ( -23.301 -6.096 2.982) 24.269 ======================= Grid point 229 (80/120) ======================= q-point: ( 0.44 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 270 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( 10.267 7.733 -5.908) 14.146 2.493 ( -2.433 3.678 -8.482) 9.560 2.591 ( 2.738 2.821 -4.101) 5.681 2.756 ( -11.600 0.845 -9.025) 14.722 3.083 ( 3.596 9.752 2.548) 10.701 3.180 ( -5.125 5.548 1.809) 7.767 3.458 ( 5.531 3.428 -8.225) 10.487 3.590 ( -7.121 4.092 -10.959) 13.695 4.389 ( 7.804 10.501 7.623) 15.142 4.504 ( -3.635 5.793 4.609) 8.247 4.651 ( 2.195 1.664 0.159) 2.759 4.684 ( -0.764 -0.693 -4.041) 4.171 5.401 ( 3.808 18.402 6.559) 19.903 5.432 ( 0.950 17.417 5.800) 18.382 6.160 ( 3.852 -0.269 5.674) 6.863 6.223 ( -2.103 -0.390 5.025) 5.461 6.585 ( 2.173 -1.739 4.309) 5.130 6.615 ( -0.782 -1.249 3.998) 4.261 6.882 ( 3.974 -4.733 -5.565) 8.316 6.938 ( -1.654 -5.319 -6.246) 8.369 7.164 ( 16.283 4.810 7.469) 18.549 7.412 ( -5.797 9.977 2.393) 11.785 7.683 ( 10.204 1.537 -5.192) 11.551 7.761 ( 5.671 9.462 7.747) 13.480 7.956 ( -7.920 13.392 -4.686) 16.249 7.980 ( -10.458 8.692 9.120) 16.374 8.225 ( 4.432 13.885 -7.707) 16.487 8.337 ( -8.603 9.340 -6.895) 14.449 8.719 ( 5.602 14.619 6.135) 16.815 8.829 ( -3.517 9.810 3.954) 11.146 9.059 ( 4.321 -0.015 0.938) 4.421 9.188 ( -7.380 -1.454 -2.586) 7.954 9.934 ( 3.012 0.920 -0.383) 3.173 10.013 ( -4.602 1.837 -3.920) 6.318 10.176 ( -0.572 -0.673 0.495) 1.012 10.231 ( -5.754 -1.014 -1.809) 6.116 17.099 ( 2.334 -1.372 0.219) 2.716 17.135 ( -1.464 -0.176 -0.679) 1.624 17.318 ( 0.006 1.186 -0.712) 1.383 17.336 ( -1.742 -0.874 -1.613) 2.530 17.655 ( 1.049 6.712 3.888) 7.828 17.677 ( -1.217 6.130 4.522) 7.714 17.815 ( 2.000 -0.888 -4.151) 4.693 17.847 ( -1.361 -1.179 -3.868) 4.266 20.981 ( 18.812 -0.788 1.886) 18.923 21.099 ( 17.719 -4.395 -3.463) 18.581 21.322 ( -15.858 -0.662 1.534) 15.946 21.413 ( -14.390 -3.209 -2.575) 14.967 27.611 ( 1.909 -5.336 1.424) 5.843 27.650 ( -2.028 -5.085 0.934) 5.554 27.672 ( 0.919 -6.154 -1.218) 6.340 27.692 ( -1.188 -5.569 -0.899) 5.765 38.069 ( 5.675 9.441 -1.371) 11.100 38.134 ( -0.427 9.376 -4.150) 10.262 38.392 ( 3.901 7.854 -0.430) 8.780 38.454 ( 0.805 12.790 -2.074) 12.982 38.803 ( 8.951 -3.908 4.496) 10.752 38.918 ( 13.105 -7.747 -0.269) 15.226 39.199 ( -19.238 3.319 8.390) 21.248 39.358 ( -21.543 -6.228 0.609) 22.434 ======================= Grid point 234 (81/120) ======================= q-point: ( 0.00 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( 0.000 17.296 10.668) 20.322 2.467 ( 0.000 14.064 0.120) 14.064 2.855 ( 0.000 0.081 -8.503) 8.504 2.929 ( 0.000 0.236 -4.212) 4.219 3.211 ( 0.000 1.948 -6.179) 6.479 3.450 ( 0.000 -8.993 -11.954) 14.959 3.676 ( 0.000 0.581 -3.018) 3.073 3.742 ( 0.000 -2.492 -7.723) 8.115 3.961 ( 0.000 -1.628 3.618) 3.967 4.292 ( 0.000 -14.201 -9.754) 17.228 4.576 ( 0.000 18.181 9.573) 20.548 4.810 ( 0.000 3.457 -1.349) 3.711 5.269 ( 0.000 15.245 -2.452) 15.441 5.310 ( 0.000 16.417 -4.617) 17.054 5.746 ( 0.000 -9.578 -1.693) 9.727 5.782 ( 0.000 -4.618 -3.246) 5.645 6.223 ( 0.000 7.828 12.395) 14.660 6.543 ( 0.000 7.789 0.916) 7.843 6.631 ( 0.000 6.322 14.084) 15.438 6.820 ( 0.000 -3.892 8.887) 9.702 6.885 ( 0.000 -14.863 0.192) 14.864 6.913 ( 0.000 -10.560 3.998) 11.291 7.516 ( 0.000 6.806 -7.598) 10.200 7.640 ( 0.000 1.640 -14.737) 14.828 8.428 ( 0.000 19.492 4.637) 20.036 8.542 ( 0.000 6.833 1.241) 6.945 8.581 ( 0.000 8.127 11.439) 14.032 8.706 ( 0.000 3.497 4.474) 5.678 8.902 ( 0.000 7.603 -3.011) 8.178 8.978 ( 0.000 -1.110 -8.592) 8.663 9.326 ( 0.000 6.721 9.279) 11.458 9.518 ( 0.000 -4.271 1.639) 4.575 10.151 ( 0.000 7.856 2.418) 8.220 10.338 ( 0.000 -0.533 -3.736) 3.774 10.519 ( 0.000 3.731 -0.644) 3.787 10.680 ( 0.000 -3.085 -9.109) 9.617 16.877 ( 0.000 -1.344 -2.130) 2.518 17.053 ( 0.000 -9.454 -8.824) 12.932 17.413 ( 0.000 1.149 1.487) 1.879 17.484 ( 0.000 -1.689 -1.368) 2.173 17.632 ( 0.000 2.077 1.501) 2.563 17.700 ( 0.000 -0.941 -1.386) 1.676 17.962 ( 0.000 5.709 4.663) 7.372 17.979 ( 0.000 5.981 5.300) 7.991 19.881 ( 0.000 0.116 0.131) 0.175 19.886 ( 0.000 -0.124 -0.090) 0.153 21.926 ( 0.000 0.030 0.353) 0.355 21.944 ( 0.000 -0.830 -0.441) 0.940 27.434 ( 0.000 -2.567 1.820) 3.147 27.498 ( 0.000 -5.518 -1.029) 5.613 27.689 ( 0.000 -2.429 0.545) 2.490 27.712 ( 0.000 -3.587 -0.519) 3.624 37.754 ( 0.000 6.316 4.395) 7.695 37.857 ( 0.000 1.204 0.507) 1.307 38.115 ( 0.000 0.771 4.256) 4.325 38.234 ( 0.000 -3.297 5.924) 6.780 38.578 ( 0.000 7.237 -8.809) 11.401 38.983 ( 0.000 -8.651 -20.033) 21.821 40.615 ( 0.000 2.849 11.663) 12.006 40.819 ( 0.000 -5.018 1.711) 5.301 ======================= Grid point 235 (82/120) ======================= q-point: ( 0.11 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.361 ( -2.953 16.724 5.614) 17.887 2.536 ( 4.384 11.599 1.438) 12.483 2.836 ( -7.765 0.229 -7.343) 10.689 2.877 ( 1.497 -1.557 -8.513) 8.782 3.220 ( 0.895 2.543 -6.118) 6.686 3.418 ( -2.977 -6.402 -11.069) 13.129 3.655 ( -1.093 2.632 0.922) 2.995 3.844 ( 6.954 2.699 -6.961) 10.203 3.959 ( 0.735 -7.124 4.360) 8.385 4.320 ( 2.142 -13.301 -8.550) 15.957 4.591 ( 1.892 15.970 8.067) 17.991 4.795 ( -1.035 4.638 -1.246) 4.913 5.336 ( 6.627 15.380 -2.833) 16.985 5.365 ( 5.590 16.680 -3.944) 18.028 5.807 ( 5.787 -8.579 -0.917) 10.389 5.847 ( 6.421 -5.019 -3.785) 8.986 6.270 ( 4.687 6.045 11.816) 14.076 6.557 ( 1.139 6.579 3.976) 7.771 6.648 ( 1.746 6.383 10.964) 12.806 6.774 ( -3.242 -7.186 5.818) 9.797 6.893 ( -0.166 -7.096 0.160) 7.100 6.914 ( 0.718 -13.715 3.303) 14.125 7.546 ( 3.199 7.135 -5.444) 9.528 7.698 ( 5.345 0.410 -12.651) 13.740 8.399 ( -3.103 17.021 5.096) 18.036 8.518 ( -2.374 4.430 2.196) 5.485 8.593 ( 0.323 10.708 8.083) 13.421 8.698 ( -0.363 3.736 4.991) 6.245 8.900 ( -0.454 7.154 -3.476) 7.967 8.947 ( -2.641 1.085 -7.497) 8.022 9.307 ( -1.967 6.319 8.744) 10.966 9.483 ( -3.438 -3.847 1.567) 5.392 10.125 ( -2.553 8.145 2.459) 8.883 10.315 ( -2.337 -0.140 -3.741) 4.414 10.483 ( -3.557 3.609 -0.463) 5.089 10.634 ( -4.520 -2.573 -8.434) 9.908 16.892 ( 1.544 -1.310 -2.071) 2.897 17.059 ( 0.595 -8.786 -8.375) 12.152 17.402 ( -1.221 0.316 1.003) 1.611 17.458 ( -2.430 -1.598 -1.168) 3.134 17.652 ( 1.728 2.212 1.409) 3.140 17.711 ( 1.125 -0.471 -1.182) 1.699 17.951 ( -1.280 5.712 4.445) 7.351 17.958 ( -1.729 5.995 4.885) 7.925 19.981 ( 9.735 -0.029 0.232) 9.737 19.994 ( 10.933 -0.754 -0.336) 10.964 21.890 ( -3.734 0.040 0.372) 3.752 21.909 ( -3.580 -0.896 -0.489) 3.723 27.441 ( 0.740 -2.588 1.758) 3.214 27.503 ( 0.507 -5.426 -0.989) 5.539 27.679 ( -0.986 -2.480 0.498) 2.715 27.700 ( -1.245 -3.493 -0.439) 3.734 37.804 ( 5.095 6.682 4.429) 9.498 37.909 ( 5.284 1.535 0.616) 5.537 38.135 ( 2.102 0.773 3.883) 4.483 38.257 ( 2.437 -3.502 5.018) 6.586 38.562 ( -1.689 6.879 -8.201) 10.837 38.954 ( -2.987 -8.342 -19.002) 20.966 40.502 ( -11.382 2.680 10.903) 15.988 40.674 ( -14.428 -3.423 2.459) 15.031 ======================= Grid point 236 (83/120) ======================= q-point: ( 0.22 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( -0.029 13.905 0.851) 13.932 2.612 ( 3.169 6.956 -0.984) 7.707 2.670 ( -7.871 0.370 -9.659) 12.465 2.909 ( 0.955 -3.557 -12.003) 12.555 3.242 ( 1.299 3.577 -5.897) 7.018 3.353 ( -3.228 -1.133 -7.537) 8.277 3.605 ( -4.949 5.194 5.325) 8.934 3.850 ( -4.671 2.198 -4.993) 7.182 4.099 ( 11.320 -6.380 2.706) 13.273 4.371 ( 3.929 -9.925 -5.231) 11.887 4.645 ( 2.971 11.356 6.087) 13.222 4.787 ( 0.138 6.104 -0.056) 6.106 5.498 ( 9.216 14.884 -2.269) 17.653 5.515 ( 9.037 18.038 -2.588) 20.340 5.944 ( 7.598 -5.715 -0.764) 9.538 6.003 ( 8.640 -5.037 -2.832) 10.394 6.388 ( 6.342 0.047 9.269) 11.231 6.584 ( 2.339 5.604 8.934) 10.803 6.699 ( 3.297 4.600 4.777) 7.406 6.728 ( -1.058 -9.155 4.201) 10.128 6.877 ( -1.099 -4.307 0.505) 4.473 6.971 ( 6.130 -10.839 -1.737) 12.573 7.638 ( 6.094 7.425 -0.678) 9.629 7.824 ( 7.004 -0.868 -9.009) 11.444 8.302 ( -6.979 10.659 5.296) 13.797 8.436 ( -6.331 1.372 1.757) 6.712 8.568 ( -3.108 14.088 3.898) 14.944 8.694 ( -1.368 1.680 3.409) 4.039 8.867 ( -1.152 7.525 -4.917) 9.062 8.926 ( 0.456 6.685 -1.658) 6.902 9.252 ( -3.618 5.372 7.284) 9.747 9.395 ( -5.272 -2.766 1.020) 6.040 10.066 ( -3.043 8.809 2.429) 9.631 10.253 ( -3.848 1.002 -3.658) 5.403 10.389 ( -5.832 3.492 0.019) 6.798 10.516 ( -7.310 -1.314 -6.715) 10.013 16.935 ( 2.882 -1.175 -1.933) 3.664 17.077 ( 1.202 -6.948 -7.170) 10.057 17.365 ( -2.623 -1.526 -0.040) 3.034 17.400 ( -3.346 -1.808 -1.258) 4.006 17.691 ( 2.199 2.929 1.645) 4.015 17.743 ( 2.081 0.446 -0.777) 2.266 17.907 ( -2.604 6.781 4.901) 8.763 17.932 ( -1.272 4.512 2.865) 5.494 20.241 ( 16.505 0.010 0.660) 16.518 20.280 ( 17.710 -2.178 -1.059) 17.875 21.779 ( -7.722 0.051 0.428) 7.734 21.803 ( -7.406 -1.116 -0.633) 7.516 27.462 ( 1.346 -2.635 1.583) 3.356 27.517 ( 0.933 -5.166 -0.881) 5.322 27.652 ( -1.742 -2.599 0.432) 3.159 27.668 ( -1.883 -3.353 -0.290) 3.857 37.944 ( 8.852 7.676 4.189) 12.443 38.052 ( 8.958 2.609 0.886) 9.372 38.208 ( 6.102 0.858 2.980) 6.845 38.332 ( 5.407 -3.849 2.331) 7.034 38.516 ( -2.895 5.553 -6.200) 8.812 38.871 ( -5.355 -7.488 -16.035) 18.490 40.192 ( -19.933 2.109 8.951) 21.952 40.290 ( -24.084 -0.066 4.000) 24.414 ======================= Grid point 237 (84/120) ======================= q-point: ( 0.33 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 4.812 9.569 -3.714) 11.337 2.557 ( -2.867 0.104 -8.503) 8.974 2.657 ( 0.658 5.273 -4.970) 7.276 2.883 ( -4.247 -4.131 -12.224) 13.584 3.264 ( 0.580 5.889 -6.404) 8.720 3.310 ( -0.965 1.813 -3.862) 4.374 3.479 ( -6.156 4.430 3.201) 8.233 3.726 ( -7.447 -2.846 -9.295) 12.246 4.324 ( 11.315 -0.390 4.597) 12.219 4.485 ( 7.259 -5.952 -0.788) 9.420 4.681 ( 0.342 8.922 6.010) 10.763 4.783 ( -1.014 5.388 2.161) 5.893 5.668 ( 7.486 15.784 -0.214) 17.471 5.676 ( 6.973 17.852 -0.177) 19.166 6.076 ( 5.689 -1.899 -1.394) 6.158 6.148 ( 5.676 -4.406 -1.771) 7.401 6.466 ( 2.352 -4.419 6.512) 8.214 6.618 ( -0.925 1.929 7.784) 8.073 6.735 ( 1.481 -7.300 -0.209) 7.452 6.789 ( 1.915 -7.200 2.738) 7.937 6.919 ( 11.167 4.514 3.928) 12.669 7.171 ( 14.066 -7.258 -4.756) 16.527 7.767 ( 5.972 7.507 2.197) 9.841 7.917 ( -0.640 1.577 -2.402) 2.943 8.154 ( -6.021 2.942 2.526) 7.162 8.293 ( -6.377 -1.683 -0.009) 6.595 8.457 ( -8.354 13.338 3.137) 16.047 8.619 ( -5.369 4.888 -1.650) 7.446 8.912 ( 4.768 6.753 -0.144) 8.268 8.946 ( 1.549 8.414 0.543) 8.573 9.170 ( -4.523 5.040 5.328) 8.617 9.287 ( -5.732 -1.638 -0.129) 5.963 10.025 ( -0.796 9.209 1.843) 9.425 10.175 ( -3.993 2.911 -3.165) 5.868 10.274 ( -5.362 3.552 0.447) 6.448 10.368 ( -7.447 0.145 -4.551) 8.729 17.001 ( 3.762 -0.828 -1.778) 4.243 17.104 ( 1.485 -4.136 -5.420) 6.978 17.305 ( -3.321 -3.492 -1.134) 4.950 17.333 ( -3.436 -2.796 -1.945) 4.838 17.734 ( 2.202 4.050 2.220) 5.116 17.787 ( 2.316 1.375 -0.348) 2.716 17.860 ( -2.153 6.536 4.327) 8.129 17.906 ( -1.418 3.430 1.569) 4.030 20.596 ( 19.419 0.050 0.910) 19.441 20.651 ( 19.793 -2.954 -1.519) 20.070 21.588 ( -11.984 0.057 0.540) 11.996 21.620 ( -11.455 -1.558 -0.886) 11.594 27.492 ( 1.761 -2.678 1.330) 3.470 27.539 ( 1.250 -4.771 -0.730) 4.986 27.613 ( -2.175 -2.669 0.518) 3.482 27.631 ( -1.868 -3.454 -0.275) 3.936 38.111 ( 7.255 7.504 1.825) 10.597 38.226 ( 8.349 4.340 -0.173) 9.411 38.405 ( 13.510 2.069 2.709) 13.933 38.439 ( 0.248 5.676 -4.758) 7.410 38.505 ( 8.986 -5.639 1.778) 10.757 38.755 ( -6.123 -6.327 -11.164) 14.218 39.757 ( -24.103 0.993 6.519) 24.989 39.780 ( -27.493 2.543 5.140) 28.085 ======================= Grid point 238 (85/120) ======================= q-point: ( 0.44 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 272 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( 6.840 6.024 -6.722) 11.325 2.558 ( 1.905 2.591 -8.301) 8.902 2.638 ( -0.904 2.137 -5.565) 6.029 2.749 ( -8.741 -1.661 -9.250) 12.835 3.262 ( -0.088 7.894 -3.636) 8.692 3.281 ( -2.068 5.451 -0.204) 5.834 3.459 ( 4.168 -2.328 -8.107) 9.409 3.579 ( -7.315 -4.290 -11.520) 14.304 4.521 ( 8.532 3.692 5.866) 10.992 4.623 ( 5.291 0.246 3.767) 6.500 4.649 ( -2.633 4.915 4.968) 7.468 4.735 ( -4.073 2.608 3.493) 5.966 5.766 ( 2.702 17.524 1.730) 17.815 5.771 ( 2.344 16.336 2.219) 16.652 6.167 ( 3.674 -0.647 -2.357) 4.413 6.206 ( 0.171 -2.486 -2.686) 3.664 6.516 ( 2.898 -3.290 6.020) 7.448 6.574 ( -2.916 -1.119 6.224) 6.964 6.757 ( 0.855 -8.338 -0.329) 8.388 6.776 ( -1.187 -9.319 -0.044) 9.394 7.257 ( 19.711 5.422 4.242) 20.879 7.467 ( 11.938 -1.906 -3.884) 12.698 7.684 ( -11.135 0.613 2.428) 11.413 7.823 ( -10.191 -2.730 -2.027) 10.744 8.106 ( 4.371 8.193 5.528) 10.807 8.268 ( -9.307 11.839 4.493) 15.715 8.332 ( 7.279 -0.302 -2.704) 7.771 8.493 ( -7.760 3.123 -3.159) 8.942 8.982 ( 2.303 9.004 2.528) 9.632 9.003 ( 2.322 6.692 1.958) 7.349 9.104 ( -0.427 3.681 1.514) 4.003 9.176 ( -5.550 -0.355 -1.023) 5.655 10.040 ( 2.201 8.595 0.426) 8.882 10.100 ( -3.698 6.150 -1.495) 7.331 10.208 ( -0.871 2.593 -0.446) 2.772 10.246 ( -4.550 1.321 -2.354) 5.290 17.075 ( 3.607 -0.095 -1.735) 4.004 17.120 ( -0.492 -0.467 -3.000) 3.076 17.254 ( -1.152 -5.737 -2.610) 6.407 17.272 ( -2.536 -4.683 -2.872) 6.050 17.775 ( 2.002 5.216 2.882) 6.286 17.810 ( -1.198 5.581 2.778) 6.348 17.841 ( 1.411 2.337 0.922) 2.881 17.876 ( -1.723 2.462 0.678) 3.081 20.973 ( 18.898 0.077 0.886) 18.919 21.027 ( 18.539 -2.818 -1.523) 18.814 21.315 ( -16.019 0.058 0.721) 16.036 21.359 ( -15.397 -2.215 -1.226) 15.604 27.529 ( 2.022 -2.693 1.041) 3.525 27.565 ( 1.317 -4.231 -0.509) 4.461 27.570 ( -2.016 -2.750 0.701) 3.481 27.596 ( -1.694 -3.823 -0.400) 4.201 38.225 ( 4.967 6.766 -1.704) 8.565 38.303 ( -1.998 7.648 -5.108) 9.412 38.456 ( 5.604 -1.690 -0.527) 5.877 38.583 ( -5.569 -2.493 -6.368) 8.819 38.765 ( 19.721 2.800 4.698) 20.465 38.826 ( 17.244 -1.268 1.604) 17.365 39.261 ( -24.471 2.410 5.376) 25.170 39.289 ( -22.957 -1.014 4.238) 23.367 ======================= Grid point 243 (86/120) ======================= q-point: ( 0.00 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.647 ( 0.000 -0.712 -1.612) 1.762 2.647 ( 0.000 0.712 -1.612) 1.762 2.854 ( 0.000 -3.246 0.987) 3.393 2.854 ( 0.000 3.246 0.987) 3.393 3.291 ( 0.000 -6.080 -10.878) 12.462 3.291 ( 0.000 6.080 -10.878) 12.462 3.696 ( 0.000 -1.750 -4.643) 4.962 3.696 ( 0.000 1.750 -4.643) 4.962 4.038 ( 0.000 -9.593 -5.596) 11.106 4.038 ( 0.000 9.593 -5.596) 11.106 4.807 ( 0.000 -5.095 5.484) 7.485 4.807 ( 0.000 5.095 5.484) 7.485 5.533 ( 0.000 -10.878 -3.487) 11.423 5.533 ( 0.000 10.878 -3.487) 11.423 5.611 ( 0.000 -11.745 -2.577) 12.024 5.611 ( 0.000 11.745 -2.577) 12.024 6.473 ( 0.000 -16.093 9.975) 18.934 6.473 ( 0.000 16.093 9.975) 18.934 6.713 ( 0.000 -2.643 3.781) 4.614 6.713 ( 0.000 2.643 3.781) 4.614 6.781 ( 0.000 -5.076 5.860) 7.753 6.781 ( 0.000 5.076 5.860) 7.753 7.621 ( 0.000 -3.444 -12.028) 12.512 7.621 ( 0.000 3.444 -12.028) 12.512 8.563 ( 0.000 -0.295 1.988) 2.010 8.563 ( 0.000 0.295 1.988) 2.010 8.730 ( 0.000 -4.365 8.854) 9.872 8.730 ( 0.000 4.365 8.854) 9.872 8.987 ( 0.000 -0.910 -4.149) 4.247 8.987 ( 0.000 0.910 -4.149) 4.247 9.443 ( 0.000 -4.256 4.993) 6.561 9.443 ( 0.000 4.256 4.993) 6.561 10.284 ( 0.000 -4.947 0.733) 5.001 10.284 ( 0.000 4.947 0.733) 5.001 10.609 ( 0.000 -4.421 -5.849) 7.332 10.609 ( 0.000 4.421 -5.849) 7.332 16.909 ( 0.000 -4.644 -6.592) 8.064 16.909 ( 0.000 4.644 -6.592) 8.064 17.440 ( 0.000 -1.975 -0.217) 1.987 17.440 ( 0.000 1.975 -0.217) 1.987 17.673 ( 0.000 -1.735 0.042) 1.736 17.673 ( 0.000 1.735 0.042) 1.736 18.034 ( 0.000 -0.648 5.971) 6.006 18.034 ( 0.000 0.648 5.971) 6.006 19.883 ( 0.000 -0.129 0.021) 0.131 19.883 ( 0.000 0.129 0.021) 0.131 21.931 ( 0.000 -0.461 -0.041) 0.463 21.931 ( 0.000 0.461 -0.041) 0.463 27.425 ( 0.000 -1.702 0.452) 1.761 27.425 ( 0.000 1.702 0.452) 1.761 27.670 ( 0.000 -0.616 -0.000) 0.616 27.670 ( 0.000 0.616 -0.000) 0.616 37.842 ( 0.000 -2.537 2.696) 3.702 37.842 ( 0.000 2.537 2.696) 3.702 38.159 ( 0.000 -3.513 6.428) 7.326 38.159 ( 0.000 3.513 6.428) 7.326 38.772 ( 0.000 -11.318 -16.273) 19.822 38.772 ( 0.000 11.318 -16.273) 19.822 40.711 ( 0.000 -5.721 6.863) 8.935 40.711 ( 0.000 5.721 6.863) 8.935 ======================= Grid point 245 (87/120) ======================= q-point: ( 0.11 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( -2.466 -7.248 -0.368) 7.665 2.626 ( -2.466 7.248 -0.368) 7.665 2.820 ( -2.402 -3.067 -5.474) 6.719 2.820 ( -2.402 3.067 -5.474) 6.719 3.299 ( 0.646 -5.157 -9.295) 10.650 3.299 ( 0.646 5.157 -9.295) 10.650 3.746 ( 3.841 -6.757 0.552) 7.792 3.746 ( 3.841 6.757 0.552) 7.792 4.052 ( 1.660 -11.726 -6.813) 13.662 4.052 ( 1.660 11.726 -6.813) 13.662 4.805 ( 0.101 -4.646 5.003) 6.829 4.805 ( 0.101 4.646 5.003) 6.829 5.602 ( 6.537 -11.603 -2.617) 13.573 5.602 ( 6.537 11.603 -2.617) 13.573 5.673 ( 6.380 -12.893 -3.851) 14.891 5.673 ( 6.380 12.893 -3.851) 14.891 6.480 ( 0.541 -14.346 9.250) 17.078 6.480 ( 0.541 14.346 9.250) 17.078 6.709 ( -0.069 -4.159 3.487) 5.428 6.709 ( -0.069 4.159 3.487) 5.428 6.788 ( 0.921 -4.260 5.662) 7.145 6.788 ( 0.921 4.260 5.662) 7.145 7.660 ( 3.890 -4.083 -10.353) 11.789 7.660 ( 3.890 4.083 -10.353) 11.789 8.525 ( -4.022 -1.533 1.953) 4.727 8.525 ( -4.022 1.533 1.953) 4.727 8.734 ( 0.194 -3.124 8.108) 8.691 8.734 ( 0.194 3.124 8.108) 8.691 8.979 ( -0.732 -0.788 -3.934) 4.078 8.979 ( -0.732 0.788 -3.934) 4.078 9.415 ( -2.768 -3.926 4.857) 6.831 9.415 ( -2.768 3.926 4.857) 6.831 10.263 ( -1.994 -5.092 0.849) 5.534 10.263 ( -1.994 5.092 0.849) 5.534 10.571 ( -3.793 -4.209 -5.572) 7.946 10.571 ( -3.793 4.209 -5.572) 7.946 16.923 ( 1.394 -4.445 -6.339) 7.866 16.923 ( 1.394 4.445 -6.339) 7.866 17.417 ( -2.190 -1.663 -0.432) 2.783 17.417 ( -2.190 1.663 -0.432) 2.783 17.692 ( 1.765 -1.526 0.243) 2.346 17.692 ( 1.765 1.526 0.243) 2.346 18.018 ( -1.540 -0.353 5.595) 5.814 18.018 ( -1.540 0.353 5.595) 5.814 19.984 ( 9.998 -0.309 0.011) 10.002 19.984 ( 9.998 0.309 0.011) 10.002 21.895 ( -3.688 -0.500 -0.051) 3.722 21.895 ( -3.688 0.500 -0.051) 3.722 27.431 ( 0.661 -1.642 0.439) 1.824 27.431 ( 0.661 1.642 0.439) 1.824 27.659 ( -1.097 -0.545 0.025) 1.225 27.659 ( -1.097 0.545 0.025) 1.225 37.897 ( 5.562 -2.591 2.844) 6.763 37.897 ( 5.562 2.591 2.844) 6.763 38.180 ( 2.113 -3.607 5.759) 7.116 38.180 ( 2.113 3.607 5.759) 7.116 38.749 ( -2.319 -10.994 -15.501) 19.145 38.749 ( -2.319 10.994 -15.501) 19.145 40.589 ( -12.269 -4.965 6.762) 14.863 40.589 ( -12.269 4.965 6.762) 14.863 ======================= Grid point 247 (88/120) ======================= q-point: ( 0.22 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.555 ( -3.898 -8.442 -1.954) 9.502 2.555 ( -3.898 8.442 -1.954) 9.502 2.794 ( -0.466 -7.532 -11.277) 13.569 2.794 ( -0.466 7.532 -11.277) 13.569 3.310 ( 0.464 -2.967 -6.949) 7.570 3.310 ( 0.464 2.967 -6.949) 7.570 3.755 ( -4.361 -9.104 2.958) 10.519 3.755 ( -4.361 9.104 2.958) 10.519 4.147 ( 8.998 -9.840 -4.428) 14.050 4.147 ( 8.998 9.840 -4.428) 14.050 4.816 ( 0.744 -3.683 4.807) 6.101 4.816 ( 0.744 3.683 4.807) 6.101 5.758 ( 8.959 -11.047 -1.020) 14.260 5.758 ( 8.959 11.047 -1.020) 14.260 5.841 ( 9.789 -12.803 -5.992) 17.194 5.841 ( 9.789 12.803 -5.992) 17.194 6.488 ( 0.349 -10.530 6.781) 12.530 6.488 ( 0.349 10.530 6.781) 12.530 6.716 ( 0.264 -4.780 6.220) 7.849 6.716 ( 0.264 4.780 6.220) 7.849 6.839 ( 5.476 -1.849 2.553) 6.318 6.839 ( 5.476 1.849 2.553) 6.318 7.763 ( 6.456 -4.935 -6.637) 10.492 7.763 ( 6.456 4.935 -6.637) 10.492 8.404 ( -8.511 -3.147 1.605) 9.215 8.404 ( -8.511 3.147 1.605) 9.215 8.720 ( -2.189 -1.937 5.816) 6.509 8.720 ( -2.189 1.937 5.816) 6.509 8.971 ( 0.372 -1.789 -2.465) 3.069 8.971 ( 0.372 1.789 -2.465) 3.069 9.343 ( -4.452 -3.317 4.200) 6.961 9.343 ( -4.452 3.317 4.200) 6.961 10.215 ( -2.652 -5.051 1.019) 5.796 10.215 ( -2.652 5.051 1.019) 5.796 10.471 ( -6.149 -3.638 -4.721) 8.563 10.471 ( -6.149 3.638 -4.721) 8.563 16.963 ( 2.672 -3.894 -5.658) 7.370 16.963 ( 2.672 3.894 -5.658) 7.370 17.360 ( -3.611 -1.294 -0.961) 3.954 17.360 ( -3.611 1.294 -0.961) 3.954 17.736 ( 2.657 -1.322 0.702) 3.050 17.736 ( 2.657 1.322 0.702) 3.050 17.981 ( -2.169 -0.458 4.692) 5.189 17.981 ( -2.169 0.458 4.692) 5.189 20.250 ( 16.803 -0.918 -0.045) 16.828 20.250 ( 16.803 0.918 -0.045) 16.828 21.786 ( -7.644 -0.612 -0.082) 7.669 21.786 ( -7.644 0.612 -0.082) 7.669 27.450 ( 1.216 -1.477 0.403) 1.955 27.450 ( 1.216 1.477 0.403) 1.955 27.629 ( -1.824 -0.430 0.087) 1.876 27.629 ( -1.824 0.430 0.087) 1.876 38.050 ( 9.682 -2.734 3.227) 10.565 38.050 ( 9.682 2.734 3.227) 10.565 38.248 ( 5.476 -3.509 3.881) 7.574 38.248 ( 5.476 3.509 3.881) 7.574 38.685 ( -4.160 -10.104 -13.311) 17.221 38.685 ( -4.160 10.104 -13.311) 17.221 40.256 ( -21.364 -3.166 6.395) 22.524 40.256 ( -21.364 3.166 6.395) 22.524 ======================= Grid point 249 (89/120) ======================= q-point: ( 0.33 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.515 ( 0.374 -4.539 -5.019) 6.777 2.515 ( 0.374 4.539 -5.019) 6.777 2.775 ( -2.159 -6.270 -11.367) 13.160 2.775 ( -2.159 6.270 -11.367) 13.160 3.321 ( 0.966 -0.703 -5.381) 5.512 3.321 ( 0.966 0.703 -5.381) 5.512 3.613 ( -8.707 -7.653 -2.881) 11.945 3.613 ( -8.707 7.653 -2.881) 11.945 4.363 ( 12.011 -4.778 1.643) 13.031 4.363 ( 12.011 4.778 1.643) 13.031 4.813 ( -1.596 -2.797 5.569) 6.433 4.813 ( -1.596 2.797 5.569) 6.433 5.927 ( 7.841 -9.518 -0.906) 12.365 5.927 ( 7.841 9.518 -0.906) 12.365 6.005 ( 6.296 -11.240 -5.840) 14.145 6.005 ( 6.296 11.240 -5.840) 14.145 6.504 ( 1.575 -9.043 4.860) 10.386 6.504 ( 1.575 9.043 4.860) 10.386 6.697 ( -2.282 -4.143 6.814) 8.295 6.697 ( -2.282 4.143 6.814) 8.295 7.035 ( 14.642 -6.556 0.550) 16.052 7.035 ( 14.642 6.556 0.550) 16.052 7.883 ( 3.477 -4.095 -2.702) 6.013 7.883 ( 3.477 4.095 -2.702) 6.013 8.219 ( -8.069 -3.967 0.906) 9.037 8.219 ( -8.069 3.967 0.906) 9.037 8.631 ( -7.033 -4.126 3.318) 8.803 8.631 ( -7.033 4.126 3.318) 8.803 9.003 ( 2.798 -1.561 -0.336) 3.222 9.003 ( 2.798 1.561 -0.336) 3.222 9.250 ( -4.970 -2.664 2.864) 6.325 9.250 ( -4.970 2.664 2.864) 6.325 10.174 ( -1.221 -3.994 0.828) 4.258 10.174 ( -1.221 3.994 0.828) 4.258 10.346 ( -6.323 -2.752 -3.318) 7.653 10.346 ( -6.323 2.752 -3.318) 7.653 17.025 ( 3.709 -3.122 -4.720) 6.766 17.025 ( 3.709 3.122 -4.720) 6.766 17.281 ( -4.392 -1.296 -1.715) 4.889 17.281 ( -4.392 1.296 -1.715) 4.889 17.790 ( 2.849 -1.319 1.285) 3.393 17.790 ( 2.849 1.319 1.285) 3.393 17.938 ( -2.262 -1.019 3.656) 4.418 17.938 ( -2.262 1.019 3.656) 4.418 20.609 ( 19.534 -1.309 -0.128) 19.578 20.609 ( 19.534 1.309 -0.128) 19.578 21.597 ( -11.862 -0.810 -0.127) 11.890 21.597 ( -11.862 0.810 -0.127) 11.890 27.477 ( 1.616 -1.241 0.350) 2.068 27.477 ( 1.616 1.241 0.350) 2.068 27.591 ( -2.095 -0.487 0.160) 2.157 27.591 ( -2.095 0.487 0.160) 2.157 38.225 ( 7.350 -3.779 1.953) 8.493 38.225 ( 7.350 3.779 1.953) 8.493 38.431 ( 13.280 -1.467 2.436) 13.581 38.431 ( 13.280 1.467 2.436) 13.581 38.598 ( -3.787 -8.644 -9.587) 13.452 38.598 ( -3.787 8.644 -9.587) 13.452 39.790 ( -25.745 -1.258 5.685) 26.395 39.790 ( -25.745 1.258 5.685) 26.395 ======================= Grid point 251 (90/120) ======================= q-point: ( 0.44 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( 5.394 -1.381 -6.628) 8.656 2.574 ( 5.394 1.381 -6.628) 8.656 2.694 ( -5.968 -3.419 -8.672) 11.068 2.694 ( -5.968 3.419 -8.672) 11.068 3.361 ( 3.443 -2.941 -6.385) 7.827 3.361 ( 3.443 2.941 -6.385) 7.827 3.459 ( -6.621 -6.276 -6.929) 11.457 3.459 ( -6.621 6.276 -6.929) 11.457 4.582 ( 10.060 -2.754 4.873) 11.512 4.582 ( 10.060 2.754 4.873) 11.512 4.740 ( -6.007 -2.333 5.957) 8.776 4.740 ( -6.007 2.333 5.957) 8.776 6.044 ( 3.920 -8.141 -2.138) 9.285 6.044 ( 3.920 8.141 -2.138) 9.285 6.074 ( 0.872 -8.923 -4.125) 9.869 6.074 ( 0.872 8.923 -4.125) 9.869 6.555 ( 3.604 -6.635 4.731) 8.910 6.555 ( 3.604 6.635 4.731) 8.910 6.633 ( -4.021 -4.407 5.437) 8.071 6.633 ( -4.021 4.407 5.437) 8.071 7.377 ( 19.388 -6.148 -0.078) 20.339 7.377 ( 19.388 6.148 -0.078) 20.339 7.739 ( -16.348 -4.413 -0.312) 16.936 7.739 ( -16.348 4.413 -0.312) 16.936 8.250 ( 9.335 -5.894 0.823) 11.070 8.250 ( 9.335 5.894 0.823) 11.070 8.456 ( -10.555 -5.885 2.084) 12.263 8.456 ( -10.555 5.885 2.084) 12.263 9.071 ( 4.016 -0.689 0.645) 4.126 9.071 ( 4.016 0.689 0.645) 4.126 9.156 ( -4.672 -1.687 1.506) 5.190 9.156 ( -4.672 1.687 1.506) 5.190 10.177 ( 1.649 -2.165 -0.068) 2.722 10.177 ( 1.649 2.165 -0.068) 2.722 10.238 ( -4.544 -1.683 -1.603) 5.104 10.238 ( -4.544 1.683 -1.603) 5.104 17.104 ( 4.393 -2.312 -3.680) 6.179 17.104 ( 4.393 2.312 -3.680) 6.179 17.193 ( -4.638 -1.657 -2.648) 5.592 17.193 ( -4.638 1.657 -2.648) 5.592 17.844 ( 2.651 -1.376 1.952) 3.569 17.844 ( 2.651 1.376 1.952) 3.569 17.893 ( -2.384 -1.321 2.728) 3.856 17.893 ( -2.384 1.321 2.728) 3.856 20.986 ( 18.843 -1.319 -0.176) 18.890 20.986 ( 18.843 1.319 -0.176) 18.890 21.326 ( -15.893 -1.085 -0.168) 15.931 21.326 ( -15.893 1.085 -0.168) 15.931 27.512 ( 1.886 -0.975 0.290) 2.143 27.512 ( 1.886 0.975 0.290) 2.143 27.550 ( -2.061 -0.709 0.228) 2.192 27.550 ( -2.061 0.709 0.228) 2.192 38.350 ( 6.035 -5.563 -1.782) 8.399 38.350 ( 6.035 5.563 -1.782) 8.399 38.464 ( -5.548 -6.803 -5.508) 10.363 38.464 ( -5.548 6.803 -5.508) 10.363 38.820 ( 21.673 -1.056 3.257) 21.942 38.820 ( 21.673 1.056 3.257) 21.942 39.285 ( -25.624 -0.270 4.675) 26.048 39.285 ( -25.624 0.270 4.675) 26.048 ======================= Grid point 297 (91/120) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.788 ( 0.000 0.000 -30.845) 30.845 1.788 ( 0.000 0.000 30.845) 30.845 1.969 ( 0.000 0.000 -28.476) 28.476 1.969 ( 0.000 0.000 28.476) 28.476 3.269 ( 0.000 0.000 -36.355) 36.355 3.269 ( 0.000 0.000 36.355) 36.355 3.406 ( 0.000 0.000 -2.660) 2.660 3.406 ( 0.000 0.000 2.660) 2.660 3.811 ( 0.000 0.000 -16.031) 16.031 3.811 ( 0.000 0.000 16.031) 16.031 4.256 ( 0.000 0.000 -7.066) 7.066 4.256 ( 0.000 0.000 7.066) 7.066 4.999 ( 0.000 0.000 -18.817) 18.817 4.999 ( 0.000 0.000 18.817) 18.817 5.983 ( 0.000 0.000 -18.645) 18.645 5.983 ( 0.000 0.000 18.645) 18.645 6.127 ( 0.000 0.000 -0.682) 0.682 6.127 ( 0.000 0.000 0.682) 0.682 6.258 ( 0.000 0.000 -3.361) 3.361 6.258 ( 0.000 0.000 3.361) 3.361 6.797 ( 0.000 0.000 -14.533) 14.533 6.797 ( 0.000 0.000 14.533) 14.533 6.817 ( 0.000 0.000 -13.527) 13.527 6.817 ( 0.000 0.000 13.527) 13.527 7.041 ( 0.000 0.000 -20.220) 20.220 7.041 ( 0.000 0.000 20.220) 20.220 7.655 ( 0.000 0.000 -9.192) 9.192 7.655 ( 0.000 0.000 9.192) 9.192 9.169 ( 0.000 0.000 -12.625) 12.625 9.169 ( 0.000 0.000 12.625) 12.625 9.544 ( 0.000 0.000 -15.021) 15.021 9.544 ( 0.000 0.000 15.021) 15.021 10.481 ( 0.000 0.000 -3.275) 3.275 10.481 ( 0.000 0.000 3.275) 3.275 10.964 ( 0.000 0.000 -13.975) 13.975 10.964 ( 0.000 0.000 13.975) 13.975 16.762 ( 0.000 0.000 -4.144) 4.144 16.762 ( 0.000 0.000 4.144) 4.144 17.249 ( 0.000 0.000 -5.635) 5.635 17.249 ( 0.000 0.000 5.635) 5.635 17.723 ( 0.000 0.000 -13.890) 13.890 17.723 ( 0.000 0.000 13.890) 13.890 18.134 ( 0.000 0.000 -6.325) 6.325 18.134 ( 0.000 0.000 6.325) 6.325 19.883 ( 0.000 0.000 -0.390) 0.390 19.883 ( 0.000 0.000 0.390) 0.390 21.970 ( 0.000 0.000 -1.428) 1.428 21.970 ( 0.000 0.000 1.428) 1.428 27.861 ( 0.000 0.000 -3.906) 3.906 27.861 ( 0.000 0.000 3.906) 3.906 27.985 ( 0.000 0.000 -1.896) 1.896 27.985 ( 0.000 0.000 1.896) 1.896 37.339 ( 0.000 0.000 -5.487) 5.487 37.339 ( 0.000 0.000 5.487) 5.487 38.142 ( 0.000 0.000 -1.878) 1.878 38.142 ( 0.000 0.000 1.878) 1.878 38.528 ( 0.000 0.000 -3.801) 3.801 38.528 ( 0.000 0.000 3.801) 3.801 41.337 ( 0.000 0.000 -3.141) 3.141 41.337 ( 0.000 0.000 3.141) 3.141 ======================= Grid point 299 (92/120) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 5.044 0.000 -29.107) 29.541 1.837 ( 5.044 0.000 29.107) 29.541 1.930 ( -3.358 0.000 -27.624) 27.827 1.930 ( -3.358 0.000 27.624) 27.827 3.348 ( 6.469 0.000 -26.717) 27.489 3.348 ( 6.469 0.000 26.717) 27.489 3.351 ( -5.506 0.000 -3.125) 6.331 3.351 ( -5.506 0.000 3.125) 6.331 3.733 ( -5.942 0.000 -20.337) 21.188 3.733 ( -5.942 0.000 20.337) 21.188 4.293 ( 3.530 0.000 -6.600) 7.484 4.293 ( 3.530 0.000 6.600) 7.484 5.024 ( 1.951 0.000 -15.597) 15.718 5.024 ( 1.951 0.000 15.597) 15.718 6.011 ( 2.814 0.000 -16.923) 17.156 6.011 ( 2.814 0.000 16.923) 17.156 6.167 ( 3.865 0.000 -1.189) 4.044 6.167 ( 3.865 0.000 1.189) 4.044 6.344 ( 7.538 0.000 -8.347) 11.247 6.344 ( 7.538 0.000 8.347) 11.247 6.832 ( 2.533 0.000 -15.837) 16.038 6.832 ( 2.117 0.000 -14.964) 15.113 6.832 ( 1.978 0.000 14.792) 14.923 6.832 ( 2.677 0.000 16.008) 16.231 7.032 ( -0.333 0.000 -16.118) 16.121 7.032 ( -0.333 0.000 16.118) 16.121 7.736 ( 8.266 0.000 -7.044) 10.860 7.736 ( 8.266 0.000 7.044) 10.860 9.102 ( -6.901 0.000 -12.401) 14.192 9.102 ( -6.901 0.000 12.401) 14.192 9.508 ( -3.505 0.000 -14.550) 14.966 9.508 ( -3.505 0.000 14.550) 14.966 10.453 ( -2.820 0.000 -2.907) 4.050 10.453 ( -2.820 0.000 2.907) 4.050 10.876 ( -8.382 0.000 -11.445) 14.185 10.876 ( -8.382 0.000 11.445) 14.185 16.776 ( 1.384 0.000 -4.179) 4.402 16.776 ( 1.384 0.000 4.179) 4.402 17.234 ( -1.529 0.000 -5.576) 5.782 17.234 ( -1.529 0.000 5.576) 5.782 17.726 ( 0.280 0.000 -13.771) 13.773 17.726 ( 0.280 0.000 13.771) 13.773 18.082 ( -4.523 0.000 -7.565) 8.814 18.082 ( -4.523 0.000 7.565) 8.814 20.045 ( 15.188 0.000 -3.199) 15.521 20.045 ( 15.188 0.000 3.199) 15.521 21.937 ( -3.341 0.000 -1.577) 3.694 21.937 ( -3.341 0.000 1.577) 3.694 27.863 ( 0.244 0.000 -3.664) 3.672 27.863 ( 0.244 0.000 3.664) 3.672 27.973 ( -1.097 0.000 -1.540) 1.891 27.973 ( -1.097 0.000 1.540) 1.891 37.360 ( 2.182 0.000 -5.460) 5.880 37.360 ( 2.182 0.000 5.460) 5.880 38.116 ( -2.615 0.000 -2.223) 3.432 38.116 ( -2.615 0.000 2.223) 3.432 38.563 ( 3.582 0.000 -2.862) 4.585 38.563 ( 3.582 0.000 2.862) 4.585 41.107 ( -21.944 0.000 -3.925) 22.292 41.107 ( -21.944 0.000 3.925) 22.292 ======================= Grid point 301 (93/120) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( -0.056 0.000 -23.674) 23.674 1.884 ( -0.056 0.000 23.674) 23.674 1.977 ( 9.109 0.000 -24.602) 26.234 1.977 ( 9.109 0.000 24.602) 26.234 3.201 ( -9.659 0.000 -4.285) 10.566 3.201 ( -9.659 0.000 4.285) 10.566 3.310 ( -12.791 0.000 -8.098) 15.138 3.310 ( -12.791 0.000 8.098) 15.138 3.792 ( 14.037 0.000 -34.039) 36.820 3.792 ( 14.037 0.000 34.039) 36.820 4.378 ( 4.802 0.000 -5.365) 7.200 4.378 ( 4.802 0.000 5.365) 7.200 5.047 ( -0.259 0.000 -9.126) 9.130 5.047 ( -0.259 0.000 9.126) 9.130 6.087 ( 4.717 0.000 -13.219) 14.035 6.087 ( 4.717 0.000 13.219) 14.035 6.258 ( 5.095 0.000 -3.190) 6.011 6.258 ( 5.095 0.000 3.190) 6.011 6.498 ( 7.583 0.000 -13.653) 15.618 6.498 ( 7.583 0.000 13.653) 15.618 6.858 ( 1.016 0.000 -17.130) 17.160 6.858 ( 1.016 0.000 17.130) 17.160 6.867 ( -1.658 0.000 -26.761) 26.812 6.867 ( -1.658 0.000 26.761) 26.812 7.099 ( 9.349 0.000 -1.025) 9.405 7.099 ( 9.349 0.000 1.025) 9.405 7.961 ( 14.004 0.000 -8.230) 16.243 7.961 ( 14.004 0.000 8.230) 16.243 8.905 ( -13.151 0.000 -11.697) 17.600 8.905 ( -13.151 0.000 11.697) 17.600 9.418 ( -5.478 0.000 -13.244) 14.332 9.418 ( -5.478 0.000 13.244) 14.332 10.374 ( -5.139 0.000 -1.891) 5.476 10.374 ( -5.139 0.000 1.891) 5.476 10.680 ( -10.736 0.000 -6.839) 12.729 10.680 ( -10.736 0.000 6.839) 12.729 16.814 ( 2.576 0.000 -4.260) 4.978 16.814 ( 2.576 0.000 4.260) 4.978 17.192 ( -2.805 0.000 -5.392) 6.078 17.192 ( -2.805 0.000 5.392) 6.078 17.732 ( 0.364 0.000 -12.815) 12.820 17.732 ( 0.364 0.000 12.815) 12.820 17.994 ( -3.957 0.000 -8.169) 9.077 17.994 ( -3.957 0.000 8.169) 9.077 20.404 ( 20.363 0.000 -7.923) 21.850 20.404 ( 20.363 0.000 7.923) 21.850 21.840 ( -6.712 0.000 -2.121) 7.039 21.840 ( -6.712 0.000 2.121) 7.039 27.869 ( 0.273 0.000 -2.933) 2.946 27.869 ( 0.273 0.000 2.933) 2.946 27.949 ( -1.186 0.000 -0.740) 1.398 27.949 ( -1.186 0.000 0.740) 1.398 37.422 ( 4.132 0.000 -5.352) 6.762 37.422 ( 4.132 0.000 5.352) 6.762 38.043 ( -4.795 0.000 -2.943) 5.627 38.043 ( -4.795 0.000 2.943) 5.627 38.669 ( 7.461 0.000 -0.137) 7.462 38.669 ( 7.461 0.000 0.137) 7.462 40.580 ( -30.022 0.000 -12.989) 32.711 40.580 ( -30.022 0.000 12.989) 32.711 ======================= Grid point 303 (94/120) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( 8.495 0.000 -16.142) 18.241 1.963 ( 8.495 0.000 16.142) 18.241 2.181 ( 11.571 0.000 -18.745) 22.029 2.181 ( 11.571 0.000 18.745) 22.029 2.981 ( -19.269 0.000 -9.745) 21.593 2.981 ( -19.269 0.000 9.745) 21.593 2.988 ( -11.943 0.000 -5.992) 13.362 2.988 ( -11.943 0.000 5.992) 13.362 4.131 ( 18.553 0.000 -25.886) 31.848 4.131 ( 18.553 0.000 25.886) 31.848 4.464 ( 3.696 0.000 -3.532) 5.112 4.464 ( 3.696 0.000 3.532) 5.112 4.995 ( -5.236 0.000 -5.352) 7.487 4.995 ( -5.236 0.000 5.352) 7.487 6.176 ( 3.954 0.000 -7.187) 8.203 6.176 ( 3.954 0.000 7.187) 8.203 6.363 ( 5.992 0.000 -10.241) 11.865 6.363 ( 5.992 0.000 10.241) 11.865 6.631 ( 6.163 0.000 -16.462) 17.578 6.631 ( 6.163 0.000 16.462) 17.578 6.784 ( -6.046 0.000 -25.742) 26.442 6.784 ( -6.046 0.000 25.742) 26.442 6.861 ( -0.840 0.000 -18.373) 18.392 6.861 ( -0.840 0.000 18.373) 18.392 7.377 ( 18.094 0.000 -3.629) 18.454 7.377 ( 18.094 0.000 3.629) 18.454 8.232 ( 12.712 0.000 -9.904) 16.115 8.232 ( 12.712 0.000 9.904) 16.115 8.600 ( -18.044 0.000 -10.420) 20.836 8.600 ( -18.044 0.000 10.420) 20.836 9.311 ( -5.116 0.000 -10.688) 11.850 9.311 ( -5.116 0.000 10.688) 11.850 10.271 ( -4.745 0.000 -1.209) 4.896 10.271 ( -4.745 0.000 1.209) 4.896 10.490 ( -8.342 0.000 -3.542) 9.063 10.490 ( -8.342 0.000 3.542) 9.063 16.873 ( 3.351 0.000 -4.265) 5.424 16.873 ( 3.351 0.000 4.265) 5.424 17.129 ( -3.560 0.000 -5.000) 6.137 17.129 ( -3.560 0.000 5.000) 6.137 17.739 ( 0.249 0.000 -9.606) 9.609 17.739 ( 0.249 0.000 9.606) 9.609 17.936 ( -1.997 0.000 -6.315) 6.623 17.936 ( -1.997 0.000 6.315) 6.623 20.797 ( 19.523 0.000 -9.095) 21.538 20.797 ( 19.523 0.000 9.095) 21.538 21.677 ( -10.104 0.000 -3.318) 10.635 21.677 ( -10.104 0.000 3.318) 10.635 27.872 ( 0.067 0.000 -1.789) 1.790 27.872 ( 0.067 0.000 1.789) 1.790 27.932 ( -0.558 0.000 -0.268) 0.619 27.932 ( -0.558 0.000 0.268) 0.619 37.517 ( 5.521 0.000 -5.043) 7.478 37.517 ( 5.521 0.000 5.043) 7.478 37.936 ( -6.105 0.000 -3.590) 7.082 37.936 ( -6.105 0.000 3.590) 7.082 38.856 ( 11.817 0.000 -4.059) 12.495 38.856 ( 11.817 0.000 4.059) 12.495 40.009 ( -27.775 0.000 -16.281) 32.195 40.009 ( -27.775 0.000 16.281) 32.195 ======================= Grid point 305 (95/120) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( 14.170 0.000 -9.334) 16.968 2.198 ( 14.170 0.000 9.334) 16.968 2.405 ( 10.128 0.000 -11.014) 14.963 2.405 ( 10.128 0.000 11.014) 14.963 2.606 ( -17.754 0.000 -8.388) 19.636 2.606 ( -17.754 0.000 8.388) 19.636 2.760 ( -10.253 0.000 -6.683) 12.238 2.760 ( -10.253 0.000 6.683) 12.238 4.454 ( 12.752 0.000 -14.176) 19.067 4.454 ( 12.752 0.000 14.176) 19.067 4.514 ( 1.339 0.000 -1.238) 1.824 4.514 ( 1.339 0.000 1.238) 1.824 4.855 ( -7.811 0.000 -6.734) 10.314 4.855 ( -7.811 0.000 6.734) 10.314 6.227 ( 1.243 0.000 -1.697) 2.103 6.227 ( 1.243 0.000 1.697) 2.103 6.496 ( 7.484 0.000 -17.820) 19.328 6.496 ( 7.484 0.000 17.820) 19.328 6.649 ( -7.500 0.000 -22.327) 23.553 6.649 ( -7.500 0.000 22.327) 23.553 6.738 ( 4.700 0.000 -16.590) 17.243 6.738 ( 4.700 0.000 16.590) 17.243 6.824 ( -2.840 0.000 -17.181) 17.414 6.824 ( -2.840 0.000 17.181) 17.414 7.760 ( 19.892 0.000 -5.618) 20.670 7.760 ( 19.892 0.000 5.618) 20.670 8.224 ( -19.530 0.000 -8.026) 21.115 8.224 ( -19.530 0.000 8.026) 21.115 8.413 ( 5.097 0.000 -4.810) 7.008 8.413 ( 5.097 0.000 4.810) 7.008 9.236 ( -2.177 0.000 -4.654) 5.138 9.236 ( -2.177 0.000 4.654) 5.138 10.210 ( -1.448 0.000 -0.718) 1.617 10.210 ( -1.448 0.000 0.718) 1.617 10.370 ( -3.571 0.000 -1.343) 3.815 10.370 ( -3.571 0.000 1.343) 3.815 16.937 ( 2.731 0.000 -3.156) 4.173 16.937 ( 2.731 0.000 3.156) 4.173 17.062 ( -2.815 0.000 -3.410) 4.422 17.062 ( -2.815 0.000 3.410) 4.422 17.742 ( 0.080 0.000 -3.607) 3.608 17.742 ( 0.080 0.000 3.607) 3.608 17.913 ( -0.551 0.000 -2.380) 2.443 17.913 ( -0.551 0.000 2.380) 2.443 21.150 ( 16.563 0.000 -7.511) 18.187 21.150 ( 16.563 0.000 7.511) 18.187 21.449 ( -13.299 0.000 -5.201) 14.279 21.449 ( -13.299 0.000 5.201) 14.279 27.872 ( -0.027 0.000 -0.575) 0.576 27.872 ( -0.027 0.000 0.575) 0.576 27.926 ( -0.101 0.000 -0.201) 0.225 27.926 ( -0.101 0.000 0.201) 0.225 37.625 ( 4.811 0.000 -3.590) 6.003 37.625 ( 4.811 0.000 3.590) 6.003 37.820 ( -5.041 0.000 -3.107) 5.922 37.820 ( -5.041 0.000 3.107) 5.922 39.130 ( 16.309 0.000 -8.854) 18.557 39.130 ( 16.309 0.000 8.854) 18.557 39.523 ( -21.862 0.000 -13.662) 25.780 39.523 ( -21.862 0.000 13.662) 25.780 ======================= Grid point 315 (96/120) ======================= q-point: ( 0.00 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( 0.000 7.128 -16.736) 18.191 2.020 ( 0.000 7.128 16.736) 18.191 2.064 ( 0.000 19.353 -16.229) 25.257 2.064 ( 0.000 19.353 16.229) 25.257 3.249 ( 0.000 3.980 -20.273) 20.660 3.249 ( 0.000 3.980 20.273) 20.660 3.522 ( 0.000 7.049 -9.358) 11.716 3.522 ( 0.000 7.049 9.358) 11.716 3.760 ( 0.000 -4.001 -18.898) 19.317 3.760 ( 0.000 -4.001 18.898) 19.317 4.365 ( 0.000 9.724 -5.361) 11.104 4.365 ( 0.000 9.724 5.361) 11.104 4.934 ( 0.000 -6.335 -17.905) 18.993 4.934 ( 0.000 -6.335 17.905) 18.993 6.071 ( 0.000 1.680 -8.311) 8.479 6.071 ( 0.000 1.680 8.311) 8.479 6.165 ( 0.000 -0.351 -0.423) 0.550 6.165 ( 0.000 -0.351 0.423) 0.550 6.387 ( 0.000 23.347 -11.557) 26.051 6.387 ( 0.000 23.347 11.557) 26.051 6.726 ( 0.000 -1.013 -17.563) 17.592 6.726 ( 0.000 -1.013 17.563) 17.592 7.004 ( 0.000 11.148 -15.253) 18.892 7.004 ( 0.000 11.148 15.253) 18.892 7.278 ( 0.000 20.511 -13.148) 24.363 7.278 ( 0.000 20.511 13.148) 24.363 7.645 ( 0.000 0.762 -6.107) 6.155 7.645 ( 0.000 0.762 6.107) 6.155 9.150 ( 0.000 -2.085 -11.349) 11.539 9.150 ( 0.000 -2.085 11.349) 11.539 9.534 ( 0.000 -0.940 -14.578) 14.608 9.534 ( 0.000 -0.940 14.578) 14.608 10.397 ( 0.000 -8.323 -4.104) 9.280 10.397 ( 0.000 -8.323 4.104) 9.280 10.857 ( 0.000 -8.726 -11.706) 14.600 10.857 ( 0.000 -8.726 11.706) 14.600 16.912 ( 0.000 13.499 -4.816) 14.333 16.912 ( 0.000 13.499 4.816) 14.333 17.279 ( 0.000 2.856 -5.239) 5.967 17.279 ( 0.000 2.856 5.239) 5.967 17.658 ( 0.000 -6.417 -14.057) 15.453 17.658 ( 0.000 -6.417 14.057) 15.453 18.060 ( 0.000 -6.438 -6.346) 9.040 18.060 ( 0.000 -6.438 6.346) 9.040 19.883 ( 0.000 0.007 -0.373) 0.373 19.883 ( 0.000 0.007 0.373) 0.373 21.966 ( 0.000 -0.357 -1.355) 1.401 21.966 ( 0.000 -0.357 1.355) 1.401 27.819 ( 0.000 -4.075 -3.845) 5.602 27.819 ( 0.000 -4.075 3.845) 5.602 27.956 ( 0.000 -2.875 -1.808) 3.396 27.956 ( 0.000 -2.875 1.808) 3.396 37.393 ( 0.000 5.325 -5.573) 7.708 37.393 ( 0.000 5.325 5.573) 7.708 38.178 ( 0.000 2.402 -0.112) 2.404 38.178 ( 0.000 2.402 0.112) 2.404 38.574 ( 0.000 4.657 -5.931) 7.541 38.574 ( 0.000 4.657 5.931) 7.541 41.224 ( 0.000 -10.257 -3.024) 10.694 41.224 ( 0.000 -10.257 3.024) 10.694 ======================= Grid point 317 (97/120) ======================= q-point: ( 0.11 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( -3.275 5.714 -25.317) 26.159 1.973 ( -3.275 5.714 25.317) 26.159 2.121 ( 4.801 21.073 -24.372) 32.575 2.121 ( 4.801 21.073 24.372) 32.575 3.263 ( -1.187 0.832 -8.786) 8.905 3.263 ( -1.187 0.832 8.786) 8.905 3.508 ( -0.261 6.753 -10.513) 12.497 3.508 ( -0.261 6.753 10.513) 12.497 3.726 ( -2.031 0.480 -23.812) 23.903 3.726 ( -2.031 0.480 23.812) 23.903 4.391 ( 2.732 9.013 -5.310) 10.812 4.391 ( 2.732 9.013 5.310) 10.812 4.960 ( 2.348 -5.954 -14.801) 16.125 4.960 ( 2.348 -5.954 14.801) 16.125 6.107 ( 3.444 3.053 -7.749) 9.012 6.107 ( 3.444 3.053 7.749) 9.012 6.244 ( 7.298 1.841 -2.456) 7.918 6.244 ( 7.298 1.841 2.456) 7.918 6.430 ( 4.336 19.699 -10.653) 22.811 6.430 ( 4.336 19.699 10.653) 22.811 6.731 ( 0.767 -1.846 -15.769) 15.895 6.731 ( 0.767 -1.846 15.769) 15.895 7.008 ( 0.404 9.737 -13.811) 16.903 7.008 ( 0.404 9.737 13.811) 16.903 7.265 ( -1.029 19.568 -10.961) 22.452 7.265 ( -1.029 19.568 10.961) 22.452 7.737 ( 9.170 1.748 -5.684) 10.930 7.737 ( 9.170 1.748 5.684) 10.930 9.083 ( -6.832 -2.022 -11.024) 13.126 9.083 ( -6.832 -2.022 11.024) 13.126 9.499 ( -3.504 -0.919 -13.995) 14.457 9.499 ( -3.504 -0.919 13.995) 14.457 10.366 ( -3.175 -8.610 -3.652) 9.876 10.366 ( -3.175 -8.610 3.652) 9.876 10.786 ( -6.752 -7.286 -9.779) 13.939 10.786 ( -6.752 -7.286 9.779) 13.939 16.915 ( 0.373 12.586 -4.572) 13.396 16.915 ( 0.373 12.586 4.572) 13.396 17.265 ( -1.436 2.917 -5.181) 6.117 17.265 ( -1.436 2.917 5.181) 6.117 17.663 ( 0.578 -6.043 -13.800) 15.076 17.663 ( 0.578 -6.043 13.800) 15.076 18.020 ( -3.516 -5.447 -7.165) 9.663 18.020 ( -3.516 -5.447 7.165) 9.663 20.034 ( 14.322 -0.962 -2.572) 14.582 20.034 ( 14.322 -0.962 2.572) 14.582 21.933 ( -3.384 -0.395 -1.493) 3.720 21.933 ( -3.384 -0.395 1.493) 3.720 27.822 ( 0.303 -4.028 -3.636) 5.435 27.822 ( 0.303 -4.028 3.636) 5.435 27.944 ( -1.149 -2.901 -1.497) 3.461 27.944 ( -1.149 -2.901 1.497) 3.461 37.417 ( 2.418 5.557 -5.516) 8.195 37.417 ( 2.418 5.557 5.516) 8.195 38.165 ( -1.434 3.630 -0.789) 3.982 38.165 ( -1.434 3.630 0.789) 3.982 38.594 ( 2.278 3.347 -4.822) 6.296 38.594 ( 2.278 3.347 4.822) 6.296 41.013 ( -20.385 -8.658 -3.040) 22.355 41.013 ( -20.385 -8.658 3.040) 22.355 ======================= Grid point 319 (98/120) ======================= q-point: ( 0.22 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( -0.108 4.845 -22.047) 22.573 1.930 ( -0.108 4.845 22.047) 22.573 2.246 ( 8.048 21.625 -21.157) 31.306 2.246 ( 8.048 21.625 21.157) 31.306 3.134 ( -11.170 -2.627 -4.749) 12.418 3.134 ( -11.170 -2.627 4.749) 12.418 3.433 ( -9.315 7.757 -2.673) 12.413 3.433 ( -9.315 7.757 2.673) 12.413 3.826 ( 12.958 4.458 -31.481) 34.334 3.826 ( 12.958 4.458 31.481) 34.334 4.463 ( 4.219 7.528 -5.304) 10.130 4.463 ( 4.219 7.528 5.304) 10.130 5.002 ( 1.354 -3.783 -8.827) 9.699 5.002 ( 1.354 -3.783 8.827) 9.699 6.194 ( 5.276 4.489 -6.791) 9.701 6.194 ( 5.276 4.489 6.791) 9.701 6.389 ( 6.440 10.404 -5.737) 13.514 6.389 ( 6.440 10.404 5.737) 13.514 6.546 ( 6.907 11.390 -11.666) 17.707 6.546 ( 6.907 11.390 11.666) 17.707 6.764 ( 2.621 -3.827 -12.643) 13.467 6.764 ( 2.621 -3.827 12.643) 13.467 7.011 ( -0.535 9.252 -15.838) 18.350 7.011 ( -0.535 9.252 15.838) 18.350 7.265 ( 2.382 15.059 -4.361) 15.857 7.265 ( 2.382 15.059 4.361) 15.857 7.972 ( 13.959 2.077 -8.343) 16.394 7.972 ( 13.959 2.077 8.343) 16.394 8.892 ( -12.623 -1.503 -10.072) 16.218 8.892 ( -12.623 -1.503 10.072) 16.218 9.406 ( -5.689 -1.092 -12.623) 13.889 9.406 ( -5.689 -1.092 12.623) 13.889 10.281 ( -5.136 -8.739 -2.592) 10.463 10.281 ( -5.136 -8.739 2.592) 10.463 10.624 ( -9.200 -4.662 -6.214) 12.041 10.624 ( -9.200 -4.662 6.214) 12.041 16.929 ( 1.147 10.386 -4.183) 11.255 16.929 ( 1.147 10.386 4.183) 11.255 17.225 ( -2.548 3.209 -5.013) 6.475 17.225 ( -2.548 3.209 5.013) 6.475 17.679 ( 0.973 -4.997 -12.638) 13.624 17.679 ( 0.973 -4.997 12.638) 13.624 17.950 ( -3.289 -4.024 -7.580) 9.191 17.950 ( -3.289 -4.024 7.580) 9.191 20.380 ( 19.961 -2.207 -6.676) 21.163 20.380 ( 19.961 -2.207 6.676) 21.163 21.834 ( -6.827 -0.536 -1.987) 7.131 21.834 ( -6.827 -0.536 1.987) 7.131 27.829 ( 0.425 -3.858 -3.018) 4.917 27.829 ( 0.425 -3.858 3.018) 4.917 27.917 ( -1.368 -3.074 -0.795) 3.457 27.917 ( -1.368 -3.074 0.795) 3.457 37.485 ( 4.534 6.180 -5.311) 9.325 37.485 ( 4.534 6.180 5.311) 9.325 38.117 ( -3.637 6.233 -1.725) 7.419 38.117 ( -3.637 6.233 1.725) 7.419 38.673 ( 6.066 0.515 -1.531) 6.278 38.673 ( 6.066 0.515 1.531) 6.278 40.515 ( -28.747 -5.957 -10.955) 31.335 40.515 ( -28.747 -5.957 10.955) 31.335 ======================= Grid point 321 (99/120) ======================= q-point: ( 0.33 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 7.045 3.671 -14.916) 16.899 1.996 ( 7.045 3.671 14.916) 16.899 2.431 ( 10.828 20.355 -16.259) 28.213 2.431 ( 10.828 20.355 16.259) 28.213 2.870 ( -15.259 -3.254 -6.343) 16.842 2.870 ( -15.259 -3.254 6.343) 16.842 3.202 ( -13.392 12.635 -4.179) 18.880 3.202 ( -13.392 12.635 4.179) 18.880 4.126 ( 16.092 1.024 -22.797) 27.923 4.126 ( 16.092 1.024 22.797) 27.923 4.535 ( 2.767 5.390 -5.070) 7.900 4.535 ( 2.767 5.390 5.070) 7.900 4.997 ( -1.965 1.259 -4.268) 4.864 4.997 ( -1.965 1.259 4.268) 4.864 6.294 ( 4.424 5.085 -4.715) 8.225 6.294 ( 4.424 5.085 4.715) 8.225 6.494 ( 4.941 12.825 -9.239) 16.561 6.494 ( 4.941 12.825 9.239) 16.561 6.664 ( 4.948 8.372 -13.915) 16.976 6.664 ( 4.948 8.372 13.915) 16.976 6.810 ( 1.277 -1.276 -12.152) 12.285 6.810 ( 1.277 -1.276 12.152) 12.285 6.970 ( -3.746 13.288 -18.369) 22.978 6.970 ( -3.746 13.288 18.369) 22.978 7.416 ( 13.549 4.563 -2.761) 14.560 7.416 ( 13.549 4.563 2.761) 14.560 8.223 ( 9.544 -0.285 -6.892) 11.776 8.223 ( 9.544 -0.285 6.892) 11.776 8.615 ( -14.424 1.217 -6.901) 16.036 8.615 ( -14.424 1.217 6.901) 16.036 9.293 ( -5.548 -1.706 -10.349) 11.865 9.293 ( -5.548 -1.706 10.349) 11.865 10.187 ( -4.029 -7.746 -1.733) 8.901 10.187 ( -4.029 -7.746 1.733) 8.901 10.452 ( -8.028 -3.430 -3.616) 9.450 10.452 ( -8.028 -3.430 3.616) 9.450 16.960 ( 1.997 7.881 -3.906) 9.019 16.960 ( 1.997 7.881 3.906) 9.019 17.170 ( -3.058 3.906 -4.604) 6.768 17.170 ( -3.058 3.906 4.604) 6.768 17.699 ( 0.971 -3.590 -9.648) 10.340 17.699 ( 0.971 -3.590 9.648) 10.340 17.899 ( -1.906 -3.492 -6.235) 7.396 17.899 ( -1.906 -3.492 6.235) 7.396 20.771 ( 19.673 -2.438 -7.927) 21.350 20.771 ( 19.673 -2.438 7.927) 21.350 21.668 ( -10.329 -0.845 -3.061) 10.806 21.668 ( -10.329 -0.845 3.061) 10.806 27.837 ( 0.288 -3.512 -2.010) 4.057 27.837 ( 0.288 -3.512 2.010) 4.057 27.895 ( -0.831 -3.490 -0.136) 3.590 27.895 ( -0.831 -3.490 0.136) 3.590 37.588 ( 5.900 6.923 -4.820) 10.294 37.588 ( 5.900 6.923 4.820) 10.294 38.026 ( -5.480 8.300 -2.630) 10.288 38.026 ( -5.480 8.300 2.630) 10.288 38.837 ( 10.945 -1.835 -3.211) 11.553 38.837 ( 10.945 -1.835 3.211) 11.553 39.960 ( -27.290 -4.459 -14.436) 31.193 39.960 ( -27.290 -4.459 14.436) 31.193 ======================= Grid point 323 (100/120) ======================= q-point: ( 0.44 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( 10.838 1.040 -7.309) 13.114 2.185 ( 10.838 1.040 7.309) 13.114 2.562 ( -11.865 0.721 -3.635) 12.430 2.562 ( -11.865 0.721 3.635) 12.430 2.672 ( 10.931 17.387 -9.374) 22.576 2.672 ( 10.931 17.387 9.374) 22.576 2.935 ( -13.647 14.764 -6.663) 21.181 2.935 ( -13.647 14.764 6.663) 21.181 4.401 ( 10.979 -2.386 -12.752) 16.996 4.401 ( 10.979 -2.386 12.752) 16.996 4.548 ( -2.098 1.204 -5.365) 5.885 4.548 ( -2.098 1.204 5.365) 5.885 4.943 ( -2.560 8.803 -2.418) 9.481 4.943 ( -2.560 8.803 2.418) 9.481 6.351 ( 1.375 5.684 -1.530) 6.045 6.351 ( 1.375 5.684 1.530) 6.045 6.587 ( 3.892 8.628 -8.400) 12.655 6.587 ( 3.892 8.628 8.400) 12.655 6.729 ( 1.077 7.787 -11.542) 13.965 6.729 ( 1.077 7.787 11.542) 13.965 6.822 ( 1.413 6.537 -10.777) 12.684 6.822 ( 1.413 6.537 10.777) 12.684 6.885 ( -4.361 12.547 -12.685) 18.367 6.885 ( -4.361 12.547 12.685) 18.367 7.750 ( 19.117 -0.734 -6.064) 20.069 7.750 ( 19.117 -0.734 6.064) 20.069 8.145 ( -16.587 -5.094 -7.123) 18.757 8.145 ( -16.587 -5.094 7.123) 18.757 8.508 ( 2.282 6.973 -4.087) 8.398 8.508 ( 2.282 6.973 4.087) 8.398 9.210 ( -2.482 -2.518 -4.687) 5.871 9.210 ( -2.482 -2.518 4.687) 5.871 10.138 ( -0.998 -6.537 -0.848) 6.667 10.138 ( -0.998 -6.537 0.848) 6.667 10.332 ( -3.698 -3.511 -1.468) 5.306 10.332 ( -3.698 -3.511 1.468) 5.306 17.000 ( 1.710 5.667 -2.584) 6.459 17.000 ( 1.710 5.667 2.584) 6.459 17.115 ( -2.095 5.103 -2.849) 6.209 17.115 ( -2.095 5.103 2.849) 6.209 17.713 ( 0.427 -2.466 -3.826) 4.571 17.713 ( 0.427 -2.466 3.826) 4.571 17.875 ( -0.624 -3.618 -2.596) 4.496 17.875 ( -0.624 -3.618 2.596) 4.496 21.129 ( 16.956 -1.946 -6.719) 18.342 21.129 ( 16.956 -1.946 6.719) 18.342 21.434 ( -13.667 -1.376 -4.739) 14.531 21.434 ( -13.667 -1.376 4.739) 14.531 27.840 ( 0.070 -3.146 -0.701) 3.224 27.840 ( 0.070 -3.146 0.701) 3.224 27.886 ( -0.222 -3.927 -0.080) 3.934 27.886 ( -0.222 -3.927 0.080) 3.934 37.700 ( 4.692 7.156 -3.102) 9.102 37.700 ( 4.692 7.156 3.102) 9.102 37.920 ( -4.583 9.546 -2.368) 10.851 37.920 ( -4.583 9.546 2.368) 10.851 39.101 ( 16.226 -2.961 -8.295) 18.462 39.101 ( 16.226 -2.961 8.295) 18.462 39.479 ( -21.981 -4.103 -12.689) 25.710 39.479 ( -21.981 -4.103 12.689) 25.710 ======================= Grid point 333 (101/120) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( 0.000 9.000 -17.428) 19.615 2.172 ( 0.000 9.000 17.428) 19.615 2.393 ( 0.000 11.695 -16.310) 20.070 2.393 ( 0.000 11.695 16.310) 20.070 3.422 ( 0.000 4.842 -7.466) 8.898 3.422 ( 0.000 4.842 7.466) 8.898 3.632 ( 0.000 3.020 -4.349) 5.294 3.632 ( 0.000 3.020 4.349) 5.294 3.776 ( 0.000 13.407 -28.335) 31.347 3.776 ( 0.000 13.407 28.335) 31.347 4.577 ( 0.000 8.034 -6.358) 10.245 4.577 ( 0.000 8.034 6.358) 10.245 4.786 ( 0.000 -4.893 -12.701) 13.611 4.786 ( 0.000 -4.893 12.701) 13.611 5.998 ( 0.000 -6.124 -5.273) 8.081 5.998 ( 0.000 -6.124 5.273) 8.081 6.211 ( 0.000 4.133 -1.673) 4.459 6.211 ( 0.000 4.133 1.673) 4.459 6.737 ( 0.000 2.387 -16.935) 17.102 6.737 ( 0.000 2.387 16.935) 17.102 7.016 ( 0.000 29.046 -11.817) 31.358 7.016 ( 0.000 29.046 11.817) 31.358 7.287 ( 0.000 22.634 -12.017) 25.626 7.287 ( 0.000 22.634 12.017) 25.626 7.423 ( 0.000 -6.033 -10.590) 12.188 7.423 ( 0.000 -6.033 10.590) 12.188 7.974 ( 0.000 29.098 -2.586) 29.213 7.974 ( 0.000 29.098 2.586) 29.213 9.072 ( 0.000 -6.173 -8.799) 10.748 9.072 ( 0.000 -6.173 8.799) 10.748 9.510 ( 0.000 -1.304 -12.880) 12.946 9.510 ( 0.000 -1.304 12.880) 12.946 10.203 ( 0.000 -8.657 -6.401) 10.766 10.203 ( 0.000 -8.657 6.401) 10.766 10.697 ( 0.000 -6.662 -8.495) 10.796 10.697 ( 0.000 -6.662 8.495) 10.796 17.173 ( 0.000 7.134 -0.763) 7.175 17.173 ( 0.000 7.134 0.763) 7.175 17.353 ( 0.000 4.325 -4.020) 5.905 17.353 ( 0.000 4.325 4.020) 5.905 17.526 ( 0.000 -2.334 -9.799) 10.073 17.526 ( 0.000 -2.334 9.799) 10.073 17.929 ( 0.000 -5.829 -5.340) 7.905 17.929 ( 0.000 -5.829 5.340) 7.905 19.884 ( 0.000 0.007 -0.322) 0.322 19.884 ( 0.000 0.007 0.322) 0.322 21.957 ( 0.000 -0.577 -1.158) 1.293 21.957 ( 0.000 -0.577 1.158) 1.293 27.710 ( 0.000 -6.517 -3.574) 7.433 27.710 ( 0.000 -6.517 3.574) 7.433 27.878 ( 0.000 -4.705 -1.555) 4.955 27.878 ( 0.000 -4.705 1.555) 4.955 37.535 ( 0.000 8.502 -5.613) 10.188 37.535 ( 0.000 8.502 5.613) 10.188 38.201 ( 0.000 -0.040 -2.547) 2.547 38.201 ( 0.000 -0.040 2.547) 2.547 38.684 ( 0.000 4.848 -10.684) 11.733 38.684 ( 0.000 4.848 10.684) 11.733 40.997 ( 0.000 -10.956 -4.628) 11.893 40.997 ( 0.000 -10.956 4.628) 11.893 ======================= Grid point 335 (102/120) ======================= q-point: ( 0.11 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( -3.901 8.967 -20.952) 23.121 2.120 ( -3.901 8.967 20.952) 23.121 2.467 ( 6.175 11.804 -18.184) 22.542 2.467 ( 6.175 11.804 18.184) 22.542 3.345 ( -7.806 2.410 -6.792) 10.624 3.345 ( -7.806 2.410 6.792) 10.624 3.613 ( -1.183 4.575 -1.456) 4.944 3.613 ( -1.183 4.575 1.456) 4.944 3.848 ( 6.284 14.686 -27.220) 31.562 3.848 ( 6.284 14.686 27.220) 31.562 4.581 ( 0.401 5.981 -4.539) 7.520 4.581 ( 0.401 5.981 4.539) 7.520 4.838 ( 5.158 -2.356 -8.852) 10.513 4.838 ( 5.158 -2.356 8.852) 10.513 6.068 ( 6.341 -5.439 -5.918) 10.238 6.068 ( 6.341 -5.439 5.918) 10.238 6.277 ( 6.857 3.327 -3.039) 8.205 6.277 ( 6.857 3.327 3.039) 8.205 6.726 ( -0.811 2.605 -15.291) 15.532 6.726 ( -0.811 2.605 15.291) 15.532 7.013 ( -0.192 22.299 -8.282) 23.788 7.013 ( -0.192 22.299 8.282) 23.788 7.262 ( -1.402 23.098 -7.979) 24.478 7.262 ( -1.402 23.098 7.979) 24.478 7.490 ( 5.050 0.913 -8.694) 10.095 7.490 ( 5.050 0.913 8.694) 10.095 8.010 ( 3.952 25.982 -1.444) 26.321 8.010 ( 3.952 25.982 1.444) 26.321 9.009 ( -6.349 -5.752 -8.356) 11.968 9.009 ( -6.349 -5.752 8.356) 11.968 9.476 ( -3.513 -1.274 -12.166) 12.727 9.476 ( -3.513 -1.274 12.166) 12.727 10.170 ( -3.179 -8.536 -5.874) 10.839 10.170 ( -3.179 -8.536 5.874) 10.839 10.650 ( -4.683 -5.925 -7.466) 10.620 10.650 ( -4.683 -5.925 7.466) 10.620 17.159 ( -1.356 6.767 -1.473) 7.057 17.159 ( -1.356 6.767 1.473) 7.057 17.340 ( -1.257 4.537 -4.126) 6.260 17.340 ( -1.257 4.537 4.126) 6.260 17.544 ( 1.777 -2.039 -9.583) 9.957 17.544 ( 1.777 -2.039 9.583) 9.957 17.905 ( -2.127 -5.264 -5.815) 8.127 17.905 ( -2.127 -5.264 5.815) 8.127 20.013 ( 12.583 -1.009 -1.508) 12.713 20.013 ( 12.583 -1.009 1.508) 12.713 21.923 ( -3.488 -0.630 -1.268) 3.764 21.923 ( -3.488 -0.630 1.268) 3.764 27.714 ( 0.413 -6.464 -3.417) 7.323 27.714 ( 0.413 -6.464 3.417) 7.323 27.866 ( -1.193 -4.693 -1.329) 5.022 27.866 ( -1.193 -4.693 1.329) 5.022 37.566 ( 3.072 8.926 -5.526) 10.938 37.566 ( 3.072 8.926 5.526) 10.938 38.211 ( 0.933 0.733 -2.599) 2.857 38.211 ( 0.933 0.733 2.599) 2.857 38.680 ( -0.166 4.060 -9.632) 10.454 38.680 ( -0.166 4.060 9.632) 10.454 40.821 ( -17.253 -9.198 -1.953) 19.649 40.821 ( -17.253 -9.198 1.953) 19.649 ======================= Grid point 337 (103/120) ======================= q-point: ( 0.22 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( -0.926 8.418 -18.995) 20.797 2.065 ( -0.926 8.418 18.995) 20.797 2.602 ( 7.383 11.025 -16.057) 20.830 2.602 ( 7.383 11.025 16.057) 20.830 3.145 ( -12.058 3.200 -5.741) 13.733 3.145 ( -12.058 3.200 5.741) 13.733 3.562 ( -4.756 5.267 -2.739) 7.607 3.562 ( -4.756 5.267 2.739) 7.607 4.012 ( 10.426 14.560 -23.888) 29.855 4.012 ( 10.426 14.560 23.888) 29.855 4.593 ( 0.677 2.122 -3.216) 3.912 4.593 ( 0.677 2.122 3.216) 3.912 4.968 ( 7.517 3.610 -4.588) 9.518 4.968 ( 7.517 3.610 4.588) 9.518 6.199 ( 6.264 -3.357 -6.316) 9.508 6.199 ( 6.264 -3.357 6.316) 9.508 6.461 ( 10.923 1.764 -3.239) 11.529 6.461 ( 10.923 1.764 3.239) 11.529 6.722 ( 0.918 1.745 -12.549) 12.703 6.722 ( 0.918 1.745 12.549) 12.703 7.017 ( 0.923 12.690 -6.141) 14.128 7.017 ( 0.923 12.690 6.141) 14.128 7.252 ( 0.461 26.562 -7.915) 27.720 7.252 ( 0.461 26.562 7.915) 27.720 7.569 ( 2.715 11.101 -11.686) 16.345 7.569 ( 2.715 11.101 11.686) 16.345 8.134 ( 8.399 16.594 -6.010) 19.545 8.134 ( 8.399 16.594 6.010) 19.545 8.837 ( -10.900 -4.210 -6.764) 13.502 8.837 ( -10.900 -4.210 6.764) 13.502 9.380 ( -6.085 -1.334 -10.670) 12.355 9.380 ( -6.085 -1.334 10.670) 12.355 10.093 ( -4.234 -7.942 -4.535) 10.078 10.093 ( -4.234 -7.942 4.535) 10.078 10.528 ( -7.558 -4.666 -5.431) 10.411 10.528 ( -7.558 -4.666 5.431) 10.411 17.130 ( -1.366 5.873 -2.092) 6.383 17.130 ( -1.366 5.873 2.092) 6.383 17.309 ( -1.894 5.091 -4.043) 6.771 17.309 ( -1.894 5.091 4.043) 6.771 17.588 ( 2.587 -1.432 -9.095) 9.564 17.588 ( 2.587 -1.432 9.095) 9.564 17.859 ( -2.368 -4.374 -6.332) 8.052 17.859 ( -2.368 -4.374 6.332) 8.052 20.330 ( 18.931 -2.569 -4.271) 19.576 20.330 ( 18.931 -2.569 4.271) 19.576 21.820 ( -7.104 -0.831 -1.640) 7.338 21.820 ( -7.104 -0.831 1.640) 7.338 27.725 ( 0.692 -6.289 -2.971) 6.990 27.725 ( 0.692 -6.289 2.971) 6.990 27.837 ( -1.640 -4.778 -0.866) 5.126 27.837 ( -1.640 -4.778 0.866) 5.126 37.651 ( 5.534 9.974 -5.180) 12.528 37.651 ( 5.534 9.974 5.180) 12.528 38.228 ( 0.385 3.810 -2.057) 4.347 38.228 ( 0.385 3.810 2.057) 4.347 38.693 ( 2.059 1.110 -5.942) 6.386 38.693 ( 2.059 1.110 5.942) 6.386 40.384 ( -26.135 -6.112 -5.294) 27.357 40.384 ( -26.135 -6.112 5.294) 27.357 ======================= Grid point 339 (104/120) ======================= q-point: ( 0.33 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( 4.946 6.775 -13.140) 15.589 2.103 ( 4.946 6.775 13.140) 15.589 2.724 ( 1.920 3.280 -12.320) 12.893 2.724 ( 1.920 3.280 12.321) 12.893 2.923 ( -7.100 11.448 -5.761) 14.651 2.923 ( -7.100 11.448 5.761) 14.651 3.428 ( -8.610 8.847 -4.764) 13.233 3.428 ( -8.610 8.847 4.764) 13.233 4.228 ( 11.051 9.811 -17.379) 22.812 4.228 ( 11.051 9.811 17.379) 22.812 4.598 ( -0.466 0.015 -4.239) 4.265 4.598 ( -0.466 0.015 4.239) 4.265 5.103 ( 5.841 10.106 -2.346) 11.906 5.103 ( 5.841 10.106 2.346) 11.906 6.294 ( 3.338 -3.344 -5.140) 6.981 6.294 ( 3.338 -3.344 5.140) 6.981 6.637 ( 6.388 3.052 -7.387) 10.232 6.637 ( 6.388 3.052 7.387) 10.232 6.766 ( 2.627 0.008 -10.322) 10.651 6.766 ( 2.627 0.008 10.322) 10.651 7.067 ( 4.318 12.177 -7.003) 14.696 7.067 ( 4.318 12.177 7.003) 14.696 7.283 ( 2.758 25.196 -7.148) 26.335 7.283 ( 2.758 25.196 7.148) 26.335 7.617 ( 3.657 15.373 -10.135) 18.773 7.617 ( 3.657 15.373 10.135) 18.773 8.263 ( 0.877 5.374 -2.058) 5.820 8.263 ( 0.877 5.374 2.058) 5.820 8.639 ( -6.211 1.514 -1.879) 6.663 8.639 ( -6.211 1.514 1.879) 6.663 9.253 ( -6.564 -1.900 -9.037) 11.330 9.253 ( -6.564 -1.900 9.037) 11.330 10.024 ( -2.569 -6.929 -2.881) 7.931 10.024 ( -2.569 -6.929 2.881) 7.931 10.374 ( -7.798 -4.047 -3.610) 9.498 10.374 ( -7.798 -4.047 3.610) 9.498 17.111 ( -0.493 4.707 -2.049) 5.158 17.111 ( -0.493 4.707 2.049) 5.158 17.271 ( -1.894 5.849 -3.317) 6.986 17.271 ( -1.894 5.849 3.317) 6.986 17.639 ( 2.538 -0.687 -7.967) 8.390 17.639 ( 2.538 -0.687 7.967) 8.390 17.818 ( -1.906 -3.983 -6.132) 7.556 17.818 ( -1.906 -3.983 6.132) 7.556 20.713 ( 19.829 -3.113 -5.445) 20.797 20.713 ( 19.829 -3.113 5.445) 20.797 21.646 ( -10.857 -1.263 -2.420) 11.195 21.646 ( -10.857 -1.263 2.420) 11.195 27.740 ( 0.787 -5.939 -2.303) 6.418 27.740 ( 0.787 -5.939 2.303) 6.418 27.807 ( -1.406 -5.129 -0.661) 5.359 27.807 ( -1.406 -5.129 0.661) 5.359 37.771 ( 6.468 10.808 -4.317) 13.315 37.771 ( 6.468 10.808 4.317) 13.315 38.212 ( -2.078 9.092 -0.899) 9.370 38.212 ( -2.078 9.092 0.899) 9.370 38.786 ( 8.066 -3.299 -0.495) 8.728 38.786 ( 8.066 -3.299 0.495) 8.728 39.862 ( -26.521 -4.576 -9.087) 28.406 39.862 ( -26.521 -4.576 9.087) 28.406 ======================= Grid point 341 (105/120) ======================= q-point: ( 0.44 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 8.036 4.308 -6.327) 11.098 2.243 ( 8.036 4.308 6.327) 11.098 2.573 ( -10.389 1.109 -5.493) 11.804 2.573 ( -10.389 1.109 5.493) 11.804 2.988 ( 7.372 12.194 -7.095) 15.918 2.988 ( 7.372 12.194 7.095) 15.918 3.252 ( -8.290 14.100 -5.119) 17.139 3.252 ( -8.290 14.100 5.119) 17.139 4.411 ( 6.928 4.103 -9.765) 12.656 4.411 ( 6.928 4.103 9.765) 12.656 4.566 ( -2.654 1.204 -5.462) 6.190 4.566 ( -2.654 1.204 5.462) 6.190 5.182 ( 2.068 14.559 -0.782) 14.726 5.182 ( 2.068 14.559 0.782) 14.726 6.331 ( 0.768 -4.458 -2.037) 4.962 6.331 ( 0.768 -4.458 2.037) 4.962 6.729 ( 3.388 1.081 -9.594) 10.231 6.729 ( 3.388 1.081 9.594) 10.231 6.783 ( -0.793 2.088 -10.673) 10.904 6.783 ( -0.793 2.088 10.673) 10.904 7.140 ( 2.129 18.901 -3.109) 19.273 7.140 ( 2.129 18.901 3.109) 19.273 7.332 ( 1.352 26.883 -3.516) 27.146 7.332 ( 1.352 26.883 3.516) 27.146 7.777 ( 13.342 6.080 -7.772) 16.594 7.777 ( 13.342 6.080 7.772) 16.594 8.082 ( -15.728 -0.323 -7.854) 17.583 8.082 ( -15.728 -0.323 7.854) 17.583 8.654 ( 3.412 7.961 -4.949) 9.975 8.654 ( 3.412 7.961 4.949) 9.975 9.148 ( -3.489 -3.245 -4.724) 6.710 9.148 ( -3.489 -3.245 4.724) 6.710 9.998 ( -0.289 -6.194 -1.137) 6.304 9.998 ( -0.289 -6.194 1.137) 6.304 10.251 ( -3.890 -3.978 -1.526) 5.770 10.251 ( -3.890 -3.978 1.526) 5.770 17.108 ( 0.037 3.635 -0.979) 3.765 17.108 ( 0.037 3.635 0.979) 3.765 17.242 ( -0.889 6.641 -1.431) 6.851 17.242 ( -0.889 6.641 1.431) 6.851 17.680 ( 1.338 0.273 -4.195) 4.412 17.680 ( 1.338 0.273 4.195) 4.412 17.787 ( -1.015 -4.362 -3.533) 5.704 17.787 ( -1.015 -4.362 3.533) 5.704 21.081 ( 17.749 -2.673 -4.893) 18.604 21.081 ( 17.749 -2.673 4.893) 18.604 21.399 ( -14.484 -1.968 -3.612) 15.057 21.399 ( -14.484 -1.968 3.612) 15.057 27.754 ( 0.591 -5.289 -1.248) 5.466 27.754 ( 0.591 -5.289 1.248) 5.466 27.785 ( -0.786 -5.825 -0.654) 5.914 27.785 ( -0.786 -5.825 0.654) 5.914 37.880 ( 3.842 10.141 -2.145) 11.054 37.880 ( 3.842 10.141 2.145) 11.054 38.161 ( -2.354 13.629 -0.946) 13.863 38.161 ( -2.354 13.629 0.946) 13.863 39.013 ( 15.220 -5.826 -6.005) 17.368 39.013 ( 15.220 -5.826 6.005) 17.368 39.386 ( -21.858 -4.470 -9.130) 24.106 39.386 ( -21.858 -4.470 9.130) 24.106 ======================= Grid point 351 (106/120) ======================= q-point: ( 0.00 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( 0.000 9.289 -4.377) 10.269 2.358 ( 0.000 9.289 4.377) 10.269 2.596 ( 0.000 10.186 -2.354) 10.455 2.596 ( 0.000 10.186 2.354) 10.455 3.359 ( 0.000 -7.000 -11.636) 13.579 3.359 ( 0.000 -7.000 11.636) 13.579 3.660 ( 0.000 0.443 -2.178) 2.223 3.660 ( 0.000 0.443 2.178) 2.223 4.168 ( 0.000 13.448 -14.046) 19.446 4.168 ( 0.000 13.448 14.046) 19.446 4.521 ( 0.000 -1.500 -13.712) 13.794 4.521 ( 0.000 -1.500 13.712) 13.794 4.951 ( 0.000 14.741 -1.163) 14.787 4.951 ( 0.000 14.741 1.163) 14.787 5.873 ( 0.000 -6.368 -2.465) 6.828 5.873 ( 0.000 -6.368 2.465) 6.828 6.309 ( 0.000 5.892 -6.036) 8.435 6.309 ( 0.000 5.892 6.036) 8.435 6.797 ( 0.000 3.409 -12.520) 12.975 6.797 ( 0.000 3.409 12.520) 12.975 7.208 ( 0.000 -11.477 -10.643) 15.652 7.208 ( 0.000 -11.477 10.643) 15.652 7.336 ( 0.000 6.865 -3.196) 7.573 7.336 ( 0.000 6.865 3.196) 7.573 7.973 ( 0.000 36.537 -7.707) 37.340 7.973 ( 0.000 36.537 7.707) 37.340 8.502 ( 0.000 21.634 -6.582) 22.613 8.502 ( 0.000 21.634 6.582) 22.613 8.914 ( 0.000 -8.749 -7.142) 11.294 8.914 ( 0.000 -8.749 7.142) 11.294 9.488 ( 0.000 -0.710 -9.908) 9.934 9.488 ( 0.000 -0.710 9.908) 9.934 10.135 ( 0.000 2.143 -7.890) 8.176 10.135 ( 0.000 2.143 7.890) 8.176 10.594 ( 0.000 -3.881 -6.400) 7.485 10.594 ( 0.000 -3.881 6.400) 7.485 17.084 ( 0.000 -10.112 -7.838) 12.794 17.084 ( 0.000 -10.112 7.838) 12.794 17.429 ( 0.000 2.753 -3.147) 4.181 17.429 ( 0.000 2.753 3.147) 4.181 17.632 ( 0.000 5.373 -1.638) 5.617 17.632 ( 0.000 5.373 1.638) 5.617 17.884 ( 0.000 3.537 -1.405) 3.806 17.884 ( 0.000 3.537 1.405) 3.806 19.884 ( 0.000 0.000 -0.239) 0.239 19.884 ( 0.000 0.000 0.239) 0.239 21.945 ( 0.000 -0.603 -0.853) 1.045 21.945 ( 0.000 -0.603 0.853) 1.045 27.577 ( 0.000 -6.460 -2.885) 7.075 27.577 ( 0.000 -6.460 2.885) 7.075 27.781 ( 0.000 -4.800 -1.147) 4.935 27.781 ( 0.000 -4.800 1.147) 4.935 37.707 ( 0.000 8.174 -5.012) 9.588 37.707 ( 0.000 8.174 5.012) 9.588 38.196 ( 0.000 0.172 -4.159) 4.162 38.196 ( 0.000 0.172 4.159) 4.162 38.716 ( 0.000 -1.918 -14.723) 14.847 38.716 ( 0.000 -1.918 14.723) 14.847 40.836 ( 0.000 -4.947 -6.744) 8.364 40.836 ( 0.000 -4.947 6.744) 8.364 ======================= Grid point 353 (107/120) ======================= q-point: ( 0.11 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -3.712 10.172 -14.230) 17.882 2.313 ( -3.712 10.172 14.230) 17.882 2.639 ( 3.628 6.990 -10.330) 12.990 2.639 ( 3.628 6.990 10.330) 12.990 3.305 ( -4.748 -4.507 -9.458) 11.503 3.305 ( -4.748 -4.507 9.458) 11.503 3.674 ( 0.590 1.957 -3.710) 4.236 3.674 ( 0.590 1.957 3.710) 4.236 4.215 ( 4.236 12.652 -14.422) 19.647 4.215 ( 4.236 12.652 14.422) 19.647 4.522 ( 0.370 -1.854 -11.460) 11.615 4.522 ( 0.370 -1.854 11.460) 11.615 5.010 ( 6.091 14.684 -0.535) 15.907 5.010 ( 6.091 14.684 0.535) 15.907 5.943 ( 6.675 -6.725 -3.199) 10.000 5.943 ( 6.675 -6.725 3.199) 10.000 6.364 ( 5.543 5.312 -5.821) 9.635 6.364 ( 5.543 5.312 5.821) 9.635 6.789 ( -0.670 3.497 -11.892) 12.413 6.789 ( -0.670 3.497 11.892) 12.413 7.100 ( -6.307 -6.545 -9.089) 12.854 7.100 ( -6.307 -6.545 9.089) 12.854 7.475 ( 9.392 1.720 -6.258) 11.417 7.475 ( 9.392 1.720 6.258) 11.417 7.974 ( 0.072 35.951 -7.462) 36.717 7.974 ( 0.072 35.951 7.462) 36.717 8.510 ( 0.740 20.994 -5.785) 21.789 8.510 ( 0.740 20.994 5.785) 21.789 8.864 ( -4.881 -7.743 -6.445) 11.195 8.864 ( -4.881 -7.743 6.445) 11.195 9.455 ( -3.360 -0.606 -9.163) 9.779 9.455 ( -3.360 -0.606 9.163) 9.779 10.105 ( -2.958 2.276 -7.684) 8.543 10.105 ( -2.958 2.276 7.684) 8.543 10.555 ( -3.873 -3.618 -5.848) 7.892 10.555 ( -3.873 -3.618 5.848) 7.892 17.085 ( 0.129 -9.200 -7.188) 11.675 17.085 ( 0.129 -9.200 7.188) 11.675 17.419 ( -1.051 2.450 -2.622) 3.739 17.419 ( -1.051 2.450 2.622) 3.739 17.640 ( 0.779 5.327 -1.707) 5.648 17.640 ( 0.779 5.327 1.707) 5.648 17.866 ( -1.663 3.544 -2.053) 4.420 17.866 ( -1.663 3.544 2.053) 4.420 19.996 ( 11.117 -0.661 -0.772) 11.163 19.996 ( 11.117 -0.661 0.772) 11.163 21.910 ( -3.598 -0.648 -0.929) 3.772 21.910 ( -3.598 -0.648 0.929) 3.772 27.583 ( 0.521 -6.410 -2.774) 7.004 27.583 ( 0.521 -6.410 2.774) 7.004 27.769 ( -1.158 -4.760 -1.001) 5.000 27.769 ( -1.158 -4.760 1.001) 5.000 37.747 ( 4.079 8.775 -5.019) 10.901 37.747 ( 4.079 8.775 5.019) 10.901 38.212 ( 1.681 0.072 -4.066) 4.400 38.212 ( 1.681 0.072 4.066) 4.400 38.706 ( -1.035 -2.006 -13.782) 13.966 38.706 ( -1.035 -2.006 13.782) 13.966 40.689 ( -14.562 -3.736 -4.976) 15.836 40.689 ( -14.562 -3.736 4.976) 15.836 ======================= Grid point 355 (108/120) ======================= q-point: ( 0.22 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( -2.247 9.639 -14.616) 17.652 2.248 ( -2.247 9.639 14.616) 17.652 2.708 ( 2.815 1.563 -11.343) 11.791 2.708 ( 2.815 1.563 11.343) 11.791 3.203 ( -5.219 1.943 -5.880) 8.099 3.203 ( -5.219 1.943 5.880) 8.099 3.648 ( -3.729 3.782 -5.666) 7.766 3.648 ( -3.729 3.782 5.666) 7.766 4.318 ( 6.371 9.188 -14.005) 17.921 4.318 ( 6.371 9.188 14.005) 17.921 4.546 ( 1.980 0.435 -6.522) 6.830 4.546 ( 1.980 0.435 6.522) 6.830 5.174 ( 10.087 14.648 -1.204) 17.826 5.174 ( 10.087 14.648 1.204) 17.826 6.092 ( 7.470 -6.627 -4.828) 11.092 6.092 ( 7.470 -6.627 4.828) 11.092 6.512 ( 8.978 3.211 -4.452) 10.523 6.512 ( 8.978 3.211 4.452) 10.523 6.779 ( -0.084 3.179 -10.347) 10.825 6.779 ( -0.084 3.179 10.347) 10.825 7.016 ( -1.581 -6.108 -9.869) 11.713 7.016 ( -1.581 -6.108 9.869) 11.713 7.646 ( 7.653 3.272 -6.736) 10.707 7.646 ( 7.653 3.272 6.736) 10.707 7.978 ( 0.445 32.902 -6.007) 33.449 7.978 ( 0.445 32.902 6.007) 33.449 8.514 ( -1.639 15.390 -6.573) 16.815 8.514 ( -1.639 15.390 6.573) 16.815 8.750 ( -5.231 -1.742 -3.106) 6.328 8.750 ( -5.231 -1.742 3.106) 6.328 9.363 ( -5.898 -0.205 -7.561) 9.592 9.363 ( -5.898 -0.205 7.561) 9.592 10.034 ( -3.899 2.426 -6.830) 8.230 10.034 ( -3.899 2.426 6.830) 8.230 10.450 ( -6.685 -2.923 -4.627) 8.639 10.450 ( -6.685 -2.923 4.627) 8.639 17.090 ( 0.439 -6.900 -5.528) 8.852 17.090 ( 0.439 -6.900 5.528) 8.852 17.388 ( -1.986 1.610 -1.735) 3.090 17.388 ( -1.986 1.610 1.735) 3.090 17.663 ( 1.531 5.060 -2.229) 5.737 17.663 ( 1.531 5.060 2.229) 5.737 17.830 ( -1.892 3.481 -3.172) 5.075 17.830 ( -1.892 3.481 3.172) 5.075 20.285 ( 17.804 -1.824 -2.301) 18.044 20.285 ( 17.804 -1.824 2.301) 18.044 21.804 ( -7.396 -0.816 -1.165) 7.532 21.804 ( -7.396 -0.816 1.165) 7.532 27.597 ( 0.928 -6.253 -2.465) 6.785 27.597 ( 0.928 -6.253 2.465) 6.785 27.740 ( -1.763 -4.743 -0.735) 5.114 27.740 ( -1.763 -4.743 0.735) 5.114 37.857 ( 6.838 10.256 -4.873) 13.255 37.857 ( 6.838 10.256 4.873) 13.255 38.264 ( 3.726 0.530 -3.347) 5.037 38.264 ( 3.726 0.530 3.347) 5.037 38.684 ( -0.865 -2.711 -10.655) 11.028 38.684 ( -0.865 -2.711 10.655) 11.028 40.306 ( -23.799 -1.473 -1.335) 23.882 40.306 ( -23.799 -1.473 1.335) 23.882 ======================= Grid point 357 (109/120) ======================= q-point: ( 0.33 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 2.602 7.547 -9.982) 12.782 2.249 ( 2.602 7.547 9.982) 12.782 2.715 ( -3.101 -1.781 -9.599) 10.243 2.715 ( -3.101 -1.781 9.599) 10.243 3.133 ( -0.960 7.755 -5.018) 9.287 3.133 ( -0.960 7.755 5.018) 9.287 3.540 ( -6.700 3.076 -7.170) 10.283 3.540 ( -6.700 3.076 7.170) 10.283 4.449 ( 6.457 6.605 -11.817) 14.999 4.449 ( 6.457 6.605 11.817) 14.999 4.587 ( 1.915 3.792 -3.355) 5.413 4.587 ( 1.915 3.792 3.355) 5.413 5.367 ( 8.903 15.324 -1.805) 17.814 5.367 ( 8.903 15.324 1.805) 17.814 6.200 ( 3.389 -5.595 -5.090) 8.289 6.200 ( 3.389 -5.595 5.090) 8.289 6.656 ( 4.396 -0.540 -5.027) 6.700 6.656 ( 4.396 -0.540 5.027) 6.700 6.791 ( 0.976 1.225 -8.259) 8.406 6.791 ( 0.976 1.225 8.259) 8.406 7.087 ( 9.834 -3.343 -11.260) 15.319 7.087 ( 9.834 -3.343 11.260) 15.319 7.749 ( 2.227 10.234 -5.278) 11.728 7.749 ( 2.227 10.234 5.278) 11.728 7.996 ( 1.601 24.324 -4.577) 24.803 7.996 ( 1.601 24.324 4.577) 24.803 8.384 ( -10.895 4.035 -8.878) 14.622 8.384 ( -10.895 4.035 8.878) 14.622 8.740 ( 3.775 10.037 -3.391) 11.247 8.740 ( 3.775 10.037 3.391) 11.247 9.235 ( -6.954 0.343 -6.357) 9.428 9.235 ( -6.954 0.343 6.357) 9.428 9.970 ( -2.403 2.218 -4.951) 5.933 9.970 ( -2.403 2.218 4.951) 5.933 10.311 ( -7.146 -1.905 -3.262) 8.083 10.311 ( -7.146 -1.905 3.262) 8.083 17.102 ( 0.773 -4.179 -3.415) 5.452 17.102 ( 0.773 -4.179 3.415) 5.452 17.346 ( -2.168 0.361 -1.118) 2.466 17.346 ( -2.168 0.361 1.118) 2.466 17.697 ( 1.877 4.483 -3.065) 5.746 17.697 ( 1.877 4.483 3.065) 5.746 17.796 ( -1.583 3.513 -3.883) 5.470 17.796 ( -1.583 3.513 3.883) 5.470 20.657 ( 19.747 -2.405 -3.121) 20.136 20.657 ( 19.747 -2.405 3.121) 20.136 21.621 ( -11.401 -1.174 -1.629) 11.576 21.621 ( -11.401 -1.174 1.629) 11.576 27.618 ( 1.190 -5.980 -2.026) 6.425 27.618 ( 1.190 -5.980 2.026) 6.425 27.704 ( -1.795 -4.904 -0.745) 5.275 27.704 ( -1.795 -4.904 0.745) 5.275 37.990 ( 6.077 10.672 -3.961) 12.904 37.990 ( 6.077 10.672 3.961) 12.904 38.352 ( 4.645 4.828 -0.789) 6.746 38.352 ( 4.645 4.828 0.789) 6.746 38.701 ( 4.011 -5.402 -4.017) 7.836 38.701 ( 4.011 -5.402 4.017) 7.836 39.810 ( -26.291 -0.411 -2.558) 26.419 39.810 ( -26.291 -0.411 2.558) 26.419 ======================= Grid point 359 (110/120) ======================= q-point: ( 0.44 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( 5.690 5.257 -4.442) 8.930 2.341 ( 5.690 5.257 4.442) 8.930 2.597 ( -6.946 0.949 -4.849) 8.524 2.597 ( -6.946 0.949 4.849) 8.524 3.164 ( 2.676 6.240 -4.055) 7.908 3.164 ( 2.676 6.240 4.055) 7.908 3.419 ( -4.572 3.126 -4.818) 7.341 3.419 ( -4.572 3.126 4.818) 7.341 4.543 ( 2.702 6.909 -6.141) 9.631 4.543 ( 2.702 6.909 6.141) 9.631 4.613 ( 0.687 4.385 -2.627) 5.158 4.613 ( 0.687 4.385 2.627) 5.158 5.493 ( 3.532 16.244 -0.997) 16.653 5.493 ( 3.532 16.244 0.997) 16.653 6.233 ( 0.468 -4.986 -2.301) 5.511 6.233 ( 0.468 -4.986 2.301) 5.511 6.693 ( 0.446 -3.073 -2.436) 3.947 6.693 ( 0.446 -3.073 2.436) 3.947 6.808 ( 0.642 -0.744 -3.285) 3.429 6.808 ( 0.642 -0.744 3.285) 3.429 7.336 ( 12.097 2.715 -8.297) 14.918 7.336 ( 12.097 2.715 8.297) 14.918 7.715 ( -4.947 8.062 -6.721) 11.604 7.715 ( -4.947 8.062 6.721) 11.604 8.048 ( 3.936 16.448 -9.080) 19.196 8.048 ( 3.936 16.448 9.080) 19.196 8.173 ( -9.076 10.066 -8.896) 16.213 8.173 ( -9.076 10.066 8.896) 16.213 8.836 ( 4.434 10.269 -3.946) 11.861 8.836 ( 4.434 10.269 3.946) 11.861 9.112 ( -4.812 0.240 -4.236) 6.416 9.112 ( -4.812 0.240 4.236) 6.416 9.944 ( -0.388 1.700 -1.960) 2.623 9.944 ( -0.388 1.700 1.960) 2.623 10.199 ( -3.505 -0.829 -1.390) 3.861 10.199 ( -3.505 -0.829 1.390) 3.861 17.116 ( 0.489 -2.108 -1.166) 2.458 17.116 ( 0.489 -2.108 1.166) 2.458 17.313 ( -1.036 -0.860 -0.426) 1.412 17.313 ( -1.036 -0.860 0.426) 1.412 17.732 ( 1.715 3.511 -3.604) 5.316 17.732 ( 1.715 3.511 3.604) 5.316 17.766 ( -1.492 4.109 -3.908) 5.863 17.766 ( -1.492 4.109 3.908) 5.863 21.031 ( 18.393 -2.222 -2.975) 18.764 21.031 ( 18.393 -2.222 2.975) 18.764 21.362 ( -15.261 -1.728 -2.314) 15.532 21.362 ( -15.261 -1.728 2.314) 15.532 27.643 ( 1.363 -5.580 -1.531) 5.945 27.643 ( 1.363 -5.580 1.531) 5.945 27.672 ( -1.571 -5.273 -1.075) 5.606 27.672 ( -1.571 -5.273 1.075) 5.606 38.073 ( 2.229 8.878 -1.659) 9.302 38.073 ( 2.229 8.878 1.659) 9.302 38.408 ( 1.053 9.821 -1.842) 10.048 38.408 ( 1.053 9.821 1.842) 10.048 38.884 ( 14.131 -6.169 -2.998) 15.707 38.884 ( 14.131 -6.169 2.998) 15.707 39.327 ( -21.785 -1.249 -3.866) 22.160 39.327 ( -21.785 -1.249 3.866) 22.160 ======================= Grid point 369 (111/120) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 0.000 7.497 -2.659) 7.954 2.528 ( 0.000 7.497 2.659) 7.954 2.795 ( 0.000 8.672 -5.653) 10.352 2.795 ( 0.000 8.672 5.653) 10.352 3.218 ( 0.000 -6.100 -7.433) 9.616 3.218 ( 0.000 -6.100 7.433) 9.616 3.659 ( 0.000 -0.318 -1.213) 1.254 3.659 ( 0.000 -0.318 1.213) 1.254 4.095 ( 0.000 -10.234 -8.812) 13.505 4.095 ( 0.000 -10.234 8.812) 13.505 4.739 ( 0.000 12.915 -5.847) 14.177 4.739 ( 0.000 12.915 5.847) 14.177 5.252 ( 0.000 14.998 -0.958) 15.029 5.252 ( 0.000 14.998 0.958) 15.029 5.739 ( 0.000 -7.497 -0.934) 7.555 5.739 ( 0.000 -7.497 0.934) 7.555 6.449 ( 0.000 8.395 -8.957) 12.277 6.449 ( 0.000 8.395 8.957) 12.277 6.851 ( 0.000 0.233 -5.464) 5.469 6.851 ( 0.000 0.233 5.464) 5.469 6.941 ( 0.000 -12.291 -2.739) 12.593 6.941 ( 0.000 -12.291 2.739) 12.593 7.440 ( 0.000 3.144 -2.455) 3.989 7.440 ( 0.000 3.144 2.455) 3.989 8.517 ( 0.000 13.863 -3.389) 14.272 8.517 ( 0.000 13.863 3.389) 14.272 8.776 ( 0.000 4.683 -5.052) 6.888 8.776 ( 0.000 4.683 5.052) 6.888 8.830 ( 0.000 5.467 -3.610) 6.551 8.830 ( 0.000 5.467 3.610) 6.551 9.490 ( 0.000 0.885 -5.058) 5.135 9.490 ( 0.000 0.885 5.058) 5.135 10.232 ( 0.000 5.512 -5.524) 7.804 10.232 ( 0.000 5.512 5.524) 7.804 10.544 ( 0.000 -1.193 -3.636) 3.827 10.544 ( 0.000 -1.193 3.636) 3.827 16.907 ( 0.000 -6.680 -4.834) 8.245 16.907 ( 0.000 -6.680 4.834) 8.245 17.448 ( 0.000 -0.559 -1.865) 1.947 17.448 ( 0.000 -0.559 1.865) 1.947 17.667 ( 0.000 0.511 -1.749) 1.822 17.667 ( 0.000 0.511 1.749) 1.822 18.024 ( 0.000 7.026 -0.814) 7.073 18.024 ( 0.000 7.026 0.814) 7.073 19.884 ( 0.000 -0.003 -0.128) 0.128 19.884 ( 0.000 -0.003 0.128) 0.128 21.934 ( 0.000 -0.396 -0.456) 0.604 21.934 ( 0.000 -0.396 0.456) 0.604 27.471 ( 0.000 -3.981 -1.645) 4.307 27.471 ( 0.000 -3.981 1.645) 4.307 27.701 ( 0.000 -3.022 -0.610) 3.083 27.701 ( 0.000 -3.022 0.610) 3.083 37.833 ( 0.000 4.135 -2.775) 4.979 37.833 ( 0.000 4.135 2.775) 4.979 38.228 ( 0.000 3.064 -5.980) 6.719 38.228 ( 0.000 3.064 5.980) 6.719 38.628 ( 0.000 -5.909 -13.252) 14.510 38.628 ( 0.000 -5.909 13.252) 14.510 40.787 ( 0.000 -0.686 -4.978) 5.025 40.787 ( 0.000 -0.686 4.978) 5.025 ======================= Grid point 371 (112/120) ======================= q-point: ( 0.11 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( -2.521 8.965 -7.540) 11.982 2.507 ( -2.521 8.965 7.540) 11.982 2.745 ( -3.726 2.747 -3.645) 5.892 2.745 ( -3.726 2.747 3.645) 5.892 3.220 ( 0.208 -3.079 -6.264) 6.983 3.220 ( 0.208 -3.079 6.264) 6.983 3.719 ( 4.493 3.317 -4.907) 7.434 3.719 ( 4.493 3.317 4.907) 7.434 4.119 ( 2.476 -11.997 -9.969) 15.793 4.119 ( 2.476 -11.997 9.969) 15.793 4.734 ( -0.033 12.609 -5.097) 13.600 4.734 ( -0.033 12.609 5.097) 13.600 5.315 ( 6.358 15.339 -0.802) 16.624 5.315 ( 6.358 15.339 0.802) 16.624 5.802 ( 6.171 -7.816 -0.705) 9.983 5.802 ( 6.171 -7.816 0.705) 9.983 6.485 ( 3.494 6.875 -8.514) 11.487 6.485 ( 3.494 6.875 8.514) 11.487 6.832 ( -2.069 -2.888 -3.353) 4.885 6.832 ( -2.069 -2.888 3.353) 4.885 6.911 ( -1.868 -6.929 -1.769) 7.391 6.911 ( -1.868 -6.929 1.769) 7.391 7.517 ( 7.034 1.692 -3.743) 8.146 7.517 ( 7.034 1.692 3.743) 8.146 8.494 ( -2.494 11.879 -3.583) 12.656 8.494 ( -2.494 11.879 3.583) 12.656 8.748 ( -3.154 4.801 -5.666) 8.069 8.748 ( -3.154 4.801 5.666) 8.069 8.836 ( 0.972 7.066 -4.240) 8.298 8.836 ( 0.972 7.066 4.240) 8.298 9.459 ( -3.146 0.956 -4.597) 5.652 9.459 ( -3.146 0.956 4.597) 5.652 10.208 ( -2.413 5.966 -5.636) 8.555 10.208 ( -2.413 5.966 5.636) 8.555 10.509 ( -3.510 -1.128 -3.414) 5.025 10.509 ( -3.510 -1.128 3.414) 5.025 16.920 ( 1.314 -6.332 -4.584) 7.927 16.920 ( 1.314 -6.332 4.584) 7.927 17.428 ( -2.003 -1.025 -1.496) 2.701 17.428 ( -2.003 -1.025 1.496) 2.701 17.682 ( 1.521 0.999 -1.518) 2.370 17.682 ( 1.521 0.999 1.518) 2.370 18.005 ( -1.829 6.957 -0.473) 7.209 18.005 ( -1.829 6.957 0.473) 7.209 19.987 ( 10.258 -0.313 -0.331) 10.268 19.987 ( 10.258 -0.313 0.331) 10.268 21.899 ( -3.674 -0.420 -0.494) 3.731 21.899 ( -3.674 -0.420 0.494) 3.731 27.477 ( 0.610 -3.947 -1.586) 4.297 27.477 ( 0.610 -3.947 1.586) 4.297 27.690 ( -1.097 -2.991 -0.538) 3.231 27.690 ( -1.097 -2.991 0.538) 3.231 37.885 ( 5.306 4.609 -2.879) 7.595 37.885 ( 5.306 4.609 2.879) 7.595 38.238 ( 1.179 2.820 -5.756) 6.517 38.238 ( 1.179 2.820 5.756) 6.517 38.617 ( -1.089 -5.909 -12.673) 14.025 38.617 ( -1.089 -5.909 12.673) 14.025 40.658 ( -12.924 -0.100 -4.199) 13.589 40.658 ( -12.924 -0.100 4.199) 13.589 ======================= Grid point 373 (113/120) ======================= q-point: ( 0.22 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.432 ( -4.241 8.584 -9.511) 13.496 2.432 ( -4.241 8.584 9.511) 13.496 2.697 ( -1.214 -2.498 -7.474) 7.973 2.697 ( -1.214 -2.498 7.474) 7.973 3.225 ( 0.293 0.567 -3.809) 3.862 3.225 ( 0.293 0.567 3.809) 3.862 3.735 ( -4.403 5.467 -6.500) 9.567 3.735 ( -4.403 5.467 6.500) 9.567 4.219 ( 8.520 -10.406 -8.099) 15.699 4.219 ( 8.520 -10.406 8.099) 15.699 4.752 ( 1.766 11.332 -3.651) 12.036 4.752 ( 1.766 11.332 3.651) 12.036 5.482 ( 10.090 15.498 -0.603) 18.503 5.482 ( 10.090 15.498 0.603) 18.503 5.951 ( 8.151 -7.736 -1.643) 11.357 5.951 ( 8.151 -7.736 1.643) 11.357 6.567 ( 4.054 1.622 -7.558) 8.729 6.567 ( 4.054 1.622 7.558) 8.729 6.798 ( -0.510 -3.426 -4.293) 5.517 6.798 ( -0.510 -3.426 4.293) 5.517 6.898 ( 1.393 -1.894 -2.491) 3.426 6.898 ( 1.393 -1.894 2.491) 3.426 7.680 ( 9.132 0.824 -4.626) 10.270 7.680 ( 9.132 0.824 4.626) 10.270 8.407 ( -6.880 5.763 -4.060) 9.851 8.407 ( -6.880 5.763 4.060) 9.851 8.661 ( -5.396 9.107 -4.877) 11.655 8.661 ( -5.396 9.107 4.877) 11.655 8.871 ( 2.636 7.522 -3.518) 8.712 8.871 ( 2.636 7.522 3.518) 8.712 9.374 ( -5.333 1.211 -3.622) 6.560 9.374 ( -5.333 1.211 3.622) 6.560 10.148 ( -3.415 6.968 -5.532) 9.530 10.148 ( -3.415 6.968 5.532) 9.530 10.416 ( -5.761 -0.696 -2.879) 6.478 10.416 ( -5.761 -0.696 2.879) 6.478 16.957 ( 2.464 -5.338 -3.897) 7.053 16.957 ( 2.464 -5.338 3.897) 7.053 17.374 ( -3.385 -2.021 -0.989) 4.064 17.374 ( -3.385 -2.021 0.989) 4.064 17.721 ( 2.381 2.001 -1.287) 3.366 17.721 ( 2.381 2.001 1.287) 3.366 17.961 ( -2.432 6.599 -0.434) 7.046 17.961 ( -2.432 6.599 0.434) 7.046 20.259 ( 17.026 -0.895 -0.986) 17.078 20.259 ( 17.026 -0.895 0.986) 17.078 21.790 ( -7.598 -0.509 -0.609) 7.639 21.790 ( -7.598 -0.509 0.609) 7.639 27.494 ( 1.115 -3.844 -1.422) 4.248 27.494 ( 1.115 -3.844 1.422) 4.248 27.661 ( -1.785 -2.957 -0.418) 3.479 27.661 ( -1.785 -2.957 0.418) 3.479 38.029 ( 8.844 6.304 -3.267) 11.341 38.029 ( 8.844 6.304 3.267) 11.341 38.281 ( 3.767 1.961 -4.503) 6.190 38.281 ( 3.767 1.961 4.503) 6.190 38.589 ( -1.583 -6.062 -10.808) 12.493 38.589 ( -1.583 -6.062 10.808) 12.493 40.309 ( -22.221 1.072 -2.379) 22.374 40.309 ( -22.221 1.072 2.379) 22.374 ======================= Grid point 375 (114/120) ======================= q-point: ( 0.33 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( 0.204 5.940 -5.700) 8.235 2.386 ( 0.204 5.940 5.700) 8.235 2.672 ( -2.121 -2.431 -6.331) 7.105 2.672 ( -2.121 -2.431 6.331) 7.105 3.233 ( 0.672 2.763 -2.274) 3.641 3.233 ( 0.672 2.763 2.274) 3.641 3.582 ( -9.554 1.651 -5.810) 11.303 3.582 ( -9.554 1.651 5.810) 11.303 4.421 ( 11.060 -3.714 -4.579) 12.533 4.421 ( 11.060 -3.714 4.579) 12.533 4.778 ( 0.166 9.226 -2.803) 9.644 4.778 ( 0.166 9.226 2.803) 9.644 5.674 ( 8.895 14.932 -0.480) 17.387 5.674 ( 8.895 14.932 0.480) 17.387 6.083 ( 4.920 -6.274 -2.503) 8.356 6.083 ( 4.920 -6.274 2.503) 8.356 6.615 ( 1.275 -3.725 -6.435) 7.544 6.615 ( 1.275 -3.725 6.435) 7.544 6.783 ( -1.691 -1.429 -3.412) 4.067 6.783 ( -1.691 -1.429 3.412) 4.067 7.041 ( 13.543 -0.570 -6.940) 15.229 7.041 ( 13.543 -0.570 6.940) 15.229 7.840 ( 5.465 1.811 -4.258) 7.160 7.840 ( 5.465 1.811 4.258) 7.160 8.240 ( -8.429 0.420 -4.426) 9.530 8.240 ( -8.429 0.420 4.426) 9.530 8.546 ( -6.590 11.576 -4.704) 14.126 8.546 ( -6.590 11.576 4.704) 14.126 8.935 ( 3.868 7.147 -1.467) 8.257 8.935 ( 3.868 7.147 1.467) 8.257 9.260 ( -6.168 1.738 -2.877) 7.024 9.260 ( -6.168 1.738 2.877) 7.024 10.088 ( -2.424 7.848 -4.369) 9.303 10.088 ( -2.425 7.848 4.369) 9.303 10.300 ( -5.697 0.370 -2.137) 6.096 10.300 ( -5.697 0.370 2.137) 6.096 17.013 ( 3.197 -3.761 -2.894) 5.722 17.013 ( 3.197 -3.761 2.894) 5.722 17.302 ( -3.940 -3.352 -0.844) 5.242 17.302 ( -3.940 -3.352 0.844) 5.242 17.771 ( 2.576 3.094 -1.284) 4.226 17.771 ( 2.576 3.094 1.284) 4.226 17.915 ( -2.302 5.840 -1.008) 6.358 17.915 ( -2.302 5.840 1.008) 6.358 20.620 ( 19.572 -1.241 -1.385) 19.660 20.620 ( 19.572 -1.241 1.385) 19.660 21.602 ( -11.765 -0.698 -0.817) 11.814 21.602 ( -11.765 -0.698 0.817) 11.814 27.519 ( 1.472 -3.670 -1.190) 4.129 27.519 ( 1.472 -3.670 1.190) 4.129 27.623 ( -1.991 -3.017 -0.463) 3.644 27.623 ( -1.991 -3.017 0.463) 3.644 38.174 ( 4.851 7.600 -3.916) 9.830 38.174 ( 4.851 7.600 3.916) 9.830 38.417 ( 9.241 2.262 -1.108) 9.578 38.417 ( 9.241 2.262 1.108) 9.578 38.578 ( 2.648 -6.523 -5.841) 9.148 38.578 ( 2.648 -6.523 5.841) 9.148 39.830 ( -26.266 1.713 -0.515) 26.327 39.830 ( -26.266 1.713 0.515) 26.327 ======================= Grid point 377 (115/120) ======================= q-point: ( 0.44 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.439 ( 4.235 4.347 -1.999) 6.390 2.439 ( 4.235 4.347 1.999) 6.390 2.601 ( -4.563 -0.626 -3.168) 5.590 2.601 ( -4.563 -0.626 3.168) 5.590 3.257 ( 1.609 3.456 -1.967) 4.290 3.257 ( 1.609 3.456 1.967) 4.290 3.424 ( -5.498 -1.499 -3.893) 6.901 3.424 ( -5.498 -1.499 3.893) 6.901 4.616 ( 8.542 1.773 -3.112) 9.263 4.616 ( 8.542 1.773 3.112) 9.263 4.741 ( -4.121 6.029 -2.642) 7.766 4.741 ( -4.121 6.029 2.642) 7.766 5.800 ( 3.560 14.102 -0.433) 14.551 5.800 ( 3.560 14.102 0.433) 14.551 6.140 ( 1.197 -4.616 -1.402) 4.971 6.140 ( 1.197 -4.616 1.402) 4.971 6.632 ( 0.482 -2.578 -2.904) 3.913 6.632 ( 0.482 -2.578 2.904) 3.913 6.751 ( -1.076 -4.335 -1.575) 4.737 6.751 ( -1.076 -4.335 1.575) 4.737 7.361 ( 17.218 0.980 -5.657) 18.150 7.361 ( 17.218 0.980 5.657) 18.150 7.754 ( -13.105 -1.084 -4.030) 13.753 7.754 ( -13.105 -1.084 4.030) 13.753 8.227 ( 6.770 3.838 -5.553) 9.560 8.227 ( 6.770 3.838 5.553) 9.560 8.400 ( -8.227 8.567 -5.663) 13.159 8.400 ( -8.227 8.567 5.663) 13.159 9.016 ( 4.123 6.589 -0.623) 7.798 9.016 ( 4.123 6.589 0.623) 7.798 9.146 ( -5.056 2.271 -2.013) 5.897 9.146 ( -5.056 2.271 2.013) 5.897 10.059 ( -0.618 8.309 -1.777) 8.519 10.059 ( -0.618 8.309 1.777) 8.519 10.214 ( -2.595 1.457 -0.915) 3.113 10.214 ( -2.595 1.457 0.915) 3.113 17.072 ( 2.340 -1.462 -1.386) 3.088 17.072 ( 2.340 -1.462 1.386) 3.088 17.232 ( -2.623 -5.425 -0.653) 6.061 17.232 ( -2.623 -5.425 0.653) 6.061 17.818 ( 2.093 4.316 -1.170) 4.937 17.818 ( 2.093 4.316 1.170) 4.937 17.873 ( -1.920 4.707 -1.126) 5.207 17.873 ( -1.920 4.707 1.126) 5.207 20.997 ( 18.733 -1.204 -1.373) 18.822 20.997 ( 18.733 -1.204 1.373) 18.822 21.334 ( -15.749 -0.980 -1.112) 15.819 21.334 ( -15.749 -0.980 1.112) 15.819 27.550 ( 1.715 -3.440 -0.927) 3.954 27.550 ( 1.715 -3.440 0.927) 3.954 27.585 ( -1.903 -3.195 -0.670) 3.779 27.585 ( -1.903 -3.195 0.670) 3.779 38.228 ( 1.219 7.004 -1.969) 7.377 38.228 ( 1.219 7.004 1.969) 7.377 38.483 ( -0.089 -2.655 -3.172) 4.138 38.483 ( -0.089 -2.655 3.172) 4.138 38.830 ( 19.492 1.058 -1.494) 19.577 38.830 ( 19.492 1.058 1.494) 19.577 39.326 ( -24.308 0.637 -0.730) 24.327 39.326 ( -24.308 0.637 0.730) 24.327 ======================= Grid point 387 (116/120) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.616 ( 0.000 0.000 0.000) 0.000 2.616 ( 0.000 0.000 0.000) 0.000 2.883 ( 0.000 0.000 0.000) 0.000 2.883 ( 0.000 0.000 0.000) 0.000 3.157 ( 0.000 0.000 -0.000) 0.000 3.157 ( 0.000 0.000 0.000) 0.000 3.655 ( 0.000 0.000 0.000) 0.000 3.655 ( 0.000 0.000 0.000) 0.000 3.972 ( 0.000 0.000 0.000) 0.000 3.972 ( 0.000 0.000 0.000) 0.000 4.871 ( 0.000 0.000 0.000) 0.000 4.871 ( 0.000 0.000 0.000) 0.000 5.479 ( 0.000 -0.000 0.000) 0.000 5.479 ( 0.000 -0.000 0.000) 0.000 5.596 ( 0.000 0.000 0.000) 0.000 5.596 ( 0.000 0.000 0.000) 0.000 6.632 ( 0.000 -0.000 -0.000) 0.000 6.632 ( 0.000 -0.000 0.000) 0.000 6.669 ( 0.000 0.000 -0.000) 0.000 6.669 ( 0.000 0.000 0.000) 0.000 6.898 ( 0.000 0.000 0.000) 0.000 6.898 ( 0.000 0.000 0.000) 0.000 7.469 ( 0.000 0.000 -0.000) 0.000 7.469 ( 0.000 0.000 0.000) 0.000 8.583 ( 0.000 0.000 0.000) 0.000 8.583 ( 0.000 0.000 0.000) 0.000 8.868 ( 0.000 0.000 -0.000) 0.000 8.868 ( 0.000 0.000 0.000) 0.000 8.903 ( 0.000 0.000 0.000) 0.000 8.903 ( 0.000 0.000 0.000) 0.000 9.506 ( 0.000 0.000 0.000) 0.000 9.506 ( 0.000 0.000 0.000) 0.000 10.293 ( 0.000 0.000 0.000) 0.000 10.293 ( 0.000 0.000 -0.000) 0.000 10.536 ( 0.000 0.000 0.000) 0.000 10.536 ( 0.000 0.000 0.000) 0.000 16.839 ( 0.000 0.000 -0.000) 0.000 16.839 ( 0.000 0.000 0.000) 0.000 17.436 ( 0.000 0.000 0.000) 0.000 17.436 ( 0.000 0.000 0.000) 0.000 17.674 ( 0.000 0.000 -0.000) 0.000 17.674 ( 0.000 0.000 0.000) 0.000 18.098 ( 0.000 0.000 0.000) 0.000 18.098 ( 0.000 0.000 0.000) 0.000 19.884 ( 0.000 0.000 0.000) 0.000 19.884 ( 0.000 0.000 0.000) 0.000 21.930 ( 0.000 0.000 0.000) 0.000 21.930 ( 0.000 0.000 0.000) 0.000 27.430 ( 0.000 0.000 0.000) 0.000 27.430 ( 0.000 0.000 0.000) 0.000 27.670 ( 0.000 0.000 0.000) 0.000 27.670 ( 0.000 0.000 0.000) 0.000 37.872 ( 0.000 0.000 0.000) 0.000 37.872 ( 0.000 0.000 0.000) 0.000 38.277 ( 0.000 0.000 0.000) 0.000 38.277 ( 0.000 0.000 0.000) 0.000 38.548 ( 0.000 0.000 -0.000) 0.000 38.548 ( 0.000 0.000 0.000) 0.000 40.784 ( 0.000 0.000 0.000) 0.000 40.784 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 391 (117/120) ======================= q-point: ( 0.11 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.623 ( 0.674 0.000 -0.000) 0.674 2.623 ( 0.674 0.000 0.000) 0.674 2.748 ( -10.720 0.000 -0.000) 10.720 2.748 ( -10.720 0.000 0.000) 10.720 3.195 ( 2.301 0.000 -0.000) 2.301 3.195 ( 2.301 0.000 0.000) 2.301 3.790 ( 12.396 -0.000 -0.000) 12.396 3.790 ( 12.396 -0.000 0.000) 12.396 3.948 ( -3.175 0.000 -0.000) 3.175 3.948 ( -3.175 0.000 0.000) 3.175 4.864 ( -0.352 0.000 -0.000) 0.352 4.864 ( -0.352 0.000 0.000) 0.352 5.554 ( 7.298 -0.000 0.000) 7.298 5.554 ( 7.298 -0.000 0.000) 7.298 5.649 ( 5.312 0.000 -0.000) 5.312 5.649 ( 5.312 0.000 0.000) 5.312 6.632 ( -3.224 -0.000 -0.000) 3.224 6.632 ( -3.224 -0.000 0.000) 3.224 6.660 ( 2.865 0.000 -0.000) 2.865 6.660 ( 2.865 0.000 0.000) 2.865 6.898 ( -0.077 0.000 0.000) 0.077 6.898 ( -0.077 0.000 0.000) 0.077 7.533 ( 6.163 0.000 -0.000) 6.163 7.533 ( 6.163 0.000 0.000) 6.163 8.545 ( -4.083 0.000 -0.000) 4.083 8.545 ( -4.083 0.000 0.000) 4.083 8.849 ( -2.009 0.000 -0.000) 2.009 8.849 ( -2.009 -0.000 0.000) 2.009 8.912 ( 1.001 0.000 -0.000) 1.001 8.912 ( 1.001 0.000 0.000) 1.001 9.475 ( -3.086 0.000 0.000) 3.086 9.475 ( -3.086 0.000 0.000) 3.086 10.274 ( -1.790 -0.000 -0.000) 1.790 10.274 ( -1.790 0.000 0.000) 1.790 10.501 ( -3.481 0.000 0.000) 3.481 10.501 ( -3.481 0.000 0.000) 3.481 16.855 ( 1.653 -0.000 -0.000) 1.653 16.855 ( 1.653 -0.000 0.000) 1.653 17.412 ( -2.411 0.000 -0.000) 2.411 17.412 ( -2.411 0.000 0.000) 2.411 17.695 ( 1.964 0.000 -0.000) 1.964 17.695 ( 1.964 0.000 0.000) 1.964 18.078 ( -1.921 -0.000 -0.000) 1.921 18.078 ( -1.921 -0.000 0.000) 1.921 19.984 ( 9.982 0.000 -0.000) 9.982 19.984 ( 9.982 0.000 0.000) 9.982 21.895 ( -3.700 0.000 -0.000) 3.700 21.895 ( -3.700 0.000 0.000) 3.700 27.436 ( 0.647 0.000 0.000) 0.647 27.436 ( 0.647 0.000 0.000) 0.647 27.659 ( -1.069 0.000 0.000) 1.069 27.659 ( -1.069 0.000 0.000) 1.069 37.928 ( 5.792 0.000 -0.000) 5.792 37.928 ( 5.792 0.000 0.000) 5.792 38.287 ( 1.047 0.000 0.000) 1.047 38.287 ( 1.047 0.000 0.000) 1.047 38.537 ( -1.205 0.000 0.000) 1.205 38.537 ( -1.205 0.000 0.000) 1.205 40.661 ( -12.388 0.000 0.000) 12.388 40.661 ( -12.388 0.000 0.000) 12.388 ======================= Grid point 395 (118/120) ======================= q-point: ( 0.22 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.552 ( -8.252 -0.000 -0.000) 8.252 2.552 ( -8.252 0.000 0.000) 8.252 2.638 ( 0.678 0.000 -0.000) 0.678 2.638 ( 0.678 0.000 0.000) 0.678 3.230 ( 1.514 0.000 -0.000) 1.514 3.230 ( 1.514 0.000 0.000) 1.514 3.824 ( -9.658 -0.000 -0.000) 9.658 3.824 ( -9.658 -0.000 0.000) 9.658 4.075 ( 15.887 0.000 -0.000) 15.887 4.075 ( 15.887 0.000 0.000) 15.887 4.871 ( 0.882 0.000 -0.000) 0.882 4.871 ( 0.882 0.000 0.000) 0.882 5.732 ( 10.104 -0.000 -0.000) 10.104 5.732 ( 10.104 -0.000 0.000) 10.104 5.790 ( 8.541 0.000 -0.000) 8.541 5.790 ( 8.541 0.000 0.000) 8.541 6.572 ( -2.326 0.000 -0.000) 2.326 6.572 ( -2.326 0.000 0.000) 2.326 6.741 ( 4.855 0.000 -0.000) 4.855 6.741 ( 4.855 0.000 0.000) 4.855 6.901 ( 1.292 0.000 0.000) 1.292 6.901 ( 1.292 0.000 0.000) 1.292 7.687 ( 9.175 0.000 -0.000) 9.175 7.687 ( 9.175 0.000 0.000) 9.175 8.419 ( -8.821 0.000 -0.000) 8.821 8.419 ( -8.821 0.000 0.000) 8.821 8.787 ( -4.538 -0.000 -0.000) 4.538 8.787 ( -4.538 -0.000 0.000) 4.538 8.945 ( 2.424 0.000 -0.000) 2.424 8.945 ( 2.424 0.000 0.000) 2.424 9.392 ( -5.203 0.000 -0.000) 5.203 9.392 ( -5.203 0.000 0.000) 5.203 10.230 ( -2.539 0.000 -0.000) 2.539 10.230 ( -2.539 0.000 0.000) 2.539 10.411 ( -5.463 0.000 0.000) 5.463 10.411 ( -5.463 0.000 0.000) 5.463 16.902 ( 3.118 -0.000 -0.000) 3.118 16.902 ( 3.118 -0.000 0.000) 3.118 17.349 ( -3.967 0.000 -0.000) 3.967 17.349 ( -3.967 0.000 0.000) 3.967 17.744 ( 2.948 0.000 -0.000) 2.948 17.744 ( 2.948 0.000 0.000) 2.948 18.031 ( -2.726 -0.000 -0.000) 2.726 18.031 ( -2.726 -0.000 0.000) 2.726 20.250 ( 16.757 0.000 -0.000) 16.757 20.250 ( 16.757 -0.000 0.000) 16.757 21.785 ( -7.667 0.000 -0.000) 7.667 21.785 ( -7.667 0.000 0.000) 7.667 27.454 ( 1.189 0.000 0.000) 1.189 27.454 ( 1.189 0.000 0.000) 1.189 27.630 ( -1.783 0.000 0.000) 1.783 27.630 ( -1.783 0.000 0.000) 1.783 38.089 ( 10.276 0.000 -0.000) 10.276 38.089 ( 10.276 0.000 0.000) 10.276 38.325 ( 3.395 0.000 0.000) 3.395 38.325 ( 3.395 0.000 0.000) 3.395 38.503 ( -2.178 0.000 -0.000) 2.178 38.503 ( -2.178 0.000 0.000) 2.178 40.324 ( -21.660 0.000 0.000) 21.660 40.324 ( -21.660 0.000 0.000) 21.660 ======================= Grid point 399 (119/120) ======================= q-point: ( 0.33 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.455 ( -1.374 -0.000 -0.000) 1.374 2.455 ( -1.374 0.000 0.000) 1.374 2.638 ( -1.021 0.000 -0.000) 1.021 2.638 ( -1.021 0.000 0.000) 1.021 3.258 ( 1.434 0.000 -0.000) 1.434 3.258 ( 1.434 0.000 0.000) 1.434 3.602 ( -12.079 -0.000 -0.000) 12.079 3.602 ( -12.079 -0.000 0.000) 12.079 4.378 ( 14.783 0.000 -0.000) 14.783 4.378 ( 14.783 0.000 0.000) 14.783 4.874 ( -1.232 0.000 -0.000) 1.232 4.874 ( -1.232 0.000 0.000) 1.232 5.912 ( 7.741 -0.000 -0.000) 7.741 5.912 ( 7.741 -0.000 0.000) 7.741 5.945 ( 6.644 0.000 -0.000) 6.644 5.945 ( 6.644 0.000 0.000) 6.644 6.558 ( 0.985 0.000 -0.000) 0.985 6.558 ( 0.985 0.000 0.000) 0.985 6.767 ( -2.487 0.000 0.000) 2.487 6.767 ( -2.487 0.000 0.000) 2.487 7.042 ( 13.678 0.000 0.000) 13.678 7.042 ( 13.678 0.000 0.000) 13.678 7.855 ( 5.728 0.000 -0.000) 5.728 7.855 ( 5.728 0.000 0.000) 5.728 8.227 ( -8.571 0.000 0.000) 8.571 8.227 ( -8.571 0.000 0.000) 8.571 8.667 ( -7.871 -0.000 -0.000) 7.871 8.667 ( -7.871 -0.000 0.000) 7.871 9.003 ( 3.525 0.000 0.000) 3.525 9.003 ( 3.525 0.000 0.000) 3.525 9.282 ( -5.894 0.000 -0.000) 5.894 9.282 ( -5.894 0.000 0.000) 5.894 10.187 ( -1.574 0.000 -0.000) 1.574 10.187 ( -1.574 0.000 0.000) 1.574 10.303 ( -5.267 0.000 0.000) 5.267 10.303 ( -5.267 0.000 0.000) 5.267 16.974 ( 4.252 -0.000 -0.000) 4.252 16.974 ( 4.252 -0.000 0.000) 4.252 17.262 ( -4.859 0.000 -0.000) 4.859 17.262 ( -4.859 0.000 0.000) 4.859 17.804 ( 3.193 0.000 -0.000) 3.193 17.804 ( 3.193 0.000 0.000) 3.193 17.977 ( -2.810 -0.000 -0.000) 2.810 17.977 ( -2.810 -0.000 0.000) 2.810 20.608 ( 19.491 0.000 -0.000) 19.491 20.608 ( 19.491 0.000 0.000) 19.491 21.595 ( -11.889 0.000 -0.000) 11.889 21.595 ( -11.889 0.000 0.000) 11.889 27.481 ( 1.583 0.000 0.000) 1.583 27.481 ( 1.583 0.000 0.000) 1.583 27.593 ( -2.054 0.000 0.000) 2.054 27.593 ( -2.054 0.000 0.000) 2.054 38.262 ( 5.672 0.000 0.000) 5.672 38.262 ( 5.672 0.000 0.000) 5.672 38.454 ( -2.772 0.000 -0.000) 2.772 38.454 ( -2.772 0.000 0.000) 2.772 38.482 ( 14.562 -0.000 -0.000) 14.562 38.482 ( 14.562 -0.000 0.000) 14.562 39.851 ( -26.229 0.000 0.000) 26.229 39.851 ( -26.229 0.000 0.000) 26.229 ======================= Grid point 403 (120/120) ======================= q-point: ( 0.44 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.491 ( 4.376 0.000 -0.000) 4.376 2.491 ( 4.376 0.000 0.000) 4.376 2.586 ( -4.369 0.000 -0.000) 4.369 2.586 ( -4.369 0.000 0.000) 4.369 3.297 ( 3.078 0.000 -0.000) 3.078 3.297 ( 3.078 0.000 0.000) 3.078 3.399 ( -7.951 -0.000 -0.000) 7.951 3.399 ( -7.951 -0.000 0.000) 7.951 4.634 ( 11.230 0.000 0.000) 11.230 4.634 ( 11.230 0.000 0.000) 11.230 4.804 ( -6.190 -0.000 -0.000) 6.190 4.804 ( -6.190 0.000 0.000) 6.190 6.018 ( 3.037 -0.000 -0.000) 3.037 6.018 ( 3.037 0.000 0.000) 3.037 6.029 ( 1.867 -0.000 0.000) 1.867 6.029 ( 1.867 0.000 0.000) 1.867 6.607 ( 3.772 -0.000 -0.000) 3.772 6.607 ( 3.772 0.000 0.000) 3.772 6.691 ( -4.597 -0.000 0.000) 4.597 6.691 ( -4.597 0.000 0.000) 4.597 7.374 ( 19.247 -0.000 -0.000) 19.247 7.374 ( 19.247 0.000 0.000) 19.247 7.736 ( -16.177 0.000 0.000) 16.177 7.736 ( -16.177 0.000 0.000) 16.177 8.260 ( 10.155 0.000 0.000) 10.155 8.260 ( 10.155 0.000 0.000) 10.155 8.481 ( -11.121 -0.000 -0.000) 11.121 8.481 ( -11.121 -0.000 0.000) 11.121 9.079 ( 4.320 0.000 -0.000) 4.320 9.079 ( 4.320 0.000 0.000) 4.320 9.172 ( -5.264 0.000 -0.000) 5.264 9.172 ( -5.264 0.000 0.000) 5.264 10.178 ( 0.732 -0.000 0.000) 0.732 10.178 ( 0.732 0.000 -0.000) 0.732 10.218 ( -3.353 0.000 0.000) 3.353 10.218 ( -3.353 0.000 0.000) 3.353 17.064 ( 4.963 0.000 -0.000) 4.963 17.064 ( 4.963 0.000 0.000) 4.963 17.164 ( -5.182 0.000 -0.000) 5.182 17.164 ( -5.182 0.000 0.000) 5.182 17.865 ( 3.046 0.000 -0.000) 3.046 17.865 ( 3.046 0.000 0.000) 3.046 17.922 ( -2.851 -0.000 -0.000) 2.851 17.922 ( -2.851 -0.000 0.000) 2.851 20.984 ( 18.832 0.000 0.000) 18.832 20.984 ( 18.832 0.000 0.000) 18.832 21.324 ( -15.910 0.000 -0.000) 15.910 21.324 ( -15.910 0.000 0.000) 15.910 27.515 ( 1.851 0.000 0.000) 1.851 27.515 ( 1.851 0.000 0.000) 1.851 27.553 ( -2.024 0.000 0.000) 2.024 27.553 ( -2.024 0.000 0.000) 2.024 38.339 ( 3.166 0.000 0.000) 3.166 38.339 ( 3.166 0.000 0.000) 3.166 38.398 ( -2.994 0.000 -0.000) 2.994 38.398 ( -2.994 0.000 0.000) 2.994 38.855 ( 22.653 0.000 -0.000) 22.653 38.855 ( 22.653 0.000 0.000) 22.653 39.335 ( -26.244 0.000 0.000) 26.244 39.335 ( -26.244 0.000 0.000) 26.244 =================== 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 3/32400 10.0 4396.511 4287.213 3397.987 0.000 0.000 -0.000 3/32400 20.0 529.218 553.632 454.306 0.000 0.000 -0.000 3/32400 30.0 154.966 160.090 137.111 0.000 0.000 -0.000 3/32400 40.0 71.325 73.046 63.551 0.000 0.000 -0.000 3/32400 50.0 41.478 42.492 37.073 0.000 0.000 -0.000 3/32400 60.0 27.733 28.644 24.888 0.000 0.000 -0.000 3/32400 70.0 20.321 21.261 18.329 0.000 0.000 -0.000 3/32400 80.0 15.866 16.850 14.386 0.000 0.000 -0.000 3/32400 90.0 12.964 13.977 11.814 0.000 0.000 -0.000 3/32400 100.0 10.953 11.978 10.025 0.000 0.000 -0.000 3/32400 110.0 9.490 10.510 8.717 0.000 0.000 -0.000 3/32400 120.0 8.382 9.387 7.722 0.000 0.000 -0.000 3/32400 130.0 7.516 8.498 6.940 0.000 0.000 -0.000 3/32400 140.0 6.822 7.775 6.310 0.000 0.000 -0.000 3/32400 150.0 6.253 7.175 5.790 0.000 0.000 -0.000 3/32400 160.0 5.778 6.668 5.355 0.000 0.000 -0.000 3/32400 170.0 5.377 6.232 4.984 0.000 0.000 -0.000 3/32400 180.0 5.033 5.854 4.664 0.000 0.000 -0.000 3/32400 190.0 4.735 5.522 4.385 0.000 0.000 -0.000 3/32400 200.0 4.474 5.229 4.139 0.000 0.000 -0.000 3/32400 210.0 4.245 4.967 3.922 0.000 0.000 -0.000 3/32400 220.0 4.041 4.731 3.727 0.000 0.000 -0.000 3/32400 230.0 3.859 4.519 3.552 0.000 0.000 -0.000 3/32400 240.0 3.695 4.325 3.394 0.000 0.000 -0.000 3/32400 250.0 3.548 4.149 3.250 0.000 0.000 -0.000 3/32400 260.0 3.414 3.988 3.118 0.000 0.000 -0.000 3/32400 270.0 3.291 3.839 2.997 0.000 0.000 -0.000 3/32400 280.0 3.180 3.702 2.886 0.000 0.000 -0.000 3/32400 290.0 3.077 3.575 2.784 0.000 0.000 -0.000 3/32400 300.0 2.983 3.457 2.689 0.000 0.000 -0.000 3/32400 310.0 2.895 3.347 2.601 0.000 0.000 -0.000 3/32400 320.0 2.815 3.244 2.518 0.000 0.000 -0.000 3/32400 330.0 2.739 3.148 2.441 0.000 0.000 -0.000 3/32400 340.0 2.669 3.057 2.369 0.000 0.000 -0.000 3/32400 350.0 2.604 2.972 2.302 0.000 0.000 -0.000 3/32400 360.0 2.543 2.892 2.238 0.000 0.000 -0.000 3/32400 370.0 2.485 2.817 2.178 0.000 0.000 -0.000 3/32400 380.0 2.431 2.745 2.122 0.000 0.000 -0.000 3/32400 390.0 2.380 2.678 2.068 0.000 0.000 -0.000 3/32400 400.0 2.332 2.614 2.018 0.000 0.000 -0.000 3/32400 410.0 2.287 2.553 1.970 0.000 0.000 -0.000 3/32400 420.0 2.244 2.495 1.924 0.000 0.000 -0.000 3/32400 430.0 2.203 2.439 1.881 0.000 0.000 0.000 3/32400 440.0 2.164 2.387 1.839 0.000 0.000 0.000 3/32400 450.0 2.127 2.336 1.800 0.000 0.000 0.000 3/32400 460.0 2.092 2.288 1.762 0.000 0.000 0.000 3/32400 470.0 2.058 2.242 1.726 0.000 0.000 0.000 3/32400 480.0 2.026 2.198 1.692 0.000 0.000 0.000 3/32400 490.0 1.995 2.156 1.659 0.000 0.000 0.000 3/32400 500.0 1.965 2.115 1.627 0.000 0.000 0.000 3/32400 510.0 1.937 2.076 1.597 0.000 0.000 0.000 3/32400 520.0 1.909 2.039 1.568 0.000 0.000 0.000 3/32400 530.0 1.883 2.003 1.540 0.000 0.000 0.000 3/32400 540.0 1.858 1.968 1.513 0.000 0.000 0.000 3/32400 550.0 1.834 1.934 1.487 0.000 0.000 0.000 3/32400 560.0 1.810 1.902 1.462 0.000 0.000 0.000 3/32400 570.0 1.787 1.871 1.438 0.000 0.000 0.000 3/32400 580.0 1.765 1.841 1.415 0.000 0.000 0.000 3/32400 590.0 1.744 1.812 1.392 0.000 0.000 0.000 3/32400 600.0 1.723 1.783 1.371 0.000 0.000 0.000 3/32400 610.0 1.703 1.756 1.350 0.000 0.000 0.000 3/32400 620.0 1.684 1.730 1.329 0.000 0.000 0.000 3/32400 630.0 1.665 1.704 1.310 0.000 0.000 0.000 3/32400 640.0 1.647 1.680 1.291 0.000 0.000 0.000 3/32400 650.0 1.629 1.656 1.272 0.000 0.000 0.000 3/32400 660.0 1.612 1.632 1.254 0.000 0.000 0.000 3/32400 670.0 1.595 1.610 1.237 0.000 0.000 0.000 3/32400 680.0 1.579 1.588 1.220 0.000 0.000 0.000 3/32400 690.0 1.563 1.566 1.204 0.000 0.000 0.000 3/32400 700.0 1.548 1.546 1.188 0.000 0.000 0.000 3/32400 710.0 1.533 1.525 1.172 0.000 0.000 0.000 3/32400 720.0 1.518 1.506 1.157 0.000 0.000 0.000 3/32400 730.0 1.503 1.487 1.142 0.000 0.000 0.000 3/32400 740.0 1.489 1.468 1.128 0.000 0.000 0.000 3/32400 750.0 1.476 1.450 1.114 0.000 0.000 0.000 3/32400 760.0 1.462 1.432 1.101 0.000 0.000 0.000 3/32400 770.0 1.449 1.415 1.088 0.000 0.000 0.000 3/32400 780.0 1.436 1.398 1.075 0.000 0.000 0.000 3/32400 790.0 1.424 1.382 1.062 0.000 0.000 0.000 3/32400 800.0 1.411 1.366 1.050 0.000 0.000 0.000 3/32400 810.0 1.399 1.350 1.038 0.000 0.000 0.000 3/32400 820.0 1.388 1.335 1.026 0.000 0.000 0.000 3/32400 830.0 1.376 1.320 1.015 0.000 0.000 0.000 3/32400 840.0 1.365 1.305 1.004 0.000 0.000 0.000 3/32400 850.0 1.354 1.291 0.993 0.000 0.000 0.000 3/32400 860.0 1.343 1.277 0.983 0.000 0.000 0.000 3/32400 870.0 1.332 1.264 0.972 0.000 0.000 0.000 3/32400 880.0 1.322 1.250 0.962 0.000 0.000 0.000 3/32400 890.0 1.311 1.237 0.952 0.000 0.000 0.000 3/32400 900.0 1.301 1.225 0.942 0.000 0.000 0.000 3/32400 910.0 1.291 1.212 0.933 0.000 0.000 0.000 3/32400 920.0 1.282 1.200 0.924 0.000 0.000 0.000 3/32400 930.0 1.272 1.188 0.915 0.000 0.000 0.000 3/32400 940.0 1.263 1.176 0.906 0.000 0.000 0.000 3/32400 950.0 1.253 1.165 0.897 0.000 0.000 0.000 3/32400 960.0 1.244 1.154 0.888 0.000 0.000 0.000 3/32400 970.0 1.235 1.143 0.880 0.000 0.000 0.000 3/32400 980.0 1.227 1.132 0.872 0.000 0.000 0.000 3/32400 990.0 1.218 1.121 0.864 0.000 0.000 0.000 3/32400 1000.0 1.210 1.111 0.856 0.000 0.000 0.000 3/32400 Thermal conductivity related properties were written into "kappa-m9106.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 04:04:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|