----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 13:52:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.786530630000109 0.000000000000000 0.000000000000000 b 0.000000000000000 5.843820660000000 0.000000000000000 c -5.754183758751183 0.000000000000000 8.208354266260987 Atomic positions (fractional): *1 Sr 0.25883536684350 0.53431053045280 0.25038811771974 87.620 2 Sr 0.74116463315649 0.03431053045280 0.24961188228026 87.620 3 Sr 0.74116463315649 0.46568946954720 0.74961188228026 87.620 4 Sr 0.25883536684350 0.96568946954720 0.75038811771974 87.620 *5 Ho 0.00000000000000 0.50000000000000 0.50000000000000 164.930 6 Ho 0.00000000000000 0.00000000000000 0.00000000000000 164.930 *7 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 8 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 *9 O 0.18602949034976 0.97903668396432 0.26312882683730 15.999 10 O 0.81397050965024 0.02096331603568 0.73687117316270 15.999 *11 O 0.34277546157512 0.77413963126583 0.04219120732189 15.999 *12 O 0.73309649431718 0.79760968392157 0.46010526470497 15.999 13 O 0.65722453842488 0.27413963126583 0.45780879267811 15.999 14 O 0.18602949034976 0.52096331603568 0.76312882683730 15.999 15 O 0.65722453842488 0.22586036873417 0.95780879267811 15.999 16 O 0.73309649431718 0.70239031607843 0.96010526470498 15.999 17 O 0.26690350568282 0.29760968392157 0.03989473529502 15.999 18 O 0.81397050965024 0.47903668396432 0.23687117316270 15.999 19 O 0.34277546157512 0.72586036873417 0.54219120732189 15.999 20 O 0.26690350568282 0.20239031607843 0.53989473529502 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.786530630000109 0.000000000000000 0.000000000000000 b 0.000000000000000 5.843820660000000 0.000000000000000 c -5.754183758751183 0.000000000000000 8.208354266260987 Atomic positions (fractional): *1 Sr 0.25883536684350 0.53431053045280 0.25038811771974 87.620 > 1 2 Sr 0.74116463315649 0.03431053045280 0.24961188228026 87.620 > 2 3 Sr 0.74116463315649 0.46568946954720 0.74961188228026 87.620 > 3 4 Sr 0.25883536684350 0.96568946954720 0.75038811771974 87.620 > 4 *5 Ho 0.00000000000000 0.50000000000000 0.50000000000000 164.930 > 5 6 Ho 0.00000000000000 0.00000000000000 0.00000000000000 164.930 > 6 *7 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 > 7 8 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 > 8 *9 O 0.18602949034976 0.97903668396432 0.26312882683730 15.999 > 9 10 O 0.81397050965024 0.02096331603568 0.73687117316270 15.999 > 10 *11 O 0.34277546157512 0.77413963126583 0.04219120732189 15.999 > 11 *12 O 0.73309649431718 0.79760968392157 0.46010526470497 15.999 > 12 13 O 0.65722453842488 0.27413963126583 0.45780879267811 15.999 > 13 14 O 0.18602949034976 0.52096331603568 0.76312882683730 15.999 > 14 15 O 0.65722453842488 0.22586036873417 0.95780879267811 15.999 > 15 16 O 0.73309649431718 0.70239031607843 0.96010526470498 15.999 > 16 17 O 0.26690350568282 0.29760968392157 0.03989473529502 15.999 > 17 18 O 0.81397050965024 0.47903668396432 0.23687117316270 15.999 > 18 19 O 0.34277546157512 0.72586036873417 0.54219120732189 15.999 > 19 20 O 0.26690350568282 0.20239031607843 0.53989473529502 15.999 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.573061260000218 0.000000000000000 0.000000000000000 b 0.000000000000000 11.687641319999999 0.000000000000000 c -5.754183758751183 0.000000000000000 8.208354266260987 Atomic positions (fractional): *1 Sr 0.12941768342175 0.26715526522640 0.25038811771974 87.620 > 1 2 Sr 0.62941768342175 0.26715526522640 0.25038811771974 87.620 > 1 3 Sr 0.12941768342175 0.76715526522640 0.25038811771974 87.620 > 1 4 Sr 0.62941768342175 0.76715526522640 0.25038811771974 87.620 > 1 5 Sr 0.37058231657825 0.01715526522640 0.24961188228026 87.620 > 2 6 Sr 0.87058231657825 0.01715526522640 0.24961188228026 87.620 > 2 7 Sr 0.37058231657825 0.51715526522640 0.24961188228026 87.620 > 2 8 Sr 0.87058231657825 0.51715526522640 0.24961188228026 87.620 > 2 9 Sr 0.37058231657825 0.23284473477360 0.74961188228026 87.620 > 3 10 Sr 0.87058231657825 0.23284473477360 0.74961188228026 87.620 > 3 11 Sr 0.37058231657825 0.73284473477360 0.74961188228026 87.620 > 3 12 Sr 0.87058231657825 0.73284473477360 0.74961188228026 87.620 > 3 13 Sr 0.12941768342175 0.48284473477360 0.75038811771974 87.620 > 4 14 Sr 0.62941768342175 0.48284473477360 0.75038811771974 87.620 > 4 15 Sr 0.12941768342175 0.98284473477360 0.75038811771974 87.620 > 4 16 Sr 0.62941768342175 0.98284473477360 0.75038811771974 87.620 > 4 *17 Ho 0.00000000000000 0.25000000000000 0.50000000000000 164.930 > 5 18 Ho 0.50000000000000 0.25000000000000 0.50000000000000 164.930 > 5 19 Ho 0.00000000000000 0.75000000000000 0.50000000000000 164.930 > 5 20 Ho 0.50000000000000 0.75000000000000 0.50000000000000 164.930 > 5 21 Ho 0.00000000000000 0.00000000000000 0.00000000000000 164.930 > 6 22 Ho 0.50000000000000 0.00000000000000 0.00000000000000 164.930 > 6 23 Ho 0.00000000000000 0.50000000000000 0.00000000000000 164.930 > 6 24 Ho 0.50000000000000 0.50000000000000 0.00000000000000 164.930 > 6 *25 Sb 0.25000000000000 0.00000000000000 0.50000000000000 121.760 > 7 26 Sb 0.75000000000000 0.00000000000000 0.50000000000000 121.760 > 7 27 Sb 0.25000000000000 0.50000000000000 0.50000000000000 121.760 > 7 28 Sb 0.75000000000000 0.50000000000000 0.50000000000000 121.760 > 7 29 Sb 0.25000000000000 0.25000000000000 0.00000000000000 121.760 > 8 30 Sb 0.75000000000000 0.25000000000000 0.00000000000000 121.760 > 8 31 Sb 0.25000000000000 0.75000000000000 0.00000000000000 121.760 > 8 32 Sb 0.75000000000000 0.75000000000000 0.00000000000000 121.760 > 8 *33 O 0.09301474517488 0.48951834198216 0.26312882683730 15.999 > 9 34 O 0.59301474517488 0.48951834198216 0.26312882683730 15.999 > 9 35 O 0.09301474517488 0.98951834198216 0.26312882683730 15.999 > 9 36 O 0.59301474517488 0.98951834198216 0.26312882683730 15.999 > 9 37 O 0.40698525482512 0.01048165801784 0.73687117316270 15.999 > 10 38 O 0.90698525482512 0.01048165801784 0.73687117316270 15.999 > 10 39 O 0.40698525482512 0.51048165801784 0.73687117316270 15.999 > 10 40 O 0.90698525482512 0.51048165801784 0.73687117316270 15.999 > 10 *41 O 0.17138773078756 0.38706981563291 0.04219120732189 15.999 > 11 42 O 0.67138773078756 0.38706981563291 0.04219120732189 15.999 > 11 43 O 0.17138773078756 0.88706981563291 0.04219120732189 15.999 > 11 44 O 0.67138773078756 0.88706981563291 0.04219120732189 15.999 > 11 *45 O 0.36654824715859 0.39880484196079 0.46010526470497 15.999 > 12 46 O 0.86654824715859 0.39880484196079 0.46010526470497 15.999 > 12 47 O 0.36654824715859 0.89880484196079 0.46010526470497 15.999 > 12 48 O 0.86654824715859 0.89880484196079 0.46010526470497 15.999 > 12 49 O 0.32861226921244 0.13706981563291 0.45780879267811 15.999 > 13 50 O 0.82861226921244 0.13706981563291 0.45780879267811 15.999 > 13 51 O 0.32861226921244 0.63706981563291 0.45780879267811 15.999 > 13 52 O 0.82861226921244 0.63706981563291 0.45780879267811 15.999 > 13 53 O 0.09301474517488 0.26048165801784 0.76312882683730 15.999 > 14 54 O 0.59301474517488 0.26048165801784 0.76312882683730 15.999 > 14 55 O 0.09301474517488 0.76048165801784 0.76312882683730 15.999 > 14 56 O 0.59301474517488 0.76048165801784 0.76312882683730 15.999 > 14 57 O 0.32861226921244 0.11293018436709 0.95780879267811 15.999 > 15 58 O 0.82861226921244 0.11293018436709 0.95780879267811 15.999 > 15 59 O 0.32861226921244 0.61293018436709 0.95780879267811 15.999 > 15 60 O 0.82861226921244 0.61293018436709 0.95780879267811 15.999 > 15 61 O 0.36654824715859 0.35119515803921 0.96010526470498 15.999 > 16 62 O 0.86654824715859 0.35119515803921 0.96010526470498 15.999 > 16 63 O 0.36654824715859 0.85119515803921 0.96010526470498 15.999 > 16 64 O 0.86654824715859 0.85119515803921 0.96010526470498 15.999 > 16 65 O 0.13345175284141 0.14880484196079 0.03989473529502 15.999 > 17 66 O 0.63345175284141 0.14880484196079 0.03989473529502 15.999 > 17 67 O 0.13345175284141 0.64880484196079 0.03989473529502 15.999 > 17 68 O 0.63345175284141 0.64880484196079 0.03989473529502 15.999 > 17 69 O 0.40698525482512 0.23951834198216 0.23687117316270 15.999 > 18 70 O 0.90698525482512 0.23951834198216 0.23687117316270 15.999 > 18 71 O 0.40698525482512 0.73951834198216 0.23687117316270 15.999 > 18 72 O 0.90698525482512 0.73951834198216 0.23687117316270 15.999 > 18 73 O 0.17138773078756 0.36293018436709 0.54219120732189 15.999 > 19 74 O 0.67138773078756 0.36293018436709 0.54219120732189 15.999 > 19 75 O 0.17138773078756 0.86293018436709 0.54219120732189 15.999 > 19 76 O 0.67138773078756 0.86293018436709 0.54219120732189 15.999 > 19 77 O 0.13345175284141 0.10119515803921 0.53989473529502 15.999 > 20 78 O 0.63345175284141 0.10119515803921 0.53989473529502 15.999 > 20 79 O 0.13345175284141 0.60119515803921 0.53989473529502 15.999 > 20 80 O 0.63345175284141 0.60119515803921 0.53989473529502 15.999 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.0621023 0.0000000 0.0022060 0.0000000 4.0620180 0.0000000 0.0022049 0.0000000 4.0195068 -------------------------- Born effective charges -------------------------- 1 Sr 2.5433304 -0.1046440 -0.0139997 -0.1159552 2.4836235 0.0041730 0.0037048 0.0064536 2.4419726 2 Sr 2.5433304 0.1046440 -0.0139997 0.1159552 2.4836235 -0.0041730 0.0037048 -0.0064536 2.4419726 3 Sr 2.5433304 -0.1046440 -0.0139997 -0.1159552 2.4836235 0.0041730 0.0037048 0.0064536 2.4419726 4 Sr 2.5433304 0.1046440 -0.0139997 0.1159552 2.4836235 -0.0041730 0.0037048 -0.0064536 2.4419726 5 Ho 4.1396826 -0.2236363 0.3689562 0.1330617 4.1233216 0.0729557 -0.2347018 0.1242239 4.1247528 6 Ho 4.1396826 0.2236363 0.3689562 -0.1330617 4.1233216 -0.0729557 -0.2347018 -0.1242239 4.1247528 7 Sb 4.8325477 0.1689626 -0.2845535 -0.0939210 4.8884096 0.0580822 0.1787995 0.0969927 4.8736642 8 Sb 4.8325477 -0.1689626 -0.2845535 0.0939210 4.8884096 -0.0580822 0.1787995 -0.0969927 4.8736642 9 O -1.9520545 0.0500965 -0.0497835 0.0967878 -1.7895421 -0.0140822 -0.0047863 0.0108431 -3.2476987 10 O -1.9520545 0.0500965 -0.0497835 0.0967878 -1.7895421 -0.0140822 -0.0047863 0.0108431 -3.2476987 11 O -2.5199301 0.6641948 0.0347562 0.7207500 -2.6055956 -0.0405647 0.0314873 -0.0910220 -1.8451134 12 O -2.5574609 0.7044005 -0.0131744 0.6879727 -2.5943514 0.0698745 -0.0024547 0.0211433 -1.8483691 13 O -2.5199301 -0.6641948 0.0347562 -0.7207500 -2.6055956 0.0405647 0.0314873 0.0910220 -1.8451134 14 O -1.9520545 -0.0500965 -0.0497835 -0.0967878 -1.7895421 0.0140822 -0.0047863 -0.0108431 -3.2476987 15 O -2.5199301 0.6641948 0.0347562 0.7207500 -2.6055956 -0.0405647 0.0314873 -0.0910220 -1.8451134 16 O -2.5574609 -0.7044005 -0.0131744 -0.6879727 -2.5943514 -0.0698745 -0.0024547 -0.0211433 -1.8483691 17 O -2.5574609 -0.7044005 -0.0131744 -0.6879727 -2.5943514 -0.0698745 -0.0024547 -0.0211433 -1.8483691 18 O -1.9520545 -0.0500965 -0.0497835 -0.0967878 -1.7895421 0.0140822 -0.0047863 -0.0108431 -3.2476987 19 O -2.5199301 -0.6641948 0.0347562 -0.7207500 -2.6055956 0.0405647 0.0314873 0.0910220 -1.8451134 20 O -2.5574609 0.7044005 -0.0131744 0.6879727 -2.5943514 0.0698745 -0.0024547 0.0211433 -1.8483691 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.542 Solver_block: 200 / 640 - Time: 2.482 Solver_block: 300 / 640 - Time: 2.497 Solver_block: 400 / 640 - Time: 2.476 Solver_block: 500 / 640 - Time: 2.359 Solver_block: 600 / 640 - Time: 2.404 Solver_block: 640 / 640 - Time: 1.060 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 16.233 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 13:53:39]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:53:40]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.786530630000109 0.000000000000000 0.000000000000000 b 0.000000000000000 5.843820660000000 0.000000000000000 c -5.754183758751183 0.000000000000000 8.208354266260987 Atomic positions (fractional): 1 Sr 0.25883536684350 0.53431053045280 0.25038811771974 87.620 2 Sr 0.74116463315649 0.03431053045280 0.24961188228026 87.620 3 Sr 0.74116463315649 0.46568946954720 0.74961188228026 87.620 4 Sr 0.25883536684350 0.96568946954720 0.75038811771974 87.620 5 Ho 0.00000000000000 0.50000000000000 0.50000000000000 164.930 6 Ho 0.00000000000000 0.00000000000000 0.00000000000000 164.930 7 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 8 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 9 O 0.18602949034976 0.97903668396432 0.26312882683730 15.999 10 O 0.81397050965024 0.02096331603568 0.73687117316270 15.999 11 O 0.34277546157512 0.77413963126583 0.04219120732189 15.999 12 O 0.73309649431718 0.79760968392157 0.46010526470497 15.999 13 O 0.65722453842488 0.27413963126583 0.45780879267811 15.999 14 O 0.18602949034976 0.52096331603568 0.76312882683730 15.999 15 O 0.65722453842488 0.22586036873417 0.95780879267811 15.999 16 O 0.73309649431718 0.70239031607843 0.96010526470498 15.999 17 O 0.26690350568282 0.29760968392157 0.03989473529502 15.999 18 O 0.81397050965024 0.47903668396432 0.23687117316270 15.999 19 O 0.34277546157512 0.72586036873417 0.54219120732189 15.999 20 O 0.26690350568282 0.20239031607843 0.53989473529502 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.573061260000218 0.000000000000000 0.000000000000000 b 0.000000000000000 11.687641319999999 0.000000000000000 c -5.754183758751183 0.000000000000000 8.208354266260987 Atomic positions (fractional): 1 Sr 0.12941768342175 0.26715526522640 0.25038811771974 87.620 > 1 2 Sr 0.62941768342175 0.26715526522640 0.25038811771974 87.620 > 1 3 Sr 0.12941768342175 0.76715526522640 0.25038811771974 87.620 > 1 4 Sr 0.62941768342175 0.76715526522640 0.25038811771974 87.620 > 1 5 Sr 0.37058231657825 0.01715526522640 0.24961188228026 87.620 > 5 6 Sr 0.87058231657825 0.01715526522640 0.24961188228026 87.620 > 5 7 Sr 0.37058231657825 0.51715526522640 0.24961188228026 87.620 > 5 8 Sr 0.87058231657825 0.51715526522640 0.24961188228026 87.620 > 5 9 Sr 0.37058231657825 0.23284473477360 0.74961188228026 87.620 > 9 10 Sr 0.87058231657825 0.23284473477360 0.74961188228026 87.620 > 9 11 Sr 0.37058231657825 0.73284473477360 0.74961188228026 87.620 > 9 12 Sr 0.87058231657825 0.73284473477360 0.74961188228026 87.620 > 9 13 Sr 0.12941768342175 0.48284473477360 0.75038811771974 87.620 > 13 14 Sr 0.62941768342175 0.48284473477360 0.75038811771974 87.620 > 13 15 Sr 0.12941768342175 0.98284473477360 0.75038811771974 87.620 > 13 16 Sr 0.62941768342175 0.98284473477360 0.75038811771974 87.620 > 13 17 Ho 0.00000000000000 0.25000000000000 0.50000000000000 164.930 > 17 18 Ho 0.50000000000000 0.25000000000000 0.50000000000000 164.930 > 17 19 Ho 0.00000000000000 0.75000000000000 0.50000000000000 164.930 > 17 20 Ho 0.50000000000000 0.75000000000000 0.50000000000000 164.930 > 17 21 Ho 0.00000000000000 0.00000000000000 0.00000000000000 164.930 > 21 22 Ho 0.50000000000000 0.00000000000000 0.00000000000000 164.930 > 21 23 Ho 0.00000000000000 0.50000000000000 0.00000000000000 164.930 > 21 24 Ho 0.50000000000000 0.50000000000000 0.00000000000000 164.930 > 21 25 Sb 0.25000000000000 0.00000000000000 0.50000000000000 121.760 > 25 26 Sb 0.75000000000000 0.00000000000000 0.50000000000000 121.760 > 25 27 Sb 0.25000000000000 0.50000000000000 0.50000000000000 121.760 > 25 28 Sb 0.75000000000000 0.50000000000000 0.50000000000000 121.760 > 25 29 Sb 0.25000000000000 0.25000000000000 0.00000000000000 121.760 > 29 30 Sb 0.75000000000000 0.25000000000000 0.00000000000000 121.760 > 29 31 Sb 0.25000000000000 0.75000000000000 0.00000000000000 121.760 > 29 32 Sb 0.75000000000000 0.75000000000000 0.00000000000000 121.760 > 29 33 O 0.09301474517488 0.48951834198216 0.26312882683730 15.999 > 33 34 O 0.59301474517488 0.48951834198216 0.26312882683730 15.999 > 33 35 O 0.09301474517488 0.98951834198216 0.26312882683730 15.999 > 33 36 O 0.59301474517488 0.98951834198216 0.26312882683730 15.999 > 33 37 O 0.40698525482512 0.01048165801784 0.73687117316270 15.999 > 37 38 O 0.90698525482512 0.01048165801784 0.73687117316270 15.999 > 37 39 O 0.40698525482512 0.51048165801784 0.73687117316270 15.999 > 37 40 O 0.90698525482512 0.51048165801784 0.73687117316270 15.999 > 37 41 O 0.17138773078756 0.38706981563291 0.04219120732189 15.999 > 41 42 O 0.67138773078756 0.38706981563291 0.04219120732189 15.999 > 41 43 O 0.17138773078756 0.88706981563291 0.04219120732189 15.999 > 41 44 O 0.67138773078756 0.88706981563291 0.04219120732189 15.999 > 41 45 O 0.36654824715859 0.39880484196079 0.46010526470497 15.999 > 45 46 O 0.86654824715859 0.39880484196079 0.46010526470497 15.999 > 45 47 O 0.36654824715859 0.89880484196079 0.46010526470497 15.999 > 45 48 O 0.86654824715859 0.89880484196079 0.46010526470497 15.999 > 45 49 O 0.32861226921244 0.13706981563291 0.45780879267811 15.999 > 49 50 O 0.82861226921244 0.13706981563291 0.45780879267811 15.999 > 49 51 O 0.32861226921244 0.63706981563291 0.45780879267811 15.999 > 49 52 O 0.82861226921244 0.63706981563291 0.45780879267811 15.999 > 49 53 O 0.09301474517488 0.26048165801784 0.76312882683730 15.999 > 53 54 O 0.59301474517488 0.26048165801784 0.76312882683730 15.999 > 53 55 O 0.09301474517488 0.76048165801784 0.76312882683730 15.999 > 53 56 O 0.59301474517488 0.76048165801784 0.76312882683730 15.999 > 53 57 O 0.32861226921244 0.11293018436709 0.95780879267811 15.999 > 57 58 O 0.82861226921244 0.11293018436709 0.95780879267811 15.999 > 57 59 O 0.32861226921244 0.61293018436709 0.95780879267811 15.999 > 57 60 O 0.82861226921244 0.61293018436709 0.95780879267811 15.999 > 57 61 O 0.36654824715859 0.35119515803921 0.96010526470498 15.999 > 61 62 O 0.86654824715859 0.35119515803921 0.96010526470498 15.999 > 61 63 O 0.36654824715859 0.85119515803921 0.96010526470498 15.999 > 61 64 O 0.86654824715859 0.85119515803921 0.96010526470498 15.999 > 61 65 O 0.13345175284141 0.14880484196079 0.03989473529502 15.999 > 65 66 O 0.63345175284141 0.14880484196079 0.03989473529502 15.999 > 65 67 O 0.13345175284141 0.64880484196079 0.03989473529502 15.999 > 65 68 O 0.63345175284141 0.64880484196079 0.03989473529502 15.999 > 65 69 O 0.40698525482512 0.23951834198216 0.23687117316270 15.999 > 69 70 O 0.90698525482512 0.23951834198216 0.23687117316270 15.999 > 69 71 O 0.40698525482512 0.73951834198216 0.23687117316270 15.999 > 69 72 O 0.90698525482512 0.73951834198216 0.23687117316270 15.999 > 69 73 O 0.17138773078756 0.36293018436709 0.54219120732189 15.999 > 73 74 O 0.67138773078756 0.36293018436709 0.54219120732189 15.999 > 73 75 O 0.17138773078756 0.86293018436709 0.54219120732189 15.999 > 73 76 O 0.67138773078756 0.86293018436709 0.54219120732189 15.999 > 73 77 O 0.13345175284141 0.10119515803921 0.53989473529502 15.999 > 77 78 O 0.63345175284141 0.10119515803921 0.53989473529502 15.999 > 77 79 O 0.13345175284141 0.60119515803921 0.53989473529502 15.999 > 77 80 O 0.63345175284141 0.60119515803921 0.53989473529502 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.0621023 0.0000000 0.0022060 0.0000000 4.0620180 0.0000000 0.0022049 0.0000000 4.0195068 -------------------------- Born effective charges -------------------------- 1 Sr 2.5433304 -0.1046440 -0.0139997 -0.1159552 2.4836235 0.0041730 0.0037048 0.0064536 2.4419726 2 Sr 2.5433304 0.1046440 -0.0139997 0.1159552 2.4836235 -0.0041730 0.0037048 -0.0064536 2.4419726 3 Sr 2.5433304 -0.1046440 -0.0139997 -0.1159552 2.4836235 0.0041730 0.0037048 0.0064536 2.4419726 4 Sr 2.5433304 0.1046440 -0.0139997 0.1159552 2.4836235 -0.0041730 0.0037048 -0.0064536 2.4419726 5 Ho 4.1396826 -0.2236363 0.3689562 0.1330617 4.1233216 0.0729557 -0.2347018 0.1242239 4.1247528 6 Ho 4.1396826 0.2236363 0.3689562 -0.1330617 4.1233216 -0.0729557 -0.2347018 -0.1242239 4.1247528 7 Sb 4.8325477 0.1689626 -0.2845535 -0.0939210 4.8884096 0.0580822 0.1787995 0.0969927 4.8736642 8 Sb 4.8325477 -0.1689626 -0.2845535 0.0939210 4.8884096 -0.0580822 0.1787995 -0.0969927 4.8736642 9 O -1.9520545 0.0500965 -0.0497835 0.0967878 -1.7895421 -0.0140822 -0.0047863 0.0108431 -3.2476987 10 O -1.9520545 0.0500965 -0.0497835 0.0967878 -1.7895421 -0.0140822 -0.0047863 0.0108431 -3.2476987 11 O -2.5199301 0.6641948 0.0347562 0.7207500 -2.6055956 -0.0405647 0.0314873 -0.0910220 -1.8451134 12 O -2.5574609 0.7044005 -0.0131744 0.6879727 -2.5943514 0.0698745 -0.0024547 0.0211433 -1.8483691 13 O -2.5199301 -0.6641948 0.0347562 -0.7207500 -2.6055956 0.0405647 0.0314873 0.0910220 -1.8451134 14 O -1.9520545 -0.0500965 -0.0497835 -0.0967878 -1.7895421 0.0140822 -0.0047863 -0.0108431 -3.2476987 15 O -2.5199301 0.6641948 0.0347562 0.7207500 -2.6055956 -0.0405647 0.0314873 -0.0910220 -1.8451134 16 O -2.5574609 -0.7044005 -0.0131744 -0.6879727 -2.5943514 -0.0698745 -0.0024547 -0.0211433 -1.8483691 17 O -2.5574609 -0.7044005 -0.0131744 -0.6879727 -2.5943514 -0.0698745 -0.0024547 -0.0211433 -1.8483691 18 O -1.9520545 -0.0500965 -0.0497835 -0.0967878 -1.7895421 0.0140822 -0.0047863 -0.0108431 -3.2476987 19 O -2.5199301 -0.6641948 0.0347562 -0.7207500 -2.6055956 0.0405647 0.0314873 0.0910220 -1.8451134 20 O -2.5574609 0.7044005 -0.0131744 0.6879727 -2.5943514 0.0698745 -0.0024547 0.0211433 -1.8483691 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Computing fc3[ 45, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0057 0.0000 0.0082] [ 0.0057 0.0000 -0.0082] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000004 (zzz) -0.00000004 (zzz) -0.00000004 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000025 (yx) -0.00000025 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:53:57]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:53:58]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.786530630000109 0.000000000000000 0.000000000000000 b 0.000000000000000 5.843820660000000 0.000000000000000 c -5.754183758751183 0.000000000000000 8.208354266260987 Atomic positions (fractional): 1 Sr 0.25883536684350 0.53431053045280 0.25038811771974 87.620 2 Sr 0.74116463315649 0.03431053045280 0.24961188228026 87.620 3 Sr 0.74116463315649 0.46568946954720 0.74961188228026 87.620 4 Sr 0.25883536684350 0.96568946954720 0.75038811771974 87.620 5 Ho 0.00000000000000 0.50000000000000 0.50000000000000 164.930 6 Ho 0.00000000000000 0.00000000000000 0.00000000000000 164.930 7 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 8 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 9 O 0.18602949034976 0.97903668396432 0.26312882683730 15.999 10 O 0.81397050965024 0.02096331603568 0.73687117316270 15.999 11 O 0.34277546157512 0.77413963126583 0.04219120732189 15.999 12 O 0.73309649431718 0.79760968392157 0.46010526470497 15.999 13 O 0.65722453842488 0.27413963126583 0.45780879267811 15.999 14 O 0.18602949034976 0.52096331603568 0.76312882683730 15.999 15 O 0.65722453842488 0.22586036873417 0.95780879267811 15.999 16 O 0.73309649431718 0.70239031607843 0.96010526470498 15.999 17 O 0.26690350568282 0.29760968392157 0.03989473529502 15.999 18 O 0.81397050965024 0.47903668396432 0.23687117316270 15.999 19 O 0.34277546157512 0.72586036873417 0.54219120732189 15.999 20 O 0.26690350568282 0.20239031607843 0.53989473529502 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.573061260000218 0.000000000000000 0.000000000000000 b 0.000000000000000 11.687641319999999 0.000000000000000 c -5.754183758751183 0.000000000000000 8.208354266260987 Atomic positions (fractional): 1 Sr 0.12941768342175 0.26715526522640 0.25038811771974 87.620 > 1 2 Sr 0.62941768342175 0.26715526522640 0.25038811771974 87.620 > 1 3 Sr 0.12941768342175 0.76715526522640 0.25038811771974 87.620 > 1 4 Sr 0.62941768342175 0.76715526522640 0.25038811771974 87.620 > 1 5 Sr 0.37058231657825 0.01715526522640 0.24961188228026 87.620 > 5 6 Sr 0.87058231657825 0.01715526522640 0.24961188228026 87.620 > 5 7 Sr 0.37058231657825 0.51715526522640 0.24961188228026 87.620 > 5 8 Sr 0.87058231657825 0.51715526522640 0.24961188228026 87.620 > 5 9 Sr 0.37058231657825 0.23284473477360 0.74961188228026 87.620 > 9 10 Sr 0.87058231657825 0.23284473477360 0.74961188228026 87.620 > 9 11 Sr 0.37058231657825 0.73284473477360 0.74961188228026 87.620 > 9 12 Sr 0.87058231657825 0.73284473477360 0.74961188228026 87.620 > 9 13 Sr 0.12941768342175 0.48284473477360 0.75038811771974 87.620 > 13 14 Sr 0.62941768342175 0.48284473477360 0.75038811771974 87.620 > 13 15 Sr 0.12941768342175 0.98284473477360 0.75038811771974 87.620 > 13 16 Sr 0.62941768342175 0.98284473477360 0.75038811771974 87.620 > 13 17 Ho 0.00000000000000 0.25000000000000 0.50000000000000 164.930 > 17 18 Ho 0.50000000000000 0.25000000000000 0.50000000000000 164.930 > 17 19 Ho 0.00000000000000 0.75000000000000 0.50000000000000 164.930 > 17 20 Ho 0.50000000000000 0.75000000000000 0.50000000000000 164.930 > 17 21 Ho 0.00000000000000 0.00000000000000 0.00000000000000 164.930 > 21 22 Ho 0.50000000000000 0.00000000000000 0.00000000000000 164.930 > 21 23 Ho 0.00000000000000 0.50000000000000 0.00000000000000 164.930 > 21 24 Ho 0.50000000000000 0.50000000000000 0.00000000000000 164.930 > 21 25 Sb 0.25000000000000 0.00000000000000 0.50000000000000 121.760 > 25 26 Sb 0.75000000000000 0.00000000000000 0.50000000000000 121.760 > 25 27 Sb 0.25000000000000 0.50000000000000 0.50000000000000 121.760 > 25 28 Sb 0.75000000000000 0.50000000000000 0.50000000000000 121.760 > 25 29 Sb 0.25000000000000 0.25000000000000 0.00000000000000 121.760 > 29 30 Sb 0.75000000000000 0.25000000000000 0.00000000000000 121.760 > 29 31 Sb 0.25000000000000 0.75000000000000 0.00000000000000 121.760 > 29 32 Sb 0.75000000000000 0.75000000000000 0.00000000000000 121.760 > 29 33 O 0.09301474517488 0.48951834198216 0.26312882683730 15.999 > 33 34 O 0.59301474517488 0.48951834198216 0.26312882683730 15.999 > 33 35 O 0.09301474517488 0.98951834198216 0.26312882683730 15.999 > 33 36 O 0.59301474517488 0.98951834198216 0.26312882683730 15.999 > 33 37 O 0.40698525482512 0.01048165801784 0.73687117316270 15.999 > 37 38 O 0.90698525482512 0.01048165801784 0.73687117316270 15.999 > 37 39 O 0.40698525482512 0.51048165801784 0.73687117316270 15.999 > 37 40 O 0.90698525482512 0.51048165801784 0.73687117316270 15.999 > 37 41 O 0.17138773078756 0.38706981563291 0.04219120732189 15.999 > 41 42 O 0.67138773078756 0.38706981563291 0.04219120732189 15.999 > 41 43 O 0.17138773078756 0.88706981563291 0.04219120732189 15.999 > 41 44 O 0.67138773078756 0.88706981563291 0.04219120732189 15.999 > 41 45 O 0.36654824715859 0.39880484196079 0.46010526470497 15.999 > 45 46 O 0.86654824715859 0.39880484196079 0.46010526470497 15.999 > 45 47 O 0.36654824715859 0.89880484196079 0.46010526470497 15.999 > 45 48 O 0.86654824715859 0.89880484196079 0.46010526470497 15.999 > 45 49 O 0.32861226921244 0.13706981563291 0.45780879267811 15.999 > 49 50 O 0.82861226921244 0.13706981563291 0.45780879267811 15.999 > 49 51 O 0.32861226921244 0.63706981563291 0.45780879267811 15.999 > 49 52 O 0.82861226921244 0.63706981563291 0.45780879267811 15.999 > 49 53 O 0.09301474517488 0.26048165801784 0.76312882683730 15.999 > 53 54 O 0.59301474517488 0.26048165801784 0.76312882683730 15.999 > 53 55 O 0.09301474517488 0.76048165801784 0.76312882683730 15.999 > 53 56 O 0.59301474517488 0.76048165801784 0.76312882683730 15.999 > 53 57 O 0.32861226921244 0.11293018436709 0.95780879267811 15.999 > 57 58 O 0.82861226921244 0.11293018436709 0.95780879267811 15.999 > 57 59 O 0.32861226921244 0.61293018436709 0.95780879267811 15.999 > 57 60 O 0.82861226921244 0.61293018436709 0.95780879267811 15.999 > 57 61 O 0.36654824715859 0.35119515803921 0.96010526470498 15.999 > 61 62 O 0.86654824715859 0.35119515803921 0.96010526470498 15.999 > 61 63 O 0.36654824715859 0.85119515803921 0.96010526470498 15.999 > 61 64 O 0.86654824715859 0.85119515803921 0.96010526470498 15.999 > 61 65 O 0.13345175284141 0.14880484196079 0.03989473529502 15.999 > 65 66 O 0.63345175284141 0.14880484196079 0.03989473529502 15.999 > 65 67 O 0.13345175284141 0.64880484196079 0.03989473529502 15.999 > 65 68 O 0.63345175284141 0.64880484196079 0.03989473529502 15.999 > 65 69 O 0.40698525482512 0.23951834198216 0.23687117316270 15.999 > 69 70 O 0.90698525482512 0.23951834198216 0.23687117316270 15.999 > 69 71 O 0.40698525482512 0.73951834198216 0.23687117316270 15.999 > 69 72 O 0.90698525482512 0.73951834198216 0.23687117316270 15.999 > 69 73 O 0.17138773078756 0.36293018436709 0.54219120732189 15.999 > 73 74 O 0.67138773078756 0.36293018436709 0.54219120732189 15.999 > 73 75 O 0.17138773078756 0.86293018436709 0.54219120732189 15.999 > 73 76 O 0.67138773078756 0.86293018436709 0.54219120732189 15.999 > 73 77 O 0.13345175284141 0.10119515803921 0.53989473529502 15.999 > 77 78 O 0.63345175284141 0.10119515803921 0.53989473529502 15.999 > 77 79 O 0.13345175284141 0.60119515803921 0.53989473529502 15.999 > 77 80 O 0.63345175284141 0.60119515803921 0.53989473529502 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.0621023 0.0000000 0.0022060 0.0000000 4.0620180 0.0000000 0.0022049 0.0000000 4.0195068 -------------------------- Born effective charges -------------------------- 1 Sr 2.5433304 -0.1046440 -0.0139997 -0.1159552 2.4836235 0.0041730 0.0037048 0.0064536 2.4419726 2 Sr 2.5433304 0.1046440 -0.0139997 0.1159552 2.4836235 -0.0041730 0.0037048 -0.0064536 2.4419726 3 Sr 2.5433304 -0.1046440 -0.0139997 -0.1159552 2.4836235 0.0041730 0.0037048 0.0064536 2.4419726 4 Sr 2.5433304 0.1046440 -0.0139997 0.1159552 2.4836235 -0.0041730 0.0037048 -0.0064536 2.4419726 5 Ho 4.1396826 -0.2236363 0.3689562 0.1330617 4.1233216 0.0729557 -0.2347018 0.1242239 4.1247528 6 Ho 4.1396826 0.2236363 0.3689562 -0.1330617 4.1233216 -0.0729557 -0.2347018 -0.1242239 4.1247528 7 Sb 4.8325477 0.1689626 -0.2845535 -0.0939210 4.8884096 0.0580822 0.1787995 0.0969927 4.8736642 8 Sb 4.8325477 -0.1689626 -0.2845535 0.0939210 4.8884096 -0.0580822 0.1787995 -0.0969927 4.8736642 9 O -1.9520545 0.0500965 -0.0497835 0.0967878 -1.7895421 -0.0140822 -0.0047863 0.0108431 -3.2476987 10 O -1.9520545 0.0500965 -0.0497835 0.0967878 -1.7895421 -0.0140822 -0.0047863 0.0108431 -3.2476987 11 O -2.5199301 0.6641948 0.0347562 0.7207500 -2.6055956 -0.0405647 0.0314873 -0.0910220 -1.8451134 12 O -2.5574609 0.7044005 -0.0131744 0.6879727 -2.5943514 0.0698745 -0.0024547 0.0211433 -1.8483691 13 O -2.5199301 -0.6641948 0.0347562 -0.7207500 -2.6055956 0.0405647 0.0314873 0.0910220 -1.8451134 14 O -1.9520545 -0.0500965 -0.0497835 -0.0967878 -1.7895421 0.0140822 -0.0047863 -0.0108431 -3.2476987 15 O -2.5199301 0.6641948 0.0347562 0.7207500 -2.6055956 -0.0405647 0.0314873 -0.0910220 -1.8451134 16 O -2.5574609 -0.7044005 -0.0131744 -0.6879727 -2.5943514 -0.0698745 -0.0024547 -0.0211433 -1.8483691 17 O -2.5574609 -0.7044005 -0.0131744 -0.6879727 -2.5943514 -0.0698745 -0.0024547 -0.0211433 -1.8483691 18 O -1.9520545 -0.0500965 -0.0497835 -0.0967878 -1.7895421 0.0140822 -0.0047863 -0.0108431 -3.2476987 19 O -2.5199301 -0.6641948 0.0347562 -0.7207500 -2.6055956 0.0405647 0.0314873 0.0910220 -1.8451134 20 O -2.5574609 0.7044005 -0.0131744 0.6879727 -2.5943514 0.0698745 -0.0024547 0.0211433 -1.8483691 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000004 (zzz) -0.00000004 (zzz) -0.00000004 (zzz) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 9 6 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.64, Number of G-points: 319, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/170) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.594 ( 0.000 0.000 0.000) 0.000 2.756 ( 0.000 0.000 0.000) 0.000 2.958 ( 0.000 0.000 0.000) 0.000 3.069 ( 0.000 0.000 0.000) 0.000 3.299 ( 0.000 0.000 0.000) 0.000 3.365 ( 0.000 0.000 0.000) 0.000 3.410 ( 0.000 0.000 0.000) 0.000 3.611 ( 0.000 0.000 0.000) 0.000 3.771 ( 0.000 0.000 0.000) 0.000 3.795 ( 0.000 0.000 0.000) 0.000 3.938 ( 0.000 0.000 0.000) 0.000 4.134 ( 0.000 0.000 0.000) 0.000 4.237 ( 0.000 0.000 0.000) 0.000 4.265 ( 0.000 0.000 0.000) 0.000 4.327 ( 0.000 0.000 0.000) 0.000 4.514 ( 0.000 0.000 0.000) 0.000 4.622 ( 0.000 0.000 0.000) 0.000 5.137 ( 0.000 0.000 0.000) 0.000 5.387 ( 0.000 0.000 0.000) 0.000 5.642 ( 0.000 0.000 0.000) 0.000 5.696 ( 0.000 0.000 0.000) 0.000 5.888 ( 0.000 0.000 0.000) 0.000 5.955 ( 0.000 0.000 0.000) 0.000 6.234 ( 0.000 0.000 0.000) 0.000 6.419 ( 0.000 0.000 0.000) 0.000 7.261 ( 0.000 0.000 0.000) 0.000 7.422 ( 0.000 0.000 0.000) 0.000 7.430 ( 0.000 0.000 0.000) 0.000 7.862 ( 0.000 0.000 0.000) 0.000 7.876 ( 0.000 0.000 0.000) 0.000 7.964 ( 0.000 0.000 0.000) 0.000 8.892 ( 0.000 0.000 0.000) 0.000 9.508 ( 0.000 0.000 0.000) 0.000 9.616 ( 0.000 0.000 0.000) 0.000 9.704 ( 0.000 0.000 0.000) 0.000 10.019 ( 0.000 0.000 0.000) 0.000 10.321 ( 0.000 0.000 0.000) 0.000 10.590 ( 0.000 0.000 0.000) 0.000 10.851 ( 0.000 0.000 0.000) 0.000 11.271 ( 0.000 0.000 0.000) 0.000 11.371 ( 0.000 0.000 0.000) 0.000 11.680 ( 0.000 0.000 0.000) 0.000 11.817 ( 0.000 0.000 0.000) 0.000 12.651 ( 0.000 0.000 0.000) 0.000 13.212 ( 0.000 0.000 0.000) 0.000 17.217 ( 0.000 0.000 0.000) 0.000 17.287 ( 0.000 0.000 0.000) 0.000 17.349 ( 0.000 0.000 0.000) 0.000 17.836 ( 0.000 0.000 0.000) 0.000 17.896 ( 0.000 0.000 0.000) 0.000 17.963 ( 0.000 0.000 0.000) 0.000 18.131 ( 0.000 0.000 0.000) 0.000 18.217 ( 0.000 0.000 0.000) 0.000 18.326 ( 0.000 0.000 0.000) 0.000 20.835 ( 0.000 0.000 0.000) 0.000 21.655 ( 0.000 0.000 0.000) 0.000 22.041 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/170) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.636 ( 23.617 0.000 22.557) 32.658 0.684 ( 28.587 0.000 19.869) 34.814 1.147 ( 47.172 0.000 34.369) 58.365 2.589 ( 2.726 0.000 -6.749) 7.279 2.697 ( -0.488 0.000 -8.982) 8.996 3.026 ( -4.355 0.000 -0.039) 4.355 3.079 ( 6.082 0.000 5.283) 8.056 3.286 ( -13.078 0.000 -1.284) 13.141 3.361 ( 6.417 0.000 -3.637) 7.376 3.381 ( -0.348 0.000 7.962) 7.969 3.609 ( -3.039 0.000 5.595) 6.367 3.740 ( -2.809 0.000 -1.479) 3.175 3.830 ( -1.320 0.000 7.643) 7.756 4.066 ( -12.001 0.000 15.418) 19.538 4.071 ( -3.098 0.000 -6.034) 6.783 4.196 ( 1.786 0.000 0.525) 1.862 4.404 ( -5.833 0.000 -8.333) 10.171 4.476 ( 10.001 0.000 5.169) 11.258 4.530 ( 6.752 0.000 -2.770) 7.298 4.690 ( 4.618 0.000 5.738) 7.365 5.054 ( -6.212 0.000 -4.667) 7.770 5.398 ( 2.104 0.000 -1.203) 2.423 5.702 ( -0.484 0.000 1.353) 1.437 5.845 ( -5.167 0.000 -1.452) 5.367 5.907 ( 1.790 0.000 0.096) 1.793 6.271 ( 3.356 0.000 1.641) 3.736 6.327 ( -8.548 0.000 -2.018) 8.782 7.015 ( -1.186 0.000 -4.248) 4.411 7.259 ( -2.536 0.000 2.521) 3.576 7.393 ( -2.347 0.000 -1.420) 2.743 7.430 ( 0.198 0.000 -0.601) 0.633 7.879 ( 0.345 0.000 -3.932) 3.947 7.892 ( 2.826 0.000 1.998) 3.461 8.100 ( 5.601 0.000 2.554) 6.156 8.971 ( 8.233 0.000 1.982) 8.469 9.462 ( -4.802 0.000 -3.012) 5.669 9.606 ( -1.005 0.000 -0.375) 1.073 9.764 ( 5.568 0.000 -0.802) 5.626 10.122 ( -6.568 0.000 11.757) 13.467 10.562 ( -2.147 0.000 -1.687) 2.731 10.827 ( -1.899 0.000 2.652) 3.262 11.206 ( -9.122 0.000 2.869) 9.563 11.359 ( -1.156 0.000 -1.948) 2.265 11.663 ( -3.039 0.000 0.770) 3.134 11.883 ( 7.869 0.000 0.765) 7.907 12.683 ( 6.165 0.000 -3.183) 6.938 13.192 ( 16.915 0.000 -21.052) 27.005 13.204 ( 0.098 0.000 -1.539) 1.542 17.090 ( -13.328 0.000 -0.945) 13.361 17.158 ( -14.087 0.000 -0.320) 14.090 17.238 ( -10.442 0.000 -2.520) 10.742 17.814 ( -5.577 0.000 -12.515) 13.702 17.954 ( 11.031 0.000 1.108) 11.087 18.047 ( 7.767 0.000 2.000) 8.021 18.188 ( -1.058 0.000 3.039) 3.218 18.302 ( -0.211 0.000 11.278) 11.280 20.953 ( 9.617 0.000 5.740) 11.200 21.207 ( 4.314 0.000 -4.046) 5.915 21.656 ( -0.633 0.000 1.001) 1.184 22.040 ( -0.406 0.000 0.290) 0.499 ======================= Grid point 2 (3/170) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.221 ( 20.633 0.000 19.738) 28.554 1.323 ( 25.670 0.000 18.261) 31.503 2.184 ( 36.601 0.000 26.931) 45.441 2.482 ( -2.423 0.000 -12.772) 13.000 2.623 ( 5.648 0.000 -7.287) 9.220 2.983 ( -4.552 0.000 1.560) 4.812 3.051 ( -12.161 0.000 1.462) 12.248 3.181 ( 2.393 0.000 1.015) 2.600 3.391 ( 2.344 0.000 -0.550) 2.407 3.594 ( 6.632 0.000 9.090) 11.252 3.624 ( -3.269 0.000 3.232) 4.597 3.667 ( 2.357 0.000 -3.013) 3.826 3.865 ( -6.096 0.000 4.197) 7.401 3.911 ( -16.456 0.000 -2.056) 16.584 4.019 ( 2.678 0.000 1.050) 2.877 4.190 ( -4.261 0.000 4.632) 6.294 4.301 ( -1.902 0.000 3.727) 4.184 4.638 ( 8.150 0.000 4.226) 9.180 4.705 ( 16.361 0.000 -6.117) 17.467 4.873 ( 7.589 0.000 7.160) 10.433 4.883 ( -8.471 0.000 -3.248) 9.072 5.427 ( 3.945 0.000 -1.689) 4.291 5.628 ( -7.181 0.000 -9.838) 12.180 5.742 ( -3.341 0.000 0.651) 3.404 5.930 ( 0.645 0.000 0.294) 0.709 6.171 ( -8.694 0.000 0.112) 8.695 6.355 ( 1.377 0.000 4.946) 5.134 6.910 ( -5.960 0.000 -4.877) 7.701 7.218 ( -5.312 0.000 1.444) 5.505 7.335 ( -2.001 0.000 -2.363) 3.097 7.416 ( -0.398 0.000 -1.994) 2.033 7.791 ( -3.458 0.000 -7.971) 8.689 8.008 ( 6.222 0.000 6.169) 8.762 8.241 ( 8.405 0.000 1.489) 8.536 9.172 ( 13.005 0.000 2.702) 13.282 9.391 ( 0.202 0.000 -1.799) 1.810 9.582 ( -1.102 0.000 -0.265) 1.134 9.833 ( 5.246 0.000 -2.142) 5.666 10.159 ( -1.427 0.000 6.101) 6.266 10.501 ( -1.636 0.000 -2.660) 3.123 10.815 ( -5.023 0.000 4.508) 6.749 11.071 ( -11.015 0.000 1.719) 11.148 11.287 ( -5.795 0.000 -0.573) 5.824 11.598 ( -5.238 0.000 -0.489) 5.261 12.069 ( 12.644 0.000 2.799) 12.950 12.757 ( 9.062 0.000 -6.479) 11.140 13.187 ( 0.234 0.000 -1.187) 1.210 13.235 ( 8.500 0.000 -7.921) 11.619 16.842 ( -16.112 0.000 -0.333) 16.115 16.897 ( -17.298 0.000 -0.582) 17.308 17.014 ( -12.405 0.000 -3.991) 13.031 17.454 ( -14.015 0.000 -20.335) 24.697 18.146 ( 11.039 0.000 1.025) 11.087 18.207 ( 6.105 0.000 7.149) 9.401 18.289 ( 7.179 0.000 3.268) 7.888 18.438 ( 3.197 0.000 8.041) 8.653 21.201 ( 12.360 0.000 4.960) 13.318 21.240 ( 5.851 0.000 -4.446) 7.349 21.663 ( -1.120 0.000 3.463) 3.640 22.031 ( -1.082 0.000 0.160) 1.094 ======================= Grid point 3 (4/170) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( 14.143 0.000 15.380) 20.894 1.881 ( 21.048 0.000 15.597) 26.197 2.309 ( -0.818 0.000 -9.820) 9.854 2.460 ( 1.152 0.000 -6.050) 6.158 2.769 ( -13.686 0.000 -2.423) 13.899 2.964 ( 13.852 0.000 1.686) 13.955 3.084 ( 1.069 0.000 7.045) 7.125 3.189 ( -0.918 0.000 -2.488) 2.652 3.379 ( -10.426 0.000 3.550) 11.014 3.528 ( -2.725 0.000 4.189) 4.997 3.535 ( -9.433 0.000 -0.909) 9.477 3.727 ( -8.100 0.000 -6.243) 10.227 3.779 ( 11.938 0.000 3.073) 12.327 4.027 ( 23.456 0.000 7.448) 24.610 4.126 ( 6.930 0.000 -0.299) 6.936 4.244 ( -3.073 0.000 16.541) 16.824 4.318 ( -3.907 0.000 3.653) 5.349 4.780 ( -3.899 0.000 5.218) 6.514 4.816 ( 6.601 0.000 5.134) 8.363 4.886 ( 16.916 0.000 -8.170) 18.786 5.015 ( 5.497 0.000 -0.729) 5.545 5.357 ( -9.751 0.000 -11.159) 14.819 5.504 ( 6.426 0.000 0.317) 6.434 5.689 ( -4.202 0.000 -1.609) 4.500 5.941 ( 0.044 0.000 1.590) 1.590 6.062 ( -5.986 0.000 0.729) 6.030 6.374 ( -9.386 0.000 8.201) 12.464 6.714 ( -10.937 0.000 -6.854) 12.908 7.153 ( -3.330 0.000 0.221) 3.337 7.282 ( -0.687 0.000 -2.875) 2.956 7.363 ( -2.248 0.000 -4.817) 5.316 7.611 ( -5.549 0.000 -9.554) 11.049 8.205 ( 7.893 0.000 8.201) 11.382 8.377 ( 6.637 0.000 1.256) 6.755 9.363 ( 5.638 0.000 -0.681) 5.679 9.438 ( 5.940 0.000 0.756) 5.988 9.617 ( 6.807 0.000 3.342) 7.583 9.887 ( 5.505 0.000 -3.172) 6.353 10.207 ( -0.078 0.000 4.505) 4.506 10.486 ( 3.409 0.000 -1.323) 3.656 10.764 ( -7.316 0.000 3.996) 8.336 10.895 ( -11.781 0.000 -1.432) 11.867 11.185 ( -7.264 0.000 1.480) 7.413 11.494 ( -6.268 0.000 -1.577) 6.463 12.317 ( 13.594 0.000 3.643) 14.073 12.791 ( 5.630 0.000 -9.258) 10.835 13.205 ( 2.409 0.000 1.024) 2.618 13.275 ( 4.228 0.000 -3.292) 5.359 16.601 ( -13.992 0.000 0.204) 13.994 16.627 ( -15.534 0.000 -0.766) 15.552 16.785 ( -10.709 0.000 -3.895) 11.395 17.006 ( -13.069 0.000 -19.751) 23.683 18.309 ( 8.011 0.000 1.019) 8.076 18.392 ( 5.846 0.000 8.762) 10.533 18.436 ( 6.597 0.000 2.881) 7.199 18.565 ( 2.988 0.000 5.842) 6.562 21.289 ( 6.267 0.000 -4.148) 7.516 21.380 ( 7.384 0.000 -3.009) 7.973 21.727 ( 1.304 0.000 9.171) 9.263 22.008 ( -1.836 0.000 -0.267) 1.856 ======================= Grid point 4 (5/170) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( 1.770 0.000 8.747) 8.924 2.187 ( 5.887 0.000 -3.409) 6.803 2.398 ( 0.107 0.000 -5.972) 5.973 2.409 ( 14.888 0.000 11.606) 18.877 2.570 ( -7.901 0.000 -0.508) 7.918 2.903 ( -3.658 0.000 -6.257) 7.248 3.085 ( -3.882 0.000 -6.437) 7.517 3.119 ( -9.377 0.000 4.593) 10.442 3.295 ( -4.338 0.000 0.608) 4.381 3.379 ( -3.042 0.000 -3.040) 4.300 3.507 ( -8.816 0.000 -8.282) 12.096 3.577 ( 1.390 0.000 4.948) 5.140 4.184 ( 3.784 0.000 3.803) 5.364 4.205 ( 11.879 0.000 0.249) 11.882 4.226 ( 7.945 0.000 -2.142) 8.229 4.381 ( -3.396 0.000 14.427) 14.821 4.595 ( 24.126 0.000 16.220) 29.072 4.867 ( 2.531 0.000 9.644) 9.971 4.897 ( -0.995 0.000 0.489) 1.109 5.048 ( 6.977 0.000 2.281) 7.341 5.121 ( 19.512 0.000 -11.555) 22.677 5.144 ( -4.319 0.000 -3.165) 5.355 5.567 ( -7.029 0.000 -4.043) 8.109 5.576 ( 2.084 0.000 -1.318) 2.466 5.977 ( -0.225 0.000 3.532) 3.539 5.993 ( -3.028 0.000 -0.596) 3.086 6.253 ( -16.075 0.000 9.663) 18.756 6.415 ( -15.361 0.000 -9.537) 18.081 7.112 ( -1.747 0.000 -1.250) 2.148 7.208 ( -6.622 0.000 -9.579) 11.645 7.265 ( 1.168 0.000 -0.897) 1.473 7.475 ( -1.922 0.000 -3.684) 4.155 8.405 ( 6.448 0.000 6.274) 8.997 8.473 ( 3.994 0.000 0.962) 4.109 9.348 ( -1.295 0.000 -3.052) 3.316 9.564 ( 6.855 0.000 2.136) 7.181 9.849 ( 12.645 0.000 6.477) 14.207 9.944 ( 7.017 0.000 -4.022) 8.088 10.246 ( -1.306 0.000 3.942) 4.153 10.584 ( 8.415 0.000 0.984) 8.473 10.669 ( -12.695 0.000 -4.479) 13.462 10.681 ( -7.354 0.000 2.476) 7.759 11.099 ( -6.185 0.000 2.278) 6.591 11.379 ( -5.470 0.000 -1.823) 5.766 12.553 ( 11.014 0.000 3.075) 11.435 12.739 ( 0.994 0.000 -8.184) 8.244 13.272 ( 3.497 0.000 1.605) 3.848 13.290 ( 0.893 0.000 -1.316) 1.590 16.409 ( -10.754 0.000 -0.738) 10.780 16.418 ( -9.369 0.000 0.343) 9.375 16.606 ( -7.061 0.000 -2.804) 7.597 16.647 ( -8.113 0.000 -14.036) 16.211 18.418 ( 4.587 0.000 0.813) 4.658 18.542 ( 5.737 0.000 0.008) 5.737 18.574 ( 2.655 0.000 9.630) 9.989 18.657 ( 2.015 0.000 3.587) 4.114 21.340 ( 4.974 0.000 -2.916) 5.766 21.390 ( 1.728 0.000 -5.570) 5.832 21.872 ( 3.030 0.000 8.299) 8.834 21.971 ( -1.999 0.000 -0.500) 2.061 ======================= Grid point 5 (6/170) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.981 ( -3.473 0.000 2.019) 4.017 2.205 ( 1.299 0.000 -2.284) 2.628 2.344 ( -0.143 0.000 -2.736) 2.740 2.558 ( 5.178 0.000 1.726) 5.458 2.716 ( 2.921 0.000 6.871) 7.466 2.884 ( 3.168 0.000 0.701) 3.245 2.952 ( -6.539 0.000 2.958) 7.177 2.963 ( -3.037 0.000 -4.793) 5.674 3.238 ( -2.331 0.000 -0.325) 2.353 3.240 ( -6.379 0.000 -10.675) 12.435 3.417 ( 0.631 0.000 1.729) 1.840 3.657 ( 1.945 0.000 2.862) 3.460 4.068 ( -4.432 0.000 -1.528) 4.688 4.314 ( 4.665 0.000 -1.242) 4.827 4.438 ( -2.710 0.000 5.426) 6.065 4.504 ( 11.593 0.000 -0.659) 11.612 4.826 ( -4.328 0.000 5.198) 6.764 4.861 ( -1.702 0.000 -0.487) 1.770 5.096 ( 8.052 0.000 3.309) 8.705 5.149 ( 2.154 0.000 2.192) 3.073 5.309 ( 15.251 0.000 6.393) 16.537 5.315 ( 15.636 0.000 -7.909) 17.522 5.418 ( -5.866 0.000 4.697) 7.515 5.552 ( -2.410 0.000 -0.687) 2.506 5.933 ( -8.647 0.000 3.849) 9.465 5.948 ( 0.716 0.000 -6.051) 6.093 6.047 ( -16.255 0.000 -6.440) 17.484 6.186 ( -2.456 0.000 4.013) 4.705 7.027 ( -3.796 0.000 -4.827) 6.141 7.076 ( -0.798 0.000 -0.961) 1.249 7.281 ( 0.750 0.000 0.164) 0.768 7.438 ( -0.286 0.000 -0.846) 0.893 8.522 ( 1.326 0.000 0.374) 1.378 8.522 ( 2.242 0.000 2.126) 3.090 9.308 ( -0.386 0.000 -1.255) 1.313 9.663 ( 2.604 0.000 1.227) 2.878 10.015 ( 5.734 0.000 -2.680) 6.329 10.124 ( 12.719 0.000 7.069) 14.552 10.244 ( -2.903 0.000 2.419) 3.778 10.405 ( -13.001 0.000 -6.425) 14.502 10.611 ( -3.101 0.000 0.744) 3.189 10.715 ( 5.027 0.000 0.717) 5.078 11.045 ( -2.968 0.000 1.273) 3.230 11.300 ( -2.257 0.000 -0.838) 2.407 12.675 ( -0.255 0.000 -3.311) 3.320 12.706 ( 4.549 0.000 1.253) 4.718 13.281 ( -0.376 0.000 -0.395) 0.545 13.327 ( 1.489 0.000 0.677) 1.635 16.285 ( -3.861 0.000 -0.349) 3.877 16.320 ( -3.289 0.000 0.152) 3.293 16.457 ( -2.603 0.000 -5.015) 5.650 16.509 ( -2.449 0.000 -1.027) 2.656 18.471 ( 1.463 0.000 0.317) 1.497 18.600 ( 1.814 0.000 0.057) 1.815 18.683 ( 1.115 0.000 3.793) 3.954 18.705 ( 0.717 0.000 1.217) 1.412 21.353 ( 0.150 0.000 -2.480) 2.485 21.375 ( 1.947 0.000 -1.048) 2.211 21.942 ( -0.923 0.000 -0.250) 0.957 21.972 ( 1.258 0.000 3.018) 3.269 ======================= Grid point 11 (7/170) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.639 ( 0.000 33.125 0.000) 33.125 0.705 ( 0.000 36.081 0.000) 36.081 1.117 ( 0.000 56.597 0.000) 56.597 2.658 ( 0.000 6.131 0.000) 6.131 2.718 ( 0.000 -4.222 0.000) 4.222 2.948 ( 0.000 -1.351 0.000) 1.351 3.119 ( 0.000 -1.147 0.000) 1.147 3.334 ( 0.000 0.656 0.000) 0.656 3.375 ( 0.000 1.766 0.000) 1.766 3.420 ( 0.000 1.346 0.000) 1.346 3.682 ( 0.000 1.364 0.000) 1.364 3.688 ( 0.000 -6.323 0.000) 6.323 3.777 ( 0.000 -8.831 0.000) 8.831 3.847 ( 0.000 3.716 0.000) 3.716 4.057 ( 0.000 -7.674 0.000) 7.674 4.360 ( 0.000 7.038 0.000) 7.038 4.412 ( 0.000 -9.423 0.000) 9.423 4.453 ( 0.000 8.279 0.000) 8.279 4.605 ( 0.000 11.972 0.000) 11.972 4.701 ( 0.000 7.999 0.000) 7.999 5.135 ( 0.000 -0.014 0.000) 0.014 5.555 ( 0.000 -0.868 0.000) 0.868 5.666 ( 0.000 -1.050 0.000) 1.050 5.727 ( 0.000 6.025 0.000) 6.025 5.928 ( 0.000 -3.002 0.000) 3.002 6.182 ( 0.000 -3.710 0.000) 3.710 6.417 ( 0.000 -0.780 0.000) 0.780 6.899 ( 0.000 0.078 0.000) 0.078 7.271 ( 0.000 -1.288 0.000) 1.288 7.443 ( 0.000 0.316 0.000) 0.316 7.567 ( 0.000 8.785 0.000) 8.785 7.713 ( 0.000 -9.183 0.000) 9.183 7.969 ( 0.000 2.172 0.000) 2.172 8.071 ( 0.000 11.888 0.000) 11.888 9.080 ( 0.000 1.291 0.000) 1.291 9.463 ( 0.000 -4.331 0.000) 4.331 9.710 ( 0.000 0.553 0.000) 0.553 10.024 ( 0.000 0.337 0.000) 0.337 10.330 ( 0.000 1.268 0.000) 1.268 10.651 ( 0.000 5.161 0.000) 5.161 10.815 ( 0.000 -2.736 0.000) 2.736 11.198 ( 0.000 -3.780 0.000) 3.780 11.436 ( 0.000 6.678 0.000) 6.678 11.647 ( 0.000 -3.403 0.000) 3.403 11.788 ( 0.000 -3.092 0.000) 3.092 12.338 ( 0.000 1.368 0.000) 1.368 12.679 ( 0.000 2.782 0.000) 2.782 13.301 ( 0.000 -4.060 0.000) 4.060 17.160 ( 0.000 -11.666 0.000) 11.666 17.172 ( 0.000 -7.744 0.000) 7.744 17.271 ( 0.000 -3.606 0.000) 3.606 17.810 ( 0.000 -3.569 0.000) 3.569 17.926 ( 0.000 0.672 0.000) 0.672 18.126 ( 0.000 -0.795 0.000) 0.795 18.278 ( 0.000 8.502 0.000) 8.502 18.388 ( 0.000 6.258 0.000) 6.258 20.916 ( 0.000 8.190 0.000) 8.190 21.151 ( 0.000 0.487 0.000) 0.487 21.640 ( 0.000 -1.582 0.000) 1.582 22.049 ( 0.000 0.669 0.000) 0.669 ======================= Grid point 12 (8/170) ======================= q-point: ( 0.09 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( 15.556 21.593 12.360) 29.343 0.902 ( 13.363 21.992 20.640) 32.988 1.642 ( 35.496 40.117 21.644) 57.774 2.643 ( 1.788 4.161 -8.152) 9.326 2.687 ( 0.486 -0.340 -4.292) 4.333 2.986 ( 0.979 -5.590 2.716) 6.291 3.052 ( -3.823 -1.430 -2.285) 4.678 3.299 ( -9.314 1.386 0.038) 9.416 3.347 ( -1.210 -0.575 0.956) 1.646 3.424 ( 5.992 3.284 0.774) 6.877 3.657 ( -1.904 1.724 3.136) 4.053 3.682 ( -2.799 -3.986 1.038) 4.980 3.814 ( -4.452 -2.897 5.439) 7.602 3.865 ( -4.608 -9.741 7.008) 12.855 4.042 ( -3.392 -3.024 1.880) 4.918 4.220 ( -2.657 1.398 2.642) 3.999 4.446 ( -0.964 6.232 -2.574) 6.812 4.590 ( 5.956 1.024 2.065) 6.386 4.651 ( 8.004 12.577 -2.175) 15.066 4.761 ( 4.367 7.081 2.419) 8.664 5.018 ( -6.837 -0.764 -3.206) 7.590 5.477 ( 0.548 4.893 -5.085) 7.079 5.677 ( -0.653 -2.230 -1.090) 2.567 5.827 ( 1.579 1.374 -2.974) 3.636 5.933 ( 4.025 -1.173 -0.615) 4.237 6.207 ( 1.542 -4.441 0.593) 4.738 6.351 ( -6.101 0.099 -1.066) 6.194 6.881 ( -4.150 -6.675 3.283) 8.518 7.266 ( -2.442 -1.128 1.819) 3.248 7.392 ( -2.998 0.283 -1.357) 3.303 7.532 ( -2.222 8.343 -1.824) 8.824 7.809 ( 6.757 -4.578 4.101) 9.134 7.963 ( -1.401 5.444 -2.304) 6.075 8.146 ( 7.145 5.911 1.499) 9.393 9.063 ( 2.555 4.247 -0.800) 5.021 9.437 ( -3.287 -2.675 -0.803) 4.313 9.657 ( -1.418 0.950 -3.054) 3.498 9.937 ( -0.511 12.330 -9.989) 15.877 10.153 ( -10.770 3.525 10.815) 15.665 10.612 ( -2.945 4.826 -1.792) 5.931 10.786 ( -1.299 -3.640 1.899) 4.306 11.183 ( -7.417 -2.856 3.457) 8.667 11.375 ( -2.893 2.341 -4.330) 5.709 11.650 ( -2.995 -2.074 1.591) 3.975 11.874 ( 9.045 -0.625 1.885) 9.261 12.710 ( 6.798 2.040 -3.161) 7.769 12.785 ( 24.529 -17.437 3.072) 30.251 13.262 ( -0.485 -2.731 -4.740) 5.492 17.016 ( -11.312 -4.113 -6.352) 13.610 17.139 ( -6.068 -7.279 -6.301) 11.380 17.253 ( 0.547 -3.128 -0.463) 3.209 17.806 ( 2.573 -4.684 -10.794) 12.044 17.934 ( -3.443 4.976 -1.708) 6.287 18.125 ( 4.072 2.576 3.877) 6.185 18.205 ( -7.868 4.083 2.628) 9.246 18.340 ( -1.923 4.718 10.008) 11.230 21.012 ( 7.620 6.553 5.041) 11.244 21.210 ( 5.589 0.094 -1.537) 5.797 21.638 ( -1.034 -1.836 1.157) 2.404 22.044 ( -0.932 0.289 0.380) 1.048 ======================= Grid point 13 (9/170) ======================= q-point: ( 0.18 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.328 ( 21.892 8.986 14.808) 27.916 1.383 ( 16.771 9.226 21.234) 28.588 2.457 ( 30.326 25.137 19.994) 44.173 2.513 ( -2.495 2.080 -12.414) 12.832 2.654 ( 4.812 3.250 -5.022) 7.677 2.966 ( -7.282 -3.804 0.244) 8.219 3.000 ( -2.745 -4.116 1.851) 5.282 3.162 ( -3.902 -0.468 0.322) 3.943 3.376 ( 2.161 -0.119 2.771) 3.516 3.593 ( -3.257 -2.078 3.413) 5.154 3.617 ( 9.570 -4.268 -0.715) 10.503 3.654 ( -1.459 1.120 0.022) 1.839 3.732 ( -8.355 -9.619 -1.684) 12.851 3.934 ( 0.154 -2.709 8.884) 9.289 3.946 ( -11.134 0.513 1.455) 11.241 4.206 ( -6.515 1.561 8.784) 11.047 4.416 ( 1.503 8.666 1.227) 8.881 4.716 ( 6.272 4.794 3.167) 8.505 4.750 ( 6.677 4.484 -4.471) 9.202 4.899 ( 4.575 4.536 1.192) 6.552 4.931 ( 4.456 4.990 0.260) 6.695 5.458 ( 3.105 3.075 -3.328) 5.493 5.617 ( -5.211 -3.138 -3.820) 7.183 5.719 ( -3.415 0.633 -7.740) 8.483 5.989 ( 1.144 3.945 0.753) 4.176 6.163 ( -6.394 -0.801 -0.097) 6.444 6.312 ( -1.517 -4.980 3.818) 6.456 6.825 ( -5.547 -7.561 -0.845) 9.416 7.219 ( -4.548 -0.501 0.759) 4.638 7.363 ( -0.336 0.935 0.026) 0.994 7.464 ( -2.575 7.199 -3.619) 8.459 7.852 ( -4.274 6.028 -7.398) 10.456 7.993 ( 7.522 -0.959 6.668) 10.098 8.285 ( 8.063 4.239 1.404) 9.217 9.185 ( 10.770 0.955 2.035) 11.002 9.391 ( -0.050 -0.106 -0.555) 0.567 9.627 ( -1.302 2.133 -0.005) 2.499 9.879 ( 2.657 6.211 -4.838) 8.309 10.164 ( -1.958 0.414 6.319) 6.629 10.537 ( -2.253 3.380 -3.176) 5.156 10.789 ( -3.357 -2.321 4.277) 5.911 11.062 ( -11.002 -1.097 1.711) 11.188 11.273 ( -5.189 -1.185 -2.178) 5.751 11.587 ( -5.397 -1.639 -0.468) 5.659 12.084 ( 12.675 1.651 4.034) 13.404 12.786 ( 8.867 2.718 -6.283) 11.202 13.056 ( 10.203 -10.295 -0.160) 14.496 13.214 ( 1.623 -3.000 -4.389) 5.558 16.762 ( -11.531 -2.568 -5.491) 13.027 16.920 ( -10.385 -3.490 -7.242) 13.133 17.135 ( -14.206 10.609 0.477) 17.737 17.554 ( -11.965 8.236 -17.565) 22.793 17.959 ( 8.604 -10.294 -0.122) 13.416 18.205 ( 3.383 -5.693 4.641) 8.087 18.313 ( 7.088 2.664 6.582) 10.033 18.465 ( 2.359 2.516 9.346) 9.962 21.193 ( 7.022 1.497 2.158) 7.497 21.296 ( 9.022 3.028 -1.436) 9.624 21.640 ( -1.809 -2.340 4.037) 5.005 22.025 ( -1.855 -0.691 0.159) 1.986 ======================= Grid point 14 (10/170) ======================= q-point: ( 0.27 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( 12.499 6.983 13.896) 19.952 1.882 ( 19.157 0.571 16.450) 25.257 2.348 ( -0.922 3.620 -9.514) 10.221 2.540 ( 0.082 6.614 -7.232) 9.801 2.760 ( -13.248 -1.377 -1.816) 13.442 3.007 ( 8.448 3.138 -0.824) 9.050 3.045 ( 1.497 -3.509 2.274) 4.442 3.157 ( 0.332 -1.680 1.265) 2.129 3.381 ( -11.688 -0.724 -0.113) 11.711 3.478 ( -6.844 -2.859 0.377) 7.427 3.559 ( -4.932 -0.577 0.943) 5.055 3.667 ( -1.341 -1.753 1.095) 2.464 3.822 ( 8.624 0.842 1.384) 8.775 3.933 ( 16.295 -7.720 5.505) 18.853 4.053 ( 6.636 -2.828 7.262) 10.236 4.290 ( -2.818 3.871 18.220) 18.839 4.457 ( -0.484 10.283 -0.930) 10.336 4.736 ( 0.685 -0.586 2.960) 3.094 4.865 ( 4.371 3.908 3.638) 6.900 4.995 ( 6.061 5.649 -2.242) 8.583 5.043 ( 11.201 5.891 -4.935) 13.584 5.424 ( -6.738 3.886 -7.436) 10.761 5.528 ( 5.236 2.635 0.316) 5.870 5.609 ( -3.198 -5.003 -4.047) 7.186 5.977 ( -3.104 2.916 1.341) 4.465 6.090 ( -3.592 1.263 1.012) 3.940 6.292 ( -9.119 -7.731 6.573) 13.643 6.667 ( -10.057 -4.825 -5.916) 12.626 7.176 ( -1.382 0.425 0.155) 1.454 7.345 ( -1.201 7.276 -3.964) 8.372 7.386 ( -1.747 3.111 -1.830) 4.010 7.666 ( -6.117 5.800 -9.520) 12.715 8.208 ( 8.463 0.286 8.597) 12.066 8.418 ( 6.518 3.878 1.375) 7.708 9.364 ( 6.130 0.075 0.001) 6.131 9.434 ( 5.084 -0.285 1.286) 5.252 9.639 ( 3.800 1.169 2.851) 4.892 9.892 ( 4.259 1.492 -3.365) 5.630 10.210 ( -0.072 0.423 4.500) 4.520 10.504 ( 2.718 1.771 -2.092) 3.860 10.764 ( -5.603 -0.008 3.484) 6.598 10.884 ( -11.341 -1.054 -1.708) 11.517 11.174 ( -6.440 -1.119 0.986) 6.611 11.481 ( -6.228 -1.642 -1.696) 6.661 12.338 ( 13.121 2.228 4.476) 14.041 12.817 ( 5.016 2.460 -8.650) 10.298 13.158 ( 4.357 -4.620 0.604) 6.380 13.229 ( 4.230 -4.034 -2.450) 6.338 16.551 ( -8.481 -0.264 -3.875) 9.328 16.690 ( -8.613 0.216 -6.420) 10.744 16.889 ( -15.947 12.825 -0.099) 20.465 17.150 ( -14.515 12.936 -15.259) 24.716 18.128 ( 11.394 -12.900 0.382) 17.215 18.347 ( 5.991 -7.387 5.907) 11.196 18.466 ( 4.088 1.671 4.975) 6.652 18.595 ( 2.428 2.281 6.819) 7.590 21.274 ( 5.145 -0.486 -2.199) 5.616 21.407 ( 6.171 1.562 -4.387) 7.731 21.702 ( 0.795 -2.537 9.547) 9.910 21.988 ( -2.682 -2.031 -0.365) 3.384 ======================= Grid point 15 (11/170) ======================= q-point: ( 0.36 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.997 ( 0.912 3.359 8.064) 8.783 2.230 ( 5.831 4.015 -0.533) 7.100 2.389 ( 12.664 -0.784 8.731) 15.402 2.473 ( 1.391 5.868 -5.703) 8.300 2.570 ( -7.997 -0.120 0.035) 7.998 2.925 ( -4.079 1.733 -6.052) 7.501 3.018 ( -2.351 -5.883 -3.514) 7.245 3.135 ( -10.121 0.808 1.161) 10.219 3.236 ( -3.643 -5.693 -2.727) 7.288 3.358 ( -2.174 -1.154 -1.174) 2.727 3.511 ( -8.227 0.841 -6.417) 10.468 3.559 ( 0.037 -2.621 3.966) 4.754 4.076 ( 2.814 -5.231 3.318) 6.804 4.175 ( 20.523 -4.584 1.731) 21.100 4.350 ( -1.885 2.800 1.907) 3.877 4.442 ( -0.820 9.388 7.707) 12.174 4.548 ( 20.389 -1.613 19.274) 28.103 4.826 ( -3.295 -2.494 -0.056) 4.133 4.877 ( 4.812 1.568 2.216) 5.525 5.069 ( 3.439 -0.357 3.241) 4.739 5.193 ( 11.675 4.971 -5.377) 13.781 5.304 ( -0.128 11.688 -0.996) 11.732 5.475 ( -1.241 -3.540 -8.211) 9.028 5.596 ( -2.095 0.186 0.524) 2.168 5.997 ( 2.993 2.199 3.532) 5.125 6.015 ( -9.874 -1.534 2.207) 10.233 6.204 ( -8.315 -2.192 4.950) 9.922 6.393 ( -13.832 -2.542 -8.213) 16.286 7.141 ( -2.420 -1.221 -4.292) 5.077 7.246 ( -2.649 10.817 -4.289) 11.934 7.369 ( -0.498 6.582 0.232) 6.605 7.502 ( -2.860 4.017 -5.630) 7.484 8.423 ( 7.134 1.529 6.804) 9.977 8.515 ( 3.913 3.921 1.206) 5.669 9.349 ( -2.089 0.185 -3.156) 3.789 9.551 ( 5.748 -1.320 2.431) 6.379 9.827 ( 11.292 -2.644 5.298) 12.750 9.931 ( 4.797 -0.840 -2.308) 5.389 10.254 ( -0.037 1.111 3.636) 3.802 10.576 ( 5.263 -0.448 0.934) 5.364 10.639 ( -9.316 -1.628 -5.288) 10.835 10.732 ( -6.218 3.539 1.850) 7.390 11.093 ( -5.844 -0.692 1.975) 6.208 11.368 ( -5.113 -1.268 -1.838) 5.579 12.574 ( 10.481 2.137 3.659) 11.305 12.766 ( 0.681 2.535 -7.358) 7.812 13.234 ( 3.952 -3.693 0.713) 5.455 13.257 ( 1.663 -3.141 -1.277) 3.777 16.420 ( -3.448 3.469 -2.477) 5.483 16.525 ( -4.554 5.076 -4.236) 8.028 16.657 ( -12.210 10.247 -1.164) 15.982 16.801 ( -11.727 13.925 -9.552) 20.559 18.300 ( 9.444 -10.233 0.413) 13.931 18.493 ( 4.592 -6.744 3.756) 8.982 18.558 ( 1.793 -0.229 4.665) 5.003 18.681 ( 0.453 1.151 4.312) 4.486 21.323 ( 4.278 -0.995 -2.458) 5.034 21.404 ( 1.232 0.625 -4.560) 4.765 21.835 ( 2.336 -3.745 7.868) 9.022 21.938 ( -2.700 -3.432 -0.649) 4.415 ======================= Grid point 16 (12/170) ======================= q-point: ( 0.45 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.014 ( -2.985 3.373 2.137) 4.986 2.233 ( -0.284 2.646 -2.143) 3.417 2.419 ( -0.034 6.713 -2.613) 7.204 2.571 ( 6.133 1.415 2.095) 6.634 2.701 ( 5.779 -1.581 8.000) 9.994 2.879 ( -0.443 -1.497 -1.455) 2.133 2.893 ( -6.022 -2.687 -2.286) 6.980 2.981 ( -3.505 0.227 0.551) 3.555 3.127 ( -3.951 -7.967 -5.743) 10.586 3.327 ( -3.565 5.191 -4.765) 7.896 3.396 ( 0.843 -1.566 1.802) 2.532 3.607 ( 0.817 -4.610 2.048) 5.110 4.099 ( -1.548 2.591 0.704) 3.099 4.368 ( 5.420 1.599 -0.644) 5.688 4.441 ( 2.584 -3.289 1.154) 4.339 4.480 ( 4.917 2.814 1.692) 5.912 4.717 ( -6.379 -5.746 1.178) 8.666 4.917 ( 4.060 1.913 5.289) 6.937 5.022 ( 7.905 -4.585 0.323) 9.144 5.138 ( -2.589 -9.312 -0.224) 9.667 5.269 ( 1.927 3.816 0.900) 4.368 5.364 ( 10.685 4.582 4.802) 12.579 5.498 ( 5.887 7.102 0.494) 9.238 5.537 ( -2.343 -3.195 -1.331) 4.180 5.850 ( -11.355 -1.224 4.110) 12.138 5.997 ( -6.604 0.881 -13.195) 14.782 6.132 ( 1.210 4.761 2.207) 5.386 6.198 ( -4.977 2.537 3.060) 6.369 7.024 ( -2.905 0.384 -4.122) 5.057 7.197 ( -0.963 12.055 -0.683) 12.113 7.369 ( 0.057 8.330 0.158) 8.332 7.446 ( -0.263 1.173 -1.420) 1.860 8.553 ( 2.528 3.150 1.934) 4.478 8.567 ( 1.394 3.821 0.980) 4.183 9.295 ( -0.896 -1.155 -1.381) 2.011 9.640 ( 2.246 -2.395 1.269) 3.520 9.964 ( 3.477 -4.827 -1.897) 6.244 10.072 ( 8.962 -4.468 5.769) 11.557 10.287 ( 0.242 3.322 2.249) 4.019 10.400 ( -10.279 -0.313 -5.347) 11.591 10.637 ( -1.375 2.502 0.265) 2.867 10.718 ( 2.884 0.605 0.249) 2.957 11.041 ( -2.795 -0.506 1.204) 3.085 11.294 ( -2.024 -0.674 -0.822) 2.286 12.703 ( -0.121 2.782 -1.921) 3.383 12.729 ( 4.170 2.295 0.504) 4.787 13.254 ( -0.171 -2.683 -0.381) 2.715 13.288 ( 1.684 -3.823 0.172) 4.181 16.393 ( 2.294 8.604 -0.891) 8.950 16.452 ( -3.157 12.174 0.624) 12.592 16.492 ( -4.527 4.380 -3.489) 7.201 16.593 ( -5.661 11.272 -2.426) 12.845 18.417 ( 4.356 -5.835 0.160) 7.283 18.545 ( 0.100 -5.717 0.536) 5.743 18.647 ( 2.993 -2.762 3.277) 5.227 18.700 ( -1.781 -1.119 0.963) 2.314 21.344 ( 1.323 -0.663 -1.930) 2.432 21.383 ( 0.470 0.495 -0.899) 1.129 21.899 ( -1.174 -4.470 -0.293) 4.631 21.923 ( 0.901 -4.972 2.773) 5.764 ======================= Grid point 22 (13/170) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( 0.000 30.848 0.000) 30.848 1.355 ( 0.000 31.864 0.000) 31.864 2.085 ( 0.000 41.985 0.000) 41.985 2.622 ( 0.000 -4.439 0.000) 4.439 2.786 ( 0.000 6.045 0.000) 6.045 2.929 ( 0.000 0.725 0.000) 0.725 3.080 ( 0.000 -2.816 0.000) 2.816 3.230 ( 0.000 -10.498 0.000) 10.498 3.399 ( 0.000 -3.393 0.000) 3.393 3.431 ( 0.000 3.173 0.000) 3.173 3.555 ( 0.000 -6.434 0.000) 6.434 3.697 ( 0.000 -0.006 0.000) 0.006 3.762 ( 0.000 2.733 0.000) 2.733 3.898 ( 0.000 -6.427 0.000) 6.427 3.935 ( 0.000 3.717 0.000) 3.717 4.211 ( 0.000 -7.418 0.000) 7.418 4.522 ( 0.000 9.464 0.000) 9.464 4.613 ( 0.000 10.628 0.000) 10.628 4.871 ( 0.000 12.024 0.000) 12.024 4.961 ( 0.000 20.223 0.000) 20.223 5.145 ( 0.000 1.242 0.000) 1.242 5.533 ( 0.000 -1.453 0.000) 1.453 5.612 ( 0.000 -4.211 0.000) 4.211 5.806 ( 0.000 -6.866 0.000) 6.866 5.900 ( 0.000 7.739 0.000) 7.739 6.085 ( 0.000 -6.560 0.000) 6.560 6.372 ( 0.000 -4.052 0.000) 4.052 6.861 ( 0.000 -4.709 0.000) 4.709 7.256 ( 0.000 -0.017 0.000) 0.017 7.445 ( 0.000 0.350 0.000) 0.350 7.532 ( 0.000 -9.513 0.000) 9.513 7.809 ( 0.000 15.904 0.000) 15.904 7.964 ( 0.000 -2.607 0.000) 2.607 8.353 ( 0.000 15.915 0.000) 15.915 9.118 ( 0.000 2.648 0.000) 2.648 9.369 ( 0.000 -4.884 0.000) 4.884 9.722 ( 0.000 0.610 0.000) 0.610 10.015 ( 0.000 -1.981 0.000) 1.981 10.377 ( 0.000 3.797 0.000) 3.797 10.687 ( 0.000 -0.895 0.000) 0.895 10.858 ( 0.000 7.785 0.000) 7.785 11.095 ( 0.000 -6.968 0.000) 6.968 11.550 ( 0.000 -6.855 0.000) 6.855 11.614 ( 0.000 11.518 0.000) 11.518 11.703 ( 0.000 -5.728 0.000) 5.728 12.366 ( 0.000 1.172 0.000) 1.172 12.745 ( 0.000 3.835 0.000) 3.835 13.195 ( 0.000 -6.695 0.000) 6.695 16.909 ( 0.000 -13.449 0.000) 13.449 16.943 ( 0.000 -13.542 0.000) 13.542 17.255 ( 0.000 0.475 0.000) 0.475 17.698 ( 0.000 -7.607 0.000) 7.607 17.944 ( 0.000 1.230 0.000) 1.230 18.103 ( 0.000 -1.468 0.000) 1.468 18.454 ( 0.000 9.134 0.000) 9.134 18.530 ( 0.000 7.645 0.000) 7.645 21.121 ( 0.000 12.427 0.000) 12.427 21.169 ( 0.000 1.502 0.000) 1.502 21.600 ( 0.000 -2.377 0.000) 2.377 22.055 ( 0.000 -0.420 0.000) 0.420 ======================= Grid point 23 (14/170) ======================= q-point: ( 0.09 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 0.694 27.258 4.704) 27.669 1.379 ( 7.181 26.305 10.920) 29.373 2.395 ( 22.086 32.074 13.553) 41.234 2.621 ( 1.701 -2.656 -3.633) 4.811 2.779 ( 1.050 6.329 -2.728) 6.972 2.903 ( -1.418 0.125 -2.380) 2.773 2.993 ( -4.231 -4.753 -1.988) 6.666 3.277 ( -4.355 -5.266 4.571) 8.221 3.362 ( -0.993 -3.582 -2.873) 4.698 3.409 ( 3.163 1.918 -1.945) 4.179 3.529 ( -2.304 -8.779 -1.968) 9.288 3.685 ( -6.317 -5.309 0.565) 8.271 3.773 ( 0.379 6.117 2.395) 6.580 3.826 ( -3.708 1.891 9.344) 10.229 4.065 ( -6.367 5.570 6.041) 10.395 4.177 ( 1.436 -7.000 5.144) 8.805 4.589 ( 4.193 2.840 4.124) 6.531 4.609 ( 1.015 10.694 -2.770) 11.093 4.901 ( 1.626 9.744 -0.846) 9.915 4.959 ( 0.139 12.867 -1.467) 12.951 5.077 ( -0.465 9.279 -2.683) 9.670 5.532 ( 2.687 0.948 -3.619) 4.606 5.619 ( -1.364 -4.088 -1.781) 4.663 5.813 ( 0.521 -8.525 -1.851) 8.740 5.926 ( 5.440 5.269 -1.260) 7.678 6.114 ( 3.027 -5.373 -0.158) 6.169 6.320 ( -5.651 -3.106 -1.585) 6.640 6.771 ( -10.306 -6.216 3.102) 12.429 7.247 ( -1.580 -0.401 0.528) 1.713 7.368 ( -2.548 -2.852 -2.114) 4.369 7.649 ( 5.643 0.049 0.510) 5.666 7.836 ( 2.948 11.449 3.585) 12.354 8.009 ( 3.578 -1.052 -0.438) 3.755 8.346 ( 1.168 13.539 -1.690) 13.694 9.124 ( 1.762 2.807 -0.078) 3.315 9.368 ( -1.458 -4.161 1.722) 4.733 9.675 ( -0.911 1.417 -3.476) 3.863 10.062 ( 3.604 1.281 1.099) 3.979 10.257 ( -13.146 6.688 1.525) 14.828 10.679 ( -1.967 0.138 1.359) 2.395 10.775 ( -2.303 5.319 -4.810) 7.532 11.097 ( -4.742 -5.747 4.194) 8.550 11.429 ( -6.545 1.710 -8.738) 11.051 11.570 ( -2.871 -6.120 2.562) 7.229 11.885 ( 11.721 2.764 4.689) 12.923 12.576 ( 16.838 -5.611 4.818) 18.390 12.782 ( 6.372 3.872 -2.603) 7.898 13.173 ( -0.486 -5.922 -2.879) 6.603 16.885 ( -6.048 -9.020 -1.955) 11.034 16.973 ( 6.405 -10.557 -4.174) 13.034 17.165 ( 0.600 -2.357 -8.668) 9.003 17.667 ( 5.144 -9.313 -11.446) 15.627 18.014 ( 0.902 2.916 3.414) 4.579 18.157 ( 0.907 0.602 6.872) 6.957 18.332 ( -13.454 8.607 1.072) 16.007 18.477 ( -5.701 8.335 4.590) 11.093 21.181 ( 4.128 9.376 2.428) 10.529 21.216 ( 5.940 1.656 0.013) 6.166 21.591 ( -2.370 -2.764 2.024) 4.166 22.041 ( -2.138 -0.900 0.569) 2.388 ======================= Grid point 24 (15/170) ======================= q-point: ( 0.18 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( 11.880 13.791 11.928) 21.762 1.664 ( 9.972 17.682 13.589) 24.429 2.527 ( -1.033 -0.330 -9.537) 9.598 2.723 ( -0.317 2.299 -2.747) 3.596 2.814 ( -3.073 -6.816 1.344) 7.596 2.952 ( 3.203 5.105 2.016) 6.355 2.988 ( 14.541 14.979 5.752) 21.653 3.155 ( -7.346 -0.533 -2.775) 7.871 3.368 ( -0.335 -4.650 2.710) 5.392 3.451 ( 0.297 -8.637 -2.761) 9.073 3.520 ( 7.187 -1.035 4.557) 8.573 3.602 ( -3.852 -1.485 -0.842) 4.213 3.734 ( -4.880 5.284 2.195) 7.520 3.908 ( -4.690 0.587 4.504) 6.529 3.993 ( -9.199 3.171 9.129) 13.342 4.227 ( -6.305 0.204 12.699) 14.179 4.610 ( 3.309 11.163 0.330) 11.647 4.758 ( 9.380 -0.300 3.693) 10.085 4.819 ( -3.757 4.462 -2.990) 6.555 5.032 ( 5.457 8.272 2.347) 10.184 5.123 ( 7.879 13.521 -3.324) 15.998 5.499 ( -2.502 -1.038 -5.077) 5.755 5.565 ( -0.013 0.515 -1.545) 1.628 5.735 ( -3.046 -1.576 -7.154) 7.934 6.014 ( 4.463 -1.976 0.163) 4.884 6.140 ( -2.571 -1.611 -0.755) 3.126 6.188 ( -5.793 -5.739 -0.320) 8.160 6.670 ( -7.480 -8.193 2.983) 11.488 7.204 ( -2.211 -0.667 -1.479) 2.743 7.361 ( 1.857 -0.845 0.436) 2.086 7.658 ( -0.862 11.173 -2.808) 11.553 7.971 ( -0.754 4.580 -1.834) 4.991 8.005 ( 5.184 3.375 3.109) 6.924 8.391 ( 5.990 6.629 -0.179) 8.936 9.203 ( 7.367 0.954 1.782) 7.639 9.375 ( -0.291 -1.894 2.975) 3.539 9.651 ( -0.259 2.005 -0.251) 2.038 10.055 ( -3.728 10.596 -5.281) 12.412 10.163 ( -1.601 -0.769 7.034) 7.255 10.609 ( -4.087 3.682 -3.126) 6.327 10.757 ( 0.449 -0.062 1.676) 1.736 11.022 ( -9.789 -3.118 2.599) 10.597 11.250 ( -5.068 -1.321 -5.919) 7.904 11.520 ( -4.631 -5.576 -0.658) 7.278 12.137 ( 12.423 4.012 6.088) 14.405 12.822 ( 8.735 -2.496 -1.872) 9.276 12.899 ( 12.429 -2.259 -1.374) 12.708 13.137 ( 1.201 -4.494 -3.487) 5.813 16.732 ( -6.639 -1.237 -5.883) 8.956 16.876 ( -2.902 -0.125 -11.811) 12.163 17.208 ( 4.051 -4.236 -0.249) 5.867 17.617 ( 3.625 -4.563 -12.632) 13.912 17.922 ( -8.193 7.350 -2.659) 11.323 18.139 ( -4.698 1.449 0.748) 4.973 18.334 ( 3.170 0.038 9.901) 10.397 18.518 ( -0.504 2.737 9.827) 10.213 21.245 ( 2.379 2.467 0.552) 3.472 21.348 ( 9.090 3.240 -1.136) 9.717 21.582 ( -3.722 -3.186 6.281) 7.966 22.000 ( -3.685 -2.165 0.235) 4.280 ======================= Grid point 25 (16/170) ======================= q-point: ( 0.27 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.915 ( 15.615 3.959 14.334) 21.563 1.939 ( 6.645 9.375 10.537) 15.591 2.420 ( 0.364 3.537 -6.680) 7.567 2.647 ( -2.067 3.431 -5.235) 6.592 2.705 ( -9.353 -3.423 -0.332) 9.965 2.942 ( -1.250 -3.512 -2.097) 4.277 3.070 ( -0.768 -2.748 -6.734) 7.314 3.154 ( 3.474 1.386 0.618) 3.791 3.283 ( -5.860 -7.637 -7.256) 12.054 3.469 ( -3.847 2.913 2.506) 5.437 3.500 ( -8.303 -4.449 1.272) 9.505 3.692 ( -3.742 -3.595 0.083) 5.190 3.768 ( 2.722 0.063 2.404) 3.633 3.890 ( 9.501 4.454 5.781) 11.980 4.063 ( 6.863 3.787 17.068) 18.782 4.344 ( -4.601 1.164 20.797) 21.332 4.662 ( 1.040 10.458 -3.642) 11.123 4.801 ( 4.858 7.433 4.835) 10.111 4.914 ( 4.315 -0.927 0.898) 4.504 5.063 ( -2.383 3.533 -5.312) 6.810 5.202 ( 5.755 6.468 -3.099) 9.195 5.418 ( -1.297 0.254 -0.519) 1.420 5.595 ( 5.697 4.854 -5.048) 9.027 5.631 ( -0.589 4.099 -0.361) 4.157 5.974 ( -12.385 -9.810 1.109) 15.838 6.050 ( -0.753 0.744 -0.143) 1.068 6.189 ( 0.438 -2.080 2.108) 2.994 6.549 ( -8.032 -6.665 -4.377) 11.318 7.173 ( 0.844 0.119 -2.679) 2.811 7.403 ( 2.291 0.865 0.484) 2.497 7.596 ( -2.807 14.918 -2.481) 15.382 7.818 ( -5.846 9.430 -7.678) 13.493 8.214 ( 8.552 0.302 8.790) 12.268 8.499 ( 6.454 3.887 0.772) 7.573 9.360 ( 7.081 -0.601 1.881) 7.351 9.425 ( 2.080 -1.040 3.201) 3.957 9.645 ( -0.208 0.758 1.816) 1.979 9.963 ( -2.407 5.027 -1.997) 5.921 10.230 ( 1.850 2.004 3.377) 4.341 10.546 ( 1.268 2.586 -2.748) 3.980 10.765 ( -3.375 0.060 0.768) 3.462 10.861 ( -9.003 -1.087 -1.108) 9.136 11.144 ( -4.735 -1.987 -0.455) 5.155 11.424 ( -5.319 -4.447 -1.900) 7.189 12.398 ( 11.906 3.834 5.997) 13.872 12.861 ( 2.703 1.054 -5.409) 6.138 13.057 ( 8.884 -4.699 -1.694) 10.192 13.152 ( 4.418 -3.624 -2.429) 6.209 16.585 ( -2.894 3.388 -6.215) 7.648 16.710 ( -2.033 2.712 -9.987) 10.546 17.155 ( -10.331 12.357 0.714) 16.122 17.429 ( -9.576 14.068 -11.564) 20.575 17.900 ( 7.934 -8.827 -0.029) 11.869 18.179 ( 6.435 -8.529 1.809) 10.836 18.470 ( 1.724 -0.839 6.971) 7.230 18.622 ( 0.380 0.155 7.516) 7.527 21.281 ( 1.966 0.779 0.155) 2.120 21.415 ( 3.414 -0.845 -4.458) 5.678 21.642 ( -0.263 -3.194 9.591) 10.112 21.931 ( -4.595 -3.899 -0.720) 6.069 ======================= Grid point 26 (17/170) ======================= q-point: ( 0.36 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( -0.527 4.046 5.854) 7.136 2.295 ( 10.749 1.415 10.846) 15.336 2.406 ( 2.973 3.638 0.679) 4.747 2.561 ( -2.014 0.504 -2.037) 2.909 2.592 ( -1.478 4.977 -3.419) 6.217 2.895 ( -1.956 -4.985 -2.375) 5.858 2.945 ( -1.898 -2.087 -7.028) 7.573 3.067 ( -5.886 -6.727 -9.436) 12.998 3.189 ( -6.777 1.552 2.369) 7.345 3.362 ( -3.772 0.604 0.139) 3.823 3.484 ( -0.447 -1.902 2.649) 3.292 3.554 ( -7.500 1.443 -2.540) 8.049 3.928 ( 9.333 -10.863 2.963) 14.625 4.031 ( 10.726 -7.977 0.360) 13.372 4.376 ( -5.589 -0.549 9.836) 11.326 4.593 ( 14.166 5.934 21.548) 26.461 4.665 ( -1.710 10.798 5.374) 12.182 4.834 ( -5.033 3.855 -8.613) 10.694 4.924 ( -0.868 -8.546 -3.871) 9.422 4.984 ( 1.000 3.864 5.825) 7.062 5.258 ( 4.640 2.972 0.607) 5.544 5.439 ( 0.698 0.685 1.958) 2.189 5.540 ( 1.312 7.953 -10.677) 13.378 5.649 ( -0.769 5.955 -3.548) 6.975 5.893 ( -6.540 -6.767 11.477) 14.842 6.041 ( 2.114 1.216 0.304) 2.458 6.225 ( 1.242 2.208 0.138) 2.538 6.330 ( -9.338 -3.273 -7.733) 12.558 7.138 ( -0.459 1.326 -5.377) 5.557 7.433 ( 1.355 2.132 -0.479) 2.571 7.536 ( -3.027 16.579 1.001) 16.883 7.666 ( -3.374 12.078 -5.914) 13.865 8.443 ( 8.132 0.026 7.706) 11.204 8.595 ( 4.091 3.653 1.154) 5.605 9.361 ( -3.749 1.071 -2.669) 4.725 9.515 ( 3.295 -2.430 3.135) 5.156 9.753 ( 8.067 -4.244 4.121) 10.004 9.924 ( -1.280 -0.055 0.111) 1.286 10.293 ( 2.668 2.923 1.759) 4.331 10.575 ( -3.931 0.128 0.338) 3.947 10.616 ( 0.377 -0.316 -7.058) 7.075 10.801 ( -3.510 3.484 2.377) 5.488 11.071 ( -4.972 -1.693 1.000) 5.346 11.328 ( -3.902 -3.018 -1.776) 5.242 12.628 ( 9.296 3.354 4.886) 11.024 12.820 ( -0.216 2.596 -4.361) 5.079 13.151 ( 5.870 -4.466 -2.050) 7.655 13.188 ( 2.712 -3.621 -2.025) 4.957 16.514 ( 1.327 5.937 -4.298) 7.448 16.605 ( 0.560 4.504 -7.044) 8.379 16.971 ( -12.526 20.144 0.996) 23.742 17.149 ( -11.194 21.601 -6.976) 25.310 18.080 ( 12.689 -12.023 0.227) 17.482 18.319 ( 6.926 -10.679 2.201) 12.917 18.541 ( -0.069 -1.736 4.140) 4.490 18.676 ( -1.754 -1.842 3.986) 4.728 21.313 ( 2.143 -0.198 -0.327) 2.177 21.398 ( -0.113 -1.346 -1.945) 2.369 21.740 ( 0.726 -5.892 6.161) 8.556 21.847 ( -4.257 -5.886 -1.408) 7.400 ======================= Grid point 27 (18/170) ======================= q-point: ( 0.45 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( -1.256 5.050 2.898) 5.957 2.293 ( -3.530 3.499 -2.179) 5.427 2.534 ( -0.693 3.632 -1.690) 4.065 2.613 ( 5.041 2.351 6.173) 8.309 2.671 ( 12.168 0.190 4.986) 13.151 2.817 ( -3.315 -2.898 -5.293) 6.885 2.871 ( -3.986 -2.671 -0.502) 4.825 2.929 ( -1.565 -6.159 -5.382) 8.328 3.033 ( -7.802 1.849 -0.812) 8.059 3.373 ( 0.966 -1.073 0.796) 1.648 3.425 ( -3.365 4.262 -2.420) 5.945 3.514 ( 0.013 -4.402 1.429) 4.628 4.096 ( 7.308 -5.673 2.116) 9.491 4.222 ( 9.211 -12.523 0.973) 15.576 4.335 ( -4.739 -8.311 1.251) 9.649 4.601 ( -5.014 2.721 0.964) 5.786 4.677 ( -7.095 -0.780 -3.537) 7.966 4.903 ( 0.353 0.192 2.512) 2.544 4.973 ( 7.458 0.780 6.997) 10.256 5.037 ( 1.081 3.841 0.788) 4.067 5.361 ( 4.261 3.254 2.892) 6.092 5.407 ( -4.563 -3.723 -1.490) 6.074 5.464 ( -0.181 0.661 1.024) 1.232 5.659 ( 4.326 8.398 -2.965) 9.901 5.888 ( -3.517 3.480 5.709) 7.555 6.012 ( -5.604 1.219 -10.348) 11.831 6.166 ( 2.468 1.131 0.627) 2.786 6.287 ( 0.194 4.348 2.425) 4.982 7.061 ( -1.479 3.607 -3.378) 5.158 7.440 ( 0.283 4.822 -0.186) 4.834 7.521 ( -1.430 15.135 1.770) 15.305 7.587 ( -0.445 12.895 -2.945) 13.235 8.606 ( 4.152 1.240 2.981) 5.260 8.646 ( 0.755 3.887 0.751) 4.031 9.278 ( -2.208 -0.214 -1.539) 2.700 9.577 ( 1.233 -4.040 1.263) 4.409 9.857 ( 1.288 -5.783 -0.711) 5.967 9.976 ( 4.207 -5.144 4.129) 7.824 10.345 ( 1.630 2.530 0.697) 3.089 10.398 ( -6.401 0.188 -3.761) 7.427 10.688 ( 5.205 2.528 -0.341) 5.797 10.757 ( -3.655 3.740 0.149) 5.232 11.023 ( -2.181 -1.325 1.010) 2.745 11.270 ( -1.454 -1.982 -0.791) 2.582 12.770 ( 1.012 3.837 1.518) 4.249 12.786 ( 2.488 3.531 -1.076) 4.451 13.189 ( 0.303 -3.846 -0.504) 3.891 13.200 ( 2.162 -4.919 -1.393) 5.551 16.523 ( 3.039 5.995 -1.139) 6.817 16.561 ( 0.256 4.715 -3.200) 5.704 16.825 ( -6.013 23.862 0.689) 24.618 16.961 ( -5.178 24.991 -2.292) 25.625 18.261 ( 8.631 -9.908 0.110) 13.141 18.392 ( -0.699 -9.759 0.879) 9.824 18.588 ( 2.532 -3.768 2.232) 5.059 18.656 ( -3.627 -3.581 0.484) 5.120 21.333 ( 1.082 -0.469 -0.893) 1.479 21.385 ( -0.315 -0.372 0.365) 0.609 21.781 ( -1.741 -7.563 -0.574) 7.782 21.793 ( 0.056 -8.252 1.816) 8.450 ======================= Grid point 33 (19/170) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 0.000 26.729 0.000) 26.729 1.907 ( 0.000 26.107 0.000) 26.107 2.547 ( 0.000 7.543 0.000) 7.543 2.598 ( 0.000 2.573 0.000) 2.573 2.867 ( 0.000 -0.180 0.000) 0.180 2.923 ( 0.000 -4.361 0.000) 4.361 3.036 ( 0.000 -8.145 0.000) 8.145 3.040 ( 0.000 -2.018 0.000) 2.018 3.301 ( 0.000 -7.012 0.000) 7.012 3.424 ( 0.000 -7.298 0.000) 7.298 3.518 ( 0.000 1.589 0.000) 1.589 3.697 ( 0.000 -5.270 0.000) 5.270 3.724 ( 0.000 6.116 0.000) 6.116 3.887 ( 0.000 0.660 0.000) 0.660 3.968 ( 0.000 10.037 0.000) 10.037 4.307 ( 0.000 13.521 0.000) 13.521 4.700 ( 0.000 8.098 0.000) 8.098 4.841 ( 0.000 11.410 0.000) 11.410 5.089 ( 0.000 10.527 0.000) 10.527 5.182 ( 0.000 2.432 0.000) 2.432 5.358 ( 0.000 18.249 0.000) 18.249 5.493 ( 0.000 -2.973 0.000) 2.973 5.526 ( 0.000 -3.316 0.000) 3.316 5.594 ( 0.000 -12.439 0.000) 12.439 5.927 ( 0.000 -10.155 0.000) 10.155 6.082 ( 0.000 10.359 0.000) 10.359 6.259 ( 0.000 -7.939 0.000) 7.939 6.721 ( 0.000 -9.521 0.000) 9.521 7.257 ( 0.000 -0.348 0.000) 0.348 7.369 ( 0.000 -7.202 0.000) 7.202 7.478 ( 0.000 3.590 0.000) 3.590 7.876 ( 0.000 -6.419 0.000) 6.419 8.138 ( 0.000 17.775 0.000) 17.775 8.604 ( 0.000 8.707 0.000) 8.707 9.176 ( 0.000 3.355 0.000) 3.355 9.296 ( 0.000 -2.475 0.000) 2.475 9.732 ( 0.000 0.498 0.000) 0.498 9.932 ( 0.000 -6.424 0.000) 6.424 10.470 ( 0.000 5.881 0.000) 5.881 10.733 ( 0.000 6.671 0.000) 6.671 10.941 ( 0.000 -8.920 0.000) 8.920 11.034 ( 0.000 9.947 0.000) 9.947 11.387 ( 0.000 -10.223 0.000) 10.223 11.573 ( 0.000 -7.785 0.000) 7.785 11.854 ( 0.000 13.264 0.000) 13.264 12.365 ( 0.000 -1.770 0.000) 1.770 12.816 ( 0.000 3.483 0.000) 3.483 13.062 ( 0.000 -6.830 0.000) 6.830 16.682 ( 0.000 -9.824 0.000) 9.824 16.707 ( 0.000 -10.545 0.000) 10.545 17.276 ( 0.000 1.763 0.000) 1.763 17.546 ( 0.000 -7.808 0.000) 7.808 17.972 ( 0.000 1.626 0.000) 1.626 18.073 ( 0.000 -1.674 0.000) 1.674 18.606 ( 0.000 6.564 0.000) 6.564 18.654 ( 0.000 5.007 0.000) 5.007 21.210 ( 0.000 2.864 0.000) 2.864 21.332 ( 0.000 7.145 0.000) 7.145 21.583 ( 0.000 2.748 0.000) 2.748 22.019 ( 0.000 -3.578 0.000) 3.578 ======================= Grid point 34 (20/170) ======================= q-point: ( 0.09 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.827 ( -4.572 23.305 -1.483) 23.795 1.861 ( 3.646 23.775 5.070) 24.581 2.592 ( 1.065 1.120 -4.119) 4.400 2.646 ( 3.646 0.764 4.574) 5.899 2.820 ( -4.287 -3.656 -2.316) 6.091 2.910 ( 0.363 -4.494 -1.820) 4.862 3.005 ( 1.669 -0.845 1.901) 2.667 3.162 ( 3.962 -4.167 8.356) 10.143 3.250 ( 1.147 -5.516 -8.819) 10.465 3.349 ( -4.916 -7.965 -2.892) 9.797 3.511 ( 1.152 5.031 0.820) 5.226 3.761 ( -1.927 12.251 7.464) 14.474 3.809 ( 2.357 0.414 9.759) 10.048 3.883 ( -1.156 -1.063 -1.806) 2.393 4.049 ( 2.602 2.059 8.789) 9.394 4.250 ( -8.764 13.667 5.485) 17.137 4.690 ( -1.213 5.859 0.344) 5.994 4.836 ( 0.549 11.159 -1.339) 11.253 5.030 ( -5.072 4.949 -4.612) 8.455 5.159 ( 1.368 10.204 -0.568) 10.311 5.353 ( 0.022 11.912 -1.997) 12.079 5.488 ( 1.604 -5.881 -2.483) 6.582 5.568 ( -4.122 -4.128 3.462) 6.784 5.588 ( 4.078 -7.534 0.275) 8.571 5.945 ( 1.862 -6.535 1.291) 6.917 6.100 ( 4.674 6.648 -5.331) 9.719 6.238 ( -2.619 -5.509 -1.018) 6.184 6.624 ( -9.830 -9.177 0.453) 13.456 7.248 ( -1.216 0.037 -1.460) 1.900 7.301 ( 0.011 -3.561 -2.213) 4.192 7.639 ( 10.999 0.800 3.179) 11.477 7.942 ( 6.469 -5.474 0.597) 8.495 8.126 ( -1.246 16.548 0.117) 16.595 8.568 ( -2.031 7.820 -3.133) 8.665 9.177 ( 0.449 2.761 0.333) 2.817 9.298 ( -0.991 -2.859 2.127) 3.699 9.714 ( 0.427 2.681 -1.122) 2.937 10.013 ( 1.821 -5.650 8.380) 10.269 10.393 ( -8.482 7.656 -0.456) 11.435 10.728 ( -1.058 6.008 0.659) 6.136 10.862 ( -3.485 -0.877 -5.770) 6.798 11.024 ( -3.346 2.137 2.441) 4.661 11.375 ( -0.409 -8.280 -6.206) 10.356 11.446 ( -8.198 -5.935 -1.241) 10.197 12.000 ( 10.676 8.958 4.797) 14.739 12.492 ( 11.093 -4.520 3.426) 12.459 12.853 ( 6.028 3.426 -2.229) 7.283 13.058 ( 1.043 -5.645 -1.977) 6.071 16.722 ( 1.943 -7.325 -0.851) 7.626 16.773 ( 11.394 -9.323 -0.950) 14.753 17.165 ( -2.625 1.649 -12.636) 13.011 17.482 ( 3.010 -9.440 -12.423) 15.890 18.060 ( 2.814 2.085 7.181) 7.990 18.152 ( 2.272 -0.898 8.612) 8.951 18.497 ( -12.135 8.058 0.466) 14.575 18.613 ( -6.131 5.307 1.576) 8.260 21.230 ( 2.170 1.795 0.052) 2.816 21.360 ( 4.047 4.745 -1.717) 6.469 21.572 ( -4.309 3.214 4.735) 7.164 21.999 ( -3.310 -3.792 0.986) 5.130 ======================= Grid point 35 (21/170) ======================= q-point: ( 0.18 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( 2.552 15.144 4.906) 16.122 1.998 ( 5.160 16.293 5.516) 17.959 2.521 ( -0.760 -0.471 -6.648) 6.707 2.686 ( -2.268 -3.015 1.691) 4.134 2.754 ( -2.963 -0.565 -0.195) 3.022 2.917 ( 2.999 -6.570 -1.894) 7.466 2.995 ( -4.139 -6.816 -0.389) 7.984 3.181 ( 1.729 -1.563 -6.858) 7.243 3.250 ( -3.148 -7.398 -2.893) 8.545 3.346 ( 5.160 -3.694 5.685) 8.520 3.575 ( 1.916 5.059 2.684) 6.039 3.710 ( -7.537 3.296 -4.949) 9.600 3.885 ( 0.973 9.128 11.768) 14.925 3.955 ( -0.632 8.253 8.821) 12.096 4.114 ( -10.814 11.480 9.912) 18.627 4.212 ( -6.617 0.272 13.408) 14.954 4.702 ( 1.574 -1.038 2.914) 3.471 4.869 ( 5.313 9.770 0.218) 11.123 4.912 ( -2.330 5.326 -4.300) 7.231 5.195 ( 2.899 8.054 -1.661) 8.719 5.306 ( -2.472 1.641 -2.620) 3.958 5.479 ( 0.056 0.582 -1.215) 1.349 5.541 ( -3.378 -9.355 5.028) 11.145 5.661 ( 5.524 2.349 -1.872) 6.288 5.976 ( -0.314 -1.684 -2.086) 2.700 6.099 ( 3.412 -0.294 -4.433) 5.602 6.142 ( -4.486 -1.042 -4.078) 6.151 6.512 ( -5.655 -8.699 1.707) 10.515 7.202 ( 0.345 0.610 -3.289) 3.362 7.333 ( 4.115 -2.036 -0.363) 4.606 7.822 ( 8.132 5.605 1.048) 9.932 8.021 ( 2.278 -0.123 -1.066) 2.518 8.127 ( 0.930 10.240 1.588) 10.404 8.505 ( 0.109 3.875 -3.122) 4.978 9.223 ( 4.066 1.235 2.313) 4.838 9.325 ( -0.092 -2.824 4.590) 5.390 9.727 ( -0.314 5.701 1.770) 5.978 10.102 ( -6.168 -4.647 9.550) 12.281 10.268 ( -1.049 10.477 -3.134) 10.986 10.670 ( -5.556 2.139 -1.594) 6.164 10.796 ( 1.347 3.657 -2.365) 4.559 10.968 ( -7.441 -1.155 1.544) 7.687 11.213 ( -4.454 -2.860 -8.347) 9.884 11.377 ( -3.160 -9.183 -0.601) 9.730 12.237 ( 11.279 6.525 6.145) 14.407 12.700 ( 9.354 -7.637 2.257) 12.285 12.940 ( 9.451 3.097 -4.817) 11.051 13.063 ( 3.564 -2.944 -3.078) 5.554 16.720 ( 1.040 0.513 -4.443) 4.592 16.916 ( 4.542 3.786 -11.570) 12.994 17.054 ( 10.327 -9.263 -2.758) 14.144 17.443 ( 9.588 -11.715 -11.092) 18.767 18.090 ( -5.623 8.224 -0.358) 9.969 18.258 ( -8.374 7.799 2.434) 11.699 18.331 ( -1.904 0.738 6.899) 7.195 18.559 ( -5.057 1.237 7.352) 9.009 21.265 ( 1.126 0.352 0.955) 1.518 21.391 ( 2.755 -0.964 -3.442) 4.513 21.572 ( -4.193 3.986 8.225) 10.056 21.939 ( -5.390 -4.332 0.619) 6.943 ======================= Grid point 36 (22/170) ======================= q-point: ( 0.27 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( 8.323 5.514 10.437) 14.443 2.108 ( 2.320 6.961 2.939) 7.904 2.485 ( 2.803 3.301 -1.905) 4.731 2.634 ( -5.384 -1.340 0.486) 5.569 2.702 ( -2.347 0.859 -0.720) 2.601 2.906 ( -2.561 -3.065 -2.644) 4.790 2.918 ( 0.572 -7.652 -7.149) 10.487 3.141 ( -1.116 -2.139 -4.883) 5.446 3.205 ( 2.002 -2.050 -1.233) 3.119 3.403 ( -4.466 -4.988 2.677) 7.211 3.537 ( -2.788 0.918 -2.209) 3.674 3.576 ( -4.127 -4.255 -3.211) 6.741 3.858 ( -6.963 7.168 2.509) 10.304 3.983 ( -11.395 6.007 1.933) 13.026 4.208 ( 3.659 6.501 19.359) 20.747 4.359 ( -0.984 3.887 23.934) 24.267 4.743 ( -5.292 -10.880 3.801) 12.682 4.862 ( 1.792 7.342 -2.948) 8.112 4.993 ( 8.369 9.422 1.994) 12.758 5.115 ( -6.385 -0.592 -6.423) 9.076 5.277 ( 1.107 3.086 -1.394) 3.563 5.460 ( -1.821 0.517 -0.358) 1.926 5.630 ( 3.381 -3.185 11.435) 12.342 5.723 ( 7.191 6.983 -6.265) 11.820 5.851 ( -6.611 1.568 -5.691) 8.863 6.069 ( -0.511 -0.104 -2.880) 2.927 6.141 ( 4.593 -2.620 0.036) 5.288 6.433 ( -4.042 -5.766 -4.095) 8.146 7.194 ( 2.936 2.239 -3.556) 5.126 7.396 ( 4.245 -1.732 -0.970) 4.686 7.884 ( -1.299 14.298 1.021) 14.393 7.994 ( -0.535 8.662 -5.262) 10.149 8.216 ( 5.280 -0.050 6.893) 8.683 8.532 ( 5.224 -1.173 -0.685) 5.398 9.343 ( 5.591 -0.949 3.472) 6.649 9.388 ( 1.058 -2.396 5.024) 5.666 9.711 ( -4.298 6.015 2.076) 7.679 10.022 ( -9.855 0.069 3.722) 10.534 10.307 ( 5.021 6.410 -0.722) 8.174 10.600 ( 0.921 2.433 -2.403) 3.541 10.757 ( -6.897 -0.655 -3.314) 7.679 10.854 ( -3.504 0.424 0.590) 3.578 11.104 ( -2.723 -1.952 -2.520) 4.193 11.314 ( -2.936 -6.916 -1.808) 7.728 12.478 ( 10.247 4.585 6.503) 12.973 12.811 ( 2.796 -5.811 1.170) 6.554 13.030 ( 9.863 1.365 -6.868) 12.096 13.102 ( 5.560 -1.597 -3.786) 6.914 16.670 ( 1.373 5.460 -6.807) 8.834 16.790 ( 0.086 5.037 -11.082) 12.173 17.269 ( 11.415 -0.744 0.903) 11.475 17.523 ( 11.744 -5.462 -7.111) 14.776 17.927 ( -10.260 11.266 -1.696) 15.332 18.116 ( -4.562 3.637 -0.443) 5.851 18.439 ( 1.157 -2.445 6.290) 6.847 18.595 ( -2.076 -3.094 6.702) 7.668 21.285 ( -1.007 -0.427 2.959) 3.155 21.375 ( -1.337 -3.267 -0.518) 3.568 21.611 ( -1.296 0.556 5.472) 5.651 21.845 ( -6.058 -5.021 -1.165) 7.954 ======================= Grid point 37 (23/170) ======================= q-point: ( 0.36 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -0.761 2.525 3.860) 4.675 2.293 ( 9.442 -0.990 13.003) 16.100 2.498 ( -5.093 4.664 -0.927) 6.968 2.591 ( 5.048 2.881 -0.098) 5.814 2.670 ( -0.125 2.282 -4.021) 4.625 2.834 ( 0.979 -4.645 -5.909) 7.580 2.850 ( -0.765 -0.390 -3.464) 3.568 3.016 ( -4.299 0.162 -7.353) 8.519 3.220 ( -3.990 0.711 0.343) 4.067 3.329 ( -4.779 -3.211 3.155) 6.565 3.493 ( -4.710 -4.098 0.701) 6.282 3.511 ( 1.276 -2.828 -3.456) 4.644 3.811 ( -1.055 1.419 1.243) 2.161 3.900 ( 1.071 -3.869 0.875) 4.109 4.299 ( -11.203 -7.488 10.525) 17.098 4.559 ( -12.710 -16.348 3.863) 21.064 4.740 ( 4.985 5.301 20.407) 21.665 4.909 ( -0.513 7.474 5.354) 9.208 4.946 ( 0.085 6.955 -7.576) 10.285 5.135 ( 3.570 8.187 1.802) 9.112 5.299 ( 4.192 0.836 -0.730) 4.337 5.416 ( -3.447 -1.358 0.390) 3.725 5.609 ( -5.530 -0.086 -9.057) 10.612 5.759 ( 5.885 4.343 -4.697) 8.692 5.898 ( 4.466 5.899 9.067) 11.703 6.039 ( 0.443 -0.071 -1.754) 1.811 6.236 ( 5.037 -1.154 2.784) 5.870 6.295 ( -3.495 -0.832 -8.610) 9.330 7.191 ( 1.796 4.162 -4.506) 6.391 7.440 ( 2.886 -1.182 -0.992) 3.273 7.855 ( -4.435 15.174 3.692) 16.235 7.925 ( -0.480 15.179 -4.925) 15.966 8.410 ( 8.021 -3.590 7.141) 11.323 8.618 ( 4.931 -2.070 0.595) 5.380 9.380 ( -3.700 0.552 -0.583) 3.786 9.465 ( 1.493 -2.654 3.253) 4.456 9.709 ( 1.720 0.579 3.896) 4.298 9.916 ( -6.819 -1.189 1.968) 7.197 10.363 ( 3.754 4.328 -2.083) 6.096 10.563 ( -8.208 -1.445 -6.192) 10.383 10.646 ( 5.923 3.229 -0.523) 6.766 10.851 ( -2.069 1.112 3.767) 4.439 11.039 ( -3.130 -0.847 -1.101) 3.425 11.254 ( -2.008 -4.597 -1.668) 5.287 12.692 ( 7.803 3.167 5.988) 10.333 12.841 ( 0.038 -0.753 1.283) 1.488 13.091 ( 7.159 -1.389 -6.602) 9.837 13.132 ( 3.573 -2.147 -4.268) 5.966 16.634 ( 2.635 6.371 -5.154) 8.608 16.699 ( 0.917 4.931 -6.996) 8.608 17.351 ( -1.903 17.697 1.438) 17.857 17.557 ( -1.368 18.490 -5.526) 19.347 17.881 ( 8.260 -6.911 0.652) 10.790 18.134 ( 5.448 -7.012 0.263) 8.884 18.486 ( -1.349 -4.144 2.829) 5.196 18.608 ( -3.487 -5.434 3.043) 7.138 21.306 ( -1.066 -0.780 3.766) 3.991 21.356 ( -2.324 -2.835 2.790) 4.607 21.635 ( -0.846 -4.296 1.826) 4.744 21.730 ( -5.180 -5.965 -3.121) 8.495 ======================= Grid point 38 (24/170) ======================= q-point: ( 0.45 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 1.313 4.484 5.308) 7.071 2.364 ( -5.477 3.398 -3.637) 7.401 2.541 ( 1.804 -1.535 5.810) 6.274 2.618 ( 4.333 -1.953 -0.077) 4.754 2.734 ( 8.939 2.909 1.410) 9.506 2.794 ( -2.639 3.113 -4.598) 6.148 2.811 ( 0.406 1.522 -1.927) 2.489 2.903 ( -2.282 0.408 -3.482) 4.183 3.100 ( -7.349 3.490 0.127) 8.137 3.329 ( -0.177 -3.421 1.526) 3.750 3.412 ( -4.112 -4.572 -0.076) 6.150 3.498 ( 0.341 0.096 -1.873) 1.906 3.906 ( 11.562 -9.817 -0.119) 15.167 3.988 ( 4.913 -10.951 2.036) 12.174 4.146 ( -14.538 -10.941 1.984) 18.303 4.360 ( -10.423 -17.796 0.163) 20.624 4.825 ( -1.503 10.255 -1.766) 10.514 5.034 ( 2.341 9.579 7.827) 12.589 5.054 ( 3.707 3.355 10.860) 11.956 5.137 ( -0.343 6.677 -3.631) 7.609 5.344 ( 0.022 -1.345 -2.782) 3.090 5.397 ( 1.700 0.599 3.054) 3.546 5.470 ( -3.020 0.078 -3.358) 4.517 5.754 ( 2.678 -1.005 -6.882) 7.452 5.954 ( -1.919 5.415 1.329) 5.897 6.069 ( -0.051 4.160 1.216) 4.334 6.203 ( 1.736 2.538 -3.113) 4.376 6.333 ( 2.492 0.415 2.163) 3.326 7.160 ( -0.027 6.575 -2.453) 7.018 7.466 ( 1.178 -0.548 -0.286) 1.330 7.840 ( -2.343 14.502 3.040) 15.002 7.878 ( 0.207 17.773 -2.962) 18.019 8.578 ( 4.588 -3.937 3.125) 6.805 8.681 ( 1.650 -1.053 0.750) 2.097 9.292 ( -3.358 1.504 -1.325) 3.911 9.493 ( -0.268 -4.660 0.730) 4.725 9.772 ( 0.444 -2.498 0.927) 2.701 9.891 ( 0.208 -3.757 2.671) 4.614 10.381 ( 1.361 1.315 -1.538) 2.438 10.404 ( -4.015 0.325 -3.261) 5.182 10.740 ( 5.028 3.089 0.402) 5.915 10.842 ( -3.035 4.237 1.271) 5.365 10.996 ( -1.189 -0.925 0.118) 1.511 11.216 ( -0.880 -3.692 -0.854) 3.890 12.836 ( 2.661 2.953 3.581) 5.350 12.851 ( 0.445 2.924 0.279) 2.971 13.113 ( 2.393 -3.493 -2.546) 4.941 13.124 ( 0.916 -3.149 -2.851) 4.346 16.635 ( 2.000 5.589 -1.588) 6.145 16.656 ( 0.103 4.931 -2.669) 5.608 17.314 ( -2.453 26.105 0.664) 26.228 17.461 ( -2.875 25.792 -1.757) 26.011 18.071 ( 10.880 -9.302 0.315) 14.318 18.205 ( 0.272 -8.867 0.526) 8.887 18.484 ( 0.096 -7.716 0.538) 7.736 18.560 ( -4.117 -6.649 0.546) 7.839 21.325 ( -0.275 -0.358 1.277) 1.354 21.367 ( -0.886 -1.503 3.090) 3.548 21.632 ( -1.078 -7.549 -0.352) 7.634 21.634 ( -1.679 -7.601 -1.998) 8.037 ======================= Grid point 44 (25/170) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( 0.000 20.124 0.000) 20.124 2.354 ( 0.000 21.353 0.000) 21.353 2.535 ( 0.000 -8.403 0.000) 8.403 2.706 ( 0.000 7.303 0.000) 7.303 2.714 ( 0.000 -15.282 0.000) 15.282 2.816 ( 0.000 -4.669 0.000) 4.669 2.950 ( 0.000 -1.018 0.000) 1.018 2.970 ( 0.000 -3.251 0.000) 3.251 3.170 ( 0.000 -4.521 0.000) 4.521 3.223 ( 0.000 -9.746 0.000) 9.746 3.553 ( 0.000 3.066 0.000) 3.066 3.618 ( 0.000 -3.529 0.000) 3.529 3.819 ( 0.000 3.227 0.000) 3.227 3.869 ( 0.000 -2.103 0.000) 2.103 4.431 ( 0.000 29.982 0.000) 29.982 4.587 ( 0.000 14.086 0.000) 14.086 4.762 ( 0.000 -3.322 0.000) 3.322 4.891 ( 0.000 -12.131 0.000) 12.131 5.223 ( 0.000 1.510 0.000) 1.510 5.226 ( 0.000 2.386 0.000) 2.386 5.364 ( 0.000 -3.064 0.000) 3.064 5.418 ( 0.000 -4.754 0.000) 4.754 5.492 ( 0.000 7.400 0.000) 7.400 5.706 ( 0.000 -12.636 0.000) 12.636 5.781 ( 0.000 17.287 0.000) 17.287 6.066 ( 0.000 -12.513 0.000) 12.513 6.292 ( 0.000 11.606 0.000) 11.606 6.516 ( 0.000 -11.679 0.000) 11.679 7.246 ( 0.000 -0.254 0.000) 0.254 7.270 ( 0.000 -3.089 0.000) 3.089 7.583 ( 0.000 7.170 0.000) 7.170 7.733 ( 0.000 -8.136 0.000) 8.136 8.451 ( 0.000 14.246 0.000) 14.246 8.642 ( 0.000 -4.769 0.000) 4.769 9.237 ( 0.000 2.689 0.000) 2.689 9.270 ( 0.000 -0.931 0.000) 0.931 9.748 ( 0.000 1.568 0.000) 1.568 9.810 ( 0.000 -5.244 0.000) 5.244 10.601 ( 0.000 7.896 0.000) 7.896 10.766 ( 0.000 -9.204 0.000) 9.204 10.923 ( 0.000 12.304 0.000) 12.304 11.167 ( 0.000 -12.664 0.000) 12.664 11.225 ( 0.000 10.059 0.000) 10.059 11.410 ( 0.000 -9.270 0.000) 9.270 12.097 ( 0.000 11.764 0.000) 11.764 12.282 ( 0.000 -7.210 0.000) 7.210 12.878 ( 0.000 3.264 0.000) 3.264 12.951 ( 0.000 -4.717 0.000) 4.717 16.554 ( 0.000 -3.287 0.000) 3.287 16.563 ( 0.000 -4.221 0.000) 4.221 17.326 ( 0.000 3.549 0.000) 3.549 17.415 ( 0.000 -5.842 0.000) 5.842 18.005 ( 0.000 1.815 0.000) 1.815 18.040 ( 0.000 -1.810 0.000) 1.810 18.697 ( 0.000 2.887 0.000) 2.887 18.713 ( 0.000 1.153 0.000) 1.153 21.276 ( 0.000 3.892 0.000) 3.892 21.348 ( 0.000 -3.087 0.000) 3.087 21.734 ( 0.000 10.417 0.000) 10.417 21.912 ( 0.000 -7.731 0.000) 7.731 ======================= Grid point 45 (26/170) ======================= q-point: ( 0.09 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( -6.689 16.545 -5.703) 18.735 2.254 ( 0.480 15.803 -2.461) 16.001 2.546 ( -2.564 -5.961 -1.488) 6.657 2.625 ( -0.298 -9.012 -2.803) 9.443 2.773 ( 2.470 1.821 1.908) 3.614 2.815 ( -0.390 -0.939 0.785) 1.284 2.916 ( -4.123 -1.932 0.823) 4.627 3.036 ( 1.397 -9.299 4.140) 10.274 3.200 ( 3.186 -0.532 -2.592) 4.141 3.227 ( 2.138 -3.955 -0.458) 4.520 3.608 ( 3.838 5.522 4.251) 7.956 3.729 ( 7.476 -7.152 6.926) 12.450 3.833 ( -4.424 1.725 6.720) 8.229 3.870 ( -4.043 -1.524 6.604) 7.892 4.438 ( -1.582 26.442 2.211) 26.581 4.540 ( -7.607 15.556 4.152) 17.807 4.722 ( -3.146 -3.897 -2.226) 5.481 4.896 ( -1.055 -10.592 2.228) 10.875 5.120 ( -5.689 5.186 -3.508) 8.460 5.242 ( -1.361 -7.099 -0.943) 7.289 5.359 ( -0.511 2.878 -3.174) 4.315 5.406 ( 0.191 -1.752 -0.014) 1.762 5.484 ( 0.017 4.061 0.957) 4.172 5.638 ( -3.533 -5.553 1.827) 6.830 5.902 ( 7.830 8.031 1.934) 11.382 6.096 ( 2.528 -9.239 0.188) 9.581 6.258 ( -1.122 8.831 -4.448) 9.952 6.438 ( -6.380 -9.944 -2.787) 12.139 7.241 ( 0.132 -0.304 -2.624) 2.645 7.252 ( 1.881 -1.490 -1.688) 2.934 7.697 ( 10.475 5.159 2.284) 11.898 7.818 ( 8.641 -6.991 1.213) 11.181 8.420 ( -2.795 13.414 -1.496) 13.783 8.600 ( -3.152 -4.582 -2.883) 6.265 9.225 ( -0.863 2.243 0.603) 2.478 9.260 ( -1.239 -1.500 1.134) 2.252 9.781 ( 1.807 4.512 3.625) 6.063 9.888 ( 1.896 -6.594 8.021) 10.555 10.549 ( -6.232 8.768 0.628) 10.776 10.718 ( -6.173 -8.382 1.003) 10.459 10.930 ( 1.909 11.550 -1.941) 11.866 11.156 ( -5.921 7.713 -2.846) 10.132 11.168 ( 2.088 -11.399 -2.987) 11.967 11.318 ( -6.658 -7.825 -4.516) 11.223 12.193 ( 8.301 10.521 3.147) 13.766 12.375 ( 8.315 -8.087 2.576) 11.881 12.912 ( 5.190 2.835 -1.680) 6.148 12.970 ( 3.417 -3.618 -1.448) 5.183 16.628 ( 8.059 -2.249 -0.426) 8.378 16.644 ( 11.207 -3.971 -0.368) 11.896 17.220 ( -2.119 4.137 -13.054) 13.856 17.325 ( -0.046 -6.959 -12.870) 14.631 18.097 ( 3.275 1.814 8.599) 9.379 18.129 ( 3.033 -1.495 8.975) 9.590 18.621 ( -8.903 4.698 0.388) 10.074 18.666 ( -6.616 0.158 0.619) 6.647 21.279 ( 0.614 3.284 -0.425) 3.367 21.347 ( 0.719 -3.452 -1.384) 3.788 21.723 ( -3.625 9.841 3.384) 11.019 21.892 ( -3.801 -7.433 1.818) 8.544 ======================= Grid point 46 (27/170) ======================= q-point: ( 0.18 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( -1.806 12.272 -2.336) 12.622 2.215 ( -0.839 3.029 -4.019) 5.103 2.500 ( 0.370 1.164 -0.462) 1.306 2.618 ( -0.398 -7.149 -0.236) 7.164 2.776 ( -2.124 0.846 -0.730) 2.400 2.845 ( 0.011 7.008 0.385) 7.018 2.870 ( -2.016 -6.105 3.098) 7.137 3.055 ( -0.465 -11.902 0.159) 11.912 3.205 ( 2.981 3.508 -3.869) 6.013 3.279 ( 3.887 -3.814 -0.545) 5.473 3.666 ( -3.483 3.782 -1.208) 5.281 3.709 ( -7.585 -1.134 -4.953) 9.130 3.934 ( -1.989 1.890 16.166) 16.397 4.003 ( 0.799 -4.487 20.116) 20.626 4.374 ( -11.480 13.630 2.833) 18.045 4.489 ( -6.763 19.420 8.527) 22.261 4.632 ( -6.943 -3.650 0.855) 7.891 4.900 ( -3.996 -10.651 5.224) 12.518 5.031 ( 0.656 6.025 -2.528) 6.566 5.147 ( -3.430 -8.675 -5.285) 10.722 5.346 ( 2.081 4.964 -2.097) 5.776 5.421 ( 0.691 -2.865 1.015) 3.117 5.528 ( 3.653 6.121 2.667) 7.611 5.674 ( 3.958 -5.742 2.988) 7.588 6.001 ( 1.947 5.574 -1.235) 6.032 6.093 ( -0.731 -3.048 -4.790) 5.725 6.175 ( 0.059 6.180 -6.071) 8.664 6.336 ( -1.595 -9.638 -1.766) 9.927 7.231 ( 2.963 2.382 -3.236) 4.992 7.285 ( 4.439 -2.961 -1.891) 5.661 7.906 ( 11.909 3.996 2.412) 12.791 7.980 ( 8.956 -3.537 0.971) 9.678 8.343 ( -4.250 10.894 -1.638) 11.808 8.499 ( -4.048 -4.694 -3.507) 7.122 9.250 ( 1.584 1.517 3.179) 3.862 9.281 ( 0.377 -1.844 4.044) 4.460 9.852 ( -0.830 7.088 5.779) 9.183 9.987 ( -2.782 -6.891 8.992) 11.665 10.462 ( -3.582 9.668 -0.351) 10.316 10.624 ( -5.298 -6.721 -0.037) 8.559 10.916 ( -1.739 8.611 -2.521) 9.139 11.001 ( -8.367 2.394 -4.350) 9.729 11.142 ( 0.222 -3.753 -7.127) 8.058 11.193 ( -1.959 -8.842 -0.877) 9.099 12.381 ( 9.439 8.338 4.382) 13.335 12.544 ( 8.436 -8.623 2.741) 12.371 12.990 ( 8.221 2.082 -4.035) 9.391 13.023 ( 6.344 -1.602 -3.245) 7.303 16.762 ( 8.825 3.991 -2.942) 10.122 16.871 ( 15.758 -7.272 -0.898) 17.378 17.044 ( 2.122 7.428 -13.972) 15.966 17.221 ( 7.691 -10.874 -12.158) 18.033 18.214 ( -0.058 4.813 4.617) 6.670 18.280 ( 2.794 -2.216 8.251) 8.988 18.450 ( -12.385 7.485 0.293) 14.474 18.549 ( -9.062 -2.707 3.280) 10.010 21.282 ( -0.827 1.765 1.096) 2.237 21.334 ( -1.400 -3.536 -0.055) 3.804 21.698 ( -4.602 7.622 3.817) 9.687 21.835 ( -5.791 -6.499 1.632) 8.856 ======================= Grid point 47 (28/170) ======================= q-point: ( 0.27 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( 3.056 5.394 3.654) 7.196 2.175 ( -0.203 -0.238 -0.493) 0.584 2.532 ( 3.157 2.192 0.329) 3.857 2.597 ( -1.167 -3.792 -0.807) 4.049 2.732 ( -2.441 2.630 0.044) 3.588 2.806 ( -2.722 -3.809 -0.930) 4.773 2.905 ( 2.716 4.883 -0.536) 5.613 3.065 ( 2.141 -8.476 -0.491) 8.756 3.206 ( 1.429 4.552 -3.540) 5.941 3.310 ( -0.505 -5.176 -0.356) 5.213 3.517 ( -8.249 -0.765 -4.296) 9.332 3.527 ( -5.992 -1.855 -4.662) 7.815 4.022 ( -7.382 8.825 8.754) 14.457 4.161 ( -11.507 7.820 7.179) 15.656 4.174 ( -11.739 -1.312 10.618) 15.883 4.434 ( -12.960 -12.181 3.375) 18.103 4.618 ( -2.698 11.799 17.364) 21.166 4.886 ( -8.553 -11.599 11.473) 18.421 5.069 ( 5.375 4.311 -3.681) 7.812 5.121 ( 8.732 1.277 -3.787) 9.603 5.344 ( 0.456 4.169 -2.592) 4.930 5.423 ( -0.910 -3.490 -0.976) 3.736 5.666 ( 6.466 5.854 4.733) 9.924 5.764 ( 3.577 -2.609 -2.998) 5.346 5.944 ( -0.612 4.852 -2.555) 5.517 6.021 ( 0.378 -3.866 -2.953) 4.880 6.171 ( 4.238 6.021 -3.959) 8.360 6.311 ( 0.879 -7.342 -4.184) 8.496 7.257 ( 4.510 4.182 -3.212) 6.938 7.339 ( 5.025 -3.984 -2.248) 6.796 8.077 ( 2.089 5.671 2.748) 6.639 8.127 ( 11.206 1.746 2.350) 11.582 8.262 ( -4.331 8.146 -0.716) 9.253 8.442 ( 1.548 -8.077 -1.588) 8.375 9.334 ( 2.892 0.163 4.338) 5.217 9.350 ( 1.731 -1.469 4.835) 5.341 9.846 ( -7.261 7.394 4.522) 11.306 9.969 ( -9.539 -5.079 6.009) 12.365 10.451 ( 3.121 7.887 -2.426) 8.822 10.580 ( 1.339 -4.887 -2.590) 5.691 10.790 ( -8.529 4.107 -3.097) 9.960 10.853 ( -4.962 -1.496 -1.173) 5.313 11.093 ( 0.629 1.652 -3.000) 3.482 11.178 ( 0.481 -6.665 -1.812) 6.924 12.573 ( 8.095 5.483 5.353) 11.147 12.688 ( 5.593 -6.508 3.441) 9.245 13.063 ( 8.121 1.492 -6.748) 10.663 13.083 ( 6.806 -0.759 -5.445) 8.749 16.784 ( 2.706 5.984 -7.572) 10.023 16.855 ( -0.082 0.038 -10.260) 10.261 17.239 ( 22.308 1.270 -0.699) 22.355 17.356 ( 18.984 -9.467 -4.117) 21.609 18.153 ( -8.826 10.213 -0.947) 13.532 18.242 ( -10.747 4.210 -0.815) 11.571 18.395 ( 0.013 0.277 5.000) 5.007 18.500 ( -3.916 -6.776 4.766) 9.163 21.279 ( -3.350 0.302 4.665) 5.751 21.310 ( -4.057 -2.911 3.914) 6.344 21.659 ( -3.684 3.950 0.716) 5.449 21.747 ( -5.771 -5.075 -1.026) 7.753 ======================= Grid point 48 (29/170) ======================= q-point: ( 0.36 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( 0.770 3.316 4.258) 5.451 2.254 ( 3.756 -3.196 8.282) 9.640 2.563 ( -0.661 2.421 -1.580) 2.966 2.606 ( 4.553 -2.077 -1.450) 5.210 2.700 ( 0.415 3.399 -1.776) 3.857 2.777 ( 1.632 -3.700 -0.536) 4.080 2.940 ( 3.312 9.642 -1.674) 10.332 3.070 ( -1.276 3.661 -4.527) 5.961 3.164 ( 0.279 -5.651 -3.709) 6.765 3.238 ( -5.711 -7.292 -0.365) 9.269 3.394 ( -3.246 0.348 -0.993) 3.413 3.457 ( -0.892 -4.824 -1.027) 5.013 3.923 ( -10.758 8.774 2.473) 14.101 3.963 ( -10.127 9.959 1.719) 14.307 4.117 ( -13.865 -10.662 6.145) 18.538 4.228 ( -14.807 -16.661 1.742) 22.357 4.839 ( 0.768 4.795 21.106) 21.657 4.923 ( -4.499 -3.511 13.812) 14.945 5.126 ( 5.654 9.408 -1.774) 11.118 5.251 ( 7.965 -1.232 0.207) 8.063 5.302 ( -1.309 3.845 -3.152) 5.141 5.387 ( -0.978 -2.852 -1.878) 3.552 5.649 ( -1.868 4.629 -9.792) 10.991 5.748 ( 2.327 -4.619 -9.113) 10.479 6.016 ( 4.128 5.755 6.943) 9.918 6.075 ( 2.090 1.141 3.170) 3.965 6.212 ( 6.066 0.252 -1.160) 6.181 6.261 ( 1.409 -3.006 -6.796) 7.563 7.288 ( 3.417 5.598 -3.084) 7.248 7.386 ( 3.800 -4.330 -1.827) 6.044 8.095 ( -2.513 10.437 3.084) 11.169 8.193 ( -3.876 7.392 0.182) 8.348 8.336 ( 10.305 0.300 3.820) 10.994 8.504 ( 6.010 -9.528 0.310) 11.270 9.387 ( -1.550 0.740 1.566) 2.324 9.417 ( 0.248 -2.264 2.459) 3.352 9.773 ( -5.396 5.176 3.785) 8.381 9.867 ( -8.230 -4.035 3.485) 9.806 10.449 ( 1.837 4.423 -6.190) 7.826 10.521 ( -2.614 -3.018 -8.008) 8.948 10.727 ( 1.294 5.048 3.353) 6.196 10.820 ( -1.644 -4.062 4.690) 6.418 11.068 ( -0.439 3.750 -2.336) 4.439 11.159 ( -0.343 -5.253 -1.869) 5.586 12.748 ( 5.829 2.788 6.143) 8.915 12.801 ( 3.072 -2.810 4.919) 6.444 13.089 ( 5.759 0.677 -8.219) 10.059 13.105 ( 4.462 -0.960 -6.836) 8.219 16.739 ( 1.895 4.082 -5.848) 7.379 16.766 ( 0.759 1.457 -6.593) 6.795 17.567 ( 16.509 5.376 1.861) 17.461 17.650 ( 20.568 -4.288 -0.817) 21.026 17.987 ( -8.845 12.564 -1.819) 15.472 18.104 ( -4.204 1.329 -1.186) 4.565 18.401 ( -3.911 -2.687 1.239) 4.904 18.474 ( -4.782 -7.867 1.840) 9.389 21.289 ( -3.878 -0.495 7.722) 8.655 21.304 ( -4.423 -2.119 7.459) 8.927 21.596 ( -2.414 0.186 -3.293) 4.087 21.635 ( -4.276 -3.727 -4.584) 7.293 ======================= Grid point 49 (30/170) ======================= q-point: ( 0.45 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 2.403 4.715 6.236) 8.179 2.363 ( -0.373 -3.718 2.764) 4.647 2.539 ( 0.520 1.818 -0.837) 2.068 2.576 ( -0.597 -1.844 -4.602) 4.994 2.789 ( 7.205 3.340 2.209) 8.243 2.834 ( 3.849 -0.666 1.056) 4.046 2.944 ( -4.529 5.755 -5.563) 9.197 2.972 ( 0.872 11.959 -0.286) 11.994 3.081 ( -3.887 -5.651 -2.588) 7.331 3.231 ( 1.183 -11.313 1.264) 11.445 3.346 ( -2.928 2.375 0.112) 3.772 3.433 ( -0.244 -5.432 -1.084) 5.544 3.835 ( -1.085 2.345 0.418) 2.617 3.889 ( -2.256 1.791 1.357) 3.184 3.950 ( -9.667 -8.736 1.369) 13.101 4.049 ( -8.072 -13.678 0.517) 15.890 4.986 ( -0.326 6.081 4.809) 7.760 5.059 ( 1.504 -1.908 10.199) 10.485 5.197 ( 0.125 6.368 5.412) 8.358 5.250 ( -1.202 2.751 -2.021) 3.619 5.335 ( 2.366 1.156 -0.861) 2.770 5.389 ( 1.613 -1.968 3.065) 3.984 5.513 ( -1.342 5.220 -8.530) 10.090 5.650 ( 0.347 -7.912 -9.297) 12.213 6.074 ( -0.406 5.423 0.641) 5.476 6.124 ( -0.208 0.557 1.274) 1.406 6.254 ( 3.219 2.863 -1.289) 4.496 6.309 ( 3.358 -2.539 1.495) 4.467 7.296 ( 1.090 7.290 -1.445) 7.512 7.416 ( 1.526 -4.757 -0.687) 5.042 8.087 ( -1.365 10.686 1.383) 10.862 8.150 ( -1.692 7.393 0.237) 7.588 8.502 ( 5.134 -1.141 2.109) 5.666 8.595 ( 3.260 -7.293 0.871) 8.035 9.333 ( -3.195 2.926 -0.845) 4.414 9.404 ( -1.930 -4.441 -0.204) 4.846 9.771 ( -0.707 2.082 2.099) 3.040 9.826 ( -1.410 -3.237 2.263) 4.194 10.399 ( -0.098 0.670 -3.290) 3.359 10.407 ( -2.037 -0.111 -3.574) 4.115 10.805 ( 2.644 3.625 2.011) 4.917 10.865 ( 0.240 -2.018 2.982) 3.609 11.031 ( -0.902 4.647 -1.488) 4.962 11.131 ( -0.624 -5.161 -1.120) 5.318 12.877 ( 2.308 1.350 4.464) 5.204 12.885 ( 0.993 0.591 3.605) 3.786 13.073 ( 2.136 -0.768 -5.031) 5.520 13.080 ( 1.257 -1.401 -4.755) 5.115 16.720 ( 1.053 2.806 -1.975) 3.589 16.728 ( 0.321 2.035 -2.292) 3.082 17.748 ( 3.800 16.460 2.224) 17.039 17.861 ( -4.180 10.794 -1.149) 11.633 17.945 ( 15.057 0.388 -0.189) 15.064 18.098 ( 2.177 -2.946 -0.357) 3.680 18.312 ( -5.735 -7.044 -0.922) 9.130 18.397 ( -5.254 -10.157 0.364) 11.441 21.320 ( -1.760 -0.016 5.012) 5.312 21.335 ( -1.927 -1.559 6.208) 6.684 21.526 ( -0.776 -2.827 -3.632) 4.667 21.530 ( -1.589 -3.069 -4.610) 5.761 ======================= Grid point 99 (31/170) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.633 ( -1.509 0.000 30.580) 30.618 0.683 ( 2.682 0.000 32.869) 32.979 1.301 ( -0.463 0.000 61.928) 61.930 2.497 ( -1.363 0.000 -9.885) 9.979 2.618 ( -2.839 0.000 -11.821) 12.157 3.050 ( 4.784 0.000 6.909) 8.404 3.054 ( 0.637 0.000 -0.215) 0.673 3.292 ( -1.177 0.000 -5.018) 5.154 3.375 ( -0.178 0.000 -2.277) 2.284 3.462 ( -2.917 0.000 3.019) 4.198 3.667 ( 2.001 0.000 2.400) 3.125 3.738 ( 0.534 0.000 -2.916) 2.964 3.937 ( -2.319 0.000 7.563) 7.911 4.097 ( -7.334 0.000 -2.727) 7.825 4.124 ( 8.057 0.000 0.801) 8.097 4.306 ( 4.825 0.000 -1.581) 5.078 4.350 ( 3.098 0.000 -2.670) 4.089 4.387 ( -2.424 0.000 5.757) 6.246 4.485 ( 2.746 0.000 1.536) 3.147 4.714 ( 0.927 0.000 8.459) 8.509 5.069 ( -6.207 0.000 -5.962) 8.606 5.423 ( -4.129 0.000 3.687) 5.536 5.681 ( 7.449 0.000 0.575) 7.471 5.895 ( 2.868 0.000 -4.280) 5.152 5.913 ( -1.024 0.000 2.576) 2.772 6.236 ( 1.818 0.000 0.127) 1.822 6.380 ( -1.112 0.000 -3.740) 3.902 6.939 ( -8.316 0.000 -10.454) 13.359 7.308 ( 0.657 0.000 3.801) 3.858 7.405 ( 0.721 0.000 -2.206) 2.321 7.441 ( -3.695 0.000 2.208) 4.304 7.843 ( 3.714 0.000 -1.241) 3.916 7.862 ( 4.415 0.000 -2.306) 4.981 8.079 ( -3.711 0.000 -1.816) 4.131 8.933 ( 0.036 0.000 3.864) 3.864 9.490 ( -2.349 0.000 -3.633) 4.326 9.622 ( -0.919 0.000 0.528) 1.060 9.694 ( 1.685 0.000 -0.730) 1.836 10.311 ( 3.595 0.000 -0.432) 3.621 10.555 ( 0.114 0.000 -3.169) 3.171 10.881 ( -1.155 0.000 4.830) 4.966 11.305 ( 5.432 0.000 1.240) 5.572 11.368 ( -6.228 0.000 1.312) 6.365 11.748 ( -4.065 0.000 5.555) 6.884 11.797 ( 3.458 0.000 -1.087) 3.625 12.588 ( 0.285 0.000 -6.002) 6.009 12.817 ( -1.808 0.000 2.203) 2.850 13.185 ( -0.522 0.000 -2.662) 2.712 17.215 ( 3.467 0.000 -0.098) 3.468 17.287 ( -0.447 0.000 -0.018) 0.447 17.349 ( 2.574 0.000 -0.029) 2.575 17.790 ( -3.742 0.000 -10.200) 10.865 17.874 ( -2.419 0.000 0.611) 2.495 17.945 ( 1.914 0.000 -0.781) 2.067 18.223 ( -0.185 0.000 0.752) 0.774 18.317 ( -0.057 0.000 -0.376) 0.380 20.921 ( 1.911 0.000 6.885) 7.145 21.129 ( -1.221 0.000 -2.804) 3.058 21.674 ( 0.216 0.000 2.298) 2.309 22.053 ( -0.284 0.000 0.634) 0.694 ======================= Grid point 100 (32/170) ======================= q-point: ( 0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.112 ( 16.982 0.000 24.641) 29.926 1.195 ( 16.340 0.000 27.432) 31.930 2.099 ( 17.733 0.000 49.333) 52.423 2.359 ( 0.962 0.000 -15.131) 15.162 2.464 ( 2.277 0.000 -13.869) 14.055 3.054 ( -1.970 0.000 2.735) 3.371 3.167 ( 0.573 0.000 1.647) 1.744 3.248 ( -11.272 0.000 -1.920) 11.435 3.296 ( 7.615 0.000 1.059) 7.688 3.514 ( 4.670 0.000 4.564) 6.530 3.669 ( -1.464 0.000 -0.898) 1.717 3.694 ( -1.985 0.000 -2.078) 2.874 3.904 ( 1.789 0.000 -8.361) 8.550 4.015 ( -5.659 0.000 5.486) 7.882 4.195 ( -17.334 0.000 -6.385) 18.473 4.303 ( 3.153 0.000 -3.160) 4.464 4.359 ( -2.324 0.000 7.453) 7.807 4.415 ( 11.704 0.000 5.361) 12.874 4.605 ( 5.409 0.000 7.276) 9.066 4.860 ( 3.335 0.000 9.722) 10.278 4.920 ( -2.926 0.000 -5.943) 6.624 5.391 ( -2.563 0.000 1.194) 2.827 5.624 ( -4.554 0.000 -11.579) 12.442 5.892 ( -7.039 0.000 6.966) 9.903 5.947 ( -0.095 0.000 4.052) 4.053 6.268 ( -5.701 0.000 -3.957) 6.940 6.326 ( 6.688 0.000 4.144) 7.868 6.786 ( 5.980 0.000 -17.357) 18.359 7.326 ( -3.318 0.000 2.805) 4.345 7.375 ( -6.021 0.000 0.345) 6.031 7.387 ( 0.252 0.000 -2.650) 2.662 7.842 ( -6.825 0.000 -1.916) 7.088 7.947 ( 7.493 0.000 3.858) 8.428 8.073 ( 9.314 0.000 -4.077) 10.167 9.046 ( 7.416 0.000 5.414) 9.182 9.377 ( -2.457 0.000 -5.119) 5.679 9.605 ( -1.607 0.000 0.334) 1.641 9.745 ( 4.212 0.000 -0.898) 4.306 10.290 ( -5.020 0.000 4.724) 6.894 10.495 ( -1.883 0.000 -4.570) 4.942 10.913 ( -2.772 0.000 5.437) 6.103 11.239 ( -8.917 0.000 -2.071) 9.155 11.366 ( -2.333 0.000 4.572) 5.132 11.682 ( -5.173 0.000 -0.448) 5.193 11.935 ( 8.285 0.000 5.944) 10.196 12.561 ( 6.318 0.000 -8.497) 10.588 12.982 ( 13.651 0.000 -2.059) 13.805 13.152 ( 1.120 0.000 -3.436) 3.614 17.109 ( -15.019 0.000 1.604) 15.104 17.151 ( -14.430 0.000 -0.439) 14.437 17.245 ( -14.504 0.000 1.968) 14.637 17.502 ( -13.704 0.000 -16.294) 21.291 17.967 ( 10.828 0.000 0.517) 10.840 18.057 ( 11.324 0.000 -0.175) 11.326 18.279 ( 3.925 0.000 4.851) 6.240 18.381 ( 8.340 0.000 -0.422) 8.350 21.083 ( 8.404 0.000 5.118) 9.840 21.113 ( 3.631 0.000 -4.017) 5.415 21.715 ( -0.174 0.000 5.489) 5.492 22.043 ( -0.733 0.000 -0.790) 1.078 ======================= Grid point 101 (33/170) ======================= q-point: ( 0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( 15.485 0.000 19.107) 24.594 1.743 ( 17.841 0.000 21.693) 28.087 2.202 ( 1.105 0.000 -14.298) 14.341 2.331 ( 3.825 0.000 -13.307) 13.846 2.825 ( 13.401 0.000 20.635) 24.604 2.969 ( -12.977 0.000 -1.583) 13.073 3.138 ( -0.914 0.000 6.054) 6.122 3.174 ( 1.166 0.000 -1.016) 1.546 3.483 ( 6.433 0.000 11.421) 13.109 3.595 ( -3.461 0.000 -6.703) 7.544 3.609 ( 0.855 0.000 -0.726) 1.122 3.770 ( -1.860 0.000 2.967) 3.501 3.803 ( -2.324 0.000 -0.938) 2.506 3.820 ( -5.116 0.000 -3.574) 6.241 4.016 ( 1.668 0.000 -0.280) 1.692 4.315 ( 11.531 0.000 -10.448) 15.561 4.393 ( -2.250 0.000 2.259) 3.188 4.608 ( 1.635 0.000 6.929) 7.119 4.815 ( 7.311 0.000 9.284) 11.817 4.862 ( -0.677 0.000 2.246) 2.345 4.969 ( 0.854 0.000 3.180) 3.293 5.379 ( -7.233 0.000 -13.067) 14.935 5.421 ( 4.451 0.000 3.300) 5.541 5.808 ( -10.290 0.000 3.047) 10.732 5.979 ( -1.608 0.000 4.138) 4.439 6.143 ( -5.218 0.000 -2.976) 6.007 6.500 ( 3.459 0.000 9.632) 10.235 6.678 ( 2.770 0.000 -16.566) 16.796 7.265 ( -8.203 0.000 2.885) 8.696 7.292 ( -2.665 0.000 -1.146) 2.901 7.346 ( -1.538 0.000 -3.706) 4.013 7.661 ( -9.400 0.000 -5.156) 10.721 8.137 ( 8.949 0.000 5.851) 10.692 8.205 ( 12.105 0.000 -4.757) 13.006 9.254 ( 9.376 0.000 5.159) 10.702 9.346 ( 4.278 0.000 -2.551) 4.981 9.594 ( 0.220 0.000 1.600) 1.615 9.791 ( 3.749 0.000 -2.043) 4.269 10.285 ( -2.973 0.000 5.494) 6.246 10.423 ( 0.514 0.000 -4.561) 4.590 10.898 ( -5.654 0.000 3.738) 6.778 11.050 ( -10.726 0.000 -3.897) 11.412 11.338 ( -7.593 0.000 5.131) 9.164 11.581 ( -6.237 0.000 -1.722) 6.470 12.168 ( 11.281 0.000 7.396) 13.489 12.582 ( 8.620 0.000 -10.302) 13.433 13.142 ( 9.047 0.000 -1.293) 9.139 13.158 ( 3.450 0.000 -1.534) 3.776 16.862 ( -17.480 0.000 1.907) 17.584 16.884 ( -17.462 0.000 -0.788) 17.480 17.010 ( -17.281 0.000 2.766) 17.501 17.069 ( -16.338 0.000 -16.120) 22.952 18.155 ( 11.464 0.000 0.205) 11.465 18.248 ( 12.121 0.000 0.022) 12.121 18.430 ( 5.745 0.000 7.317) 9.303 18.515 ( 7.744 0.000 0.168) 7.745 21.151 ( 6.161 0.000 -3.124) 6.908 21.240 ( 7.574 0.000 -1.111) 7.655 21.799 ( 0.698 0.000 9.052) 9.079 22.013 ( -0.685 0.000 -2.733) 2.817 ======================= Grid point 102 (34/170) ======================= q-point: ( 0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( 8.527 0.000 10.951) 13.879 2.069 ( 5.623 0.000 -4.775) 7.377 2.271 ( 15.305 0.000 12.286) 19.626 2.273 ( 5.627 0.000 -9.727) 11.238 2.751 ( -12.465 0.000 2.223) 12.661 2.926 ( -6.093 0.000 -3.271) 6.916 3.128 ( -5.022 0.000 -2.723) 5.713 3.231 ( 1.203 0.000 6.888) 6.992 3.374 ( -10.034 0.000 -5.384) 11.387 3.409 ( -7.453 0.000 -10.942) 13.239 3.615 ( -0.251 0.000 5.407) 5.413 3.637 ( -13.424 0.000 -2.070) 13.583 3.953 ( 17.108 0.000 10.028) 19.831 4.070 ( 7.621 0.000 -3.225) 8.276 4.213 ( 11.035 0.000 6.321) 12.717 4.379 ( 9.955 0.000 7.372) 12.387 4.448 ( 16.251 0.000 -7.308) 17.819 4.649 ( 3.952 0.000 -5.004) 6.376 4.875 ( 2.747 0.000 -9.486) 9.876 4.952 ( 2.450 0.000 9.289) 9.607 5.086 ( 0.976 0.000 13.577) 13.612 5.162 ( -4.281 0.000 -7.547) 8.677 5.558 ( 3.643 0.000 6.377) 7.345 5.651 ( -8.767 0.000 -3.356) 9.388 5.997 ( -0.618 0.000 2.849) 2.916 6.036 ( -4.341 0.000 -3.163) 5.372 6.488 ( -6.235 0.000 -13.201) 14.599 6.571 ( -10.003 0.000 10.604) 14.578 7.179 ( -5.581 0.000 1.756) 5.851 7.231 ( -6.257 0.000 -6.342) 8.909 7.268 ( -0.972 0.000 2.685) 2.856 7.496 ( -4.735 0.000 -2.470) 5.340 8.329 ( 10.799 0.000 -5.838) 12.276 8.336 ( 8.641 0.000 4.312) 9.657 9.344 ( -0.770 0.000 -1.179) 1.408 9.443 ( 9.175 0.000 -0.213) 9.178 9.730 ( 10.397 0.000 7.372) 12.745 9.821 ( 3.955 0.000 -3.302) 5.152 10.311 ( -1.232 0.000 4.965) 5.116 10.445 ( 7.243 0.000 -2.208) 7.573 10.819 ( -11.992 0.000 -5.570) 13.223 10.819 ( -7.977 0.000 1.544) 8.125 11.261 ( -8.863 0.000 5.204) 10.277 11.455 ( -6.504 0.000 -2.348) 6.915 12.430 ( 10.834 0.000 7.710) 13.297 12.587 ( 6.646 0.000 -10.471) 12.402 13.226 ( 4.706 0.000 1.370) 4.901 13.238 ( 4.361 0.000 -0.615) 4.404 16.610 ( -15.398 0.000 -1.129) 15.439 16.623 ( -15.060 0.000 1.667) 15.152 16.693 ( -12.043 0.000 -9.606) 15.405 16.791 ( -15.017 0.000 4.332) 15.629 18.315 ( 8.546 0.000 -0.122) 8.547 18.420 ( 9.539 0.000 -0.187) 9.541 18.590 ( 4.510 0.000 5.873) 7.405 18.615 ( 5.353 0.000 -0.863) 5.422 21.232 ( 6.499 0.000 -0.718) 6.538 21.296 ( 4.013 0.000 -4.100) 5.738 21.917 ( 1.360 0.000 8.067) 8.181 21.964 ( -0.271 0.000 -4.481) 4.489 ======================= Grid point 103 (35/170) ======================= q-point: ( 0.36 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -1.593 0.000 2.416) 2.894 2.138 ( 7.794 0.000 -0.947) 7.851 2.256 ( 0.709 0.000 -5.175) 5.223 2.503 ( 1.812 0.000 0.859) 2.005 2.768 ( 2.481 0.000 14.910) 15.115 2.816 ( 2.353 0.000 -2.330) 3.312 3.012 ( -6.405 0.000 -0.192) 6.408 3.130 ( -12.531 0.000 -5.325) 13.615 3.235 ( -6.262 0.000 -5.762) 8.510 3.243 ( -1.353 0.000 -5.145) 5.320 3.465 ( -4.298 0.000 2.130) 4.797 3.687 ( 0.094 0.000 6.141) 6.142 4.123 ( -5.810 0.000 -5.169) 7.777 4.166 ( 9.237 0.000 -4.444) 10.251 4.289 ( 14.700 0.000 3.858) 15.198 4.526 ( -3.512 0.000 0.444) 3.540 4.767 ( 30.316 0.000 -19.428) 36.007 4.803 ( 2.443 0.000 -9.289) 9.605 4.846 ( 15.275 0.000 7.284) 16.923 5.039 ( -0.501 0.000 6.073) 6.093 5.171 ( 8.362 0.000 0.435) 8.373 5.209 ( -2.298 0.000 9.902) 10.165 5.513 ( -2.608 0.000 1.114) 2.836 5.631 ( -3.180 0.000 6.430) 7.174 5.921 ( -5.027 0.000 -6.026) 7.848 6.023 ( 0.739 0.000 0.374) 0.828 6.210 ( -12.381 0.000 -7.903) 14.688 6.436 ( -18.012 0.000 7.320) 19.443 7.063 ( -5.800 0.000 -3.534) 6.792 7.131 ( -3.951 0.000 3.200) 5.084 7.303 ( -0.862 0.000 4.634) 4.714 7.446 ( -1.189 0.000 0.389) 1.251 8.412 ( 8.514 0.000 -6.750) 10.865 8.483 ( 5.249 0.000 1.462) 5.449 9.301 ( -0.817 0.000 -1.418) 1.636 9.595 ( 8.020 0.000 0.947) 8.076 9.854 ( 6.454 0.000 -4.537) 7.889 9.996 ( 11.971 0.000 7.181) 13.960 10.345 ( -1.867 0.000 4.958) 5.298 10.525 ( -5.540 0.000 -6.371) 8.443 10.599 ( 2.234 0.000 -1.980) 2.984 10.691 ( -8.057 0.000 -1.174) 8.142 11.185 ( -8.335 0.000 5.574) 10.027 11.340 ( -4.525 0.000 -1.968) 4.934 12.580 ( 5.663 0.000 -7.166) 9.133 12.656 ( 6.785 0.000 7.144) 9.853 13.268 ( 1.029 0.000 -1.145) 1.539 13.310 ( 2.779 0.000 2.247) 3.573 16.395 ( -10.353 0.000 -0.465) 10.364 16.437 ( -10.332 0.000 1.109) 10.391 16.500 ( -5.760 0.000 0.119) 5.761 16.645 ( -11.203 0.000 6.779) 13.094 18.417 ( 5.043 0.000 -0.882) 5.119 18.539 ( 5.843 0.000 -0.307) 5.852 18.664 ( 3.565 0.000 -2.692) 4.467 18.675 ( 1.860 0.000 -0.289) 1.883 21.309 ( 2.696 0.000 -1.779) 3.230 21.330 ( 4.570 0.000 2.177) 5.062 21.913 ( 0.990 0.000 -5.424) 5.513 21.993 ( -0.053 0.000 3.231) 3.231 ======================= Grid point 104 (36/170) ======================= q-point: ( 0.45 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( -8.126 0.000 2.219) 8.424 2.250 ( 2.337 0.000 5.841) 6.291 2.270 ( 7.813 0.000 -4.110) 8.828 2.561 ( 4.629 0.000 -0.868) 4.710 2.728 ( -8.727 0.000 -5.121) 10.118 2.894 ( 3.183 0.000 -0.540) 3.228 2.956 ( -11.209 0.000 -4.830) 12.205 2.968 ( 0.509 0.000 5.324) 5.348 3.191 ( 1.082 0.000 -3.712) 3.867 3.213 ( 8.324 0.000 9.625) 12.725 3.449 ( -3.020 0.000 1.062) 3.201 3.703 ( -4.744 0.000 0.859) 4.821 4.017 ( 1.025 0.000 -3.499) 3.646 4.231 ( 7.205 0.000 -9.018) 11.543 4.438 ( -4.179 0.000 -3.364) 5.365 4.510 ( 9.539 0.000 0.781) 9.571 4.770 ( 5.124 0.000 -6.209) 8.050 4.865 ( -10.127 0.000 -0.280) 10.130 5.084 ( 29.191 0.000 -11.416) 31.344 5.112 ( -0.057 0.000 -6.178) 6.178 5.231 ( -4.870 0.000 5.012) 6.989 5.259 ( 10.186 0.000 -0.164) 10.187 5.544 ( -17.236 0.000 -1.722) 17.322 5.631 ( -4.521 0.000 5.778) 7.337 5.834 ( 13.701 0.000 0.380) 13.706 5.986 ( -6.764 0.000 0.436) 6.778 6.035 ( -4.328 0.000 2.741) 5.122 6.225 ( -12.262 0.000 0.050) 12.262 7.029 ( 1.576 0.000 4.474) 4.744 7.126 ( -2.701 0.000 5.159) 5.823 7.325 ( -2.645 0.000 4.484) 5.206 7.451 ( -0.159 0.000 2.237) 2.243 8.447 ( 5.891 0.000 -7.408) 9.465 8.519 ( -0.008 0.000 -2.535) 2.535 9.305 ( 1.292 0.000 0.952) 1.604 9.667 ( 0.802 0.000 -0.952) 1.245 9.942 ( 9.537 0.000 -3.294) 10.090 10.253 ( 7.310 0.000 0.552) 7.331 10.266 ( -7.712 0.000 -2.021) 7.973 10.341 ( -6.966 0.000 5.906) 9.132 10.571 ( -2.087 0.000 -4.341) 4.817 10.676 ( 5.208 0.000 -3.918) 6.517 11.117 ( -7.642 0.000 4.941) 9.100 11.285 ( -0.324 0.000 -0.658) 0.734 12.629 ( 6.615 0.000 -1.006) 6.691 12.773 ( -1.445 0.000 5.090) 5.291 13.264 ( 1.078 0.000 -1.292) 1.683 13.348 ( -0.608 0.000 1.207) 1.351 16.284 ( -3.399 0.000 0.255) 3.408 16.331 ( -4.108 0.000 0.540) 4.144 16.510 ( -0.407 0.000 9.978) 9.987 16.592 ( -6.803 0.000 9.206) 11.447 18.454 ( 2.093 0.000 -2.538) 3.290 18.594 ( 1.828 0.000 -1.446) 2.330 18.642 ( -0.191 0.000 -6.967) 6.970 18.670 ( 1.839 0.000 -3.991) 4.395 21.356 ( 2.727 0.000 2.520) 3.713 21.410 ( 0.739 0.000 4.157) 4.223 21.887 ( 3.216 0.000 -4.964) 5.915 21.979 ( -2.581 0.000 -2.053) 3.298 ======================= Grid point 105 (37/170) ======================= q-point: (-0.45 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( -3.968 0.000 -0.328) 3.982 2.336 ( -4.309 0.000 9.644) 10.563 2.371 ( 7.004 0.000 0.034) 7.004 2.441 ( -6.055 0.000 -9.468) 11.238 2.602 ( -8.306 0.000 -2.212) 8.596 2.897 ( 11.618 0.000 -3.238) 12.061 2.908 ( 1.128 0.000 2.840) 3.056 3.105 ( 4.679 0.000 7.632) 8.952 3.198 ( 4.216 0.000 -3.612) 5.552 3.381 ( -2.011 0.000 -2.181) 2.967 3.470 ( 7.238 0.000 9.853) 12.226 3.581 ( -5.185 0.000 -5.407) 7.492 4.068 ( 7.039 0.000 -2.301) 7.406 4.170 ( 3.855 0.000 -17.166) 17.594 4.346 ( -5.493 0.000 0.528) 5.518 4.529 ( -16.272 0.000 1.313) 16.325 4.616 ( -5.767 0.000 -13.263) 14.463 4.823 ( 6.307 0.000 -2.070) 6.638 5.060 ( -22.941 0.000 -9.217) 24.724 5.091 ( 1.820 0.000 3.600) 4.034 5.149 ( -7.845 0.000 1.978) 8.090 5.367 ( 8.061 0.000 -1.054) 8.130 5.479 ( 9.299 0.000 4.086) 10.157 5.637 ( -1.161 0.000 4.065) 4.227 5.873 ( -1.918 0.000 -1.901) 2.700 5.957 ( 1.931 0.000 -1.244) 2.297 6.073 ( -2.792 0.000 -6.009) 6.626 6.225 ( 16.236 0.000 5.810) 17.245 7.147 ( -1.961 0.000 4.576) 4.978 7.185 ( 7.049 0.000 8.298) 10.888 7.327 ( -3.592 0.000 5.287) 6.392 7.497 ( 1.068 0.000 5.761) 5.859 8.427 ( -4.538 0.000 -7.374) 8.659 8.435 ( 3.236 0.000 -7.640) 8.296 9.353 ( 1.870 0.000 3.140) 3.655 9.618 ( -3.459 0.000 -3.231) 4.734 10.000 ( -12.790 0.000 -4.526) 13.567 10.024 ( 2.249 0.000 -0.677) 2.349 10.274 ( -7.226 0.000 4.375) 8.447 10.491 ( 11.969 0.000 1.066) 12.016 10.546 ( 5.020 0.000 -5.043) 7.115 10.657 ( -1.199 0.000 -3.524) 3.723 11.071 ( -3.012 0.000 3.189) 4.387 11.316 ( 4.038 0.000 0.629) 4.087 12.713 ( -10.096 0.000 1.251) 10.173 12.756 ( 6.366 0.000 4.503) 7.798 13.288 ( 2.164 0.000 0.584) 2.241 13.318 ( -3.569 0.000 -0.499) 3.604 16.297 ( 4.176 0.000 0.711) 4.237 16.323 ( 2.692 0.000 0.096) 2.693 16.633 ( -2.175 0.000 11.130) 11.340 16.694 ( 4.508 0.000 17.023) 17.609 18.429 ( 0.130 0.000 -4.978) 4.979 18.497 ( -1.267 0.000 -12.982) 13.044 18.601 ( -1.919 0.000 -0.403) 1.961 18.635 ( -0.573 0.000 -4.244) 4.283 21.436 ( -3.027 0.000 3.974) 4.995 21.439 ( 1.975 0.000 5.000) 5.376 21.870 ( -5.378 0.000 -6.224) 8.226 21.907 ( 4.734 0.000 -2.879) 5.541 ======================= Grid point 106 (38/170) ======================= q-point: (-0.36 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -12.853 0.000 -6.594) 14.445 2.085 ( -19.416 0.000 -10.642) 22.141 2.394 ( -1.916 0.000 8.078) 8.302 2.470 ( 4.330 0.000 1.449) 4.566 2.619 ( 7.393 0.000 2.653) 7.855 3.005 ( 4.848 0.000 -5.426) 7.276 3.054 ( 7.410 0.000 7.505) 10.547 3.210 ( 4.946 0.000 -6.985) 8.559 3.235 ( -0.271 0.000 6.610) 6.615 3.385 ( 7.076 0.000 -1.418) 7.217 3.469 ( -1.075 0.000 -4.980) 5.094 3.656 ( 7.069 0.000 1.559) 7.239 3.989 ( -16.802 0.000 -11.868) 20.571 4.016 ( 1.123 0.000 -15.008) 15.050 4.239 ( -5.648 0.000 1.272) 5.789 4.274 ( -5.618 0.000 2.575) 6.179 4.335 ( -18.446 0.000 -7.627) 19.961 4.717 ( -5.203 0.000 -4.756) 7.049 4.858 ( -1.848 0.000 -1.449) 2.348 5.046 ( -6.316 0.000 1.025) 6.399 5.294 ( 10.387 0.000 10.483) 14.757 5.295 ( -15.461 0.000 5.189) 16.308 5.583 ( -6.319 0.000 -2.934) 6.967 5.654 ( 6.400 0.000 4.348) 7.737 5.934 ( 2.979 0.000 0.460) 3.015 5.972 ( 2.488 0.000 -1.813) 3.078 6.079 ( 15.125 0.000 -6.779) 16.575 6.521 ( 16.389 0.000 0.602) 16.400 7.155 ( -1.536 0.000 2.055) 2.566 7.338 ( -3.015 0.000 6.107) 6.811 7.346 ( 4.360 0.000 2.646) 5.101 7.642 ( 4.449 0.000 12.189) 12.976 8.235 ( -6.741 0.000 -9.872) 11.954 8.382 ( 0.466 0.000 -7.195) 7.210 9.419 ( 0.636 0.000 3.746) 3.800 9.507 ( -5.133 0.000 -3.461) 6.191 9.756 ( -13.246 0.000 -2.574) 13.493 10.001 ( -4.649 0.000 1.524) 4.892 10.224 ( -4.366 0.000 2.360) 4.963 10.522 ( -1.535 0.000 -4.597) 4.847 10.596 ( 8.010 0.000 -5.341) 9.627 10.730 ( 9.792 0.000 1.354) 9.885 11.103 ( 2.958 0.000 2.390) 3.803 11.412 ( 6.211 0.000 1.256) 6.336 12.514 ( -14.158 0.000 -1.453) 14.233 12.901 ( 2.541 0.000 7.514) 7.932 13.235 ( -4.289 0.000 -2.401) 4.916 13.329 ( 0.559 0.000 2.492) 2.554 16.417 ( 9.156 0.000 -0.104) 9.156 16.425 ( 10.780 0.000 0.835) 10.813 16.765 ( 2.121 0.000 12.712) 12.887 17.015 ( 9.815 0.000 20.197) 22.455 18.319 ( -1.765 0.000 -14.305) 14.414 18.351 ( -1.358 0.000 -7.427) 7.550 18.539 ( -5.477 0.000 -0.210) 5.481 18.556 ( -3.550 0.000 -4.139) 5.453 21.409 ( -4.777 0.000 2.557) 5.418 21.504 ( -2.218 0.000 4.891) 5.370 21.689 ( -5.664 0.000 -8.609) 10.305 21.959 ( 4.007 0.000 -0.807) 4.088 ======================= Grid point 107 (39/170) ======================= q-point: (-0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( -22.768 0.000 -10.276) 24.980 1.611 ( -26.019 0.000 -9.827) 27.813 2.489 ( -9.689 0.000 -1.694) 9.836 2.530 ( 4.648 0.000 10.939) 11.886 2.798 ( 13.312 0.000 -0.843) 13.339 2.865 ( -24.220 0.000 -3.545) 24.478 2.966 ( -0.864 0.000 -3.853) 3.949 3.224 ( -3.927 0.000 0.535) 3.963 3.371 ( 4.295 0.000 0.204) 4.299 3.451 ( 9.380 0.000 -1.975) 9.586 3.508 ( 7.505 0.000 -2.656) 7.961 3.685 ( 6.407 0.000 -12.200) 13.780 3.744 ( 0.563 0.000 -3.511) 3.556 3.941 ( -18.534 0.000 -0.499) 18.541 3.963 ( 3.306 0.000 -0.209) 3.312 4.222 ( 1.816 0.000 -4.127) 4.509 4.234 ( -4.307 0.000 4.488) 6.220 4.736 ( -8.933 0.000 -2.546) 9.289 4.744 ( 8.671 0.000 -0.256) 8.674 4.931 ( -8.309 0.000 -3.334) 8.953 5.066 ( -19.603 0.000 3.689) 19.947 5.477 ( -1.911 0.000 -2.030) 2.788 5.585 ( 9.953 0.000 10.187) 14.242 5.770 ( 0.395 0.000 7.234) 7.245 5.960 ( -1.196 0.000 2.977) 3.209 6.012 ( 7.627 0.000 -3.948) 8.588 6.243 ( 10.409 0.000 -4.769) 11.450 6.748 ( 13.779 0.000 -2.332) 13.975 7.162 ( 1.206 0.000 0.328) 1.250 7.361 ( -1.764 0.000 4.886) 5.195 7.402 ( 2.012 0.000 -0.327) 2.039 7.841 ( 3.244 0.000 10.234) 10.736 8.033 ( -5.557 0.000 -7.862) 9.627 8.291 ( -2.946 0.000 -6.039) 6.719 9.375 ( -12.250 0.000 0.692) 12.269 9.412 ( -2.285 0.000 -1.831) 2.928 9.591 ( -2.959 0.000 0.349) 2.979 9.936 ( -5.456 0.000 1.256) 5.598 10.177 ( -5.140 0.000 2.621) 5.769 10.486 ( 1.426 0.000 -1.271) 1.910 10.664 ( 7.886 0.000 -5.390) 9.552 10.888 ( 10.175 0.000 -1.208) 10.246 11.206 ( 5.909 0.000 2.800) 6.539 11.524 ( 5.881 0.000 1.316) 6.026 12.260 ( -14.617 0.000 -2.479) 14.826 12.948 ( -7.427 0.000 5.564) 9.279 13.176 ( 1.270 0.000 -1.620) 2.058 13.359 ( -1.145 0.000 4.085) 4.242 16.603 ( 14.338 0.000 0.063) 14.338 16.642 ( 15.372 0.000 0.675) 15.387 16.971 ( 5.105 0.000 13.615) 14.540 17.425 ( 13.821 0.000 19.051) 23.536 18.140 ( -1.660 0.000 -12.904) 13.011 18.225 ( -3.028 0.000 -8.829) 9.334 18.426 ( -8.616 0.000 -0.099) 8.617 18.431 ( -6.511 0.000 -4.333) 7.821 21.350 ( -4.932 0.000 0.863) 5.007 21.370 ( -13.718 0.000 -3.496) 14.156 21.616 ( 1.881 0.000 -1.503) 2.408 22.006 ( 2.260 0.000 0.176) 2.267 ======================= Grid point 108 (40/170) ======================= q-point: (-0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.914 ( -28.374 0.000 -3.332) 28.569 1.072 ( -31.346 0.000 -4.577) 31.678 1.866 ( -53.163 0.000 -0.787) 53.168 2.679 ( -0.832 0.000 4.999) 5.068 2.760 ( -0.228 0.000 5.831) 5.836 2.953 ( 3.250 0.000 0.007) 3.250 3.027 ( 18.302 0.000 -1.728) 18.384 3.128 ( -6.261 0.000 -5.660) 8.440 3.317 ( -0.301 0.000 -5.597) 5.605 3.503 ( 2.866 0.000 -6.778) 7.359 3.510 ( -6.583 0.000 0.902) 6.645 3.695 ( 2.982 0.000 -1.404) 3.296 3.732 ( 6.695 0.000 -0.556) 6.718 3.896 ( 2.340 0.000 1.179) 2.620 4.038 ( 4.577 0.000 0.267) 4.585 4.238 ( -1.993 0.000 4.710) 5.114 4.298 ( 10.722 0.000 0.531) 10.735 4.557 ( -8.764 0.000 -4.109) 9.679 4.729 ( -11.280 0.000 -5.430) 12.519 4.795 ( -15.797 0.000 2.232) 15.954 4.893 ( 10.996 0.000 -3.211) 11.456 5.454 ( -1.798 0.000 1.422) 2.293 5.767 ( 1.843 0.000 6.798) 7.043 5.824 ( -2.066 0.000 3.090) 3.716 5.958 ( -2.895 0.000 2.421) 3.774 6.158 ( 13.422 0.000 -0.360) 13.427 6.284 ( 0.651 0.000 -2.395) 2.482 6.915 ( 10.304 0.000 -0.463) 10.314 7.197 ( 3.184 0.000 -0.705) 3.261 7.396 ( -0.029 0.000 4.180) 4.180 7.415 ( 1.129 0.000 -1.468) 1.852 7.901 ( -2.642 0.000 -4.514) 5.230 7.947 ( 0.891 0.000 3.676) 3.782 8.154 ( -6.939 0.000 -4.641) 8.347 9.144 ( -14.400 0.000 -0.115) 14.400 9.410 ( 3.139 0.000 -0.287) 3.152 9.600 ( 0.651 0.000 1.383) 1.528 9.852 ( -5.870 0.000 -0.652) 5.906 10.125 ( -6.069 0.000 4.276) 7.424 10.520 ( 3.505 0.000 -0.769) 3.588 10.728 ( 6.698 0.000 -3.264) 7.451 11.033 ( 10.134 0.000 -1.150) 10.199 11.328 ( 5.012 0.000 2.720) 5.703 11.616 ( 4.077 0.000 1.092) 4.221 12.022 ( -11.849 0.000 -2.174) 12.047 12.827 ( -9.704 0.000 0.123) 9.704 13.206 ( 1.360 0.000 0.741) 1.549 13.387 ( -0.758 0.000 3.036) 3.129 16.856 ( 17.035 0.000 0.430) 17.041 16.908 ( 17.093 0.000 0.421) 17.098 17.191 ( 5.627 0.000 7.851) 9.659 17.824 ( 12.584 0.000 12.799) 17.949 17.993 ( -0.519 0.000 -10.305) 10.318 18.081 ( -5.264 0.000 -3.127) 6.122 18.261 ( -8.325 0.000 -4.485) 9.457 18.276 ( -9.970 0.000 0.520) 9.983 21.104 ( -14.071 0.000 -2.688) 14.325 21.278 ( -3.907 0.000 -1.031) 4.041 21.634 ( 1.315 0.000 -0.272) 1.342 22.033 ( 0.805 0.000 0.344) 0.875 ======================= Grid point 109 (41/170) ======================= q-point: (-0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.587 ( -23.274 0.000 23.197) 32.860 0.607 ( -29.011 0.000 14.475) 32.422 1.120 ( -51.729 0.000 30.814) 60.211 2.623 ( -4.864 0.000 -3.394) 5.931 2.782 ( -4.119 0.000 -3.306) 5.282 2.967 ( -1.779 0.000 -1.423) 2.278 3.024 ( 4.259 0.000 -0.763) 4.327 3.288 ( 13.111 0.000 -0.371) 13.116 3.324 ( 2.545 0.000 0.752) 2.654 3.454 ( -2.002 0.000 5.831) 6.165 3.547 ( 7.969 0.000 -0.056) 7.969 3.737 ( 3.047 0.000 -2.086) 3.692 3.832 ( 1.014 0.000 7.942) 8.007 3.981 ( 5.895 0.000 13.525) 14.754 4.089 ( 3.220 0.000 -2.893) 4.329 4.248 ( -1.782 0.000 -1.026) 2.056 4.374 ( -10.331 0.000 0.329) 10.336 4.426 ( 4.931 0.000 -6.710) 8.327 4.512 ( -5.147 0.000 -4.155) 6.615 4.674 ( -4.636 0.000 3.485) 5.799 5.029 ( 11.237 0.000 -0.624) 11.255 5.440 ( -3.154 0.000 3.132) 4.445 5.708 ( -8.729 0.000 -5.733) 10.443 5.866 ( 3.337 0.000 1.695) 3.743 5.928 ( -3.512 0.000 1.925) 4.005 6.247 ( -1.789 0.000 -1.021) 2.060 6.343 ( 8.647 0.000 -0.740) 8.678 7.077 ( 5.094 0.000 3.157) 5.993 7.246 ( 2.779 0.000 1.419) 3.120 7.412 ( 1.096 0.000 -1.817) 2.122 7.440 ( -0.545 0.000 3.592) 3.633 7.842 ( 0.293 0.000 -3.276) 3.289 7.921 ( -2.115 0.000 -10.982) 11.184 8.059 ( -0.841 0.000 7.564) 7.610 8.968 ( -8.315 0.000 1.671) 8.481 9.470 ( 4.103 0.000 -0.597) 4.146 9.620 ( 0.065 0.000 1.010) 1.012 9.746 ( -5.295 0.000 -1.046) 5.397 10.125 ( 0.397 0.000 9.922) 9.930 10.559 ( 2.705 0.000 -1.798) 3.248 10.812 ( 5.360 0.000 1.283) 5.512 11.179 ( 8.991 0.000 0.093) 8.991 11.399 ( 0.137 0.000 2.016) 2.021 11.679 ( 2.543 0.000 1.756) 3.090 11.858 ( -6.673 0.000 -0.641) 6.703 12.684 ( -5.812 0.000 -3.162) 6.616 13.214 ( -0.538 0.000 -0.558) 0.776 13.272 ( -13.568 0.000 -19.934) 24.113 17.107 ( 12.003 0.000 -2.182) 12.200 17.164 ( 13.865 0.000 0.217) 13.867 17.241 ( 6.013 0.000 -8.052) 10.049 17.897 ( 0.440 0.000 -7.742) 7.755 17.993 ( -3.038 0.000 0.833) 3.150 18.000 ( -11.195 0.000 2.742) 11.526 18.200 ( 2.505 0.000 13.920) 14.144 18.201 ( 0.025 0.000 3.174) 3.174 20.916 ( -8.330 0.000 2.504) 8.698 21.206 ( -2.852 0.000 -2.950) 4.103 21.651 ( 0.769 0.000 0.528) 0.933 22.043 ( 0.134 0.000 0.557) 0.573 ======================= Grid point 110 (42/170) ======================= q-point: ( 0.00 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( -4.148 25.711 19.345) 32.442 1.016 ( -0.000 23.919 24.173) 34.007 1.652 ( 2.371 34.558 45.662) 57.314 2.543 ( -0.758 3.238 -10.547) 11.059 2.641 ( -2.344 2.533 -8.084) 8.789 2.988 ( 2.028 -5.653 3.993) 7.212 3.060 ( 0.253 -0.055 -1.913) 1.931 3.300 ( 0.627 1.163 -5.095) 5.264 3.362 ( -0.082 -0.705 -3.286) 3.362 3.424 ( 1.092 -3.271 4.604) 5.752 3.672 ( 0.320 -5.126 -1.159) 5.265 3.701 ( 0.184 0.626 -3.073) 3.141 3.971 ( -2.073 1.806 10.504) 10.858 4.030 ( -7.439 -8.129 1.137) 11.077 4.093 ( 3.275 -7.056 11.644) 14.003 4.191 ( 7.931 0.902 -1.495) 8.121 4.377 ( 3.449 6.519 -1.789) 7.589 4.516 ( 2.311 2.999 1.058) 3.931 4.563 ( 1.325 12.864 -1.698) 13.044 4.779 ( -0.770 6.378 6.800) 9.355 5.069 ( -5.253 0.267 -5.648) 7.718 5.469 ( -3.857 2.545 -1.904) 4.998 5.708 ( 5.926 3.309 1.116) 6.878 5.806 ( -4.371 -5.945 3.966) 8.377 5.880 ( -0.301 -2.163 -3.299) 3.956 6.182 ( 0.817 -4.408 -0.502) 4.511 6.388 ( -0.287 -0.265 -2.739) 2.767 6.913 ( -2.198 -1.891 -4.385) 5.257 7.286 ( 1.608 -1.981 1.062) 2.764 7.445 ( -3.436 2.308 0.604) 4.183 7.552 ( -2.097 8.172 -0.619) 8.459 7.723 ( 6.575 -5.775 0.885) 8.796 8.020 ( 4.354 0.241 -0.914) 4.455 8.041 ( -3.669 9.387 -0.061) 10.079 9.045 ( -1.040 5.646 -0.782) 5.794 9.462 ( -0.837 -2.840 -1.300) 3.234 9.641 ( -1.079 0.576 -3.361) 3.577 9.853 ( -0.279 11.904 -7.179) 13.904 10.327 ( 3.391 1.814 -0.015) 3.845 10.608 ( 0.226 5.003 -3.918) 6.358 10.827 ( -1.599 -5.055 3.814) 6.532 11.268 ( 3.324 -3.672 3.918) 6.316 11.381 ( -4.245 1.513 -3.174) 5.512 11.743 ( -6.883 -1.668 2.920) 7.660 11.779 ( 6.714 -0.874 3.725) 7.728 12.602 ( -0.049 -4.929 6.151) 7.882 12.630 ( 0.307 -2.209 1.954) 2.966 13.218 ( -0.818 -1.061 -6.023) 6.170 17.086 ( 2.362 -6.459 -4.959) 8.479 17.161 ( -3.148 -11.651 -0.006) 12.069 17.223 ( -0.219 -10.756 -0.464) 10.768 17.680 ( -1.945 -7.988 -11.356) 14.020 17.960 ( 1.671 5.234 2.237) 5.932 18.122 ( -0.961 8.692 -0.644) 8.768 18.313 ( 1.165 7.499 1.632) 7.763 18.387 ( -0.965 6.577 -0.085) 6.648 20.989 ( 1.615 6.841 5.656) 9.022 21.128 ( 0.725 0.247 -2.354) 2.476 21.663 ( 0.151 -1.090 2.784) 2.994 22.060 ( -0.212 0.674 0.731) 1.016 ======================= Grid point 111 (43/170) ======================= q-point: ( 0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( 11.413 13.180 22.310) 28.315 1.388 ( 10.109 15.198 24.042) 30.186 2.341 ( 17.635 23.514 40.663) 50.174 2.401 ( 0.511 3.440 -14.490) 14.901 2.525 ( 1.791 6.254 -12.010) 13.659 3.036 ( -2.162 -1.982 1.774) 3.428 3.053 ( -0.778 -9.954 2.415) 10.272 3.260 ( -6.882 -0.050 -3.896) 7.908 3.320 ( 6.061 2.854 1.353) 6.835 3.489 ( 3.752 -3.145 2.059) 5.311 3.621 ( -1.970 -7.144 -5.158) 9.029 3.668 ( -0.380 -2.165 -1.136) 2.474 3.852 ( -4.935 -2.914 -4.483) 7.276 4.024 ( -6.414 1.103 7.247) 9.740 4.166 ( -8.762 -0.514 5.309) 10.258 4.310 ( 0.048 3.192 -6.937) 7.636 4.435 ( 3.262 5.146 14.094) 15.355 4.557 ( 8.201 11.104 -3.292) 14.192 4.645 ( 5.498 4.335 4.485) 8.315 4.885 ( 1.669 2.223 5.497) 6.160 4.929 ( -2.399 2.165 -1.798) 3.698 5.402 ( -1.221 1.403 -1.986) 2.721 5.666 ( -5.135 3.439 -8.045) 10.145 5.765 ( -6.610 -7.769 3.113) 10.665 5.961 ( 5.854 -0.939 3.629) 6.951 6.203 ( 0.462 -4.470 -1.681) 4.798 6.345 ( -0.133 -0.785 1.695) 1.873 6.794 ( 0.160 -0.422 -12.158) 12.166 7.303 ( -2.713 -2.124 1.670) 3.829 7.381 ( -2.470 -0.279 -0.435) 2.524 7.488 ( -4.371 8.827 -1.496) 9.963 7.882 ( 3.842 1.934 1.732) 4.637 7.937 ( -2.161 1.834 -0.035) 2.835 8.124 ( 10.067 4.806 -3.015) 11.555 9.086 ( 5.025 3.310 3.745) 7.087 9.386 ( -1.915 1.013 -3.689) 4.278 9.642 ( 0.239 0.864 1.093) 1.414 9.794 ( 1.584 7.376 -4.739) 8.909 10.312 ( -5.496 2.213 5.167) 7.862 10.533 ( -2.346 3.751 -5.453) 7.022 10.860 ( -1.560 -5.272 5.161) 7.541 11.231 ( -9.369 -0.802 -3.278) 9.958 11.328 ( -1.767 -3.570 4.163) 5.762 11.663 ( -4.473 -2.612 -1.358) 5.355 11.965 ( 8.332 3.032 7.711) 11.750 12.595 ( 6.271 3.282 -8.072) 10.736 12.867 ( 12.948 -8.800 4.440) 16.273 13.149 ( 0.821 -1.795 -5.670) 6.004 16.914 ( -13.199 -9.277 -1.822) 16.236 17.075 ( -13.283 -10.137 -2.693) 16.925 17.247 ( 2.717 -5.185 -0.079) 5.854 17.541 ( -2.879 -0.921 -12.343) 12.708 17.914 ( -3.992 3.136 -0.277) 5.084 18.163 ( 2.255 4.023 0.314) 4.622 18.279 ( 2.618 4.337 3.382) 6.091 18.475 ( 6.021 6.044 3.467) 9.209 21.112 ( 5.137 3.355 1.852) 6.409 21.148 ( 6.628 2.607 -2.120) 7.431 21.707 ( -0.597 -0.710 6.266) 6.334 22.049 ( -1.243 0.494 -0.624) 1.476 ======================= Grid point 112 (44/170) ======================= q-point: ( 0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( 15.389 6.628 18.729) 25.130 1.814 ( 12.258 6.668 20.698) 24.962 2.251 ( 0.795 4.421 -13.023) 13.776 2.415 ( 3.035 7.974 -13.628) 16.078 2.908 ( 6.216 6.383 12.560) 15.400 2.955 ( -9.328 -0.991 0.737) 9.410 3.057 ( 0.430 -6.621 2.992) 7.278 3.165 ( -0.461 -1.626 0.182) 1.700 3.475 ( -3.447 -9.456 -7.765) 12.712 3.526 ( 5.975 2.668 10.031) 11.977 3.593 ( 1.284 -3.401 -2.833) 4.609 3.737 ( 10.719 -4.329 7.250) 13.646 3.750 ( -6.745 1.595 3.917) 7.961 3.855 ( -9.304 0.747 -4.946) 10.563 4.055 ( -3.966 3.966 1.052) 5.707 4.342 ( 9.191 6.312 -4.349) 11.968 4.516 ( -2.026 6.908 1.365) 7.327 4.659 ( 2.615 5.717 3.058) 6.991 4.841 ( 7.482 2.712 6.569) 10.319 4.898 ( 1.788 3.969 3.458) 5.560 4.983 ( 0.532 1.858 3.544) 4.037 5.383 ( 0.992 1.869 -6.947) 7.262 5.498 ( -2.295 5.904 -2.618) 6.854 5.681 ( -7.090 -9.027 1.669) 11.599 6.034 ( -1.721 2.640 3.140) 4.449 6.146 ( -2.964 -0.128 -1.379) 3.272 6.432 ( 0.189 -7.552 8.158) 11.119 6.651 ( 0.045 -2.701 -14.712) 14.958 7.234 ( -5.336 -3.493 -0.085) 6.378 7.371 ( -1.709 4.358 0.935) 4.774 7.395 ( -3.661 7.903 -1.570) 8.850 7.717 ( -9.476 5.918 -5.850) 12.612 8.124 ( 10.550 -0.421 4.821) 11.607 8.259 ( 11.037 4.351 -3.170) 12.280 9.260 ( 8.670 0.621 5.252) 10.155 9.367 ( 3.267 2.124 -1.765) 4.278 9.643 ( -0.544 3.792 1.413) 4.083 9.796 ( 3.499 1.964 -3.029) 5.027 10.302 ( -3.750 1.683 6.164) 7.409 10.446 ( -0.074 2.222 -5.133) 5.593 10.867 ( -3.943 -3.113 3.423) 6.079 11.027 ( -10.489 -2.190 -4.877) 11.773 11.310 ( -6.777 -2.730 5.210) 8.973 11.561 ( -5.855 -2.350 -2.287) 6.711 12.206 ( 10.708 3.737 8.117) 13.946 12.618 ( 8.466 3.597 -9.833) 13.465 13.068 ( 8.360 -6.412 1.468) 10.637 13.135 ( 4.110 -3.107 -3.202) 6.066 16.688 ( -12.546 -7.196 -1.735) 14.567 16.810 ( -13.243 -7.627 -4.640) 15.971 17.153 ( -14.092 10.465 1.116) 17.588 17.273 ( -14.523 12.333 -8.489) 20.859 17.958 ( 8.890 -10.817 -0.021) 14.002 18.250 ( 8.639 -8.186 0.780) 11.927 18.420 ( 6.850 4.578 3.510) 8.956 18.602 ( 4.394 4.827 4.126) 7.722 21.169 ( 5.158 2.061 -2.305) 6.014 21.262 ( 7.488 1.598 -2.576) 8.078 21.789 ( -0.104 -0.972 9.463) 9.514 22.009 ( -1.617 -0.482 -2.566) 3.071 ======================= Grid point 113 (45/170) ======================= q-point: ( 0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( 6.916 5.096 11.883) 14.663 2.139 ( 5.118 6.854 -2.807) 9.003 2.263 ( 13.219 -0.636 10.659) 16.993 2.338 ( 4.963 6.265 -10.533) 13.222 2.746 ( -11.833 -0.874 1.934) 12.022 2.954 ( -6.138 2.203 -2.960) 7.161 3.065 ( -3.761 -6.367 0.124) 7.396 3.210 ( 3.211 -3.067 1.295) 4.625 3.242 ( -8.248 -8.311 -9.155) 14.863 3.441 ( -9.292 0.937 -3.791) 10.079 3.595 ( -1.300 -1.014 2.523) 3.014 3.652 ( -12.194 0.098 -1.351) 12.269 3.919 ( 14.529 -4.561 5.074) 16.051 4.018 ( 6.138 -4.422 1.718) 7.758 4.276 ( 16.190 6.315 9.261) 19.691 4.391 ( 5.946 5.386 -0.507) 8.039 4.538 ( 7.639 6.810 -0.308) 10.238 4.700 ( 4.667 5.250 -5.605) 8.987 4.863 ( -0.324 -0.812 -6.447) 6.506 5.024 ( 4.826 5.997 5.971) 9.742 5.100 ( 2.412 2.954 11.344) 11.968 5.281 ( -0.553 8.791 -5.406) 10.335 5.481 ( -4.557 -6.289 -0.881) 7.816 5.642 ( -0.456 -0.143 3.400) 3.433 6.011 ( -2.047 1.459 1.502) 2.928 6.094 ( -3.212 4.158 -1.190) 5.388 6.407 ( -8.734 -8.470 -5.222) 13.240 6.502 ( -7.237 -6.498 1.720) 9.877 7.150 ( -3.720 -3.507 -3.175) 6.018 7.302 ( -5.297 11.778 1.974) 13.065 7.389 ( -0.517 6.152 1.635) 6.387 7.526 ( -6.363 4.614 -4.141) 8.883 8.328 ( 10.697 0.810 0.635) 10.746 8.392 ( 9.338 4.240 -1.631) 10.384 9.351 ( -0.858 0.887 -1.466) 1.916 9.454 ( 7.888 1.005 0.620) 7.976 9.739 ( 7.484 0.326 6.850) 10.151 9.822 ( 4.395 0.995 -3.254) 5.559 10.324 ( -1.864 1.336 5.671) 6.117 10.449 ( 6.262 0.412 -2.811) 6.876 10.772 ( -10.808 -3.261 -3.942) 11.958 10.835 ( -6.625 0.352 -1.001) 6.709 11.245 ( -8.289 -1.651 5.144) 9.894 11.437 ( -6.099 -2.023 -2.570) 6.920 12.464 ( 10.283 3.322 7.945) 13.412 12.626 ( 6.335 3.798 -9.946) 12.388 13.173 ( 5.067 -5.194 1.074) 7.335 13.200 ( 4.577 -3.687 -0.460) 5.895 16.501 ( -8.561 -2.949 -1.018) 9.111 16.594 ( -9.091 -2.623 -2.116) 9.695 16.901 ( -16.949 15.879 -0.378) 23.229 16.966 ( -16.263 14.157 -1.232) 21.597 18.130 ( 11.748 -13.192 -0.057) 17.665 18.407 ( 8.859 -8.741 1.115) 12.495 18.537 ( 4.546 1.627 1.224) 4.981 18.692 ( 2.224 3.130 2.153) 4.402 21.232 ( 4.995 0.669 -1.193) 5.179 21.316 ( 4.600 1.416 -3.454) 5.924 21.892 ( 0.270 -2.516 7.794) 8.195 21.946 ( -1.339 -1.919 -4.180) 4.791 ======================= Grid point 114 (46/170) ======================= q-point: ( 0.36 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( -3.955 3.336 3.535) 6.266 2.182 ( 4.457 4.201 -2.276) 6.534 2.329 ( 5.246 7.029 -5.338) 10.268 2.499 ( 2.538 -0.009 1.807) 3.115 2.742 ( 2.298 -1.973 12.712) 13.068 2.845 ( 0.262 1.858 -0.756) 2.023 2.946 ( -6.759 -6.251 -4.555) 10.272 3.081 ( -2.921 -6.054 -3.594) 7.623 3.196 ( -12.239 0.094 -0.879) 12.270 3.299 ( -0.379 1.661 -4.539) 4.848 3.446 ( -5.364 -0.054 0.062) 5.365 3.649 ( -1.278 -3.719 5.191) 6.513 4.110 ( 2.545 -0.621 -0.051) 2.620 4.198 ( 12.168 -8.387 -1.697) 14.876 4.262 ( 6.656 5.409 -4.037) 9.479 4.533 ( -2.503 2.736 -2.541) 4.495 4.726 ( 11.587 -2.747 -10.725) 16.026 4.783 ( 11.997 1.636 -7.701) 14.349 4.872 ( 8.719 1.973 7.298) 11.540 5.127 ( 3.643 4.486 3.413) 6.711 5.214 ( -0.712 1.152 -6.879) 7.011 5.285 ( 2.391 7.533 9.741) 12.543 5.454 ( 2.281 0.607 6.320) 6.746 5.644 ( -4.793 -2.189 5.288) 7.465 5.954 ( -5.804 2.120 -10.670) 12.330 6.024 ( -2.854 0.319 -0.425) 2.903 6.191 ( -7.730 -1.382 -1.445) 7.985 6.392 ( -12.564 -3.930 6.012) 14.472 7.047 ( -4.043 -0.600 -2.337) 4.708 7.253 ( -4.197 11.687 2.359) 12.639 7.401 ( -1.873 9.502 3.804) 10.405 7.450 ( -1.173 0.556 0.324) 1.338 8.447 ( 8.696 3.188 -6.050) 11.063 8.516 ( 5.671 3.121 0.780) 6.520 9.297 ( -1.506 -0.232 -1.791) 2.352 9.584 ( 6.566 -1.067 0.859) 6.708 9.840 ( 5.143 -1.439 -3.726) 6.512 9.986 ( 10.383 -1.104 7.155) 12.657 10.360 ( -1.850 1.445 5.552) 6.028 10.493 ( -5.679 -2.903 -7.473) 9.825 10.585 ( 2.250 -1.001 -0.666) 2.551 10.722 ( -5.729 2.864 -2.523) 6.884 11.174 ( -8.006 -1.128 5.400) 9.722 11.329 ( -4.025 -1.277 -1.957) 4.655 12.616 ( 5.299 3.598 -7.042) 9.519 12.684 ( 6.318 2.779 7.198) 9.972 13.237 ( 1.349 -3.111 -0.990) 3.532 13.262 ( 3.378 -4.744 2.064) 6.179 16.411 ( -3.942 3.249 1.794) 5.414 16.489 ( -3.570 2.703 2.099) 4.946 16.652 ( -13.233 15.798 -0.586) 20.616 16.750 ( -13.512 11.099 4.527) 18.062 18.299 ( 9.563 -10.145 -0.449) 13.949 18.524 ( 4.106 -5.088 0.494) 6.557 18.598 ( 3.996 -2.267 -1.662) 4.886 18.708 ( -0.203 0.474 -2.513) 2.566 21.287 ( 3.646 -0.813 -1.013) 3.871 21.361 ( 2.872 1.704 1.133) 3.526 21.879 ( 0.154 -3.492 -5.275) 6.328 21.953 ( -0.901 -4.094 3.225) 5.289 ======================= Grid point 115 (47/170) ======================= q-point: ( 0.45 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( -7.563 2.923 1.695) 8.284 2.223 ( 4.320 -0.091 -0.720) 4.380 2.395 ( 4.234 9.132 1.709) 10.210 2.576 ( 4.533 1.396 -0.981) 4.844 2.716 ( -4.841 -1.491 -6.057) 7.896 2.872 ( -2.249 -1.791 -1.279) 3.147 2.906 ( -2.831 -2.701 3.636) 5.341 2.986 ( -4.010 0.580 0.654) 4.105 3.118 ( 2.577 -6.296 3.609) 7.700 3.274 ( 4.615 3.791 0.864) 6.034 3.428 ( -2.060 -1.282 1.346) 2.774 3.650 ( -4.343 -4.744 1.842) 6.690 4.062 ( -0.150 3.941 -4.941) 6.322 4.273 ( 7.876 0.530 -11.022) 13.557 4.392 ( 2.878 -3.220 -3.120) 5.328 4.501 ( 4.866 0.545 0.610) 4.934 4.697 ( -0.427 -5.157 -4.073) 6.585 4.917 ( 1.980 -1.799 -2.114) 3.410 4.983 ( 10.565 -3.768 -5.563) 12.521 5.114 ( -0.669 -0.299 -0.512) 0.894 5.269 ( 4.092 6.500 -0.847) 7.727 5.348 ( 1.918 3.858 -0.733) 4.370 5.476 ( -8.072 -3.324 -3.808) 9.524 5.638 ( -7.381 -2.802 4.221) 8.952 5.828 ( 1.676 2.277 -0.633) 2.898 5.946 ( 3.031 0.843 4.000) 5.089 6.161 ( -0.596 5.716 0.974) 5.829 6.241 ( -11.811 2.220 0.858) 12.049 7.029 ( 1.377 0.746 4.291) 4.568 7.233 ( -2.049 10.301 3.297) 11.008 7.406 ( -2.914 7.307 4.042) 8.845 7.467 ( -0.020 2.586 3.465) 4.324 8.485 ( 5.758 3.730 -7.400) 10.091 8.551 ( 0.276 2.815 -3.387) 4.413 9.289 ( 1.106 -1.346 0.870) 1.947 9.643 ( 0.525 -2.496 -1.026) 2.750 9.899 ( 7.067 -3.981 -3.345) 8.774 10.188 ( -2.303 -6.221 3.500) 7.501 10.279 ( 0.595 2.033 -3.399) 4.005 10.379 ( -4.451 2.462 4.490) 6.784 10.596 ( -0.384 2.591 -4.106) 4.870 10.680 ( 4.361 0.726 -3.039) 5.365 11.109 ( -7.323 -0.827 4.724) 8.754 11.280 ( -0.139 -0.640 -0.637) 0.914 12.654 ( 5.994 2.567 -1.738) 6.748 12.795 ( -1.571 2.099 4.815) 5.483 13.240 ( 1.172 -2.423 -0.899) 2.838 13.311 ( 0.003 -3.510 1.793) 3.942 16.396 ( 0.512 10.358 0.587) 10.387 16.486 ( -7.559 13.688 0.470) 15.644 16.546 ( 1.268 5.187 10.635) 11.900 16.648 ( -7.982 7.228 8.266) 13.575 18.403 ( 4.516 -5.553 -1.904) 7.406 18.548 ( -0.344 -4.867 -0.314) 4.889 18.626 ( 1.184 -1.870 -6.281) 6.659 18.638 ( 0.948 -2.570 -5.485) 6.131 21.342 ( 3.214 -1.314 1.532) 3.795 21.411 ( -0.235 -0.068 3.336) 3.345 21.846 ( 2.888 -4.104 -4.525) 6.757 21.933 ( -2.797 -4.661 -1.563) 5.656 ======================= Grid point 116 (48/170) ======================= q-point: (-0.45 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -3.626 3.103 -0.341) 4.784 2.314 ( 2.695 -0.404 4.049) 4.880 2.426 ( -6.895 -1.622 -10.183) 12.404 2.476 ( 0.673 7.720 3.973) 8.709 2.611 ( -8.479 1.292 -0.743) 8.609 2.886 ( 9.991 0.018 -1.309) 10.076 2.941 ( 4.996 2.546 1.875) 5.913 3.056 ( 1.598 -5.305 7.980) 9.715 3.171 ( 5.223 -2.400 -2.363) 6.215 3.350 ( -0.761 -2.473 -2.552) 3.634 3.473 ( 5.142 0.264 6.938) 8.640 3.564 ( -4.484 -2.301 -2.226) 5.510 4.028 ( 2.508 -2.026 -6.777) 7.505 4.175 ( 3.659 -0.918 -18.088) 18.477 4.417 ( 0.591 5.779 1.359) 5.966 4.452 ( -9.474 -8.161 -3.198) 12.907 4.656 ( -16.308 3.360 -9.331) 19.087 4.786 ( 4.653 -0.562 2.816) 5.468 5.021 ( -18.069 -2.786 -4.151) 18.748 5.080 ( 3.030 -6.659 0.139) 7.318 5.247 ( -1.345 6.600 -0.083) 6.736 5.317 ( 10.308 2.882 1.184) 10.769 5.496 ( 2.933 -0.671 0.536) 3.056 5.644 ( -2.095 0.948 5.298) 5.776 5.781 ( 5.866 -3.144 -3.824) 7.676 6.047 ( -8.830 4.138 -4.254) 10.639 6.139 ( 0.368 6.048 -1.829) 6.329 6.228 ( 13.705 0.309 6.396) 15.127 7.147 ( 2.862 0.343 5.728) 6.412 7.269 ( 1.727 8.567 5.004) 10.070 7.403 ( -3.547 6.383 4.757) 8.715 7.529 ( 1.410 4.222 6.871) 8.187 8.440 ( -3.794 1.676 -8.555) 9.508 8.479 ( 2.256 3.600 -7.683) 8.780 9.343 ( 2.522 -0.972 3.210) 4.196 9.592 ( -3.230 -2.642 -3.419) 5.394 9.953 ( 0.529 -4.210 -1.944) 4.668 9.987 ( -10.668 -3.933 -2.504) 11.643 10.307 ( -6.824 3.174 3.262) 8.203 10.464 ( 10.649 -1.563 0.568) 10.778 10.595 ( 5.674 3.978 -3.929) 7.966 10.678 ( -0.984 1.877 -2.087) 2.974 11.067 ( -2.704 -0.493 3.148) 4.179 11.310 ( 3.786 -0.786 0.519) 3.902 12.712 ( -6.938 0.425 0.680) 6.984 12.781 ( 3.254 1.906 3.256) 4.983 13.263 ( 1.099 -2.172 0.941) 2.610 13.300 ( -3.028 -1.813 0.840) 3.628 16.424 ( -1.126 10.593 1.228) 10.723 16.451 ( 5.735 14.016 0.362) 15.148 16.655 ( -3.087 2.494 11.890) 12.535 16.773 ( 6.666 9.065 15.311) 19.001 18.385 ( -2.311 -5.037 -4.253) 6.986 18.483 ( -2.007 -1.893 -9.968) 10.342 18.533 ( -1.737 -5.183 -2.804) 6.143 18.632 ( 1.793 -1.165 -4.129) 4.649 21.403 ( -1.673 -2.684 2.989) 4.351 21.431 ( 1.260 -1.807 2.703) 3.487 21.833 ( -4.990 -3.572 -4.979) 7.902 21.873 ( 4.641 -3.453 -2.097) 6.153 ======================= Grid point 117 (49/170) ======================= q-point: (-0.36 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( -11.183 5.223 -5.858) 13.662 2.067 ( -18.791 -1.307 -10.509) 21.570 2.423 ( -0.129 2.356 6.927) 7.318 2.534 ( 5.607 4.566 0.890) 7.286 2.621 ( 4.878 0.736 3.424) 6.005 3.005 ( 4.193 -0.296 -3.285) 5.335 3.081 ( 7.023 2.288 7.062) 10.219 3.158 ( 1.776 -5.320 1.913) 5.926 3.240 ( 5.274 1.607 -0.843) 5.578 3.348 ( 5.925 -1.981 -1.914) 6.534 3.463 ( 0.585 -1.678 -5.124) 5.424 3.639 ( 4.938 -2.773 3.262) 6.536 3.919 ( -3.621 -3.648 -13.626) 14.563 4.052 ( 1.461 0.383 -14.285) 14.365 4.142 ( -23.640 -2.154 -2.042) 23.826 4.224 ( -15.438 -10.080 -7.041) 19.736 4.458 ( 0.683 10.683 0.844) 10.738 4.743 ( -7.584 3.568 -3.898) 9.243 4.917 ( -0.398 5.526 3.126) 6.361 5.056 ( -3.952 0.219 1.586) 4.264 5.318 ( -9.137 1.028 4.647) 10.302 5.359 ( 6.205 4.648 4.816) 9.127 5.556 ( 0.173 -1.578 -1.647) 2.288 5.650 ( 0.542 2.321 5.872) 6.337 5.899 ( 4.630 -4.339 -3.383) 7.191 5.983 ( 11.036 -0.189 -1.535) 11.143 6.116 ( 1.158 4.725 -2.829) 5.628 6.493 ( 14.116 -2.879 0.494) 14.415 7.185 ( -1.373 2.338 1.384) 3.045 7.360 ( 2.535 2.377 0.183) 3.480 7.418 ( -2.710 7.862 8.388) 11.812 7.684 ( 4.861 4.478 11.763) 13.493 8.238 ( -6.882 0.290 -10.475) 12.537 8.421 ( 0.527 3.775 -7.506) 8.418 9.418 ( 0.944 -0.188 3.507) 3.637 9.486 ( -4.271 -2.054 -3.851) 6.106 9.746 ( -12.245 -1.486 -2.430) 12.572 9.963 ( -1.758 -2.973 1.036) 3.606 10.242 ( -5.131 1.910 2.231) 5.912 10.533 ( 0.381 0.799 -2.925) 3.056 10.632 ( 5.370 3.581 -5.673) 8.593 10.732 ( 8.544 0.164 2.016) 8.780 11.102 ( 2.962 -0.146 2.485) 3.869 11.399 ( 6.018 -1.370 1.148) 6.277 12.521 ( -13.650 0.834 -2.069) 13.831 12.906 ( 3.199 0.251 6.354) 7.118 13.221 ( -5.189 -1.196 -1.022) 5.422 13.295 ( -1.088 -3.025 2.361) 3.989 16.470 ( 5.098 6.349 1.568) 8.292 16.594 ( 10.809 15.314 1.760) 18.827 16.782 ( 2.164 1.928 12.188) 12.528 17.105 ( 11.390 9.448 18.346) 23.571 18.254 ( -5.721 -6.978 -6.507) 11.125 18.337 ( -3.222 -2.231 -8.766) 9.602 18.447 ( -2.771 -4.323 -6.751) 8.482 18.592 ( -2.322 -0.099 -2.793) 3.633 21.363 ( -4.460 -3.760 0.486) 5.854 21.497 ( 1.092 -2.036 3.524) 4.214 21.672 ( -6.668 -1.436 -6.855) 9.670 21.934 ( 4.224 -2.519 -0.207) 4.922 ======================= Grid point 118 (50/170) ======================= q-point: (-0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( -19.875 9.228 -9.919) 24.053 1.616 ( -24.590 1.871 -8.123) 25.965 2.547 ( 4.269 2.219 7.726) 9.102 2.629 ( 1.470 8.731 3.669) 9.584 2.776 ( 11.626 -2.171 -1.012) 11.870 2.946 ( -25.736 10.163 -5.237) 28.161 2.975 ( -1.176 0.749 -2.800) 3.128 3.166 ( -4.736 -5.255 1.162) 7.169 3.344 ( 2.371 0.273 -3.392) 4.148 3.434 ( 11.680 -1.129 0.828) 11.763 3.528 ( 8.939 -1.524 -2.242) 9.341 3.655 ( 1.760 -4.422 -5.100) 6.976 3.750 ( 2.949 1.776 -8.294) 8.980 3.876 ( -15.125 -5.616 -1.695) 16.222 3.895 ( -0.478 -6.630 -0.545) 6.670 4.085 ( 1.712 -3.679 -2.056) 4.549 4.422 ( -1.952 10.080 -2.166) 10.493 4.712 ( 3.459 0.929 0.161) 3.585 4.831 ( -7.553 4.651 -2.537) 9.226 4.984 ( -7.574 5.270 -2.479) 9.555 5.145 ( -15.447 7.447 4.021) 17.613 5.506 ( 0.139 2.761 0.483) 2.806 5.575 ( 7.848 -2.944 6.858) 10.830 5.778 ( 1.171 2.195 10.982) 11.260 5.963 ( 5.921 1.943 -0.390) 6.244 6.069 ( 1.434 3.570 -0.947) 3.962 6.188 ( 10.383 -5.625 -3.651) 12.360 6.664 ( 10.506 -8.291 -5.053) 14.306 7.178 ( 0.358 1.544 0.179) 1.595 7.368 ( -0.221 0.378 0.006) 0.438 7.475 ( -0.037 8.418 4.843) 9.712 7.886 ( 3.340 4.671 10.148) 11.660 8.031 ( -5.875 -0.121 -7.347) 9.408 8.327 ( -2.430 3.719 -6.925) 8.227 9.363 ( -11.003 -1.325 -0.301) 11.087 9.397 ( -2.588 -1.520 -1.916) 3.561 9.619 ( -1.036 1.891 0.545) 2.224 9.943 ( -2.304 1.221 1.653) 3.087 10.188 ( -5.462 1.191 2.778) 6.243 10.517 ( 1.661 2.539 -0.962) 3.183 10.666 ( 6.168 0.847 -5.386) 8.232 10.883 ( 9.644 -0.596 -0.979) 9.711 11.206 ( 5.903 -0.005 3.141) 6.687 11.509 ( 5.870 -1.725 1.116) 6.219 12.268 ( -14.478 0.917 -2.814) 14.778 12.967 ( -6.132 1.546 5.760) 8.554 13.137 ( -2.077 -3.867 -1.674) 4.698 13.289 ( -3.016 -5.727 2.781) 7.044 16.615 ( 10.775 2.560 1.630) 11.194 16.827 ( 14.994 15.159 3.457) 21.600 16.976 ( 5.221 1.353 11.630) 12.820 17.514 ( 14.384 8.872 17.855) 24.584 18.091 ( -6.309 -6.941 -5.099) 10.676 18.182 ( -4.819 -4.101 -7.701) 9.967 18.302 ( -3.410 -3.691 -10.378) 11.531 18.490 ( -7.030 -0.385 -2.482) 7.465 21.276 ( -5.879 -2.995 -2.217) 6.960 21.449 ( -10.240 3.567 -0.937) 10.884 21.576 ( 2.781 -4.094 -1.834) 5.278 21.991 ( 2.731 -1.591 0.379) 3.183 ======================= Grid point 119 (51/170) ======================= q-point: (-0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( -22.868 14.601 -4.061) 27.434 1.163 ( -25.777 11.773 0.635) 28.345 2.199 ( -43.500 29.773 -2.334) 52.765 2.721 ( 1.318 2.654 6.349) 7.006 2.725 ( -1.290 -2.148 1.281) 2.814 2.942 ( 3.837 -3.602 -1.595) 5.499 2.997 ( 8.251 -1.967 1.664) 8.644 3.119 ( 3.927 0.203 -4.991) 6.353 3.318 ( 0.892 1.264 -2.054) 2.572 3.489 ( -2.147 -0.286 -5.644) 6.046 3.579 ( 2.459 1.594 -3.490) 4.557 3.669 ( -2.825 -1.318 -0.246) 3.127 3.708 ( 6.675 -2.851 1.247) 7.365 3.804 ( 1.837 -5.137 1.806) 5.747 3.960 ( 4.862 -7.086 -0.079) 8.594 4.136 ( 5.150 -3.111 -0.230) 6.021 4.429 ( 3.170 8.251 1.163) 8.915 4.629 ( -8.245 2.275 -8.283) 11.907 4.795 ( 3.480 2.506 2.268) 4.851 4.814 ( -9.848 7.618 -2.996) 12.806 4.975 ( -6.458 7.856 0.796) 10.201 5.524 ( -0.761 4.864 1.219) 5.072 5.740 ( 2.710 -2.933 7.860) 8.816 5.868 ( -2.197 3.682 3.930) 5.816 6.002 ( -2.392 3.812 1.685) 4.805 6.155 ( 8.901 -0.369 -0.294) 8.914 6.266 ( 3.789 -2.409 -0.981) 4.595 6.739 ( 7.831 -14.654 -4.188) 17.135 7.206 ( 2.974 0.340 -0.708) 3.076 7.377 ( 1.011 0.078 1.469) 1.785 7.523 ( 0.969 9.146 2.557) 9.546 7.854 ( -5.048 -2.055 -5.647) 7.848 8.024 ( -0.656 5.605 7.035) 9.019 8.192 ( -4.706 4.275 -7.165) 9.580 9.169 ( -10.553 1.580 0.260) 10.674 9.387 ( 2.598 -2.331 -0.788) 3.579 9.647 ( 1.974 2.636 1.578) 3.651 9.934 ( 0.383 7.672 -0.551) 7.702 10.133 ( -6.164 0.941 4.448) 7.659 10.557 ( 4.154 2.992 -1.200) 5.258 10.708 ( 5.374 -0.954 -2.909) 6.185 11.021 ( 9.693 -1.547 -1.271) 9.897 11.337 ( 5.780 0.931 2.762) 6.473 11.597 ( 3.965 -2.206 0.647) 4.584 12.026 ( -12.460 0.651 -1.727) 12.596 12.857 ( -9.657 2.809 0.224) 10.060 13.065 ( -9.942 -13.397 0.699) 16.697 13.285 ( -0.212 -5.809 1.456) 5.993 16.831 ( 14.300 -1.563 0.995) 14.419 17.113 ( 15.334 12.788 2.027) 20.069 17.170 ( 4.439 -1.173 7.126) 8.477 17.900 ( 9.328 6.340 9.782) 14.930 17.959 ( -6.539 -6.075 2.454) 9.256 18.042 ( 2.284 -0.479 -9.094) 9.389 18.142 ( -3.413 -2.556 -5.175) 6.706 18.326 ( -9.372 -1.248 -2.839) 9.872 21.120 ( -9.597 2.876 -2.458) 10.316 21.299 ( -6.559 1.232 -1.526) 6.846 21.607 ( 2.059 -2.843 -0.226) 3.517 22.027 ( 1.378 -0.712 0.317) 1.583 ======================= Grid point 120 (52/170) ======================= q-point: (-0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.838 ( -11.064 26.448 13.580) 31.722 0.912 ( -16.438 22.492 19.398) 33.947 1.579 ( -38.074 39.440 16.414) 57.223 2.657 ( -3.129 1.807 -4.484) 5.759 2.752 ( -3.259 -1.661 -1.197) 3.848 2.945 ( 0.232 -2.132 -0.159) 2.151 3.056 ( 3.572 1.380 -2.705) 4.689 3.282 ( 12.099 -2.152 1.293) 12.357 3.334 ( 1.517 1.391 -1.505) 2.550 3.400 ( -1.967 -0.254 -2.144) 2.921 3.631 ( 6.956 4.804 2.096) 8.710 3.676 ( 1.695 -6.199 -0.463) 6.443 3.829 ( 1.643 -3.612 11.009) 11.703 3.873 ( 1.629 -1.802 7.391) 7.779 4.021 ( 3.823 -6.573 -0.434) 7.616 4.206 ( 5.439 -2.881 -2.784) 6.755 4.422 ( -4.947 1.400 -8.881) 10.262 4.480 ( 0.518 6.358 1.666) 6.593 4.635 ( -6.595 12.043 -3.164) 14.090 4.798 ( -6.608 9.155 2.573) 11.580 5.044 ( 10.655 1.694 0.647) 10.808 5.507 ( -0.980 2.996 -0.485) 3.189 5.768 ( -6.903 5.288 -4.855) 9.959 5.828 ( -2.454 -2.952 3.310) 5.068 5.940 ( -4.895 -1.604 -0.179) 5.154 6.199 ( -1.094 -4.030 -0.543) 4.211 6.355 ( 6.642 0.035 -0.829) 6.694 6.872 ( 6.299 -10.034 5.311) 12.983 7.245 ( 2.715 -1.179 -0.131) 2.963 7.432 ( 2.269 1.950 2.277) 3.759 7.559 ( 0.706 9.438 1.211) 9.542 7.722 ( -3.505 -6.588 -4.288) 8.607 8.031 ( -5.228 0.247 0.100) 5.235 8.073 ( -0.347 10.576 -1.547) 10.694 9.077 ( -2.355 4.523 0.280) 5.107 9.433 ( 3.296 -3.540 -0.203) 4.842 9.695 ( 1.394 1.543 -1.171) 2.386 9.929 ( 3.291 12.499 -8.164) 15.287 10.157 ( 4.541 3.803 8.138) 10.065 10.604 ( 3.587 3.905 -1.902) 5.633 10.780 ( 4.745 -2.184 1.005) 5.320 11.156 ( 7.557 -2.692 0.624) 8.047 11.418 ( 1.740 2.097 0.001) 2.725 11.656 ( 2.763 -2.395 2.151) 4.242 11.856 ( -8.392 -0.367 0.557) 8.419 12.712 ( -6.172 2.595 -3.164) 7.406 12.787 ( -26.453 -19.943 3.183) 33.281 13.282 ( -0.006 -3.339 -3.137) 4.582 17.052 ( 11.954 -5.688 -1.710) 13.348 17.182 ( 0.367 -5.140 -9.863) 11.128 17.259 ( 0.516 -1.653 0.148) 1.738 17.840 ( -4.825 -3.907 -4.353) 7.583 17.924 ( 0.711 1.754 -3.795) 4.241 18.162 ( -2.491 2.236 2.193) 4.002 18.202 ( 6.510 2.240 0.195) 6.888 18.261 ( 8.476 8.931 12.325) 17.421 20.980 ( -6.481 7.089 2.322) 9.882 21.189 ( -4.772 -0.716 -2.423) 5.400 21.634 ( 1.130 -1.799 0.736) 2.248 22.046 ( 0.678 0.231 0.609) 0.941 ======================= Grid point 121 (53/170) ======================= q-point: ( 0.00 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.454 ( -3.147 27.075 11.242) 29.484 1.464 ( -2.801 23.512 15.208) 28.141 2.377 ( 3.040 33.321 25.494) 42.065 2.545 ( 1.047 -1.697 -6.630) 6.923 2.741 ( -0.423 7.098 -4.365) 8.343 2.900 ( -1.281 -0.877 -2.062) 2.581 3.026 ( -1.912 -4.049 -1.912) 4.869 3.262 ( 3.897 -7.297 -5.073) 9.704 3.329 ( 2.309 -6.471 1.583) 7.051 3.382 ( 0.110 3.645 -3.606) 5.128 3.538 ( -1.854 -7.484 -2.193) 8.016 3.681 ( -0.318 -2.257 -7.384) 7.727 3.921 ( -0.923 -3.630 3.961) 5.451 3.975 ( -3.723 0.291 16.666) 17.079 4.114 ( 8.035 -5.039 8.310) 12.610 4.138 ( 4.413 8.652 6.299) 11.576 4.555 ( 2.561 10.889 1.244) 11.255 4.618 ( -2.789 8.661 0.569) 9.117 4.872 ( 1.376 14.821 -1.692) 14.981 4.962 ( -2.572 15.140 1.506) 15.430 5.090 ( -3.801 2.228 -4.607) 6.375 5.480 ( -0.458 -0.943 -3.899) 4.038 5.696 ( -5.374 -5.136 5.950) 9.522 5.789 ( 2.537 -3.729 -1.297) 4.693 5.844 ( 0.694 4.787 -3.540) 5.994 6.079 ( 0.204 -6.600 -0.999) 6.678 6.347 ( -0.166 -4.018 -2.433) 4.700 6.848 ( 0.008 -5.583 -3.561) 6.622 7.254 ( 1.483 -0.993 0.103) 1.788 7.437 ( -7.786 -3.599 -1.304) 8.677 7.564 ( 6.243 -3.958 3.073) 8.006 7.813 ( 2.561 11.902 0.723) 12.195 7.986 ( 0.190 -0.977 1.267) 1.611 8.308 ( -0.094 14.930 -4.006) 15.458 9.127 ( -1.351 3.790 1.321) 4.235 9.395 ( 0.254 -3.655 1.951) 4.151 9.661 ( -1.721 1.719 -3.057) 3.907 10.027 ( 0.264 6.135 -1.301) 6.277 10.386 ( 3.306 4.426 0.605) 5.557 10.665 ( 1.851 -2.637 -0.124) 3.224 10.780 ( -4.066 4.486 -4.984) 7.842 11.172 ( 1.596 -6.184 5.336) 8.323 11.394 ( -0.901 -1.574 -8.698) 8.885 11.663 ( -4.784 -6.019 -2.344) 8.038 11.812 ( 3.674 4.795 11.591) 13.071 12.503 ( 0.426 -2.910 10.551) 10.953 12.692 ( 0.316 4.207 -5.155) 6.661 13.146 ( -0.717 -5.636 -4.572) 7.293 16.908 ( -0.141 -13.335 -0.343) 13.340 16.933 ( -0.837 -12.311 -1.639) 12.448 17.075 ( -2.206 -2.163 -10.381) 10.831 17.512 ( -2.207 -9.265 -14.311) 17.191 18.043 ( 2.420 3.462 6.356) 7.631 18.210 ( 0.019 1.470 5.974) 6.152 18.471 ( 1.855 8.499 1.465) 8.821 18.531 ( -1.725 7.650 0.020) 7.842 21.142 ( 1.973 2.709 -1.687) 3.752 21.158 ( 0.290 8.589 1.526) 8.728 21.640 ( 0.113 -0.849 4.635) 4.713 22.069 ( -0.110 -0.170 1.024) 1.043 ======================= Grid point 122 (54/170) ======================= q-point: ( 0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 2.610 18.701 14.543) 23.833 1.698 ( 4.655 16.910 17.947) 25.094 2.437 ( 0.251 0.724 -10.460) 10.488 2.658 ( 2.812 7.030 -5.844) 9.564 2.859 ( -0.761 -7.629 2.215) 7.980 2.874 ( 10.065 22.402 16.653) 29.673 2.989 ( -2.431 -0.950 2.452) 3.582 3.189 ( -2.484 -8.361 -9.148) 12.640 3.392 ( 3.526 -6.526 1.738) 7.618 3.416 ( 5.305 6.579 5.270) 9.961 3.437 ( -3.292 -8.383 -5.923) 10.779 3.625 ( -1.152 0.323 -1.570) 1.974 3.844 ( -4.221 0.491 -1.848) 4.633 4.057 ( -7.627 2.614 9.794) 12.686 4.220 ( -6.975 5.524 10.166) 13.510 4.378 ( 3.252 2.065 8.203) 9.063 4.572 ( 3.195 10.220 5.087) 11.854 4.646 ( 4.889 2.726 1.486) 5.792 4.838 ( -2.268 8.254 -3.669) 9.313 4.994 ( 3.050 11.742 1.410) 12.213 5.019 ( 1.586 8.046 -1.001) 8.262 5.441 ( 2.247 2.222 -4.479) 5.481 5.626 ( -7.754 -4.280 0.983) 8.911 5.751 ( -4.351 0.936 -3.658) 5.761 5.927 ( 7.875 -1.045 2.305) 8.272 6.105 ( 3.744 -6.359 -1.232) 7.481 6.282 ( -4.752 -5.231 -0.809) 7.113 6.736 ( -3.965 -5.948 -7.864) 10.627 7.253 ( -3.874 -2.871 -0.221) 4.827 7.349 ( -0.161 -2.799 -0.073) 2.805 7.643 ( 0.849 5.272 -0.297) 5.348 7.928 ( 8.180 4.815 4.162) 10.364 7.992 ( -2.153 2.142 -1.135) 3.242 8.274 ( 4.033 10.638 -4.901) 12.387 9.152 ( 2.188 3.532 3.465) 5.409 9.399 ( -0.501 -0.304 0.539) 0.796 9.653 ( 0.794 2.146 1.965) 3.016 9.993 ( 0.628 11.687 -6.153) 13.223 10.368 ( -8.175 3.320 6.880) 11.189 10.624 ( -3.643 5.473 -6.616) 9.327 10.739 ( 2.296 -6.172 2.495) 7.042 11.195 ( -9.358 -3.837 0.497) 10.126 11.252 ( -0.915 -3.772 -3.310) 5.101 11.574 ( -3.555 -6.621 -2.173) 7.823 12.042 ( 8.692 4.951 10.099) 14.214 12.674 ( 5.887 4.609 -6.254) 9.747 12.717 ( 10.612 -6.517 6.276) 13.946 13.082 ( 0.417 -4.732 -5.666) 7.394 16.785 ( -8.091 -5.369 -5.934) 11.380 16.888 ( -6.990 -8.485 -3.564) 11.557 17.061 ( 10.825 -11.212 -1.980) 15.710 17.416 ( 7.573 -10.471 -11.086) 17.026 18.047 ( -8.037 8.096 0.882) 11.442 18.269 ( -5.474 6.199 2.148) 8.544 18.373 ( -3.166 5.020 3.055) 6.675 18.582 ( 2.440 5.239 4.548) 7.354 21.174 ( 4.696 2.006 -2.512) 5.691 21.217 ( 5.495 5.044 -0.935) 7.517 21.697 ( -1.905 0.137 8.517) 8.728 22.054 ( -2.536 -0.306 -0.009) 2.554 ======================= Grid point 123 (55/170) ======================= q-point: ( 0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( 11.076 9.164 16.653) 22.000 1.968 ( 5.270 8.953 15.806) 18.914 2.337 ( 1.555 4.153 -8.635) 9.708 2.588 ( 0.835 8.930 -10.937) 14.145 2.816 ( -4.874 -7.964 -0.011) 9.337 2.965 ( -2.165 -3.265 0.103) 3.919 3.046 ( -2.878 -5.907 -5.325) 8.457 3.094 ( 2.516 0.909 0.923) 2.830 3.306 ( -5.169 -6.379 -4.925) 9.574 3.476 ( 5.993 -5.172 0.371) 7.925 3.566 ( -2.684 -1.140 -2.771) 4.022 3.667 ( 3.872 -2.116 5.959) 7.415 3.891 ( -7.925 6.631 1.037) 10.385 3.925 ( 0.351 13.562 14.324) 19.729 4.131 ( -5.372 4.342 4.594) 8.296 4.528 ( 7.815 10.808 3.685) 13.838 4.612 ( -5.447 4.675 3.879) 8.159 4.785 ( 1.531 6.518 2.986) 7.331 4.856 ( 6.452 -2.029 3.868) 7.791 5.039 ( 0.544 4.256 -0.901) 4.384 5.079 ( 7.101 14.202 0.127) 15.879 5.443 ( 3.873 2.708 -8.229) 9.490 5.506 ( -7.722 -3.342 2.454) 8.765 5.655 ( -1.845 6.041 -0.330) 6.325 6.045 ( 2.520 -2.369 2.305) 4.156 6.118 ( -1.974 -2.804 -0.273) 3.440 6.228 ( -3.634 -12.421 4.588) 13.731 6.566 ( -3.938 -6.431 -12.304) 14.431 7.172 ( -3.399 -2.575 -1.679) 4.583 7.385 ( 1.873 -0.932 1.811) 2.767 7.621 ( -2.058 12.472 -0.405) 12.648 7.862 ( -7.087 7.890 -5.423) 11.911 8.134 ( 9.833 1.694 5.421) 11.355 8.346 ( 9.802 4.484 -3.563) 11.352 9.279 ( 6.536 1.323 5.593) 8.704 9.415 ( 1.771 2.135 0.401) 2.803 9.687 ( -1.062 2.384 3.654) 4.490 9.927 ( 0.690 10.985 -6.474) 12.770 10.339 ( -6.252 1.657 8.715) 10.853 10.502 ( -1.565 3.530 -6.386) 7.463 10.796 ( 0.708 -3.581 1.822) 4.080 10.977 ( -10.005 -2.983 -6.627) 12.365 11.239 ( -4.851 -4.602 4.776) 8.217 11.482 ( -4.589 -5.981 -2.950) 8.095 12.296 ( 9.805 5.348 9.261) 14.509 12.705 ( 8.043 5.121 -8.664) 12.883 12.925 ( 8.198 -8.134 2.926) 11.913 13.058 ( 3.923 -4.372 -3.844) 7.020 16.606 ( -6.516 -1.787 -4.558) 8.150 16.712 ( -6.951 -2.394 -5.121) 8.960 17.215 ( 5.664 -5.017 1.032) 7.636 17.414 ( 1.069 -0.515 -6.493) 6.600 17.896 ( -7.566 5.903 -0.557) 9.612 18.142 ( -3.176 0.027 -0.201) 3.182 18.474 ( 4.231 0.790 3.938) 5.834 18.670 ( 1.502 2.165 4.862) 5.530 21.223 ( 4.181 3.031 -1.588) 5.402 21.285 ( 6.400 0.884 -4.143) 7.675 21.767 ( -2.524 -1.019 10.138) 10.497 21.990 ( -4.037 -1.577 -1.943) 4.750 ======================= Grid point 124 (56/170) ======================= q-point: ( 0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 2.596 4.728 10.406) 11.721 2.244 ( 10.579 0.864 15.193) 18.533 2.316 ( 4.502 9.012 -4.237) 10.929 2.476 ( 2.130 7.318 -10.733) 13.163 2.707 ( -8.348 -3.048 1.811) 9.069 2.929 ( -3.386 -6.452 -0.424) 7.299 2.932 ( -3.188 -7.112 -4.654) 9.077 3.069 ( -5.791 -4.092 -8.438) 11.022 3.202 ( 1.844 -0.816 -0.302) 2.039 3.454 ( -6.835 -0.413 -3.553) 7.714 3.556 ( -0.348 -2.036 3.758) 4.288 3.641 ( -4.523 -4.185 -2.940) 6.828 3.820 ( 0.939 -1.035 2.209) 2.614 3.947 ( -0.016 -1.844 1.267) 2.237 4.449 ( 5.881 9.377 6.688) 12.932 4.550 ( 7.813 11.230 7.068) 15.399 4.710 ( 7.866 9.621 1.831) 12.561 4.813 ( -0.946 5.531 -2.105) 5.993 4.856 ( -2.553 -0.223 -4.995) 5.614 5.067 ( -0.162 0.031 5.519) 5.521 5.232 ( 5.185 6.479 6.479) 10.528 5.334 ( 2.351 0.671 -10.086) 10.378 5.485 ( -1.966 5.372 3.244) 6.576 5.673 ( -0.760 3.750 -0.220) 3.833 6.032 ( -1.745 0.029 -0.168) 1.753 6.108 ( -5.458 -6.737 8.190) 11.927 6.227 ( -3.317 -5.545 -0.797) 6.510 6.355 ( -3.891 -8.107 -9.411) 13.016 7.113 ( -1.578 -0.318 -2.568) 3.031 7.430 ( 0.750 0.109 2.260) 2.384 7.587 ( -2.568 16.049 0.756) 16.271 7.701 ( -6.102 12.006 -2.992) 13.796 8.343 ( 10.717 0.296 2.325) 10.971 8.470 ( 9.613 3.230 -2.374) 10.415 9.380 ( -0.859 1.970 -1.062) 2.397 9.472 ( 4.922 0.610 1.911) 5.316 9.730 ( 1.449 -0.216 6.251) 6.421 9.892 ( 2.415 6.119 -3.973) 7.686 10.352 ( -3.814 1.036 7.571) 8.540 10.467 ( 5.149 1.810 -4.900) 7.334 10.705 ( -9.868 -3.435 -5.401) 11.762 10.842 ( -1.568 0.618 -0.892) 1.907 11.197 ( -6.942 -3.409 4.748) 9.075 11.375 ( -4.633 -4.564 -2.746) 7.059 12.545 ( 9.110 4.869 8.393) 13.309 12.717 ( 5.599 5.390 -8.614) 11.602 13.047 ( 6.105 -7.461 0.867) 9.679 13.114 ( 5.002 -4.931 -1.071) 7.105 16.500 ( -2.608 2.411 -1.052) 3.705 16.588 ( -3.690 1.906 -1.832) 4.539 17.189 ( -10.787 12.739 2.740) 16.916 17.272 ( -10.077 15.617 -4.262) 19.069 17.899 ( 8.402 -8.943 -0.155) 12.272 18.202 ( 8.339 -10.515 0.717) 13.440 18.552 ( 2.024 -0.697 1.103) 2.408 18.718 ( -0.297 -0.452 1.537) 1.630 21.264 ( 2.980 2.411 -1.492) 4.113 21.333 ( 4.736 0.292 -2.371) 5.305 21.826 ( -2.641 -4.171 7.227) 8.753 21.892 ( -4.228 -3.766 -3.601) 6.710 ======================= Grid point 125 (57/170) ======================= q-point: ( 0.36 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -5.340 2.577 5.275) 7.936 2.289 ( 0.032 6.299 -7.327) 9.662 2.470 ( 10.439 6.188 -2.497) 12.389 2.526 ( 1.944 3.716 3.241) 5.301 2.694 ( 0.609 -3.289 13.469) 13.878 2.808 ( -3.116 -6.966 -7.638) 10.797 2.871 ( -1.030 0.684 -1.907) 2.273 2.935 ( -2.853 -7.707 0.342) 8.225 3.210 ( -8.667 0.577 0.333) 8.692 3.313 ( -0.668 0.833 -4.263) 4.395 3.491 ( -6.592 3.103 -2.591) 7.733 3.573 ( -2.911 -3.431 4.843) 6.611 3.951 ( 11.395 -13.942 -1.089) 18.040 4.044 ( 9.009 -7.018 0.891) 11.455 4.387 ( -2.677 6.137 -4.779) 8.227 4.629 ( -2.827 5.865 -8.784) 10.934 4.755 ( 2.794 -3.838 -10.957) 11.942 4.812 ( -0.712 8.298 -1.606) 8.482 4.949 ( 8.689 5.446 11.151) 15.149 5.069 ( -1.533 -2.875 1.309) 3.512 5.303 ( 5.626 4.735 -0.210) 7.356 5.416 ( -2.211 4.342 5.265) 7.174 5.547 ( 3.359 0.364 9.382) 9.972 5.579 ( -3.742 3.151 -2.904) 5.689 5.929 ( -5.182 -3.517 -13.675) 15.041 6.059 ( -5.099 2.460 -1.759) 5.928 6.170 ( -0.673 -1.144 7.775) 7.888 6.328 ( -1.043 -1.978 2.962) 3.711 7.063 ( -1.641 2.483 -1.107) 3.175 7.459 ( -0.242 1.020 2.491) 2.702 7.532 ( -2.707 15.510 -2.728) 15.979 7.640 ( -3.486 15.056 4.777) 16.176 8.498 ( 9.477 1.080 -3.797) 10.266 8.581 ( 6.098 3.126 -1.049) 6.933 9.304 ( -3.238 1.232 -2.590) 4.325 9.554 ( 3.138 -2.162 0.596) 3.857 9.806 ( 1.763 -1.726 -0.798) 2.593 9.959 ( 5.609 -1.312 5.382) 7.883 10.386 ( -2.033 0.584 6.744) 7.068 10.438 ( -4.565 -2.413 -9.054) 10.423 10.583 ( 4.062 1.500 -0.814) 4.406 10.789 ( -2.817 3.968 -2.893) 5.662 11.139 ( -7.004 -2.616 5.032) 9.012 11.289 ( -2.712 -2.892 -1.832) 4.367 12.704 ( 4.522 5.221 -6.458) 9.455 12.752 ( 5.192 4.094 6.886) 9.547 13.151 ( 4.302 -6.154 1.967) 7.762 13.160 ( 2.704 -4.824 -0.751) 5.581 16.501 ( 0.696 5.771 3.335) 6.702 16.559 ( -0.716 4.704 2.886) 5.564 17.014 ( -13.688 20.478 3.168) 24.834 17.068 ( -10.454 21.703 -1.147) 24.116 18.081 ( 12.835 -11.918 -0.160) 17.516 18.350 ( 7.426 -11.431 1.017) 13.669 18.567 ( 0.737 -2.313 -1.692) 2.959 18.689 ( -2.183 -2.424 -3.168) 4.547 21.286 ( 2.569 0.618 -1.909) 3.260 21.382 ( 1.897 0.532 1.112) 2.262 21.785 ( -1.989 -6.133 -4.790) 8.032 21.845 ( -3.090 -6.931 3.387) 8.310 ======================= Grid point 126 (58/170) ======================= q-point: ( 0.45 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( -5.582 3.718 -0.977) 6.777 2.242 ( 2.761 2.312 -2.497) 4.382 2.563 ( -0.313 5.989 5.560) 8.178 2.602 ( -0.440 2.039 -5.851) 6.211 2.686 ( 7.569 -0.248 -4.309) 8.713 2.850 ( -1.328 -2.627 6.719) 7.336 2.859 ( -3.608 -0.131 -0.378) 3.630 2.966 ( 1.030 -8.090 7.771) 11.265 3.021 ( -6.477 3.055 -0.174) 7.164 3.305 ( 3.332 -0.753 -4.118) 5.351 3.430 ( -0.543 0.557 0.394) 0.872 3.565 ( -4.023 -3.145 3.161) 6.006 4.075 ( 7.672 -8.001 -4.730) 12.052 4.172 ( 2.995 -4.578 -7.648) 9.404 4.283 ( 2.243 -10.724 -4.027) 11.673 4.558 ( -2.394 2.219 -7.852) 8.504 4.641 ( 2.181 -6.372 1.117) 6.827 4.786 ( 6.489 3.945 -8.940) 11.731 5.056 ( -7.297 2.969 -1.519) 8.023 5.097 ( -2.405 -0.056 7.123) 7.518 5.330 ( 1.628 3.385 -5.303) 6.499 5.399 ( 0.703 -1.564 0.109) 1.718 5.480 ( -5.480 2.017 2.786) 6.470 5.645 ( 0.964 6.932 -5.032) 8.620 5.884 ( 4.158 1.635 5.691) 7.236 5.992 ( 0.840 3.390 0.855) 3.596 6.212 ( -2.658 1.327 2.381) 3.807 6.312 ( -3.409 3.646 0.149) 4.994 7.074 ( 1.464 4.083 4.442) 6.209 7.472 ( 0.753 7.212 -2.243) 7.590 7.485 ( -2.231 9.376 3.362) 10.207 7.657 ( -2.807 14.777 6.556) 16.408 8.560 ( 6.290 2.435 -6.929) 9.670 8.601 ( 0.038 2.532 -5.252) 5.831 9.268 ( 0.464 -0.509 0.567) 0.892 9.576 ( -0.063 -4.353 -1.260) 4.532 9.816 ( 3.104 -4.183 -2.649) 5.843 10.059 ( -4.557 -6.809 2.911) 8.695 10.316 ( 3.409 1.656 -2.755) 4.686 10.417 ( -3.399 1.294 4.789) 6.013 10.654 ( 5.761 3.076 -3.442) 7.382 10.722 ( -0.727 4.102 -2.115) 4.672 11.085 ( -6.424 -1.764 4.241) 7.897 11.257 ( 0.305 -1.931 -0.560) 2.034 12.719 ( 4.645 3.937 -3.250) 6.902 12.841 ( -2.054 2.464 3.357) 4.643 13.183 ( 1.761 -3.192 0.693) 3.711 13.233 ( 1.221 -4.244 3.459) 5.609 16.574 ( 2.603 7.156 4.384) 8.787 16.612 ( -1.942 5.200 8.327) 10.008 16.871 ( -8.821 22.555 4.454) 24.624 16.958 ( -2.760 24.397 2.311) 24.661 18.252 ( 8.210 -9.579 -1.066) 12.661 18.407 ( -1.933 -9.496 0.646) 9.712 18.565 ( 3.512 -4.359 -4.546) 7.211 18.594 ( -1.855 -2.489 -6.296) 7.020 21.310 ( 2.898 -2.064 -1.538) 3.876 21.396 ( -1.522 -1.800 0.318) 2.378 21.742 ( 2.135 -6.373 -2.550) 7.189 21.815 ( -3.230 -7.277 0.279) 7.967 ======================= Grid point 127 (59/170) ======================= q-point: (-0.45 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -2.212 3.505 -0.521) 4.177 2.323 ( 7.827 1.526 0.370) 7.982 2.381 ( -10.674 -2.486 -10.862) 15.430 2.617 ( -2.687 6.438 4.306) 8.198 2.658 ( -7.102 3.245 0.524) 7.826 2.893 ( 5.686 -0.239 1.777) 5.962 2.949 ( 5.628 -3.153 5.958) 8.781 3.007 ( 4.199 3.451 1.473) 5.631 3.085 ( 3.971 -6.328 4.146) 8.544 3.305 ( 1.524 -2.436 -4.036) 4.955 3.455 ( 2.406 -3.303 -1.485) 4.348 3.538 ( -2.071 1.547 3.746) 4.551 3.991 ( -4.507 -3.668 -9.519) 11.153 4.100 ( 4.246 -7.524 -12.154) 14.912 4.226 ( -6.154 -11.764 -6.867) 14.948 4.526 ( 8.595 -0.405 -5.219) 10.063 4.684 ( -17.404 -0.387 -10.379) 20.267 4.836 ( 7.332 -8.642 1.626) 11.449 4.845 ( 4.134 3.781 4.420) 7.136 5.059 ( -6.869 4.885 0.396) 8.439 5.329 ( -2.434 4.822 0.171) 5.404 5.434 ( 1.012 -1.319 1.355) 2.145 5.500 ( 6.374 6.367 4.656) 10.142 5.662 ( 5.436 3.225 -3.217) 7.092 5.832 ( -7.089 6.686 -0.936) 9.790 6.098 ( -5.297 0.244 -0.444) 5.321 6.205 ( 7.430 1.319 -0.374) 7.555 6.272 ( -0.098 4.020 3.333) 5.223 7.179 ( 1.882 3.203 6.763) 7.716 7.464 ( 0.915 8.162 -2.006) 8.455 7.511 ( -1.004 7.751 6.636) 10.253 7.701 ( -0.341 13.167 6.776) 14.812 8.464 ( -5.355 0.003 -10.289) 11.599 8.558 ( 3.394 4.223 -7.609) 9.341 9.325 ( 3.710 -0.638 2.909) 4.757 9.526 ( -2.530 -3.985 -3.609) 5.942 9.847 ( 0.919 -6.336 -0.758) 6.448 9.909 ( -8.475 -3.732 -2.547) 9.605 10.373 ( -5.388 3.293 1.239) 6.435 10.453 ( 8.973 0.672 2.746) 9.408 10.682 ( 3.468 4.920 -3.751) 7.093 10.714 ( -0.118 1.686 -0.131) 1.695 11.052 ( -1.998 -1.069 3.107) 3.845 11.283 ( 3.085 -2.087 0.280) 3.735 12.733 ( -5.832 1.592 -1.253) 6.174 12.810 ( 2.035 0.892 0.583) 2.297 13.224 ( -0.003 -1.563 2.999) 3.382 13.259 ( -2.852 -2.053 3.537) 4.986 16.611 ( -4.553 8.377 5.570) 11.042 16.704 ( 2.097 5.300 8.486) 10.223 16.846 ( -0.234 23.057 4.325) 23.460 17.071 ( 8.005 21.740 9.399) 25.001 18.242 ( -6.884 -9.376 -2.231) 11.844 18.365 ( -2.773 -8.909 -1.971) 9.537 18.482 ( 0.194 -1.602 -7.640) 7.808 18.590 ( 3.797 -3.139 -5.104) 7.094 21.334 ( -0.169 -4.738 -1.400) 4.944 21.362 ( 1.927 -5.515 -2.732) 6.450 21.750 ( -4.144 -4.647 -1.147) 6.332 21.789 ( 4.163 -4.854 0.591) 6.422 ======================= Grid point 128 (60/170) ======================= q-point: (-0.36 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.976 ( -7.530 7.326 -3.876) 11.198 2.054 ( -15.039 0.444 -9.472) 17.779 2.450 ( 5.574 0.362 2.294) 6.038 2.585 ( 2.074 1.508 1.445) 2.943 2.664 ( -0.033 2.789 3.196) 4.242 2.960 ( 0.278 -3.854 2.900) 4.831 3.109 ( 7.289 -0.409 8.201) 10.979 3.114 ( 3.244 0.472 -4.207) 5.333 3.234 ( 8.126 -2.562 5.843) 10.332 3.315 ( 8.301 -3.731 -3.567) 9.775 3.429 ( -0.400 0.623 -3.619) 3.694 3.600 ( 3.473 0.424 1.872) 3.968 3.845 ( -2.638 -5.998 -6.867) 9.491 3.955 ( -4.564 -8.250 -10.358) 14.006 4.087 ( 0.336 -2.915 -10.150) 10.566 4.164 ( -23.133 3.144 -13.651) 27.044 4.624 ( 5.798 4.716 -3.920) 8.439 4.855 ( -6.592 5.503 -2.301) 8.890 4.985 ( -3.181 -2.435 2.172) 4.557 5.057 ( 7.044 5.136 9.887) 13.181 5.304 ( -0.221 0.557 3.411) 3.464 5.435 ( -3.122 2.336 1.548) 4.195 5.601 ( -2.087 4.011 -5.399) 7.042 5.736 ( -0.758 1.871 3.967) 4.451 5.775 ( 10.401 -0.700 3.177) 10.898 6.025 ( 0.494 3.402 -1.803) 3.882 6.195 ( -2.337 2.475 -0.871) 3.514 6.424 ( 9.165 -3.669 -0.232) 9.875 7.230 ( -2.262 2.663 3.174) 4.720 7.440 ( -1.784 4.844 -1.050) 5.268 7.601 ( 0.898 10.531 7.662) 13.054 7.817 ( 4.429 9.582 8.884) 13.797 8.242 ( -6.821 -0.078 -10.937) 12.890 8.507 ( 0.691 4.497 -7.332) 8.629 9.402 ( 0.191 -1.907 0.325) 1.944 9.440 ( -2.105 -2.261 -2.821) 4.184 9.695 ( -8.879 -3.185 -1.457) 9.545 9.918 ( 3.137 -1.779 0.243) 3.614 10.298 ( -5.507 3.975 1.231) 6.902 10.554 ( 1.887 1.694 -1.802) 3.111 10.712 ( 2.635 4.152 -3.383) 5.969 10.734 ( 5.741 -0.023 2.465) 6.248 11.095 ( 2.973 -0.549 2.820) 4.135 11.356 ( 5.133 -3.287 0.872) 6.158 12.547 ( -12.258 1.930 -3.260) 12.830 12.892 ( 3.454 -2.154 3.107) 5.121 13.206 ( -6.779 0.017 2.483) 7.219 13.241 ( -3.608 -2.108 2.866) 5.067 16.618 ( -0.730 8.359 4.259) 9.410 16.829 ( -1.481 4.242 14.194) 14.888 16.968 ( 10.911 21.064 0.880) 23.738 17.367 ( 12.200 17.456 13.879) 25.420 18.071 ( -11.376 -11.251 -0.788) 16.020 18.247 ( -5.693 -6.803 -5.210) 10.288 18.405 ( 0.047 -0.981 -9.059) 9.113 18.561 ( -0.109 -2.656 -6.065) 6.622 21.282 ( -0.853 -4.840 -3.577) 6.078 21.405 ( 5.048 -7.269 -1.906) 9.052 21.649 ( -6.719 -0.752 -1.658) 6.961 21.871 ( 4.250 -3.884 1.428) 5.932 ======================= Grid point 129 (61/170) ======================= q-point: (-0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -16.227 7.804 -7.556) 19.527 1.769 ( -14.453 14.500 -5.096) 21.097 2.565 ( 3.959 -0.403 5.694) 6.947 2.705 ( 7.533 -4.948 -0.346) 9.019 2.717 ( 4.133 1.157 2.903) 5.182 2.978 ( -1.403 -0.800 0.718) 1.768 3.070 ( 1.076 -2.233 -3.051) 3.931 3.250 ( -10.976 11.937 4.219) 16.756 3.340 ( 2.119 -5.760 -1.317) 6.277 3.394 ( 5.377 -2.912 -2.341) 6.548 3.481 ( 8.659 0.602 -1.371) 8.787 3.578 ( -5.791 2.593 -5.199) 8.203 3.744 ( -4.086 -3.550 -0.690) 5.457 3.787 ( 4.502 0.149 -5.270) 6.933 3.839 ( -2.400 -0.203 -6.757) 7.174 4.038 ( 4.908 -2.352 -6.053) 8.140 4.602 ( 0.339 7.012 -6.603) 9.638 4.782 ( 0.090 5.813 0.352) 5.824 4.883 ( -9.180 2.720 -1.486) 9.689 5.122 ( -6.652 8.607 -0.157) 10.879 5.320 ( -10.444 9.549 5.966) 15.358 5.466 ( 7.829 -6.427 3.307) 10.655 5.563 ( 2.533 1.392 1.530) 3.271 5.802 ( 0.206 -2.644 10.705) 11.029 6.010 ( 11.092 -3.807 2.902) 12.081 6.044 ( 2.968 1.957 -1.633) 3.912 6.153 ( -0.610 2.193 -1.340) 2.641 6.494 ( 5.867 -7.776 -8.478) 12.914 7.216 ( -1.588 2.444 1.573) 3.312 7.395 ( -2.360 2.155 -0.503) 3.236 7.679 ( 0.347 11.780 4.939) 12.778 7.994 ( 1.066 5.303 5.630) 7.807 8.041 ( -3.453 2.110 -3.638) 5.441 8.421 ( -1.368 5.528 -6.910) 8.954 9.324 ( -6.304 -2.724 -2.987) 7.489 9.359 ( -4.579 -2.259 -1.054) 5.214 9.646 ( 0.899 1.460 1.297) 2.150 9.973 ( 3.663 0.846 0.349) 3.776 10.228 ( -5.721 3.318 2.132) 6.948 10.555 ( 2.959 1.684 -2.642) 4.309 10.722 ( 2.380 4.818 -1.521) 5.585 10.860 ( 8.039 -1.823 -1.151) 8.323 11.203 ( 6.033 -0.393 3.849) 7.166 11.450 ( 5.231 -4.573 0.814) 6.996 12.303 ( -13.751 2.937 -3.237) 14.429 12.948 ( -2.547 -5.212 3.452) 6.751 13.089 ( -10.012 0.811 0.628) 10.064 13.198 ( -4.117 -3.301 1.749) 5.559 16.686 ( 4.097 4.620 2.910) 6.826 16.988 ( 0.517 3.360 15.622) 15.988 17.154 ( 9.750 12.900 0.597) 16.181 17.728 ( 10.847 11.723 16.360) 22.864 17.903 ( -7.523 -8.959 0.300) 11.703 18.111 ( -2.959 -3.445 -5.410) 7.063 18.273 ( -2.102 -0.465 -11.388) 11.589 18.449 ( -3.850 -2.715 -8.152) 9.415 21.238 ( 0.152 -1.627 -3.544) 3.903 21.467 ( 5.283 -7.024 -2.001) 9.014 21.504 ( -9.591 2.807 -0.912) 10.035 21.945 ( 3.524 -3.200 0.840) 4.834 ======================= Grid point 130 (62/170) ======================= q-point: (-0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -10.404 20.588 0.864) 23.083 1.502 ( -14.334 21.752 0.460) 26.054 2.650 ( -0.098 -3.309 0.741) 3.392 2.708 ( -13.557 5.492 -1.825) 14.740 2.824 ( -2.033 4.995 4.221) 6.848 2.902 ( -7.901 14.247 -1.910) 16.403 2.962 ( 0.820 -1.899 1.476) 2.541 3.117 ( 8.224 -1.080 -5.978) 10.224 3.348 ( 1.226 -1.151 0.067) 1.683 3.444 ( -0.201 -2.032 -5.357) 5.733 3.485 ( 2.654 -6.578 1.101) 7.179 3.618 ( 2.803 -4.149 3.208) 5.947 3.738 ( 2.101 4.407 1.071) 4.998 3.797 ( 0.543 2.307 2.682) 3.579 3.872 ( 9.250 0.412 -5.697) 10.871 4.076 ( 5.734 -4.710 -5.117) 9.014 4.584 ( 2.374 4.946 -4.400) 7.033 4.663 ( -7.610 7.119 -2.310) 10.674 4.884 ( 5.941 5.961 3.629) 9.165 4.993 ( -6.162 10.693 -1.481) 12.430 5.191 ( -10.189 14.109 2.450) 17.575 5.567 ( 0.679 -1.718 -0.827) 2.024 5.656 ( 2.706 -5.133 7.100) 9.169 5.898 ( -4.884 -5.491 8.035) 10.889 6.005 ( -4.295 -3.507 -2.969) 6.290 6.149 ( 0.642 0.535 1.063) 1.352 6.216 ( 8.088 -0.807 1.587) 8.281 6.509 ( 13.431 -7.705 -8.028) 17.442 7.221 ( 0.799 1.573 -0.321) 1.793 7.378 ( -0.294 -0.460 2.352) 2.414 7.721 ( -1.822 8.670 3.308) 9.457 7.848 ( -5.242 3.633 -6.712) 9.259 8.104 ( -4.652 1.785 5.073) 7.111 8.341 ( 0.974 10.914 -4.706) 11.925 9.191 ( -6.371 0.842 0.324) 6.434 9.330 ( 1.067 -3.188 -0.700) 3.434 9.685 ( 1.343 1.889 2.244) 3.226 10.036 ( 3.825 0.497 -1.784) 4.250 10.181 ( -2.437 5.035 3.490) 6.593 10.585 ( 5.237 0.704 -4.282) 6.801 10.764 ( 3.106 6.787 1.412) 7.596 10.964 ( 7.861 -4.302 -1.815) 9.144 11.354 ( 7.946 0.327 2.237) 8.261 11.524 ( 3.189 -5.593 0.425) 6.453 12.061 ( -13.555 3.518 -0.962) 14.037 12.834 ( -15.163 -9.212 0.757) 17.758 12.925 ( -9.868 3.493 -0.437) 10.477 13.184 ( 0.058 -5.098 0.903) 5.178 16.795 ( 6.594 -1.956 0.891) 6.936 17.135 ( -3.428 -2.050 7.993) 8.935 17.223 ( -0.415 -1.729 1.100) 2.091 17.828 ( -3.925 -6.763 4.235) 8.893 18.015 ( -0.152 4.237 2.276) 4.812 18.097 ( 7.990 3.950 -2.754) 9.329 18.144 ( 2.477 2.721 -1.258) 3.888 18.317 ( 2.967 3.419 -7.209) 8.513 21.201 ( -1.049 3.561 -2.382) 4.411 21.336 ( -9.598 4.270 -1.054) 10.558 21.530 ( 3.985 -5.085 -0.226) 6.464 22.000 ( 2.772 -2.258 0.270) 3.585 ======================= Grid point 131 (63/170) ======================= q-point: (-0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -6.391 26.045 8.787) 28.221 1.406 ( -3.529 29.061 11.718) 31.532 2.336 ( -22.921 33.418 8.491) 41.403 2.608 ( -1.401 -4.005 -3.915) 5.773 2.798 ( -1.388 4.504 -2.155) 5.183 2.921 ( 0.639 1.264 -0.052) 1.417 3.044 ( 3.587 -2.818 -0.006) 4.561 3.186 ( 6.459 -8.351 -0.730) 10.582 3.334 ( 1.227 -2.904 -6.630) 7.341 3.413 ( 1.219 2.560 -1.652) 3.282 3.536 ( 2.089 -5.862 1.174) 6.333 3.702 ( 2.733 -0.376 2.314) 3.600 3.797 ( 2.537 0.405 6.209) 6.720 3.884 ( 2.269 -4.997 6.406) 8.436 3.939 ( 2.073 5.230 1.170) 5.746 4.097 ( 5.416 -5.063 -4.569) 8.709 4.513 ( -0.011 8.650 -1.720) 8.819 4.643 ( -0.978 10.624 1.328) 10.751 4.892 ( -2.629 12.965 -1.290) 13.292 5.026 ( -3.677 13.240 3.177) 14.104 5.103 ( 3.019 6.646 -0.309) 7.306 5.526 ( -1.847 -0.482 -2.457) 3.111 5.733 ( -4.227 -7.003 6.107) 10.208 5.822 ( -6.498 -8.528 -1.545) 10.832 5.890 ( -1.607 3.994 -4.265) 6.061 6.116 ( -2.784 -4.164 -0.942) 5.097 6.327 ( 4.772 -2.926 -0.544) 5.624 6.741 ( 14.223 -5.631 1.621) 15.383 7.233 ( 1.935 0.266 -1.082) 2.233 7.438 ( 2.481 -1.804 4.658) 5.577 7.610 ( -9.677 -4.285 -2.936) 10.983 7.792 ( 1.252 13.643 -1.040) 13.739 8.021 ( -6.123 -0.879 0.493) 6.206 8.334 ( 1.372 14.945 -2.490) 15.213 9.140 ( -2.300 2.876 1.532) 3.989 9.357 ( 1.765 -3.845 0.973) 4.341 9.717 ( -0.086 1.086 -0.807) 1.356 10.031 ( -1.264 -0.197 0.582) 1.405 10.266 ( 8.882 6.701 0.045) 11.126 10.628 ( 4.841 -0.914 -2.461) 5.507 10.827 ( 2.901 7.482 -0.901) 8.076 11.071 ( 5.468 -6.089 1.969) 8.418 11.445 ( 4.228 -1.284 -5.531) 7.079 11.598 ( 5.277 -3.338 3.748) 7.283 11.864 ( -13.152 2.612 2.967) 13.733 12.566 ( -17.816 -5.646 3.998) 19.112 12.781 ( -5.906 3.875 -2.746) 7.579 13.187 ( 0.065 -6.158 -1.532) 6.347 16.896 ( 5.417 -9.511 -0.426) 10.954 17.007 ( -10.263 -12.225 -1.419) 16.025 17.219 ( -0.537 -0.266 -6.840) 6.866 17.729 ( -7.354 -8.398 -7.138) 13.250 17.960 ( -0.093 1.950 0.702) 2.074 18.146 ( -1.513 -1.799 6.466) 6.881 18.321 ( 14.192 8.698 0.089) 16.645 18.460 ( 8.988 9.961 3.541) 13.875 21.155 ( -2.313 7.815 -0.293) 8.156 21.200 ( -5.842 4.344 -0.551) 7.301 21.587 ( 2.404 -2.893 1.504) 4.051 22.042 ( 1.915 -0.967 0.678) 2.250 ======================= Grid point 132 (64/170) ======================= q-point: ( 0.00 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( -1.160 20.335 6.258) 21.307 1.932 ( -5.347 22.283 3.932) 23.250 2.528 ( 0.613 2.081 -6.008) 6.387 2.651 ( 2.044 0.890 5.274) 5.726 2.836 ( -0.492 -2.887 -3.421) 4.504 2.904 ( -3.329 -5.742 -4.159) 7.832 3.019 ( 1.429 3.622 8.662) 9.497 3.117 ( 4.078 -5.188 -3.287) 7.373 3.188 ( 2.094 -6.127 -1.176) 6.581 3.375 ( -2.536 -10.155 -7.331) 12.779 3.470 ( 1.458 4.029 -3.034) 5.250 3.737 ( 7.939 -0.941 3.483) 8.720 3.864 ( 1.410 10.233 2.385) 10.602 3.996 ( -3.806 1.269 19.939) 20.338 4.110 ( 1.123 5.871 11.643) 13.088 4.360 ( 1.556 13.835 5.594) 15.004 4.733 ( -1.176 7.361 3.146) 8.091 4.841 ( -2.395 12.179 -0.276) 12.415 5.069 ( -3.540 8.185 -1.877) 9.113 5.157 ( -1.525 5.093 -2.225) 5.763 5.330 ( -0.233 17.633 -3.598) 17.998 5.450 ( 1.150 -1.708 -2.006) 2.875 5.578 ( -1.857 -8.171 3.733) 9.174 5.643 ( -0.713 -7.037 3.725) 7.994 5.903 ( 4.448 -8.418 -2.383) 9.815 6.001 ( -0.247 5.930 -5.355) 7.994 6.245 ( -0.536 -6.046 -2.375) 6.518 6.692 ( -0.413 -10.675 -4.195) 11.477 7.249 ( 0.272 0.118 -0.565) 0.638 7.336 ( -5.764 -5.457 -2.053) 8.199 7.532 ( 4.585 0.514 3.969) 6.086 7.848 ( 3.423 -5.662 -2.417) 7.044 8.157 ( -1.186 15.350 1.531) 15.472 8.542 ( -0.061 8.152 -5.604) 9.893 9.199 ( -1.548 3.763 2.486) 4.768 9.338 ( -0.558 -2.181 3.706) 4.336 9.711 ( -0.747 3.676 0.741) 3.824 10.063 ( 1.785 -2.870 8.855) 9.478 10.492 ( 1.253 6.404 2.001) 6.825 10.650 ( 2.974 4.042 -6.369) 8.108 10.887 ( -4.247 2.602 -5.059) 7.099 11.067 ( 1.551 -2.286 2.741) 3.891 11.299 ( 1.121 -7.861 -7.654) 11.029 11.528 ( -3.742 -8.065 -3.677) 9.622 11.961 ( 1.144 10.117 9.152) 13.690 12.450 ( 0.142 -3.610 7.055) 7.926 12.772 ( 0.300 4.103 -4.154) 5.847 13.029 ( -0.414 -6.158 -3.250) 6.975 16.682 ( -0.550 -9.827 -0.110) 9.843 16.705 ( -0.504 -10.443 -0.354) 10.461 17.076 ( -2.343 1.463 -14.270) 14.535 17.344 ( -2.310 -8.113 -15.517) 17.661 18.098 ( 2.406 2.530 8.795) 9.462 18.210 ( 0.943 -1.028 9.053) 9.160 18.615 ( 1.657 6.308 0.853) 6.578 18.655 ( -1.305 5.069 0.079) 5.234 21.187 ( 1.283 2.873 -2.181) 3.828 21.304 ( -0.074 4.261 -2.972) 5.196 21.664 ( 0.147 4.444 7.645) 8.844 22.042 ( -0.054 -2.930 1.875) 3.479 ======================= Grid point 133 (65/170) ======================= q-point: ( 0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -2.006 14.318 5.681) 15.534 2.012 ( 1.359 15.261 9.079) 17.809 2.452 ( 0.624 1.426 -8.176) 8.323 2.704 ( 0.837 -0.924 -0.371) 1.301 2.795 ( -2.339 -1.420 -0.907) 2.883 2.845 ( 2.070 -8.827 -3.708) 9.796 3.034 ( -0.934 -1.572 -7.311) 7.536 3.119 ( -1.003 -3.930 2.858) 4.962 3.251 ( 0.167 -6.923 -6.692) 9.630 3.312 ( 2.746 -6.403 3.224) 7.676 3.547 ( 5.918 6.310 5.556) 10.281 3.751 ( -4.231 2.348 -6.213) 7.875 3.968 ( 3.120 20.814 14.421) 25.513 4.109 ( -6.882 2.238 10.768) 12.974 4.332 ( 3.538 0.283 18.976) 19.305 4.410 ( -5.933 9.669 8.133) 13.959 4.716 ( -3.535 3.270 2.658) 5.501 4.808 ( 1.063 12.665 -0.782) 12.734 4.953 ( -6.282 6.042 -2.213) 8.993 5.135 ( 2.326 6.918 -2.196) 7.622 5.316 ( 1.888 13.753 -2.719) 14.146 5.474 ( 2.177 -0.640 0.640) 2.357 5.572 ( -1.419 -0.651 -2.441) 2.898 5.653 ( -2.619 -8.220 6.149) 10.594 5.941 ( 2.288 -5.921 -1.658) 6.560 5.988 ( 4.753 1.932 -3.879) 6.432 6.177 ( -3.780 -5.204 -4.265) 7.717 6.569 ( -4.665 -11.397 -7.258) 14.295 7.207 ( -3.866 -1.677 -1.924) 4.633 7.293 ( 1.791 -2.866 0.842) 3.483 7.685 ( 9.202 0.887 1.249) 9.328 7.920 ( 7.385 -4.417 -2.392) 8.931 8.157 ( -1.205 12.640 2.630) 12.967 8.459 ( -0.724 7.045 -6.812) 9.826 9.220 ( 0.247 3.601 4.267) 5.589 9.372 ( -0.339 -2.085 4.177) 4.681 9.747 ( 0.869 7.378 4.354) 8.611 10.174 ( 2.774 4.336 3.588) 6.275 10.418 ( -13.281 3.119 5.063) 14.552 10.686 ( 7.512 3.232 -3.490) 8.892 10.732 ( -5.696 3.929 -6.990) 9.836 11.098 ( -4.936 -4.692 4.200) 8.002 11.172 ( -1.898 -5.517 -10.506) 12.017 11.420 ( -3.846 -9.264 -2.690) 10.385 12.155 ( 8.123 6.969 9.735) 14.468 12.598 ( 7.569 -6.380 5.817) 11.482 12.766 ( 5.583 4.608 -5.842) 9.302 12.990 ( 1.359 -4.506 -4.543) 6.542 16.678 ( -0.726 -5.374 -3.760) 6.599 16.752 ( 7.221 -6.992 -1.187) 10.121 16.913 ( 0.936 -2.892 -9.049) 9.546 17.205 ( 6.186 -10.643 -12.395) 17.469 18.180 ( -3.334 5.647 4.294) 7.839 18.329 ( 2.627 0.406 6.909) 7.403 18.501 ( -12.175 7.697 -0.099) 14.405 18.665 ( -1.341 3.079 3.006) 4.507 21.207 ( 4.041 1.803 -1.986) 4.850 21.292 ( 3.450 1.962 -4.544) 6.034 21.733 ( -3.681 4.003 9.896) 11.291 22.029 ( -3.976 -2.527 1.334) 4.897 ======================= Grid point 134 (66/170) ======================= q-point: ( 0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.997 ( 5.454 6.516 11.620) 14.395 2.121 ( 0.943 6.069 6.703) 9.092 2.413 ( 3.529 4.147 -3.558) 6.505 2.681 ( -1.318 0.135 -3.373) 3.624 2.740 ( -3.134 -1.195 -1.238) 3.575 2.839 ( 1.080 -8.130 -4.272) 9.248 2.946 ( -1.820 2.114 -4.608) 5.387 3.093 ( -0.993 -3.308 -1.881) 3.932 3.176 ( -1.602 -7.675 -4.186) 8.888 3.385 ( 5.250 -5.902 -1.268) 8.000 3.565 ( -5.635 1.318 -5.329) 7.867 3.635 ( -3.921 -1.465 0.182) 4.190 4.021 ( -10.314 8.501 2.767) 13.649 4.242 ( -15.952 9.990 3.447) 19.135 4.298 ( 8.285 18.929 22.582) 30.609 4.620 ( -1.578 -0.499 20.845) 20.911 4.738 ( 3.900 0.209 -0.409) 3.927 4.803 ( 0.377 5.200 -3.437) 6.245 4.921 ( 1.356 6.900 2.269) 7.389 5.144 ( 1.058 5.836 -2.095) 6.290 5.310 ( -1.791 5.774 0.397) 6.058 5.474 ( -2.860 2.077 -1.876) 4.002 5.538 ( 5.717 6.294 -6.108) 10.469 5.727 ( 0.590 -2.371 11.553) 11.809 5.908 ( -4.467 -6.301 -3.261) 8.384 6.053 ( 5.734 -5.254 -0.724) 7.811 6.063 ( -3.011 -3.421 -2.348) 5.126 6.411 ( -2.677 -9.569 -11.529) 15.220 7.150 ( -0.604 0.466 -1.673) 1.838 7.346 ( 2.742 -3.098 1.579) 4.428 7.821 ( 7.418 7.907 -0.880) 10.877 7.968 ( 1.675 2.729 -3.129) 4.477 8.201 ( 2.440 5.545 4.421) 7.500 8.417 ( 4.626 2.487 -4.768) 7.094 9.310 ( 3.557 1.898 5.854) 7.108 9.420 ( 0.729 -1.357 3.644) 3.956 9.796 ( -2.216 8.909 4.820) 10.369 10.163 ( -3.145 12.911 -6.933) 14.988 10.327 ( -7.484 -3.730 11.431) 14.163 10.574 ( -3.168 3.319 -6.791) 8.196 10.765 ( 3.974 1.213 -1.441) 4.398 10.918 ( -8.358 -2.834 -6.851) 11.172 11.142 ( -2.354 -5.302 3.022) 6.541 11.338 ( -2.897 -9.035 -3.032) 9.961 12.399 ( 9.110 5.415 9.306) 14.104 12.769 ( 6.729 -7.887 3.814) 11.047 12.801 ( 8.110 4.602 -8.062) 12.327 12.985 ( 4.471 -3.146 -4.334) 6.977 16.608 ( -0.649 1.932 -4.971) 5.373 16.721 ( -1.657 3.065 -6.082) 7.009 17.041 ( 15.964 -10.701 0.521) 19.226 17.272 ( 12.911 -11.665 -5.199) 18.160 18.086 ( -10.354 11.203 -0.100) 15.255 18.259 ( -12.899 10.100 -0.738) 16.400 18.460 ( 2.270 -2.079 4.120) 5.143 18.679 ( -1.949 -1.402 3.882) 4.565 21.262 ( 4.476 1.027 -0.672) 4.641 21.303 ( 4.115 0.784 -4.628) 6.242 21.763 ( -5.962 0.947 9.244) 11.041 21.947 ( -6.828 -3.001 -0.566) 7.480 ======================= Grid point 135 (67/170) ======================= q-point: ( 0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( -0.442 0.296 6.104) 6.127 2.266 ( 9.391 1.275 13.684) 16.645 2.478 ( 6.077 6.292 0.484) 8.761 2.571 ( -4.223 1.657 -8.191) 9.363 2.681 ( -3.411 1.476 -0.506) 3.750 2.790 ( -1.595 -3.837 -2.499) 4.849 2.864 ( -2.851 -0.060 -1.699) 3.320 3.016 ( -4.917 -2.487 -6.150) 8.258 3.159 ( 5.573 -4.574 -3.630) 8.072 3.406 ( -2.208 -4.918 -2.702) 6.030 3.478 ( 1.969 -5.840 -3.831) 7.257 3.546 ( -4.305 -3.263 1.376) 5.574 3.919 ( -7.846 9.330 2.929) 12.538 3.997 ( -13.838 7.635 -0.043) 15.805 4.543 ( -7.281 -1.447 9.338) 11.929 4.732 ( -6.446 -11.762 -3.423) 13.843 4.789 ( 7.418 11.913 8.630) 16.475 4.860 ( 5.846 8.279 3.606) 10.757 4.937 ( -0.274 6.677 2.957) 7.308 5.146 ( -1.580 7.246 2.015) 7.685 5.270 ( 0.478 1.066 -0.345) 1.218 5.450 ( 2.755 5.250 -2.400) 6.396 5.548 ( -0.172 1.732 -1.678) 2.418 5.728 ( -6.527 -1.540 -6.115) 9.076 5.940 ( 3.503 -3.373 15.651) 16.390 6.005 ( -0.211 -1.762 -4.847) 5.162 6.174 ( 5.928 -3.437 3.162) 7.547 6.230 ( -1.235 -4.694 -13.525) 14.369 7.140 ( 0.959 3.080 -1.394) 3.514 7.404 ( 2.241 -2.691 1.768) 3.923 7.879 ( 1.747 13.451 -3.547) 14.020 7.939 ( -1.911 12.811 1.994) 13.105 8.325 ( 7.642 -2.276 2.548) 8.371 8.491 ( 8.629 -1.511 -2.313) 9.060 9.407 ( 0.320 0.651 1.317) 1.504 9.468 ( 1.613 -1.123 2.536) 3.208 9.783 ( -4.511 6.348 5.450) 9.505 10.024 ( -5.332 6.549 -3.987) 9.339 10.348 ( -2.434 -1.122 5.081) 5.745 10.506 ( 2.273 0.445 -6.810) 7.193 10.670 ( -6.262 1.397 -3.681) 7.397 10.863 ( 2.038 1.514 -0.139) 2.543 11.118 ( -5.154 -4.586 3.455) 7.715 11.266 ( -2.087 -6.631 -2.449) 7.371 12.636 ( 8.063 4.490 8.737) 12.708 12.814 ( 3.822 4.199 -5.548) 7.938 12.912 ( 8.375 -6.115 0.112) 10.370 13.026 ( 5.353 -4.079 -3.350) 7.518 16.577 ( 1.044 5.314 -0.876) 5.486 16.655 ( -0.697 4.565 -1.907) 4.996 17.304 ( 12.886 -1.573 2.451) 13.211 17.424 ( 9.717 -1.259 -2.560) 10.127 17.906 ( -9.295 9.954 -0.921) 13.650 18.106 ( -3.905 2.586 -0.261) 4.691 18.512 ( 0.518 -3.373 0.849) 3.517 18.673 ( -2.564 -4.410 0.819) 5.166 21.309 ( 2.042 1.944 -1.835) 3.364 21.332 ( 4.155 -0.178 -0.491) 4.187 21.748 ( -6.559 -3.607 5.898) 9.530 21.811 ( -7.771 -4.448 -2.602) 9.324 ======================= Grid point 136 (68/170) ======================= q-point: ( 0.36 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.238 ( -1.306 1.788 4.779) 5.267 2.391 ( -5.022 3.522 -9.189) 11.048 2.549 ( 7.740 0.585 5.858) 9.725 2.597 ( 7.438 2.110 1.316) 7.843 2.636 ( -2.817 -0.302 7.885) 8.379 2.756 ( 0.292 3.216 -2.197) 3.906 2.833 ( -2.484 -1.937 0.372) 3.171 2.880 ( -1.301 0.099 -4.305) 4.498 3.186 ( 0.610 -4.094 -3.570) 5.466 3.326 ( -3.104 -0.253 -2.193) 3.809 3.461 ( -1.016 -7.833 -2.323) 8.233 3.525 ( -3.439 -2.210 2.925) 5.026 3.807 ( -1.650 1.734 -1.175) 2.666 3.923 ( 1.438 -2.848 0.732) 3.273 4.401 ( -14.691 -6.757 -0.892) 16.195 4.530 ( -11.290 -14.901 -5.085) 19.374 4.782 ( 1.364 9.136 -7.314) 11.783 5.022 ( 2.868 10.066 -1.789) 10.618 5.056 ( 2.854 7.343 0.050) 7.879 5.120 ( 2.699 5.133 6.200) 8.489 5.340 ( 0.923 -1.155 1.813) 2.340 5.445 ( -3.366 1.432 2.175) 4.255 5.505 ( -4.463 -2.503 2.564) 5.723 5.666 ( 4.780 0.088 1.059) 4.896 5.906 ( 0.908 2.931 -11.035) 11.453 6.093 ( -1.040 1.028 -2.401) 2.811 6.161 ( 3.759 0.859 7.008) 7.998 6.306 ( 4.390 -1.156 3.061) 5.475 7.143 ( 0.583 5.803 0.231) 5.837 7.455 ( 1.466 -1.564 2.221) 3.087 7.825 ( -1.206 14.812 -4.299) 15.470 7.952 ( -2.929 16.800 5.290) 17.855 8.465 ( 9.315 -4.530 -2.632) 10.687 8.603 ( 6.923 -1.632 -1.314) 7.233 9.340 ( -4.516 2.174 -2.939) 5.810 9.502 ( -0.113 -3.293 0.027) 3.295 9.796 ( -2.473 1.292 2.817) 3.965 9.946 ( -1.697 -0.202 2.235) 2.813 10.372 ( 0.471 -1.433 1.927) 2.447 10.402 ( -3.208 -1.846 -6.581) 7.550 10.657 ( 4.419 6.016 0.020) 7.465 10.868 ( -0.689 4.075 -1.668) 4.456 11.076 ( -5.132 -3.809 4.285) 7.695 11.218 ( -1.154 -4.551 -1.616) 4.965 12.800 ( 3.657 4.631 -5.196) 7.862 12.829 ( 3.879 3.664 5.691) 7.801 13.044 ( 5.854 -4.710 3.268) 8.194 13.067 ( 3.920 -4.711 -1.667) 6.351 16.617 ( 1.603 6.078 3.653) 7.270 16.658 ( -0.075 5.289 3.422) 6.300 17.403 ( -4.371 18.903 3.893) 19.788 17.480 ( 0.110 18.502 -2.454) 18.665 17.887 ( 9.119 -6.730 -0.150) 11.335 18.143 ( 6.342 -8.400 0.812) 10.557 18.494 ( -1.596 -5.404 -2.148) 6.031 18.614 ( -3.446 -5.513 -2.445) 6.946 21.304 ( 0.967 1.130 -3.449) 3.756 21.382 ( 0.991 -0.556 0.376) 1.196 21.663 ( -4.635 -6.076 -3.275) 8.314 21.707 ( -5.620 -7.006 3.866) 9.778 ======================= Grid point 137 (69/170) ======================= q-point: ( 0.45 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( -3.891 3.166 -6.203) 7.977 2.313 ( 1.878 4.004 -0.233) 4.429 2.571 ( -4.922 -0.747 -1.696) 5.259 2.650 ( 1.630 0.404 -1.579) 2.305 2.763 ( 4.556 6.318 0.178) 7.792 2.809 ( 1.590 -3.206 8.467) 9.192 2.829 ( 1.498 1.011 3.446) 3.891 2.897 ( 1.551 0.574 3.715) 4.066 3.088 ( -6.370 1.890 -1.009) 6.720 3.281 ( 1.262 -0.170 -4.250) 4.436 3.383 ( -2.168 -5.562 -2.377) 6.425 3.538 ( -0.762 -1.699 3.699) 4.141 3.868 ( 9.843 -8.986 -3.494) 13.778 4.001 ( 6.243 -10.677 -1.060) 12.414 4.123 ( -14.644 -8.418 -4.364) 17.446 4.309 ( -7.160 -16.871 -5.234) 19.060 4.740 ( 5.185 7.582 -10.737) 14.130 4.947 ( 0.665 8.457 -7.853) 11.560 5.049 ( -6.456 -0.303 -7.288) 9.741 5.177 ( -1.695 5.767 4.997) 7.816 5.353 ( 4.747 -1.443 -1.381) 5.150 5.435 ( -2.903 5.270 5.499) 8.151 5.495 ( -2.493 0.908 5.958) 6.522 5.815 ( 3.426 6.208 -0.037) 7.091 5.873 ( 5.361 -0.273 3.361) 6.333 6.055 ( -0.057 2.717 -2.670) 3.810 6.246 ( -0.245 2.370 2.529) 3.474 6.353 ( -0.998 0.698 0.412) 1.285 7.182 ( 1.325 6.998 4.469) 8.408 7.496 ( -0.226 -0.434 3.113) 3.151 7.768 ( 0.432 15.192 -4.429) 15.830 7.958 ( -3.560 15.625 5.342) 16.892 8.532 ( 4.749 -4.350 -6.972) 9.491 8.641 ( 2.208 0.053 -4.895) 5.370 9.276 ( -0.380 1.245 -0.123) 1.307 9.484 ( -0.349 -5.168 -1.413) 5.369 9.763 ( -0.820 -0.908 -1.684) 2.082 9.944 ( -5.304 -5.187 1.798) 7.633 10.342 ( 4.247 1.293 -2.030) 4.881 10.423 ( -0.112 -0.578 5.144) 5.178 10.723 ( 4.426 4.383 -2.653) 6.770 10.820 ( -1.938 5.401 -1.914) 6.049 11.045 ( -4.572 -2.220 3.685) 6.278 11.203 ( 0.858 -3.683 -0.405) 3.803 12.791 ( 3.017 3.334 -4.789) 6.570 12.876 ( -2.475 0.934 -0.027) 2.646 13.132 ( 2.871 -1.827 4.031) 5.275 13.164 ( 2.279 -2.830 5.802) 6.846 16.692 ( 0.640 5.592 6.243) 8.406 16.715 ( -1.536 5.172 8.307) 9.905 17.344 ( -5.487 25.725 2.473) 26.420 17.450 ( -0.084 25.101 0.830) 25.115 18.070 ( 10.195 -8.691 -0.308) 13.400 18.221 ( -0.869 -8.966 0.989) 9.062 18.449 ( 1.841 -8.129 -3.842) 9.178 18.527 ( -2.358 -5.120 -3.849) 6.826 21.264 ( 1.332 -2.640 -6.493) 7.135 21.335 ( -2.426 -4.543 -5.907) 7.837 21.632 ( 1.115 -4.509 2.321) 5.192 21.681 ( -3.191 -6.214 3.728) 7.918 ======================= Grid point 138 (70/170) ======================= q-point: (-0.45 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( 0.155 1.845 -2.350) 2.991 2.301 ( -4.171 -3.565 -8.799) 10.369 2.434 ( 0.363 7.441 -2.372) 7.818 2.706 ( -3.259 1.188 -0.747) 3.549 2.716 ( -4.927 3.940 4.224) 7.592 2.872 ( -0.125 -0.922 4.037) 4.143 2.924 ( 0.880 -1.524 7.791) 7.987 3.001 ( 4.199 0.550 4.871) 6.454 3.084 ( 7.168 3.588 -0.759) 8.052 3.250 ( 0.835 -3.062 -4.597) 5.586 3.380 ( 5.018 -4.221 -3.065) 7.238 3.573 ( -0.086 0.169 3.538) 3.543 3.861 ( -6.081 -7.996 -5.618) 11.510 3.923 ( -4.482 -8.548 -3.907) 10.412 4.045 ( 7.660 -8.384 -7.779) 13.765 4.315 ( 12.137 -16.900 -3.834) 21.157 4.663 ( -8.865 -0.813 -17.010) 19.199 4.744 ( 7.730 -2.385 -12.120) 14.571 5.018 ( 0.798 10.462 6.238) 12.207 5.186 ( -2.963 8.198 2.346) 9.028 5.412 ( -2.281 -1.068 4.742) 5.369 5.421 ( -4.176 3.526 3.549) 6.516 5.587 ( 4.606 5.053 6.698) 9.571 5.797 ( 0.933 8.301 -6.351) 10.493 5.956 ( -4.902 4.289 2.581) 7.007 6.053 ( 0.900 -3.033 2.107) 3.801 6.240 ( 0.941 1.859 -3.427) 4.011 6.326 ( -1.626 1.432 2.505) 3.312 7.264 ( -0.194 5.520 6.946) 8.874 7.513 ( -2.845 0.001 4.396) 5.237 7.752 ( 3.569 13.989 -3.654) 14.893 7.971 ( -1.211 13.791 4.549) 14.572 8.430 ( -4.467 -3.167 -10.235) 11.608 8.607 ( 1.848 0.067 -6.374) 6.637 9.323 ( 4.057 0.361 1.599) 4.375 9.453 ( -1.060 -3.464 -2.978) 4.690 9.743 ( -2.014 -3.809 -1.189) 4.470 9.843 ( -2.530 -3.419 -2.216) 4.796 10.430 ( 1.818 3.001 0.704) 3.579 10.486 ( 3.285 2.310 6.086) 7.292 10.736 ( 0.768 0.749 -0.950) 1.433 10.766 ( -1.278 3.164 -3.704) 5.037 11.036 ( -0.603 0.014 3.087) 3.145 11.230 ( 2.312 -3.508 0.214) 4.207 12.762 ( -5.344 1.280 -3.147) 6.333 12.812 ( 0.865 -0.572 -2.201) 2.434 13.210 ( -0.657 -0.019 5.649) 5.687 13.232 ( -2.458 -0.775 6.367) 6.869 16.750 ( -3.748 6.453 8.372) 11.215 16.797 ( -0.639 4.643 10.003) 11.046 17.320 ( -0.292 24.602 1.597) 24.656 17.527 ( 5.827 24.043 4.958) 25.231 18.057 ( -10.261 -9.221 -0.926) 13.827 18.198 ( -1.996 -7.655 -0.301) 7.916 18.429 ( 1.218 -4.485 -4.618) 6.552 18.509 ( 4.423 -5.591 -4.287) 8.318 21.224 ( 2.733 -6.387 -7.527) 10.243 21.232 ( 2.456 -7.341 -9.015) 11.883 21.675 ( -2.902 -2.910 3.388) 5.326 21.706 ( 2.743 -3.578 4.153) 6.129 ======================= Grid point 139 (71/170) ======================= q-point: (-0.36 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( -8.770 2.437 -7.706) 11.926 2.121 ( -0.650 4.224 0.282) 4.283 2.471 ( 5.184 2.699 -3.362) 6.742 2.607 ( -3.884 0.735 1.180) 4.125 2.708 ( -2.360 2.108 1.136) 3.363 2.904 ( 0.178 -2.608 2.694) 3.754 3.017 ( -1.475 -6.657 7.586) 10.200 3.121 ( 5.902 -0.956 1.845) 6.257 3.202 ( 1.134 -0.586 -2.022) 2.391 3.252 ( 10.118 -1.173 -0.296) 10.190 3.442 ( 7.729 -1.351 -3.983) 8.799 3.602 ( -1.326 -2.568 4.208) 5.105 3.770 ( 0.738 1.723 -2.003) 2.744 3.854 ( 3.374 -1.879 -5.320) 6.574 4.025 ( 5.056 -4.085 -13.665) 15.133 4.250 ( -11.607 5.397 -16.488) 20.873 4.518 ( 13.739 -14.063 -7.147) 20.919 4.831 ( 8.765 -5.794 -1.039) 10.558 5.068 ( -5.196 6.343 0.497) 8.215 5.178 ( -0.016 8.790 8.762) 12.411 5.359 ( -5.570 3.575 2.516) 7.081 5.447 ( -0.957 -0.077 4.701) 4.798 5.622 ( -4.916 2.168 -6.625) 8.530 5.808 ( 5.150 6.169 4.742) 9.331 5.868 ( -5.899 4.801 1.037) 7.676 6.080 ( 0.806 1.625 1.340) 2.255 6.198 ( -2.921 -1.040 -0.061) 3.102 6.374 ( 4.162 -1.875 -1.232) 4.728 7.294 ( -4.201 4.128 4.914) 7.670 7.496 ( -5.406 0.561 3.585) 6.511 7.809 ( 5.722 11.173 -0.018) 12.553 8.031 ( 2.055 11.964 5.394) 13.284 8.228 ( -6.065 -1.420 -9.536) 11.390 8.554 ( -0.056 -0.467 -5.660) 5.680 9.354 ( -1.333 -2.296 -3.216) 4.170 9.404 ( -1.887 -2.053 -1.692) 3.262 9.663 ( -1.654 0.618 -0.654) 1.883 9.878 ( 5.805 -2.879 -1.147) 6.581 10.395 ( -4.770 6.237 0.180) 7.854 10.604 ( 2.722 3.573 -0.957) 4.592 10.713 ( 0.547 -2.139 3.170) 3.863 10.778 ( 4.513 1.928 -1.321) 5.083 11.087 ( 2.499 0.037 3.012) 3.913 11.277 ( 3.218 -4.770 0.461) 5.773 12.593 ( -10.021 2.810 -3.696) 11.045 12.825 ( 0.727 -4.494 0.225) 4.558 13.220 ( -6.819 1.132 5.059) 8.566 13.223 ( -4.857 0.111 4.152) 6.391 16.774 ( -3.596 7.866 6.817) 11.012 16.912 ( -0.421 4.253 12.666) 13.367 17.346 ( -0.180 16.536 1.330) 16.590 17.720 ( 5.171 17.149 10.458) 20.741 17.865 ( -9.043 -8.716 -0.664) 12.577 18.125 ( -4.173 -4.185 -0.897) 5.978 18.383 ( 0.033 -1.646 -7.115) 7.303 18.498 ( 1.703 -4.099 -7.395) 8.626 21.179 ( 4.731 -5.662 -7.673) 10.645 21.248 ( 7.793 -8.451 -6.404) 13.159 21.648 ( -4.558 0.693 1.968) 5.013 21.795 ( 3.159 -3.898 3.136) 5.917 ======================= Grid point 140 (72/170) ======================= q-point: (-0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -6.575 11.412 -3.020) 13.512 2.061 ( -6.873 14.641 -1.640) 16.257 2.535 ( 4.663 -3.256 1.955) 6.014 2.621 ( 3.237 -2.799 0.150) 4.282 2.713 ( 1.854 -0.032 0.591) 1.946 2.935 ( 1.157 -4.401 0.495) 4.578 2.998 ( -3.923 -6.262 -0.355) 7.398 3.193 ( 3.232 -7.725 -0.694) 8.403 3.263 ( 2.877 -2.382 6.863) 7.813 3.344 ( 1.043 -1.652 -2.665) 3.305 3.536 ( 5.062 2.213 -2.294) 5.982 3.649 ( 2.430 -0.532 2.520) 3.541 3.784 ( 3.067 -0.572 -7.002) 7.665 3.861 ( 4.704 3.588 -7.760) 9.758 3.944 ( -4.462 19.799 -6.817) 21.410 3.990 ( 7.933 -0.158 -7.701) 11.058 4.607 ( 7.606 -5.600 -7.129) 11.834 4.932 ( 0.789 4.226 3.463) 5.521 4.956 ( -5.782 5.472 -0.476) 7.975 5.274 ( -3.562 5.416 4.855) 8.099 5.330 ( 2.400 -2.905 -0.758) 3.843 5.459 ( -3.726 -0.987 5.330) 6.577 5.530 ( 0.390 -1.367 1.329) 1.946 5.747 ( -5.126 1.768 -1.790) 5.710 5.972 ( 3.050 -0.345 4.216) 5.215 6.111 ( 2.521 3.318 0.373) 4.184 6.178 ( -1.233 0.298 3.735) 3.944 6.386 ( 3.508 -4.224 -7.206) 9.059 7.271 ( -3.837 3.328 3.648) 6.254 7.426 ( -6.138 0.589 1.259) 6.294 7.883 ( 0.705 8.871 1.166) 8.975 8.044 ( -4.727 1.334 -5.000) 7.008 8.145 ( 1.741 7.417 4.956) 9.088 8.497 ( 0.918 1.355 -4.157) 4.468 9.276 ( -3.062 -1.813 -3.440) 4.950 9.317 ( -4.761 -2.154 -0.818) 5.290 9.693 ( 2.902 3.605 0.337) 4.640 9.950 ( 4.958 -3.078 -1.875) 6.130 10.318 ( -3.990 6.006 -0.244) 7.215 10.598 ( 2.590 2.214 -2.599) 4.286 10.786 ( 3.583 0.130 0.395) 3.607 10.859 ( 5.350 3.864 0.839) 6.653 11.186 ( 5.454 -1.534 3.808) 6.827 11.336 ( 3.224 -7.188 0.631) 7.903 12.382 ( -11.925 5.363 -2.759) 13.364 12.811 ( -4.485 -8.113 1.103) 9.336 13.129 ( -9.612 2.285 2.519) 10.196 13.164 ( -6.241 -0.503 1.903) 6.544 16.787 ( -2.428 6.103 3.810) 7.593 17.064 ( 1.075 3.982 13.418) 14.037 17.270 ( -12.475 -0.224 1.332) 12.548 17.692 ( -10.196 -9.612 7.998) 16.134 18.006 ( 9.817 11.598 6.745) 16.624 18.113 ( 5.066 5.203 -1.102) 7.345 18.268 ( -2.347 -0.297 -9.495) 9.786 18.409 ( 1.653 -1.648 -11.112) 11.355 21.199 ( 5.652 -2.392 -4.588) 7.663 21.323 ( 8.493 -7.468 -3.516) 11.843 21.575 ( -6.240 4.627 0.467) 7.783 21.871 ( 3.446 -4.538 1.256) 5.835 ======================= Grid point 141 (73/170) ======================= q-point: (-0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -0.178 20.489 3.345) 20.761 1.928 ( -7.180 21.908 0.591) 23.062 2.623 ( 1.203 -2.012 1.543) 2.806 2.651 ( 0.234 -2.059 -1.834) 2.767 2.773 ( 4.845 -5.058 3.167) 7.687 2.932 ( -1.361 -3.199 0.277) 3.487 2.982 ( 3.119 -7.822 -1.427) 8.540 3.181 ( -7.719 -2.380 -7.149) 10.787 3.269 ( 2.421 -3.236 -0.866) 4.134 3.392 ( -1.995 -4.398 11.060) 12.068 3.459 ( 0.439 2.184 -9.397) 9.657 3.685 ( 1.710 6.149 -1.877) 6.653 3.770 ( 2.460 -0.838 -1.935) 3.241 3.867 ( 1.389 4.600 -1.186) 4.949 3.969 ( 5.089 5.814 -3.881) 8.646 4.051 ( 9.599 13.609 -1.749) 16.745 4.658 ( 4.206 3.763 -0.719) 5.689 4.868 ( -2.997 10.325 0.430) 10.760 5.002 ( 3.341 5.867 4.107) 7.902 5.204 ( -4.283 11.038 -0.656) 11.858 5.408 ( 1.767 -5.887 3.839) 7.247 5.464 ( 0.060 4.293 0.373) 4.309 5.560 ( -1.884 -8.930 3.345) 9.721 5.665 ( -4.981 -8.307 0.384) 9.694 5.961 ( -2.671 -2.888 -3.166) 5.050 6.169 ( 1.836 -0.045 -2.400) 3.022 6.224 ( -1.269 1.722 5.209) 5.631 6.411 ( 12.485 -4.017 -4.352) 13.819 7.262 ( -1.358 2.424 1.476) 3.146 7.361 ( -3.891 -1.125 2.642) 4.836 7.786 ( -10.571 1.756 -1.941) 10.890 7.982 ( -0.273 2.539 -3.809) 4.586 8.160 ( -4.210 8.403 3.215) 9.933 8.524 ( 5.055 6.212 -1.305) 8.115 9.205 ( -2.649 0.816 0.233) 2.781 9.280 ( -0.341 -1.903 0.838) 2.107 9.728 ( 0.583 2.660 1.487) 3.102 9.971 ( 0.230 -5.684 -2.197) 6.098 10.303 ( 3.027 7.213 0.251) 7.827 10.634 ( 5.433 3.613 -3.941) 7.623 10.852 ( 4.060 -2.397 1.546) 4.962 10.940 ( 4.652 7.166 -0.297) 8.548 11.320 ( 7.275 -4.837 -1.098) 8.805 11.393 ( 2.883 -7.260 3.167) 8.429 12.168 ( -12.821 7.625 -0.307) 14.920 12.683 ( -12.698 -7.588 0.580) 14.804 12.988 ( -9.373 2.873 -0.169) 9.805 13.100 ( -3.066 -3.367 0.427) 4.574 16.771 ( -2.884 -0.245 0.824) 3.010 17.028 ( -18.003 -8.205 1.472) 19.840 17.217 ( 2.519 2.402 6.786) 7.626 17.652 ( -6.657 -10.959 6.321) 14.296 18.063 ( -4.311 1.622 -4.210) 6.240 18.129 ( -2.273 -0.312 -3.955) 4.572 18.277 ( 13.497 9.839 -0.794) 16.722 18.438 ( 12.488 6.543 -2.213) 14.270 21.227 ( 1.854 0.451 -2.049) 2.800 21.420 ( 3.803 -5.525 -0.085) 6.708 21.483 ( -2.614 9.199 -0.484) 9.576 21.936 ( 3.871 -4.640 0.234) 6.047 ======================= Grid point 142 (74/170) ======================= q-point: (-0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( -2.313 23.387 3.992) 23.838 1.930 ( 0.162 25.292 7.252) 26.312 2.578 ( -1.975 2.001 -3.886) 4.796 2.619 ( -3.085 0.857 1.654) 3.603 2.890 ( -1.303 -1.812 0.742) 2.352 2.925 ( 1.028 -5.583 2.554) 6.225 3.009 ( -0.356 -3.750 -5.500) 6.666 3.013 ( 2.209 -1.991 2.016) 3.593 3.259 ( 0.668 -4.574 -8.704) 9.856 3.403 ( 2.665 -7.336 0.903) 7.857 3.515 ( 1.154 -0.378 2.697) 2.958 3.626 ( 0.924 -3.766 -7.394) 8.349 3.831 ( -0.421 7.037 6.379) 9.507 3.862 ( 0.057 2.790 4.302) 5.128 3.997 ( 0.759 8.003 5.508) 9.745 4.238 ( 8.822 15.324 3.202) 17.969 4.700 ( 1.296 9.115 1.434) 9.317 4.859 ( -0.752 10.453 1.028) 10.530 5.102 ( 1.625 7.955 1.518) 8.260 5.163 ( 0.387 7.167 -0.315) 7.185 5.393 ( -3.660 15.410 0.458) 15.845 5.487 ( -0.022 -4.081 -3.761) 5.550 5.566 ( -1.557 -8.591 5.026) 10.074 5.604 ( -2.090 -12.006 2.041) 12.356 5.892 ( 0.363 -5.340 -3.774) 6.549 6.095 ( -2.607 1.943 -5.999) 6.824 6.255 ( 0.335 -3.559 0.851) 3.675 6.618 ( 11.933 -7.600 0.071) 14.148 7.253 ( 0.234 1.501 -0.897) 1.764 7.371 ( -0.285 -4.245 3.527) 5.527 7.581 ( -11.260 1.054 -1.467) 11.404 7.891 ( -3.696 -4.345 -3.970) 6.950 8.152 ( -0.843 15.125 2.081) 15.290 8.569 ( 2.797 8.022 -2.921) 8.983 9.195 ( -1.108 2.948 2.155) 3.816 9.303 ( 0.345 -1.636 2.584) 3.078 9.739 ( -1.166 1.240 -0.242) 1.719 9.962 ( -0.583 -6.104 5.047) 7.941 10.399 ( 7.691 7.317 -0.455) 10.626 10.662 ( 4.108 5.044 -4.802) 8.086 10.929 ( 3.003 -6.415 -0.324) 7.091 11.006 ( 3.424 8.688 0.854) 9.378 11.340 ( 2.068 -8.785 -5.415) 10.525 11.516 ( 6.223 -5.905 1.491) 8.707 11.986 ( -11.670 9.627 3.641) 15.561 12.487 ( -11.763 -4.170 3.000) 12.836 12.851 ( -5.659 3.403 -2.375) 7.018 13.066 ( -1.203 -6.019 -1.189) 6.252 16.728 ( -2.493 -7.393 -0.047) 7.803 16.787 ( -12.302 -9.868 0.258) 15.773 17.237 ( -0.034 1.954 -8.174) 8.404 17.552 ( -5.745 -9.249 -7.838) 13.416 17.997 ( -0.535 2.001 3.300) 3.896 18.111 ( -0.789 -1.870 6.589) 6.895 18.488 ( 12.295 8.161 -0.307) 14.760 18.610 ( 7.160 5.514 1.266) 9.126 21.209 ( -0.818 2.411 -1.745) 3.087 21.363 ( -4.157 5.212 -1.333) 6.799 21.563 ( 4.461 3.020 3.818) 6.603 21.999 ( 3.090 -3.852 0.973) 5.033 ======================= Grid point 143 (75/170) ======================= q-point: ( 0.00 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( -2.242 14.971 -5.292) 16.036 2.285 ( -5.747 13.270 -1.945) 14.591 2.559 ( 0.144 -4.520 0.410) 4.541 2.565 ( -0.159 -8.554 -8.260) 11.892 2.763 ( 1.695 3.072 2.474) 4.293 2.847 ( -1.324 -1.272 1.584) 2.425 2.949 ( 1.525 -3.329 -0.234) 3.669 3.041 ( 1.207 -7.184 0.368) 7.294 3.151 ( 1.800 0.732 1.291) 2.333 3.197 ( -0.202 -5.434 -3.244) 6.332 3.536 ( 5.677 3.494 -0.969) 6.736 3.623 ( 9.798 -5.942 2.994) 11.844 3.995 ( -2.561 1.963 13.891) 14.261 4.022 ( -2.623 -0.407 14.557) 14.797 4.503 ( -1.564 28.018 6.983) 28.918 4.629 ( 0.542 13.230 4.589) 14.014 4.786 ( -4.236 -2.968 2.453) 5.725 4.932 ( 0.087 -8.431 3.639) 9.183 5.194 ( -4.514 5.448 -0.841) 7.125 5.265 ( -0.506 3.157 1.375) 3.480 5.355 ( -1.270 -3.914 -4.326) 5.970 5.385 ( -0.670 -6.614 1.804) 6.889 5.503 ( -0.278 4.768 0.308) 4.786 5.689 ( 1.050 -12.259 -1.495) 12.394 5.787 ( 4.376 15.417 -0.058) 16.026 6.025 ( 4.337 -8.128 -3.562) 9.877 6.237 ( -1.998 8.712 -5.318) 10.401 6.460 ( -1.001 -12.987 -6.029) 14.353 7.247 ( -1.895 -0.183 0.052) 1.904 7.261 ( -3.945 -2.158 -0.595) 4.536 7.588 ( 3.514 5.300 0.486) 6.378 7.715 ( 3.280 -7.468 -1.598) 8.312 8.430 ( -0.585 12.150 -2.002) 12.327 8.586 ( -0.062 -3.509 -5.036) 6.138 9.265 ( -1.753 2.909 3.090) 4.592 9.306 ( -1.604 -1.590 3.644) 4.287 9.807 ( 0.700 6.489 6.612) 9.290 9.948 ( 1.755 -7.767 10.909) 13.506 10.626 ( -0.019 7.736 2.388) 8.096 10.758 ( 3.564 -2.047 -2.833) 4.992 10.863 ( -1.044 5.825 -3.682) 6.970 11.058 ( 2.819 -8.374 -9.017) 12.624 11.205 ( -2.308 5.134 -2.783) 6.279 11.363 ( -3.105 -9.072 -4.168) 10.455 12.165 ( 0.153 10.656 6.139) 12.299 12.344 ( -0.095 -7.703 5.383) 9.398 12.847 ( 0.230 3.844 -2.990) 4.875 12.925 ( -0.009 -4.657 -2.519) 5.294 16.553 ( -0.450 -3.320 -0.122) 3.352 16.562 ( -0.458 -4.182 -0.194) 4.212 17.123 ( -2.377 3.511 -15.229) 15.808 17.211 ( -2.355 -5.808 -15.601) 16.813 18.142 ( 2.112 2.173 9.800) 10.257 18.181 ( 1.618 -1.846 9.914) 10.213 18.702 ( 0.847 2.725 0.507) 2.898 18.716 ( -0.303 1.273 0.254) 1.333 21.250 ( 0.607 3.576 -2.515) 4.414 21.311 ( 0.064 -2.381 -3.438) 4.182 21.802 ( 0.018 8.656 6.167) 10.628 21.952 ( -0.040 -6.541 3.555) 7.445 ======================= Grid point 144 (76/170) ======================= q-point: ( 0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( -2.528 9.979 -3.938) 11.021 2.209 ( -2.738 2.013 -2.833) 4.424 2.477 ( 0.724 2.320 -3.131) 3.964 2.596 ( 1.227 -8.449 -0.419) 8.548 2.812 ( -0.400 5.326 2.621) 5.949 2.822 ( 0.422 6.552 -2.052) 6.879 2.959 ( -2.745 -7.827 3.021) 8.828 3.025 ( 1.855 -9.982 -5.579) 11.585 3.136 ( 0.618 1.930 -4.180) 4.645 3.212 ( 3.136 -4.650 -0.834) 5.670 3.663 ( 3.850 5.398 2.558) 7.107 3.736 ( -0.655 -2.227 -2.654) 3.526 4.124 ( -3.639 1.284 14.215) 14.730 4.168 ( 2.090 -2.619 19.517) 19.802 4.526 ( -4.150 16.613 7.392) 18.651 4.698 ( -7.699 12.028 7.588) 16.172 4.725 ( -3.159 4.137 6.499) 8.327 4.964 ( -1.226 0.242 3.219) 3.453 5.072 ( -7.488 6.269 -1.210) 9.840 5.259 ( -6.248 -7.347 -1.905) 9.831 5.287 ( 1.160 -1.483 2.687) 3.281 5.412 ( 1.854 -5.550 -0.305) 5.860 5.512 ( 1.450 4.865 2.361) 5.599 5.665 ( -0.285 -6.194 0.488) 6.220 5.901 ( 8.605 9.376 -2.694) 13.009 6.047 ( 1.784 -2.201 -4.162) 5.034 6.125 ( -2.308 4.078 -7.880) 9.168 6.322 ( -3.466 -13.642 -9.358) 16.903 7.199 ( -1.663 1.029 -1.115) 2.251 7.239 ( 0.598 -2.743 0.347) 2.829 7.723 ( 11.523 3.574 0.228) 12.067 7.816 ( 10.315 -5.776 -1.309) 11.894 8.382 ( -2.391 9.937 -1.809) 10.380 8.505 ( -2.150 -2.379 -5.606) 6.458 9.284 ( -0.914 2.955 4.974) 5.857 9.332 ( -1.047 -2.174 5.186) 5.719 9.915 ( 1.040 9.882 8.795) 13.270 10.102 ( 0.814 -8.913 11.906) 14.895 10.558 ( -8.647 9.694 -0.994) 13.027 10.718 ( -6.331 -5.582 -2.513) 8.806 10.831 ( 5.228 9.917 -5.960) 12.696 11.025 ( 3.624 -9.266 -8.668) 13.195 11.095 ( -5.923 4.528 -2.636) 7.908 11.238 ( -5.160 -9.264 -3.598) 11.198 12.303 ( 6.731 8.356 7.176) 12.909 12.461 ( 6.237 -7.949 5.280) 11.400 12.846 ( 4.588 3.825 -4.449) 7.449 12.915 ( 3.115 -3.569 -3.882) 6.125 16.610 ( 6.827 -1.287 -1.424) 7.091 16.637 ( 11.116 -4.108 -0.239) 11.854 16.928 ( -1.890 3.471 -12.843) 13.437 17.032 ( 1.592 -7.377 -13.292) 15.285 18.264 ( 0.469 3.377 6.648) 7.471 18.313 ( 2.399 -1.780 7.539) 8.110 18.628 ( -9.157 5.172 0.204) 10.518 18.687 ( -5.082 -0.944 1.327) 5.336 21.247 ( 2.732 2.377 -2.492) 4.396 21.290 ( 2.483 -1.722 -3.944) 4.969 21.839 ( -4.759 6.482 7.133) 10.749 21.955 ( -4.851 -5.198 3.702) 8.016 ======================= Grid point 145 (77/170) ======================= q-point: ( 0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( 2.845 4.487 3.058) 6.130 2.166 ( 0.504 -1.731 -0.292) 1.826 2.490 ( 2.387 4.289 -0.070) 4.909 2.596 ( -0.529 -6.539 -0.234) 6.564 2.790 ( -1.144 6.828 -1.109) 7.012 2.825 ( -1.304 4.882 -0.059) 5.054 2.930 ( -4.728 -5.652 2.229) 7.699 2.997 ( 3.007 -9.824 -5.034) 11.441 3.119 ( 3.042 6.236 -5.570) 8.897 3.256 ( 4.343 -7.274 -2.649) 8.876 3.589 ( -7.950 1.202 -5.662) 9.834 3.612 ( -7.854 -1.127 -3.333) 8.606 4.207 ( -4.571 10.543 8.792) 14.469 4.380 ( -3.498 -3.187 13.547) 14.350 4.477 ( -14.180 5.553 6.409) 16.522 4.615 ( -6.909 -4.631 3.255) 8.932 4.821 ( -2.168 17.478 18.077) 25.238 4.959 ( 0.642 6.448 -1.043) 6.564 5.015 ( 0.708 1.966 -0.715) 2.208 5.152 ( -8.098 -10.612 6.816) 14.988 5.328 ( -0.127 2.475 1.299) 2.798 5.436 ( 0.306 -5.821 0.862) 5.893 5.621 ( 5.499 1.860 5.894) 8.273 5.686 ( 2.095 0.319 -3.484) 4.078 5.937 ( -0.878 4.895 -4.291) 6.568 5.982 ( 1.148 -1.449 -3.958) 4.368 6.039 ( 3.269 2.744 -6.509) 7.783 6.209 ( 2.963 -11.383 -10.783) 15.957 7.190 ( 1.551 3.593 -0.594) 3.958 7.272 ( 2.612 -4.479 0.699) 5.232 7.925 ( 13.921 3.645 -0.659) 14.405 7.974 ( 10.838 -1.517 -1.338) 11.026 8.327 ( -3.378 6.659 0.351) 7.475 8.420 ( -1.459 -2.522 -3.567) 4.606 9.348 ( 1.137 2.012 5.732) 6.181 9.386 ( 0.261 -1.985 5.222) 5.593 9.994 ( -3.889 11.095 7.589) 13.994 10.193 ( -7.514 -9.232 10.414) 15.816 10.401 ( -2.947 11.111 -6.534) 13.222 10.565 ( -4.665 -5.142 -6.646) 9.611 10.846 ( 1.093 5.513 -2.946) 6.345 10.891 ( -5.320 -0.062 -5.178) 7.424 11.064 ( 0.122 -1.286 0.241) 1.314 11.155 ( -1.041 -9.215 -2.449) 9.592 12.505 ( 8.154 5.874 7.449) 12.509 12.626 ( 7.267 -6.984 4.826) 11.174 12.878 ( 6.615 3.412 -6.400) 9.816 12.933 ( 5.457 -2.545 -5.307) 8.026 16.678 ( 4.036 5.339 -4.102) 7.850 16.781 ( -0.405 -1.550 -6.634) 6.825 16.895 ( 19.109 0.446 -0.780) 19.130 17.044 ( 14.151 -11.213 -4.818) 18.686 18.273 ( -5.593 8.093 1.426) 9.941 18.392 ( -3.226 -4.210 2.352) 5.802 18.462 ( -8.325 9.302 1.056) 12.528 18.611 ( -5.918 -5.779 2.173) 8.552 21.279 ( 3.663 1.086 -1.046) 3.961 21.301 ( 3.328 -0.914 -2.548) 4.289 21.807 ( -8.394 3.385 5.699) 10.696 21.879 ( -8.599 -3.935 1.948) 9.655 ======================= Grid point 146 (78/170) ======================= q-point: ( 0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 2.620 1.450 4.266) 5.212 2.249 ( 5.692 -3.114 6.906) 9.476 2.534 ( 2.543 2.438 -0.610) 3.575 2.586 ( -1.116 -1.516 2.313) 2.983 2.737 ( -4.953 3.926 -0.264) 6.326 2.790 ( -1.989 0.891 -0.273) 2.197 2.882 ( -0.200 2.336 -1.821) 2.968 3.015 ( 4.308 -7.081 -3.462) 8.982 3.069 ( 1.217 6.365 -9.290) 11.327 3.249 ( -0.215 -9.897 -5.830) 11.488 3.445 ( -4.024 0.910 -2.025) 4.596 3.484 ( -3.136 -2.952 -0.177) 4.310 4.144 ( -11.597 13.711 4.065) 18.412 4.203 ( -17.832 12.903 0.622) 22.019 4.402 ( -13.422 -11.897 7.466) 19.427 4.466 ( -13.452 -14.599 -0.553) 19.860 4.973 ( 2.519 6.692 -3.914) 8.151 5.002 ( 0.116 3.338 10.582) 11.096 5.081 ( 5.730 8.721 9.550) 14.145 5.204 ( 0.540 -2.920 10.428) 10.843 5.306 ( -1.954 3.872 -1.556) 4.608 5.425 ( -3.105 -6.399 1.263) 7.224 5.595 ( -2.195 3.071 -9.315) 10.051 5.654 ( -1.428 -3.130 -7.035) 7.831 5.985 ( 7.290 4.581 5.410) 10.169 6.035 ( 3.708 4.616 -3.661) 6.962 6.087 ( 9.016 -4.899 2.651) 10.598 6.144 ( 3.215 -5.125 -9.245) 11.049 7.224 ( 2.702 5.423 0.073) 6.060 7.329 ( 3.102 -5.103 1.182) 6.088 8.081 ( 6.148 8.129 -2.757) 10.559 8.150 ( 12.598 5.296 0.677) 13.683 8.283 ( -3.521 1.185 1.650) 4.065 8.408 ( 3.798 -6.961 -0.786) 7.969 9.416 ( 0.078 0.712 2.691) 2.784 9.439 ( 0.260 -1.595 3.025) 3.430 9.942 ( -9.805 8.999 4.778) 14.140 10.072 ( -12.916 -2.985 2.402) 13.472 10.359 ( 2.375 3.512 -4.353) 6.077 10.452 ( 0.103 -4.942 -8.558) 9.883 10.768 ( -2.599 7.024 0.454) 7.503 10.872 ( 0.170 -2.316 1.826) 2.954 11.059 ( -1.098 0.167 0.129) 1.118 11.136 ( 0.581 -6.499 -1.701) 6.743 12.714 ( 7.175 3.824 8.173) 11.528 12.791 ( 5.532 -4.471 6.429) 9.587 12.903 ( 7.084 3.117 -8.456) 11.463 12.960 ( 5.782 -2.995 -6.233) 9.014 16.682 ( 1.451 4.966 -0.973) 5.264 16.724 ( -0.261 1.363 -1.645) 2.152 17.244 ( 23.657 -1.110 0.882) 23.700 17.313 ( 21.077 -7.188 -0.435) 22.273 18.134 ( -10.839 11.085 -1.294) 15.557 18.227 ( -11.242 4.352 -0.541) 12.067 18.449 ( -1.271 -0.622 0.324) 1.451 18.553 ( -4.053 -7.828 0.428) 8.825 21.329 ( 3.040 0.362 -1.361) 3.350 21.333 ( 2.530 0.091 0.825) 2.663 21.707 ( -9.796 -0.328 2.905) 10.223 21.736 ( -10.169 -3.055 -0.497) 10.629 ======================= Grid point 147 (79/170) ======================= q-point: ( 0.36 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 2.203 3.347 3.607) 5.392 2.367 ( 0.784 -4.824 -1.087) 5.007 2.561 ( 0.607 2.798 5.642) 6.327 2.610 ( -4.217 -1.908 3.839) 6.014 2.695 ( 4.796 5.261 -0.558) 7.141 2.779 ( 1.722 -3.031 -0.319) 3.501 2.898 ( 3.895 7.053 -1.824) 8.261 2.957 ( -1.804 9.769 -5.299) 11.259 3.055 ( 3.254 -8.602 -5.179) 10.555 3.186 ( 1.812 -12.759 -3.471) 13.346 3.402 ( -2.161 2.323 0.982) 3.321 3.467 ( -2.013 -3.891 1.346) 4.583 3.943 ( -12.658 10.757 -0.794) 16.630 3.992 ( -10.203 9.321 0.717) 13.838 4.185 ( -16.737 -13.550 -0.305) 21.537 4.234 ( -14.464 -15.070 -0.981) 20.911 4.964 ( 2.008 8.733 -5.110) 10.316 5.082 ( 1.619 -2.892 0.727) 3.393 5.196 ( -0.683 6.120 -9.110) 10.995 5.268 ( -1.609 5.607 3.766) 6.943 5.294 ( 2.859 0.362 1.088) 3.080 5.426 ( -0.170 -5.078 4.865) 7.035 5.504 ( -1.815 3.387 1.888) 4.282 5.593 ( 2.033 -5.617 1.917) 6.274 6.006 ( 4.141 5.681 -7.507) 10.284 6.086 ( 2.711 -2.254 -6.134) 7.075 6.205 ( 5.642 3.378 6.532) 9.269 6.268 ( 5.578 -2.847 4.818) 7.901 7.270 ( 2.074 7.047 1.455) 7.489 7.391 ( 2.402 -5.188 2.144) 6.105 8.087 ( 0.020 12.424 -3.326) 12.861 8.223 ( -4.748 6.663 2.279) 8.493 8.360 ( 11.954 -1.823 -2.173) 12.286 8.505 ( 7.199 -8.442 0.089) 11.096 9.381 ( -3.968 2.339 -2.060) 5.045 9.436 ( -2.372 -3.362 -0.942) 4.221 9.858 ( -6.751 4.459 3.503) 8.816 9.929 ( -7.270 -2.312 2.187) 7.936 10.353 ( 2.083 -0.223 -2.310) 3.119 10.367 ( 0.364 -1.554 -5.879) 6.091 10.789 ( 1.864 7.235 2.008) 7.737 10.900 ( -0.230 -2.823 2.118) 3.537 11.038 ( -1.544 1.937 0.336) 2.500 11.121 ( -0.192 -5.377 -1.316) 5.539 12.871 ( 2.359 2.634 -2.515) 4.339 12.882 ( 2.245 1.615 3.175) 4.211 12.980 ( 7.140 -1.782 3.415) 8.112 12.991 ( 5.998 -2.861 -1.710) 6.862 16.715 ( 0.706 3.646 3.668) 5.219 16.734 ( -0.218 1.891 3.707) 4.167 17.622 ( 18.135 2.909 3.547) 18.706 17.638 ( 20.888 0.106 -0.373) 20.892 17.949 ( -9.191 11.640 -2.195) 14.993 18.090 ( -4.507 -0.206 -0.167) 4.514 18.392 ( -4.741 -2.397 -2.129) 5.723 18.480 ( -4.702 -8.167 -1.276) 9.510 21.329 ( -0.036 1.528 -4.561) 4.810 21.361 ( 0.046 -1.604 -2.631) 3.081 21.582 ( -6.639 -1.829 0.722) 6.924 21.601 ( -7.059 -3.656 3.761) 8.794 ======================= Grid point 148 (80/170) ======================= q-point: ( 0.45 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( -3.196 4.383 -7.025) 8.875 2.329 ( -0.800 -2.619 -3.752) 4.645 2.588 ( -1.991 2.403 3.375) 4.597 2.632 ( -0.017 -1.888 4.798) 5.156 2.809 ( 5.434 2.731 1.522) 6.269 2.847 ( -0.425 0.184 -0.353) 0.582 2.885 ( 4.585 4.842 1.129) 6.764 2.961 ( 1.830 4.391 -0.492) 4.782 3.044 ( 2.431 -1.706 -0.040) 2.970 3.215 ( 2.563 -11.519 -1.704) 11.923 3.351 ( -4.881 5.726 0.103) 7.524 3.456 ( -0.658 -5.473 2.509) 6.057 3.817 ( -1.249 3.054 -2.228) 3.982 3.894 ( -1.982 0.474 -0.937) 2.243 3.944 ( -10.273 -9.094 -2.314) 13.913 4.021 ( -7.521 -12.101 -3.042) 14.569 4.864 ( 1.005 5.584 -17.434) 18.334 4.959 ( -4.071 -4.283 -17.963) 18.910 5.151 ( 2.406 7.852 -0.408) 8.223 5.251 ( 1.975 -1.209 2.131) 3.147 5.362 ( -0.023 3.892 2.909) 4.859 5.441 ( -3.270 -2.930 4.560) 6.331 5.595 ( 1.014 7.425 11.031) 13.335 5.740 ( 2.579 -7.331 11.986) 14.285 5.995 ( 4.156 6.505 -6.632) 10.177 6.073 ( 2.819 -1.402 -4.679) 5.639 6.298 ( 0.091 2.805 2.089) 3.499 6.342 ( -0.580 -1.670 1.551) 2.352 7.325 ( 0.915 7.539 4.161) 8.660 7.447 ( 0.370 -4.800 3.700) 6.072 8.038 ( 0.097 12.441 -4.779) 13.328 8.169 ( -3.214 2.548 0.045) 4.102 8.466 ( 5.148 1.041 -4.822) 7.130 8.577 ( 2.815 -6.511 -2.893) 7.660 9.315 ( -0.725 2.928 -0.754) 3.109 9.388 ( -0.491 -4.663 -1.193) 4.838 9.785 ( -3.988 2.947 -1.067) 5.072 9.856 ( -5.388 -4.193 0.095) 6.828 10.369 ( 4.452 1.571 0.300) 4.730 10.401 ( 3.213 -1.613 3.346) 4.911 10.815 ( -0.462 4.873 -1.360) 5.081 10.880 ( -3.048 -0.687 -1.425) 3.434 11.035 ( -0.168 2.556 2.002) 3.251 11.119 ( 1.238 -5.009 0.070) 5.160 12.842 ( 0.931 2.123 -5.322) 5.805 12.874 ( -1.375 -1.085 -3.759) 4.146 13.116 ( 3.333 0.012 7.149) 7.888 13.127 ( 2.951 -1.120 7.620) 8.248 16.778 ( -0.477 2.926 7.102) 7.695 16.788 ( -1.311 1.973 7.817) 8.168 17.784 ( -1.638 16.700 0.888) 16.804 17.820 ( 0.530 11.417 -2.105) 11.621 17.957 ( 13.927 -1.056 1.258) 14.023 18.109 ( 2.904 -4.349 1.353) 5.401 18.279 ( -3.712 -5.425 -2.019) 6.876 18.386 ( -4.241 -9.471 -1.460) 10.480 21.224 ( -0.841 -0.880 -10.669) 10.738 21.249 ( -2.274 -3.528 -10.714) 11.507 21.581 ( -0.437 -0.916 6.258) 6.340 21.596 ( -2.075 -2.572 6.557) 7.342 ======================= Grid point 149 (81/170) ======================= q-point: (-0.45 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.147 ( -0.317 3.449 -5.169) 6.222 2.224 ( -2.774 -4.364 -7.797) 9.355 2.580 ( -1.206 6.780 -0.491) 6.904 2.680 ( -1.674 -3.725 0.833) 4.168 2.776 ( -5.175 2.934 3.250) 6.779 2.836 ( -3.028 -3.031 1.846) 4.665 2.974 ( 1.617 7.359 0.949) 7.594 3.060 ( 6.550 3.135 5.028) 8.833 3.115 ( 4.944 -0.606 0.011) 4.981 3.176 ( -2.564 -6.092 -1.857) 6.865 3.342 ( 3.841 3.024 -0.921) 4.974 3.478 ( -0.386 -8.975 1.752) 9.153 3.805 ( 2.161 2.112 -2.255) 3.771 3.853 ( 1.614 2.239 -1.673) 3.227 3.896 ( 6.503 -6.459 -3.817) 9.929 4.015 ( 9.054 -13.160 -1.985) 16.096 4.661 ( -2.320 0.604 -21.415) 21.549 4.691 ( 3.326 -2.555 -20.113) 20.546 5.210 ( 0.001 9.061 5.069) 10.383 5.323 ( 1.069 1.674 5.160) 5.529 5.374 ( -4.111 0.212 4.052) 5.776 5.436 ( -3.511 -1.882 4.953) 6.356 5.720 ( 0.347 8.046 9.035) 12.104 5.861 ( -1.949 -5.209 5.916) 8.120 5.980 ( 1.821 4.537 -3.764) 6.170 6.049 ( 0.771 -0.985 -5.259) 5.406 6.278 ( -2.343 2.553 -0.972) 3.599 6.324 ( -2.015 -1.601 1.750) 3.113 7.378 ( -2.087 6.035 6.259) 8.942 7.476 ( -3.054 -3.835 5.279) 7.204 8.001 ( 2.964 11.440 -5.802) 13.165 8.137 ( 1.281 0.030 -2.631) 2.927 8.409 ( -3.971 4.193 -5.293) 7.834 8.543 ( -1.195 -6.598 -4.104) 7.861 9.342 ( 2.867 1.827 0.023) 3.400 9.391 ( 1.132 -3.116 -1.425) 3.609 9.722 ( -1.450 1.456 -2.316) 3.096 9.776 ( -0.729 -3.555 -2.659) 4.499 10.488 ( 5.740 2.750 4.098) 7.570 10.516 ( 3.638 0.203 7.073) 7.957 10.753 ( -2.551 1.302 -3.190) 4.287 10.783 ( -4.712 -1.148 -4.200) 6.416 11.071 ( 1.353 3.583 2.124) 4.379 11.152 ( 1.869 -4.455 0.781) 4.894 12.781 ( -3.832 0.774 -3.962) 5.566 12.796 ( -1.367 -0.905 -3.641) 3.993 13.217 ( -1.176 0.526 7.346) 7.458 13.224 ( -1.716 -0.264 7.727) 7.920 16.848 ( -2.499 3.335 9.461) 10.338 16.863 ( -1.394 1.717 9.932) 10.175 17.706 ( -5.117 13.970 -1.585) 14.961 17.849 ( 0.645 0.155 -1.928) 2.039 17.981 ( -9.041 9.295 3.246) 13.367 18.117 ( -1.699 -1.169 1.158) 2.365 18.315 ( 5.366 -5.441 -0.579) 7.664 18.375 ( 4.662 -8.159 -1.745) 9.558 21.120 ( 4.164 -3.428 -12.321) 13.450 21.121 ( 3.644 -3.453 -11.964) 12.974 21.644 ( -1.126 -0.416 5.819) 5.941 21.656 ( 0.797 -1.677 5.989) 6.270 ======================= Grid point 150 (82/170) ======================= q-point: (-0.36 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( -1.395 2.986 -4.363) 5.468 2.151 ( 3.322 -0.717 0.042) 3.399 2.545 ( -0.033 4.174 -3.663) 5.554 2.602 ( -3.882 -1.520 -1.286) 4.363 2.754 ( -3.604 2.492 1.747) 4.717 2.822 ( -1.540 -5.092 2.951) 6.083 2.966 ( -3.563 2.697 1.377) 4.676 3.073 ( -1.695 -5.859 -4.096) 7.347 3.208 ( 4.500 3.028 2.946) 6.172 3.252 ( 6.760 -0.350 1.960) 7.047 3.422 ( 7.181 1.005 0.728) 7.287 3.502 ( 1.905 -6.578 2.264) 7.213 3.844 ( 5.964 4.725 -5.592) 9.442 3.935 ( 7.204 1.024 -9.018) 11.588 3.939 ( 8.567 4.036 -2.833) 9.885 4.185 ( 14.096 -14.734 -1.792) 20.470 4.419 ( 1.501 8.416 -16.948) 18.982 4.632 ( 10.639 -12.689 -10.303) 19.502 5.211 ( -6.799 7.854 3.951) 11.114 5.313 ( -9.053 0.158 5.451) 10.569 5.388 ( -0.618 2.903 4.695) 5.554 5.446 ( -1.254 -1.068 3.559) 3.921 5.725 ( -5.978 7.328 -4.436) 10.446 5.840 ( -2.943 -3.344 1.783) 4.799 5.961 ( -0.580 5.107 0.343) 5.151 6.052 ( 1.109 -4.087 4.737) 6.354 6.233 ( -2.047 4.689 -0.566) 5.148 6.324 ( 0.431 -3.910 -1.065) 4.076 7.382 ( -5.687 4.874 5.702) 9.414 7.465 ( -6.117 -3.441 5.556) 8.951 8.007 ( 4.866 9.112 -4.697) 11.347 8.138 ( 2.969 -4.050 -5.984) 7.812 8.289 ( -5.114 10.539 0.344) 11.719 8.474 ( -2.073 -7.696 -2.657) 8.402 9.334 ( -1.882 0.328 -2.984) 3.543 9.361 ( -2.495 -2.168 -2.571) 4.187 9.716 ( 4.320 4.364 -1.653) 6.359 9.806 ( 6.256 -4.544 -2.152) 8.025 10.526 ( -4.331 7.003 0.002) 8.234 10.643 ( -4.360 -4.851 0.030) 6.522 10.688 ( 6.761 4.652 2.130) 8.479 10.769 ( 6.364 -2.925 1.314) 7.126 11.112 ( 1.026 2.736 1.883) 3.476 11.185 ( 1.157 -4.627 0.612) 4.809 12.655 ( -6.911 3.759 -2.922) 8.392 12.735 ( -3.173 -4.653 -1.523) 5.834 13.233 ( -5.586 0.628 5.253) 7.694 13.237 ( -6.121 0.386 5.669) 8.352 16.907 ( -3.115 5.636 8.887) 10.975 16.963 ( -0.774 0.169 11.134) 11.162 17.551 ( -14.670 6.373 0.608) 16.006 17.676 ( -16.368 -7.737 1.945) 18.209 18.039 ( 7.090 11.837 3.739) 14.295 18.129 ( 3.790 2.292 1.045) 4.551 18.343 ( 0.895 -1.361 -4.349) 4.644 18.401 ( 2.539 -5.800 -5.487) 8.378 21.095 ( 8.974 -2.201 -9.815) 13.480 21.117 ( 9.696 -4.497 -9.282) 14.156 21.675 ( -1.637 2.155 3.608) 4.510 21.727 ( 1.063 -3.214 3.924) 5.182 ======================= Grid point 151 (83/170) ======================= q-point: (-0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( 0.956 11.494 1.315) 11.608 2.234 ( 2.539 -0.407 4.518) 5.198 2.493 ( -0.009 2.554 -4.444) 5.126 2.575 ( 1.952 -3.117 -1.926) 4.152 2.752 ( 2.003 2.572 1.849) 3.748 2.828 ( -0.880 -6.281 1.505) 6.518 2.901 ( -4.933 0.811 -0.671) 5.044 3.027 ( 0.711 -9.303 -3.088) 9.828 3.279 ( -0.579 3.211 5.142) 6.090 3.332 ( -0.034 -1.321 2.131) 2.508 3.566 ( 8.418 1.637 -0.825) 8.615 3.607 ( 7.815 -2.739 1.039) 8.346 3.779 ( 0.260 0.812 -13.076) 13.104 3.831 ( 1.663 -4.279 -14.538) 15.245 4.131 ( 14.621 13.750 -0.914) 20.092 4.345 ( 6.446 13.044 -2.657) 14.791 4.434 ( 14.993 -5.275 -2.801) 16.139 4.751 ( 10.246 -17.481 -1.373) 20.309 5.120 ( -6.748 8.008 1.996) 10.661 5.244 ( -6.258 -5.143 4.937) 9.486 5.390 ( -2.516 5.924 1.855) 6.698 5.468 ( -3.100 -1.260 4.039) 5.245 5.570 ( -5.552 7.240 -3.174) 9.659 5.729 ( -6.534 -6.482 -3.938) 10.011 6.021 ( 0.893 5.911 2.529) 6.491 6.123 ( 0.688 -3.432 3.269) 4.790 6.212 ( 0.176 4.405 1.865) 4.787 6.304 ( 0.931 -4.741 -3.306) 5.854 7.341 ( -6.050 3.912 4.534) 8.513 7.407 ( -7.327 -2.558 3.687) 8.592 8.006 ( -2.589 4.205 -3.683) 6.160 8.052 ( -3.697 -0.801 -4.343) 5.759 8.305 ( 2.363 8.903 2.922) 9.664 8.453 ( 2.933 -5.761 -0.519) 6.485 9.263 ( -2.479 0.327 -2.332) 3.419 9.281 ( -3.280 -1.489 -1.475) 3.893 9.777 ( 4.008 4.920 -1.791) 6.593 9.871 ( 4.352 -4.839 -2.860) 7.109 10.447 ( -2.078 7.187 -1.956) 7.733 10.572 ( -0.023 -5.153 -2.191) 5.600 10.840 ( 7.259 5.869 0.813) 9.370 10.918 ( 7.612 -0.070 3.721) 8.473 11.155 ( 2.048 -0.623 1.992) 2.924 11.204 ( 0.339 -5.598 1.310) 5.760 12.504 ( -9.191 7.305 -1.450) 11.829 12.654 ( -6.491 -8.286 -0.058) 10.526 13.160 ( -8.885 0.904 2.569) 9.293 13.165 ( -8.011 0.227 2.310) 8.341 16.918 ( -6.260 7.507 4.411) 10.724 17.056 ( -3.535 -5.800 6.637) 9.497 17.306 ( -16.870 6.880 6.807) 19.450 17.487 ( -13.033 -11.030 8.140) 18.915 18.179 ( 2.398 6.190 1.044) 6.719 18.251 ( -0.456 -1.761 -4.607) 4.953 18.259 ( 8.183 7.743 -3.244) 11.723 18.367 ( 6.767 -3.410 -7.276) 10.505 21.168 ( 9.502 -0.234 -4.949) 10.716 21.206 ( 10.595 -4.364 -4.530) 12.321 21.673 ( -1.770 5.470 1.161) 5.866 21.776 ( 1.696 -5.320 1.403) 5.758 ======================= Grid point 152 (84/170) ======================= q-point: (-0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 4.479 16.727 4.785) 17.965 2.290 ( -0.549 13.163 2.941) 13.498 2.502 ( 3.924 -6.754 0.116) 7.812 2.601 ( 3.646 -7.870 0.079) 8.674 2.794 ( -2.887 6.465 -4.522) 8.401 2.831 ( -1.300 -4.180 1.033) 4.498 2.847 ( 3.529 -3.401 3.296) 5.906 3.010 ( 0.606 -11.279 -2.754) 11.626 3.267 ( -4.937 1.581 -0.476) 5.206 3.320 ( -6.284 -3.504 3.717) 8.098 3.530 ( 2.549 5.583 -12.446) 13.877 3.656 ( 3.631 -6.811 -13.626) 15.660 3.755 ( 3.855 1.667 3.635) 5.554 3.805 ( 4.325 -3.513 2.501) 6.108 4.346 ( 12.519 17.403 -1.314) 21.478 4.405 ( 3.072 22.098 2.435) 22.443 4.651 ( 10.647 -4.754 1.928) 11.818 4.867 ( 2.854 -14.766 2.056) 15.179 5.100 ( 1.236 6.487 3.558) 7.501 5.246 ( 1.724 -8.640 1.510) 8.939 5.385 ( -1.355 3.125 2.658) 4.320 5.408 ( -4.357 8.292 0.114) 9.368 5.515 ( -2.335 -2.933 1.148) 3.921 5.605 ( -2.988 -5.462 -3.301) 7.046 5.972 ( -4.618 5.998 -3.799) 8.470 6.108 ( -1.437 -6.057 -4.073) 7.439 6.279 ( 0.796 3.191 3.413) 4.740 6.339 ( 6.909 -3.404 0.482) 7.717 7.305 ( -3.968 1.998 3.179) 5.463 7.337 ( -5.594 -1.422 3.045) 6.526 7.841 ( -10.565 4.143 -3.433) 11.856 7.932 ( -7.650 -4.904 -3.546) 9.755 8.380 ( 3.518 11.482 1.672) 12.125 8.540 ( 6.074 -4.434 0.336) 7.528 9.227 ( -0.667 1.377 0.855) 1.752 9.253 ( -0.273 -1.285 1.439) 1.949 9.785 ( -0.700 3.406 -0.473) 3.510 9.864 ( -1.154 -5.019 -2.255) 5.622 10.452 ( 4.712 8.286 -0.982) 9.583 10.604 ( 6.035 -6.819 -1.521) 9.232 10.912 ( 3.230 9.187 -2.398) 10.029 11.064 ( 7.003 0.345 0.676) 7.044 11.188 ( 1.024 -3.316 -0.660) 3.533 11.272 ( 4.413 -6.307 4.229) 8.783 12.338 ( -10.844 9.782 0.295) 14.607 12.523 ( -10.365 -9.309 0.650) 13.947 13.031 ( -8.572 1.632 -0.141) 8.727 13.057 ( -6.622 -1.454 0.008) 6.779 16.795 ( -11.374 2.897 0.651) 11.755 16.883 ( -17.173 -6.342 0.529) 18.314 17.299 ( -0.606 6.168 7.209) 9.507 17.450 ( -4.561 -9.618 6.801) 12.632 18.091 ( -4.357 1.380 -5.549) 7.189 18.114 ( -3.735 -1.042 -5.437) 6.678 18.444 ( 12.373 6.683 -0.290) 14.066 18.508 ( 11.949 0.213 -0.453) 11.960 21.250 ( 4.438 2.292 -1.304) 5.163 21.317 ( 5.843 -4.750 -0.634) 7.556 21.665 ( 0.841 9.219 0.048) 9.257 21.823 ( 3.428 -7.220 0.192) 7.995 ======================= Grid point 153 (85/170) ======================= q-point: (-0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 0.697 18.329 -0.006) 18.343 2.362 ( 1.516 20.170 4.387) 20.697 2.521 ( 0.470 -9.620 -2.404) 9.927 2.693 ( -1.517 5.873 -4.462) 7.530 2.712 ( 2.493 -13.803 2.867) 14.316 2.807 ( 0.953 -5.247 -0.403) 5.348 2.929 ( 2.665 -0.155 0.231) 2.679 2.993 ( -0.897 -3.803 2.574) 4.680 3.176 ( -2.048 -2.619 -4.476) 5.576 3.229 ( -3.140 -7.622 -0.699) 8.273 3.508 ( 3.219 1.588 -2.681) 4.480 3.559 ( 1.858 -3.247 -9.189) 9.921 3.877 ( 0.636 1.637 11.069) 11.208 3.903 ( 1.042 -0.739 7.813) 7.917 4.435 ( 1.954 27.515 3.137) 27.762 4.549 ( 5.535 15.483 3.991) 16.920 4.775 ( 2.183 -3.040 2.524) 4.514 4.901 ( -0.399 -10.636 2.501) 10.933 5.199 ( 4.069 2.939 3.186) 5.945 5.259 ( -2.608 -3.044 0.630) 4.057 5.361 ( 1.121 1.960 -1.995) 3.013 5.449 ( 0.809 -0.545 2.106) 2.321 5.464 ( -1.857 -0.545 -0.062) 1.936 5.608 ( 5.938 -4.220 -0.858) 7.335 5.844 ( -5.555 7.604 -3.185) 9.941 6.036 ( 0.215 -8.648 -5.270) 10.130 6.294 ( -0.537 7.167 -1.043) 7.262 6.456 ( 6.080 -9.064 -1.185) 10.979 7.278 ( -2.508 1.069 0.980) 2.897 7.306 ( -3.092 -2.316 2.534) 4.620 7.644 ( -8.660 5.431 -2.221) 10.460 7.770 ( -6.299 -7.202 -3.204) 10.090 8.433 ( 1.885 12.931 -0.276) 13.071 8.605 ( 3.081 -4.190 -2.327) 5.697 9.249 ( -0.004 2.546 2.670) 3.689 9.284 ( 0.071 -1.061 3.045) 3.226 9.771 ( -1.667 2.449 1.951) 3.547 9.844 ( -0.923 -5.403 4.969) 7.398 10.546 ( 6.681 8.234 0.207) 10.605 10.697 ( 6.697 -5.953 -1.297) 9.054 10.907 ( 0.586 8.532 -3.365) 9.190 11.110 ( 2.403 -8.293 -5.818) 10.412 11.215 ( 2.072 5.971 0.418) 6.334 11.377 ( 4.033 -8.407 0.261) 9.328 12.190 ( -8.976 10.879 2.861) 14.391 12.374 ( -9.044 -7.998 2.587) 12.347 12.910 ( -4.884 2.901 -1.815) 5.964 12.971 ( -3.256 -3.900 -1.306) 5.245 16.633 ( -8.442 -2.228 0.214) 8.733 16.651 ( -11.557 -4.156 0.349) 12.287 17.293 ( -0.912 4.107 -8.177) 9.196 17.397 ( -2.877 -6.873 -8.056) 10.973 18.036 ( -0.744 2.043 4.733) 5.209 18.074 ( -0.766 -1.983 5.787) 6.165 18.615 ( 9.027 4.873 -0.178) 10.260 18.663 ( 6.934 0.024 0.307) 6.941 21.269 ( 0.222 3.842 -1.251) 4.046 21.347 ( -0.320 -3.892 -1.331) 4.126 21.718 ( 3.382 10.128 2.909) 11.067 21.890 ( 3.548 -7.532 1.663) 8.491 ======================= Grid point 198 (86/170) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.231 ( -0.550 0.000 28.026) 28.032 1.320 ( 2.649 0.000 29.532) 29.650 2.202 ( -1.818 0.000 -18.550) 18.639 2.310 ( -2.500 0.000 -18.327) 18.497 2.470 ( -1.681 0.000 51.827) 51.855 3.082 ( 1.217 0.000 2.379) 2.672 3.200 ( -2.779 0.000 0.339) 2.799 3.209 ( 6.931 0.000 4.604) 8.321 3.331 ( -0.332 0.000 -1.801) 1.831 3.515 ( -0.487 0.000 1.638) 1.709 3.660 ( -0.005 0.000 -3.544) 3.544 3.683 ( 0.799 0.000 -1.096) 1.357 3.835 ( -4.394 0.000 -8.966) 9.985 4.066 ( 1.135 0.000 -15.361) 15.403 4.131 ( 3.727 0.000 -3.476) 5.097 4.257 ( -1.167 0.000 -3.191) 3.398 4.365 ( 8.169 0.000 13.401) 15.695 4.505 ( -3.304 0.000 4.617) 5.678 4.621 ( 1.155 0.000 8.638) 8.714 4.926 ( -6.616 0.000 -7.550) 10.038 4.940 ( 1.448 0.000 13.476) 13.553 5.551 ( -0.384 0.000 -12.784) 12.790 5.569 ( -10.778 0.000 11.668) 15.884 5.880 ( 15.118 0.000 1.605) 15.203 5.997 ( -0.319 0.000 5.666) 5.675 6.241 ( 6.617 0.000 0.704) 6.654 6.275 ( -1.042 0.000 -6.305) 6.390 6.643 ( -12.806 0.000 -17.631) 21.791 7.357 ( 0.032 0.000 0.495) 0.496 7.362 ( 0.955 0.000 -1.518) 1.794 7.534 ( -8.708 0.000 6.641) 10.951 7.789 ( 9.653 0.000 -4.826) 10.792 7.846 ( 8.798 0.000 2.118) 9.049 8.021 ( -7.109 0.000 -3.923) 8.120 9.042 ( 0.533 0.000 6.736) 6.757 9.371 ( -4.263 0.000 -7.715) 8.814 9.638 ( -1.760 0.000 1.026) 2.037 9.681 ( 2.937 0.000 -0.698) 3.019 10.323 ( 3.309 0.000 1.865) 3.798 10.475 ( -0.777 0.000 -4.419) 4.487 11.006 ( 0.011 0.000 6.977) 6.977 11.259 ( 2.046 0.000 -4.405) 4.857 11.466 ( -2.808 0.000 6.599) 7.172 11.716 ( -1.157 0.000 -4.625) 4.768 11.945 ( 0.509 0.000 10.999) 11.011 12.418 ( 0.467 0.000 -10.354) 10.365 12.885 ( -0.182 0.000 4.461) 4.465 13.105 ( -0.754 0.000 -5.028) 5.085 17.223 ( 5.033 0.000 1.146) 5.162 17.284 ( -0.814 0.000 -0.410) 0.911 17.352 ( 4.776 0.000 0.516) 4.804 17.554 ( -7.183 0.000 -11.138) 13.253 17.891 ( -2.233 0.000 0.972) 2.435 17.930 ( 2.046 0.000 -0.815) 2.202 18.247 ( 2.077 0.000 1.499) 2.562 18.304 ( -3.434 0.000 -0.949) 3.563 21.036 ( 2.645 0.000 3.296) 4.226 21.078 ( -2.085 0.000 -1.716) 2.700 21.771 ( 0.486 0.000 7.256) 7.273 22.037 ( -0.580 0.000 -2.790) 2.850 ======================= Grid point 199 (87/170) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 9.452 0.000 23.258) 25.105 1.738 ( 10.453 0.000 25.230) 27.309 2.001 ( 3.720 0.000 -19.602) 19.952 2.106 ( 4.004 0.000 -19.689) 20.092 2.950 ( 0.517 0.000 26.317) 26.322 3.105 ( -3.431 0.000 1.526) 3.755 3.158 ( -1.092 0.000 0.503) 1.202 3.235 ( -7.074 0.000 0.604) 7.100 3.462 ( 12.012 0.000 16.342) 20.282 3.562 ( 3.118 0.000 1.640) 3.523 3.566 ( -2.657 0.000 -8.804) 9.196 3.718 ( 3.731 0.000 4.627) 5.944 3.739 ( 5.023 0.000 -9.234) 10.512 3.919 ( 10.134 0.000 -23.076) 25.203 4.049 ( -18.596 0.000 -6.947) 19.852 4.113 ( -6.209 0.000 3.627) 7.190 4.449 ( -3.978 0.000 0.341) 3.992 4.640 ( 8.169 0.000 4.429) 9.292 4.774 ( 5.402 0.000 8.411) 9.997 4.837 ( 2.742 0.000 -2.613) 3.788 5.094 ( -3.177 0.000 14.279) 14.628 5.340 ( -4.537 0.000 -15.072) 15.740 5.489 ( -8.456 0.000 8.196) 11.776 6.025 ( -9.528 0.000 4.592) 10.577 6.059 ( -1.751 0.000 6.427) 6.662 6.161 ( -1.868 0.000 -6.560) 6.821 6.363 ( 9.460 0.000 -21.954) 23.905 6.464 ( 12.245 0.000 10.113) 15.882 7.326 ( -2.903 0.000 -1.001) 3.071 7.350 ( -1.178 0.000 -0.870) 1.465 7.450 ( -9.706 0.000 5.538) 11.174 7.781 ( -9.594 0.000 -3.722) 10.291 7.949 ( 11.363 0.000 -7.999) 13.896 8.039 ( 9.540 0.000 4.520) 10.557 9.190 ( 6.673 0.000 8.476) 10.787 9.262 ( 1.325 0.000 -5.998) 6.142 9.619 ( -1.626 0.000 0.967) 1.892 9.720 ( 3.253 0.000 -1.613) 3.631 10.365 ( -1.165 0.000 3.351) 3.547 10.391 ( -2.174 0.000 -5.293) 5.722 11.031 ( -5.601 0.000 5.776) 8.046 11.148 ( -7.122 0.000 -5.913) 9.256 11.497 ( -4.805 0.000 6.969) 8.465 11.632 ( -3.022 0.000 -3.974) 4.992 12.119 ( 5.756 0.000 11.103) 12.506 12.354 ( 6.656 0.000 -11.516) 13.301 13.010 ( 7.695 0.000 3.634) 8.510 13.072 ( 3.683 0.000 -4.181) 5.572 17.130 ( -14.718 0.000 -2.697) 14.963 17.139 ( -14.117 0.000 1.312) 14.178 17.225 ( -17.858 0.000 -8.886) 19.946 17.309 ( -12.703 0.000 4.550) 13.493 17.980 ( 10.103 0.000 0.673) 10.125 18.049 ( 12.035 0.000 -0.601) 12.050 18.349 ( 9.479 0.000 -2.150) 9.720 18.369 ( 8.269 0.000 3.791) 9.096 21.063 ( 2.257 0.000 -0.904) 2.432 21.128 ( 5.797 0.000 -0.032) 5.798 21.869 ( 0.771 0.000 8.510) 8.545 21.983 ( -0.456 0.000 -5.415) 5.434 ======================= Grid point 200 (88/170) ======================= q-point: ( 0.18 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( 7.444 0.000 -15.131) 16.863 1.883 ( 8.096 0.000 -7.230) 10.854 2.102 ( 10.206 0.000 5.865) 11.771 2.191 ( 13.132 0.000 19.179) 23.243 2.965 ( -11.285 0.000 1.655) 11.406 3.042 ( -7.154 0.000 4.479) 8.440 3.132 ( -0.009 0.000 -3.571) 3.571 3.247 ( 2.465 0.000 2.912) 3.815 3.395 ( -3.379 0.000 -12.227) 12.685 3.515 ( -12.942 0.000 -7.295) 14.856 3.715 ( -7.214 0.000 5.468) 9.053 3.732 ( 2.290 0.000 -6.342) 6.742 3.850 ( 8.468 0.000 10.940) 13.835 3.881 ( 16.757 0.000 -23.116) 28.551 4.047 ( 20.331 0.000 18.320) 27.368 4.056 ( -3.627 0.000 2.534) 4.424 4.374 ( -2.891 0.000 -3.019) 4.180 4.714 ( 4.230 0.000 -10.320) 11.153 4.774 ( -10.258 0.000 2.453) 10.547 4.918 ( 7.417 0.000 0.401) 7.428 5.131 ( -2.402 0.000 -10.919) 11.180 5.228 ( -0.149 0.000 16.580) 16.580 5.570 ( 3.838 0.000 9.358) 10.115 5.775 ( -12.526 0.000 -8.242) 14.995 6.072 ( -4.325 0.000 4.431) 6.192 6.072 ( -3.955 0.000 -2.571) 4.717 6.358 ( 7.268 0.000 -11.547) 13.644 6.739 ( 2.714 0.000 12.947) 13.228 7.264 ( -3.836 0.000 0.168) 3.839 7.286 ( -5.408 0.000 -2.476) 5.948 7.380 ( -6.949 0.000 7.089) 9.927 7.581 ( -8.630 0.000 -2.291) 8.929 8.059 ( 13.373 0.000 -9.146) 16.201 8.224 ( 9.116 0.000 2.459) 9.442 9.289 ( 8.149 0.000 -3.105) 8.721 9.352 ( 1.218 0.000 3.411) 3.622 9.662 ( 5.777 0.000 5.302) 7.841 9.744 ( 2.746 0.000 -2.641) 3.810 10.336 ( 2.887 0.000 -3.644) 4.650 10.375 ( -1.947 0.000 3.542) 4.042 10.939 ( -10.332 0.000 -6.485) 12.199 10.967 ( -8.389 0.000 2.959) 8.896 11.453 ( -8.760 0.000 5.534) 10.362 11.526 ( -5.291 0.000 -3.377) 6.277 12.358 ( 9.061 0.000 -11.313) 14.494 12.360 ( 8.974 0.000 10.903) 14.121 13.139 ( 7.354 0.000 0.050) 7.355 13.156 ( 6.159 0.000 1.957) 6.462 16.816 ( -15.534 0.000 -5.729) 16.557 16.889 ( -18.006 0.000 -1.082) 18.039 16.896 ( -17.199 0.000 1.175) 17.239 17.125 ( -18.026 0.000 8.625) 19.983 18.158 ( 10.940 0.000 0.034) 10.940 18.243 ( 12.434 0.000 -0.478) 12.443 18.476 ( 9.117 0.000 -3.399) 9.730 18.539 ( 7.197 0.000 2.926) 7.769 21.130 ( 6.207 0.000 0.721) 6.249 21.199 ( 4.534 0.000 -1.907) 4.919 21.907 ( 0.057 0.000 -7.432) 7.432 21.970 ( 0.820 0.000 6.655) 6.705 ======================= Grid point 201 (89/170) ======================= q-point: ( 0.27 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( 12.791 0.000 -13.820) 18.831 1.911 ( 14.244 0.000 -9.464) 17.102 2.335 ( 1.413 0.000 11.155) 11.244 2.517 ( 4.196 0.000 10.103) 10.940 2.855 ( -11.707 0.000 -3.608) 12.251 2.908 ( -3.053 0.000 12.389) 12.760 3.123 ( -2.044 0.000 2.331) 3.100 3.146 ( -5.110 0.000 -13.002) 13.970 3.214 ( -7.728 0.000 -8.570) 11.540 3.353 ( -1.849 0.000 3.358) 3.834 3.599 ( -10.915 0.000 -2.021) 11.101 3.760 ( -0.887 0.000 7.919) 7.969 3.920 ( 17.203 0.000 -18.665) 25.383 4.091 ( 7.320 0.000 1.453) 7.462 4.128 ( 17.955 0.000 -8.645) 19.928 4.199 ( -1.648 0.000 -1.523) 2.244 4.533 ( -1.810 0.000 -13.989) 14.105 4.635 ( 20.320 0.000 11.791) 23.493 4.721 ( -2.044 0.000 -1.087) 2.315 5.015 ( 7.546 0.000 -6.843) 10.187 5.062 ( 3.191 0.000 -1.732) 3.631 5.372 ( -3.542 0.000 13.299) 13.762 5.548 ( -4.979 0.000 -4.477) 6.696 5.726 ( 1.435 0.000 8.609) 8.728 5.984 ( -5.491 0.000 -0.361) 5.502 6.029 ( -3.403 0.000 0.006) 3.403 6.275 ( -4.555 0.000 -6.998) 8.350 6.756 ( -13.529 0.000 6.209) 14.885 7.141 ( -7.386 0.000 -2.508) 7.800 7.224 ( -3.432 0.000 3.177) 4.677 7.402 ( -3.162 0.000 9.696) 10.199 7.490 ( -3.307 0.000 1.543) 3.649 8.157 ( 12.585 0.000 -10.371) 16.308 8.380 ( 8.530 0.000 0.224) 8.533 9.321 ( -3.201 0.000 -0.746) 3.287 9.431 ( 12.017 0.000 -0.848) 12.046 9.750 ( 2.635 0.000 -3.633) 4.488 9.881 ( 10.708 0.000 6.368) 12.458 10.389 ( -0.509 0.000 2.579) 2.628 10.408 ( 8.283 0.000 -1.406) 8.401 10.692 ( -11.639 0.000 -6.428) 13.297 10.839 ( -10.348 0.000 0.656) 10.369 11.374 ( -8.594 0.000 5.677) 10.300 11.401 ( -5.772 0.000 -2.889) 6.455 12.384 ( 9.068 0.000 -9.061) 12.820 12.620 ( 8.439 0.000 10.383) 13.380 13.234 ( 2.323 0.000 -0.223) 2.334 13.270 ( 5.821 0.000 3.073) 6.582 16.585 ( -12.842 0.000 0.502) 12.851 16.643 ( -10.920 0.000 3.057) 11.340 16.649 ( -15.110 0.000 0.748) 15.128 16.964 ( -16.813 0.000 12.407) 20.896 18.302 ( 7.913 0.000 -1.504) 8.055 18.413 ( 9.634 0.000 -0.518) 9.648 18.549 ( 6.273 0.000 -4.826) 7.915 18.620 ( 2.809 0.000 -3.576) 4.547 21.245 ( 3.785 0.000 -0.442) 3.811 21.263 ( 7.467 0.000 3.196) 8.122 21.827 ( 1.065 0.000 -8.508) 8.575 22.025 ( -0.443 0.000 2.482) 2.521 ======================= Grid point 202 (90/170) ======================= q-point: ( 0.36 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( 14.435 0.000 -7.491) 16.263 2.096 ( 18.093 0.000 -4.861) 18.734 2.283 ( -14.982 0.000 4.180) 15.554 2.578 ( -3.866 0.000 6.710) 7.744 2.798 ( 5.836 0.000 0.008) 5.836 2.839 ( -11.048 0.000 -8.682) 14.051 3.044 ( -4.869 0.000 -1.082) 4.988 3.140 ( -6.342 0.000 3.015) 7.023 3.151 ( 0.716 0.000 0.749) 1.036 3.209 ( -3.530 0.000 7.993) 8.738 3.510 ( -3.019 0.000 0.954) 3.166 3.801 ( -4.975 0.000 2.896) 5.756 3.966 ( -2.172 0.000 -9.603) 9.845 3.983 ( 12.496 0.000 -14.797) 19.367 4.368 ( 9.646 0.000 3.693) 10.329 4.378 ( 12.806 0.000 -10.420) 16.510 4.446 ( 21.667 0.000 -10.052) 23.885 4.685 ( 1.165 0.000 -2.518) 2.774 4.925 ( 6.555 0.000 0.791) 6.602 4.991 ( 4.085 0.000 -10.552) 11.315 5.166 ( 4.364 0.000 5.156) 6.755 5.407 ( -7.672 0.000 9.376) 12.115 5.582 ( 11.135 0.000 1.229) 11.203 5.761 ( -5.812 0.000 4.320) 7.242 5.846 ( -14.425 0.000 -0.207) 14.427 5.998 ( 0.760 0.000 -1.831) 1.982 6.119 ( -5.583 0.000 -1.981) 5.924 6.515 ( -19.584 0.000 0.081) 19.584 7.061 ( -1.575 0.000 2.548) 2.996 7.221 ( -2.863 0.000 4.847) 5.629 7.453 ( -4.633 0.000 10.147) 11.154 7.486 ( -0.900 0.000 3.377) 3.495 8.223 ( 10.690 0.000 -10.867) 15.243 8.467 ( 3.570 0.000 -3.105) 4.731 9.297 ( 0.361 0.000 1.103) 1.160 9.604 ( 7.761 0.000 -0.180) 7.763 9.769 ( 6.806 0.000 -3.513) 7.659 10.102 ( 10.924 0.000 2.357) 11.175 10.409 ( -10.469 0.000 -3.655) 11.089 10.413 ( 0.762 0.000 1.083) 1.324 10.545 ( 5.555 0.000 -3.676) 6.661 10.665 ( -11.520 0.000 -0.277) 11.523 11.299 ( -3.124 0.000 -2.192) 3.817 11.304 ( -8.806 0.000 5.637) 10.456 12.466 ( 10.784 0.000 -3.660) 11.388 12.830 ( 3.386 0.000 9.356) 9.950 13.233 ( 0.326 0.000 -2.533) 2.554 13.360 ( 1.434 0.000 2.369) 2.769 16.394 ( -10.056 0.000 0.196) 10.058 16.451 ( -10.456 0.000 0.297) 10.460 16.648 ( -2.773 0.000 13.721) 13.999 16.875 ( -13.853 0.000 15.102) 20.494 18.362 ( 4.514 0.000 -5.580) 7.177 18.519 ( 3.897 0.000 -4.629) 6.051 18.561 ( 1.840 0.000 -7.707) 7.924 18.582 ( 4.436 0.000 -3.955) 5.943 21.321 ( 4.360 0.000 2.510) 5.031 21.416 ( 5.016 0.000 5.509) 7.451 21.764 ( 3.431 0.000 -8.465) 9.134 22.007 ( -2.668 0.000 -1.247) 2.944 ======================= Grid point 203 (91/170) ======================= q-point: ( 0.45 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( -7.641 0.000 4.728) 8.985 2.203 ( 10.146 0.000 -1.703) 10.288 2.325 ( 13.586 0.000 -2.059) 13.741 2.562 ( -5.828 0.000 -10.147) 11.701 2.608 ( -6.536 0.000 8.029) 10.352 2.898 ( 4.474 0.000 0.537) 4.506 2.900 ( -12.832 0.000 0.443) 12.840 3.003 ( 3.771 0.000 -4.860) 6.151 3.202 ( 0.276 0.000 7.282) 7.288 3.385 ( 0.725 0.000 1.205) 1.406 3.465 ( 0.895 0.000 2.745) 2.887 3.610 ( -7.421 0.000 -11.513) 13.698 3.955 ( 3.946 0.000 -1.538) 4.235 3.962 ( 5.122 0.000 -12.325) 13.347 4.390 ( 1.052 0.000 -1.101) 1.522 4.482 ( 3.857 0.000 -3.881) 5.472 4.678 ( 8.670 0.000 -3.174) 9.233 4.863 ( -14.093 0.000 0.010) 14.093 4.902 ( 33.072 0.000 -5.994) 33.611 4.996 ( 5.308 0.000 0.672) 5.350 5.300 ( 6.019 0.000 1.818) 6.287 5.347 ( -10.489 0.000 6.079) 12.123 5.500 ( -22.057 0.000 -1.345) 22.098 5.683 ( -4.106 0.000 -2.929) 5.044 5.829 ( 14.262 0.000 -0.670) 14.278 5.985 ( -2.709 0.000 1.633) 3.163 6.100 ( 3.044 0.000 1.521) 3.403 6.192 ( -18.045 0.000 -3.111) 18.311 7.147 ( 5.472 0.000 5.374) 7.669 7.228 ( -2.804 0.000 3.916) 4.816 7.482 ( -6.188 0.000 10.657) 12.324 7.538 ( 1.212 0.000 6.124) 6.243 8.253 ( 8.168 0.000 -10.407) 13.230 8.412 ( -2.546 0.000 -7.866) 8.268 9.348 ( 2.471 0.000 3.292) 4.116 9.619 ( -0.903 0.000 -3.727) 3.835 9.911 ( 10.353 0.000 0.340) 10.359 10.143 ( -8.233 0.000 -4.287) 9.282 10.335 ( 7.065 0.000 1.988) 7.339 10.431 ( 1.583 0.000 -1.221) 1.999 10.489 ( -10.846 0.000 1.210) 10.914 10.583 ( 4.391 0.000 -4.791) 6.498 11.215 ( -8.937 0.000 4.318) 9.925 11.266 ( 1.667 0.000 -1.417) 2.188 12.637 ( 11.764 0.000 1.725) 11.890 12.882 ( -7.540 0.000 4.490) 8.776 13.238 ( 3.905 0.000 -0.800) 3.986 13.366 ( -2.369 0.000 0.312) 2.389 16.294 ( -3.044 0.000 0.615) 3.105 16.335 ( -4.231 0.000 -0.122) 4.232 16.814 ( 1.086 0.000 17.732) 17.765 16.861 ( -9.761 0.000 16.055) 18.789 18.330 ( 2.850 0.000 -9.827) 10.232 18.379 ( -0.621 0.000 -15.156) 15.169 18.595 ( 2.103 0.000 -0.529) 2.168 18.601 ( 1.669 0.000 -1.819) 2.469 21.425 ( 4.247 0.000 3.364) 5.418 21.506 ( -1.017 0.000 4.068) 4.193 21.773 ( 7.538 0.000 -4.981) 9.035 21.917 ( -5.669 0.000 -3.129) 6.476 ======================= Grid point 204 (92/170) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( -12.868 0.000 5.439) 13.970 2.263 ( -13.232 0.000 -6.948) 14.945 2.364 ( 9.504 0.000 -0.130) 9.505 2.468 ( 2.250 0.000 -4.597) 5.118 2.619 ( -3.253 0.000 8.455) 9.060 2.868 ( 5.181 0.000 2.377) 5.701 2.983 ( 6.418 0.000 3.710) 7.414 3.028 ( 7.872 0.000 -9.523) 12.355 3.288 ( -0.108 0.000 4.223) 4.225 3.308 ( -0.369 0.000 -4.619) 4.634 3.435 ( 0.203 0.000 -5.500) 5.504 3.544 ( 4.148 0.000 -4.098) 5.831 3.919 ( 1.328 0.000 -3.308) 3.564 3.971 ( 0.868 0.000 -5.772) 5.837 4.367 ( -3.383 0.000 1.455) 3.683 4.432 ( -3.378 0.000 -4.166) 5.363 4.563 ( -22.885 0.000 1.959) 22.969 4.806 ( 7.692 0.000 0.350) 7.700 4.916 ( -22.003 0.000 -5.189) 22.607 5.210 ( -9.101 0.000 3.168) 9.637 5.261 ( 4.678 0.000 11.696) 12.597 5.309 ( 14.384 0.000 -4.133) 14.966 5.524 ( 11.596 0.000 -0.362) 11.602 5.616 ( 6.345 0.000 -6.215) 8.882 5.857 ( -14.769 0.000 -0.022) 14.769 5.958 ( 1.621 0.000 1.976) 2.556 6.012 ( -1.165 0.000 0.895) 1.469 6.249 ( 15.505 0.000 -2.831) 15.762 7.212 ( -3.174 0.000 1.634) 3.570 7.285 ( 5.571 0.000 1.651) 5.810 7.493 ( -6.734 0.000 9.692) 11.802 7.672 ( 4.911 0.000 8.843) 10.115 8.239 ( -5.777 0.000 -9.960) 11.514 8.256 ( 5.372 0.000 -7.969) 9.611 9.432 ( 2.275 0.000 4.426) 4.977 9.534 ( -3.358 0.000 -4.851) 5.900 9.948 ( -12.284 0.000 -0.923) 12.319 10.033 ( 2.694 0.000 1.692) 3.181 10.369 ( -7.557 0.000 3.520) 8.337 10.436 ( 5.006 0.000 -4.685) 6.856 10.445 ( 3.687 0.000 -3.198) 4.881 10.616 ( 6.126 0.000 -1.404) 6.285 11.149 ( -4.479 0.000 4.007) 6.010 11.318 ( 5.999 0.000 -0.671) 6.036 12.724 ( -13.539 0.000 -0.621) 13.553 12.849 ( 10.232 0.000 4.408) 11.141 13.297 ( -5.356 0.000 -1.767) 5.640 13.314 ( 3.734 0.000 1.929) 4.203 16.312 ( 4.315 0.000 0.812) 4.391 16.319 ( 2.698 0.000 -0.424) 2.731 16.921 ( -4.404 0.000 15.036) 15.668 17.058 ( 6.396 0.000 15.426) 16.699 18.210 ( -0.983 0.000 -12.700) 12.738 18.249 ( 1.690 0.000 -10.999) 11.128 18.586 ( -1.948 0.000 -0.702) 2.070 18.593 ( -1.683 0.000 -0.381) 1.725 21.488 ( -3.604 0.000 0.489) 3.637 21.516 ( 3.313 0.000 2.048) 3.895 21.763 ( -9.229 0.000 -3.365) 9.824 21.866 ( 7.021 0.000 -0.583) 7.045 ======================= Grid point 205 (93/170) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( -23.660 0.000 3.604) 23.933 1.919 ( -21.175 0.000 -4.993) 21.756 2.497 ( 5.839 0.000 2.454) 6.333 2.500 ( 8.625 0.000 -1.863) 8.824 2.679 ( 0.053 0.000 5.285) 5.285 2.945 ( 1.192 0.000 -0.373) 1.249 3.001 ( 0.799 0.000 -9.399) 9.433 3.184 ( 11.289 0.000 -0.513) 11.301 3.314 ( 4.388 0.000 4.134) 6.029 3.363 ( 8.665 0.000 1.482) 8.791 3.457 ( -2.651 0.000 3.147) 4.115 3.504 ( 2.910 0.000 -9.387) 9.828 3.784 ( -13.479 0.000 -7.687) 15.517 3.934 ( 1.476 0.000 1.124) 1.855 4.226 ( -18.247 0.000 -1.633) 18.320 4.272 ( -13.761 0.000 0.148) 13.762 4.337 ( -3.686 0.000 3.479) 5.068 4.665 ( -0.947 0.000 -0.938) 1.333 4.840 ( -4.815 0.000 -0.653) 4.859 5.060 ( -10.976 0.000 -0.827) 11.007 5.304 ( -3.042 0.000 -3.594) 4.709 5.525 ( 9.428 0.000 10.963) 14.459 5.528 ( -12.739 0.000 -0.086) 12.739 5.700 ( 12.301 0.000 -1.187) 12.358 5.923 ( 17.983 0.000 -3.009) 18.233 5.968 ( -2.420 0.000 2.267) 3.316 6.036 ( 1.639 0.000 2.613) 3.085 6.475 ( 17.022 0.000 -3.257) 17.331 7.170 ( -2.203 0.000 -0.762) 2.331 7.352 ( 3.249 0.000 -1.271) 3.488 7.484 ( -5.912 0.000 7.048) 9.200 7.833 ( 5.873 0.000 2.105) 6.239 8.049 ( -5.782 0.000 -6.884) 8.990 8.257 ( 1.498 0.000 -1.398) 2.049 9.426 ( -3.163 0.000 -4.283) 5.324 9.497 ( -0.925 0.000 3.945) 4.052 9.731 ( -13.683 0.000 -0.384) 13.689 10.032 ( -4.663 0.000 2.123) 5.124 10.319 ( -6.186 0.000 6.031) 8.639 10.431 ( 2.306 0.000 -3.409) 4.116 10.487 ( 7.451 0.000 -4.933) 8.936 10.729 ( 9.012 0.000 -1.209) 9.092 11.173 ( 1.773 0.000 3.906) 4.290 11.424 ( 7.612 0.000 -0.200) 7.614 12.476 ( -15.323 0.000 -2.281) 15.492 13.037 ( 5.968 0.000 5.551) 8.150 13.164 ( -6.643 0.000 -4.467) 8.005 13.379 ( 1.593 0.000 1.934) 2.505 16.410 ( 9.453 0.000 -0.449) 9.464 16.441 ( 10.690 0.000 0.674) 10.712 17.041 ( 1.365 0.000 9.799) 9.894 17.340 ( 13.060 0.000 6.880) 14.762 18.080 ( -2.550 0.000 -5.178) 5.772 18.155 ( -0.166 0.000 -7.010) 7.012 18.521 ( -5.753 0.000 -0.221) 5.757 18.535 ( -5.279 0.000 -0.173) 5.282 21.420 ( -4.394 0.000 -1.164) 4.546 21.555 ( -11.926 0.000 -1.303) 11.997 21.576 ( 1.559 0.000 -0.479) 1.631 21.958 ( 4.430 0.000 0.529) 4.461 ======================= Grid point 206 (94/170) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( -27.840 0.000 9.856) 29.534 1.515 ( -26.198 0.000 0.803) 26.210 2.526 ( -16.360 0.000 7.361) 17.940 2.706 ( 16.997 0.000 1.544) 17.067 2.713 ( 1.400 0.000 -2.381) 2.762 2.850 ( -7.516 0.000 0.190) 7.519 2.944 ( -0.353 0.000 1.450) 1.492 3.205 ( -11.805 0.000 -2.952) 12.169 3.296 ( -3.025 0.000 -0.343) 3.044 3.392 ( 2.604 0.000 -7.799) 8.222 3.519 ( 7.996 0.000 3.973) 8.929 3.605 ( 0.275 0.000 -9.119) 9.124 3.632 ( 9.902 0.000 8.934) 13.337 3.971 ( 2.935 0.000 -1.134) 3.147 4.012 ( -9.841 0.000 7.001) 12.077 4.159 ( 2.418 0.000 -2.607) 3.556 4.321 ( -3.471 0.000 2.880) 4.510 4.683 ( -10.735 0.000 -2.192) 10.956 4.725 ( 6.848 0.000 -1.243) 6.960 4.860 ( -10.854 0.000 -2.546) 11.148 5.098 ( -18.690 0.000 -0.522) 18.698 5.463 ( 1.254 0.000 0.938) 1.566 5.720 ( 6.067 0.000 1.321) 6.209 5.920 ( 15.292 0.000 1.330) 15.350 5.935 ( -4.606 0.000 1.181) 4.755 6.019 ( -1.051 0.000 1.901) 2.172 6.177 ( 10.255 0.000 -1.717) 10.398 6.718 ( 15.380 0.000 1.720) 15.476 7.149 ( 1.613 0.000 -1.420) 2.149 7.371 ( 2.065 0.000 -2.531) 3.267 7.477 ( -3.445 0.000 5.705) 6.665 7.875 ( 4.307 0.000 -8.326) 9.374 7.914 ( -4.690 0.000 -3.119) 5.633 8.254 ( -4.997 0.000 4.039) 6.425 9.365 ( 0.687 0.000 -2.529) 2.621 9.392 ( -15.327 0.000 0.936) 15.356 9.619 ( -1.465 0.000 2.258) 2.692 9.954 ( -7.075 0.000 0.981) 7.143 10.288 ( -7.033 0.000 6.475) 9.560 10.450 ( 3.318 0.000 -1.779) 3.765 10.573 ( 9.116 0.000 -2.835) 9.546 10.867 ( 10.056 0.000 -0.798) 10.088 11.273 ( 5.079 0.000 3.458) 6.145 11.535 ( 6.700 0.000 -0.716) 6.739 12.215 ( -14.535 0.000 -1.292) 14.592 12.972 ( -10.103 0.000 -3.887) 10.825 13.172 ( 4.148 0.000 1.808) 4.525 13.399 ( -0.438 0.000 -0.688) 0.815 16.601 ( 14.887 0.000 -0.234) 14.888 16.653 ( 15.219 0.000 0.379) 15.224 17.125 ( 4.205 0.000 -5.675) 7.063 17.576 ( 16.707 0.000 -8.910) 18.934 18.038 ( -3.454 0.000 7.128) 7.920 18.135 ( -0.903 0.000 7.399) 7.454 18.401 ( -9.307 0.000 0.071) 9.307 18.428 ( -8.236 0.000 0.463) 8.249 21.323 ( -14.702 0.000 -0.223) 14.703 21.328 ( -4.603 0.000 -2.323) 5.156 21.610 ( 1.734 0.000 0.408) 1.781 22.015 ( 2.128 0.000 0.586) 2.208 ======================= Grid point 207 (95/170) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.155 ( -23.479 0.000 19.660) 30.624 1.165 ( -25.508 0.000 12.785) 28.533 2.160 ( -43.076 0.000 28.052) 51.405 2.642 ( -3.239 0.000 -8.236) 8.850 2.820 ( -5.009 0.000 -4.367) 6.646 2.964 ( 4.795 0.000 1.229) 4.950 2.987 ( -3.148 0.000 -0.937) 3.285 3.047 ( 16.041 0.000 4.122) 16.562 3.301 ( -0.144 0.000 -2.293) 2.298 3.399 ( 7.831 0.000 -3.896) 8.746 3.533 ( -1.759 0.000 3.398) 3.826 3.640 ( 6.133 0.000 -2.798) 6.741 3.875 ( 4.706 0.000 11.232) 12.178 4.000 ( 4.194 0.000 -3.070) 5.198 4.044 ( 1.462 0.000 12.573) 12.658 4.250 ( 8.945 0.000 -4.203) 9.883 4.260 ( -3.535 0.000 -4.668) 5.856 4.535 ( -8.202 0.000 4.881) 9.545 4.649 ( -14.086 0.000 -3.558) 14.528 4.836 ( -11.961 0.000 3.053) 12.345 4.840 ( 10.387 0.000 -0.768) 10.415 5.496 ( 0.119 0.000 2.696) 2.699 5.742 ( -0.713 0.000 -7.712) 7.745 5.850 ( -3.470 0.000 -2.137) 4.075 6.007 ( -2.906 0.000 2.110) 3.592 6.161 ( 12.991 0.000 0.121) 12.992 6.247 ( 1.245 0.000 -1.383) 1.860 6.982 ( 11.557 0.000 4.059) 12.249 7.197 ( 4.757 0.000 0.916) 4.845 7.367 ( 1.618 0.000 -3.192) 3.579 7.507 ( -1.196 0.000 5.934) 6.053 7.807 ( 2.173 0.000 -12.445) 12.634 7.823 ( -3.177 0.000 -2.473) 4.026 8.187 ( -7.659 0.000 4.046) 8.662 9.166 ( -13.823 0.000 2.155) 13.990 9.392 ( 4.576 0.000 -0.794) 4.644 9.637 ( -0.398 0.000 2.207) 2.243 9.838 ( -7.487 0.000 -1.017) 7.556 10.239 ( -6.034 0.000 4.242) 7.376 10.485 ( 3.658 0.000 -2.309) 4.326 10.713 ( 8.985 0.000 2.194) 9.249 11.025 ( 10.380 0.000 -0.086) 10.381 11.387 ( 4.171 0.000 3.075) 5.182 11.614 ( 5.466 0.000 -1.861) 5.774 12.017 ( -11.310 0.000 2.925) 11.683 12.760 ( -9.043 0.000 -6.461) 11.114 13.215 ( 0.032 0.000 -0.051) 0.060 13.308 ( -7.153 0.000 -7.777) 10.566 16.854 ( 16.798 0.000 -0.745) 16.815 16.913 ( 17.015 0.000 0.111) 17.015 17.051 ( 4.663 0.000 -14.268) 15.011 17.663 ( 12.917 0.000 -15.456) 20.142 18.085 ( -3.983 0.000 6.430) 7.564 18.210 ( -11.199 0.000 2.833) 11.552 18.310 ( -7.788 0.000 3.077) 8.374 18.312 ( -0.081 0.000 13.601) 13.601 21.114 ( -12.666 0.000 2.644) 12.940 21.232 ( -3.813 0.000 -2.729) 4.689 21.645 ( 1.228 0.000 1.956) 2.309 22.044 ( 0.721 0.000 0.855) 1.118 ======================= Grid point 208 (96/170) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.071 ( -12.898 0.000 26.806) 29.748 1.082 ( -16.640 0.000 24.356) 29.498 2.052 ( -23.259 0.000 51.422) 56.438 2.445 ( -5.396 0.000 -13.850) 14.864 2.576 ( -7.522 0.000 -14.652) 16.470 3.030 ( 2.215 0.000 2.064) 3.027 3.055 ( 2.922 0.000 6.930) 7.521 3.258 ( 0.263 0.000 -4.569) 4.576 3.278 ( 9.175 0.000 -1.452) 9.290 3.536 ( -3.465 0.000 2.353) 4.188 3.575 ( 11.976 0.000 2.726) 12.282 3.679 ( 2.997 0.000 -2.765) 4.078 3.978 ( 4.777 0.000 -1.829) 5.115 4.007 ( -1.385 0.000 -5.538) 5.708 4.207 ( -0.580 0.000 7.024) 7.048 4.268 ( 1.289 0.000 1.418) 1.917 4.338 ( -9.947 0.000 -12.497) 15.972 4.349 ( 11.269 0.000 8.856) 14.333 4.542 ( -5.235 0.000 11.323) 12.475 4.808 ( -2.053 0.000 9.424) 9.645 5.019 ( 8.949 0.000 -2.291) 9.237 5.540 ( -1.596 0.000 7.703) 7.866 5.590 ( -1.235 0.000 -6.016) 6.141 5.791 ( 1.536 0.000 -7.101) 7.265 5.984 ( -3.770 0.000 3.771) 5.332 6.218 ( -0.757 0.000 -2.081) 2.215 6.297 ( 6.251 0.000 -3.885) 7.360 7.006 ( -7.920 0.000 -9.864) 12.650 7.300 ( 4.340 0.000 2.975) 5.262 7.361 ( 1.934 0.000 -2.760) 3.370 7.552 ( -3.389 0.000 7.477) 8.209 7.728 ( 5.206 0.000 -8.074) 9.607 7.769 ( 1.381 0.000 -3.014) 3.315 8.131 ( -4.243 0.000 0.633) 4.290 9.033 ( -7.297 0.000 4.512) 8.579 9.459 ( 2.971 0.000 -1.737) 3.442 9.646 ( -1.076 0.000 1.566) 1.900 9.705 ( -5.132 0.000 -3.139) 6.016 10.238 ( 2.318 0.000 2.479) 3.393 10.504 ( 2.306 0.000 -3.255) 3.988 10.883 ( 6.338 0.000 5.473) 8.374 11.180 ( 9.425 0.000 -0.774) 9.457 11.452 ( -0.691 0.000 3.481) 3.549 11.695 ( 7.196 0.000 -1.327) 7.318 11.916 ( -8.957 0.000 6.984) 11.358 12.562 ( -5.255 0.000 -8.530) 10.019 13.014 ( -15.964 0.000 -4.706) 16.643 13.179 ( -2.146 0.000 -2.931) 3.633 17.031 ( 13.673 0.000 -2.620) 13.922 17.166 ( 13.875 0.000 -0.058) 13.875 17.169 ( 16.148 0.000 -0.826) 16.169 17.671 ( 7.065 0.000 -12.290) 14.175 18.003 ( -8.133 0.000 -0.145) 8.135 18.019 ( -12.703 0.000 0.707) 12.723 18.260 ( -4.200 0.000 2.400) 4.837 18.400 ( -5.577 0.000 4.186) 6.974 21.008 ( -5.485 0.000 4.592) 7.153 21.149 ( -3.397 0.000 -2.391) 4.154 21.696 ( 0.764 0.000 4.559) 4.622 22.057 ( 0.083 0.000 -0.038) 0.091 ======================= Grid point 209 (97/170) ======================= q-point: ( 0.00 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( -2.787 14.621 23.477) 27.797 1.521 ( 1.937 16.905 24.978) 30.223 2.251 ( -1.120 4.744 -17.432) 18.101 2.390 ( -1.831 7.164 -15.601) 17.265 2.627 ( -0.344 15.947 43.886) 46.695 3.068 ( 0.261 -2.211 2.669) 3.476 3.093 ( 0.033 -9.060 5.277) 10.485 3.212 ( 3.790 0.606 -1.921) 4.292 3.303 ( 0.458 -3.302 -2.695) 4.287 3.481 ( 0.772 -3.236 0.509) 3.365 3.593 ( -0.923 -7.284 -5.714) 9.304 3.653 ( 0.628 -2.602 -0.346) 2.699 3.839 ( -3.036 0.266 -7.660) 8.244 4.129 ( 1.758 7.426 -9.623) 12.282 4.170 ( 1.615 4.000 0.123) 4.316 4.321 ( -2.888 5.324 -1.799) 6.318 4.418 ( 8.866 4.551 12.122) 15.692 4.515 ( 0.198 1.946 4.853) 5.232 4.661 ( -0.335 5.244 7.581) 9.224 4.916 ( -4.094 0.568 -3.724) 5.564 4.995 ( -0.917 4.061 9.362) 10.246 5.461 ( -4.574 -4.918 -2.156) 7.053 5.666 ( -3.237 6.251 -1.950) 7.304 5.810 ( 9.228 -5.687 -0.410) 10.847 5.942 ( -3.508 -4.041 6.141) 8.146 6.150 ( 2.076 -5.358 -2.924) 6.447 6.335 ( 2.190 1.708 -1.104) 2.988 6.698 ( -6.212 2.556 -14.906) 16.350 7.309 ( 2.668 -2.436 1.415) 3.880 7.422 ( -3.609 1.522 -3.109) 5.001 7.598 ( -7.311 5.677 5.173) 10.603 7.752 ( 10.845 -0.155 1.299) 10.923 7.946 ( 8.621 6.245 -3.242) 11.128 8.030 ( -7.623 2.737 -2.681) 8.532 9.095 ( -0.553 4.697 5.333) 7.128 9.381 ( -3.187 1.033 -6.145) 6.999 9.640 ( 1.528 0.112 1.988) 2.510 9.750 ( -0.907 7.455 -3.736) 8.387 10.344 ( 3.956 2.209 1.952) 4.934 10.511 ( -1.201 3.662 -5.245) 6.508 10.950 ( -0.446 -5.690 7.374) 9.324 11.236 ( 2.225 -2.280 -5.596) 6.440 11.432 ( -3.078 -3.596 6.397) 7.957 11.683 ( -1.114 -3.468 -4.796) 6.022 11.982 ( 0.755 3.579 11.803) 12.357 12.456 ( 0.433 3.691 -9.966) 10.636 12.815 ( 0.497 -5.821 7.523) 9.526 13.091 ( -1.098 -1.992 -6.439) 6.829 17.048 ( 8.089 -12.478 0.825) 14.893 17.152 ( -5.249 -11.958 -1.122) 13.108 17.229 ( -1.829 -11.214 0.863) 11.394 17.430 ( -2.177 -10.382 -11.474) 15.626 18.006 ( 0.076 8.867 2.343) 9.172 18.098 ( 0.972 11.768 -1.742) 11.935 18.338 ( 5.126 8.014 1.148) 9.582 18.381 ( -6.003 7.032 -0.595) 9.265 21.073 ( 2.139 3.405 1.599) 4.327 21.083 ( -0.866 0.829 -1.253) 1.735 21.774 ( 0.442 0.439 7.985) 8.010 22.048 ( -0.475 1.031 -2.617) 2.852 ======================= Grid point 210 (98/170) ======================= q-point: ( 0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( 7.741 8.276 22.608) 25.289 1.862 ( 6.828 10.509 21.756) 25.107 2.073 ( 3.535 6.666 -17.291) 18.865 2.210 ( 3.316 9.754 -18.278) 20.981 3.009 ( 0.791 4.856 17.111) 17.805 3.073 ( -0.468 -4.873 0.160) 4.898 3.095 ( -5.993 -5.168 3.736) 8.751 3.192 ( -4.791 -4.711 -2.282) 7.096 3.433 ( 1.463 -5.955 -2.494) 6.620 3.496 ( 6.511 -1.220 8.061) 10.434 3.553 ( 4.068 -1.558 4.955) 6.598 3.665 ( 3.941 -3.404 -1.028) 5.308 3.772 ( 1.788 3.436 -0.602) 3.920 4.013 ( 7.335 9.409 -19.870) 23.177 4.084 ( -15.863 3.792 -3.314) 16.643 4.190 ( -6.336 7.543 2.457) 10.153 4.515 ( -2.122 5.823 -1.671) 6.419 4.692 ( 8.403 4.584 3.267) 10.114 4.772 ( 4.165 1.104 7.163) 8.360 4.870 ( 4.058 2.874 -0.658) 5.016 5.112 ( -4.455 1.097 13.275) 14.045 5.333 ( -2.561 -0.179 -7.841) 8.250 5.540 ( -6.531 5.290 0.932) 8.457 5.830 ( -7.860 -11.919 1.098) 14.319 6.057 ( 5.589 -1.749 5.041) 7.727 6.142 ( 0.642 -2.866 -3.769) 4.778 6.450 ( 6.829 -2.122 8.106) 10.810 6.463 ( 0.295 5.038 -16.463) 17.219 7.310 ( -5.054 -2.784 -1.967) 6.096 7.371 ( 1.439 0.768 1.279) 2.073 7.517 ( -8.500 7.714 3.827) 12.099 7.833 ( -10.468 5.064 -4.428) 12.443 7.945 ( 12.635 0.526 -3.213) 13.048 8.081 ( 9.516 3.808 0.925) 10.291 9.211 ( 5.302 2.175 7.925) 9.780 9.298 ( 1.490 3.472 -4.958) 6.233 9.664 ( -1.059 4.369 0.357) 4.510 9.729 ( 2.465 1.752 -1.491) 3.372 10.387 ( -1.997 2.423 0.890) 3.264 10.420 ( -1.525 2.925 -3.199) 4.595 10.981 ( -5.069 -5.136 6.286) 9.570 11.115 ( -7.027 -3.231 -6.763) 10.274 11.462 ( -4.492 -3.512 7.181) 9.169 11.601 ( -2.663 -3.400 -4.260) 6.066 12.165 ( 5.805 4.450 11.173) 13.354 12.395 ( 6.660 4.008 -11.221) 13.650 12.964 ( 7.317 -4.472 5.245) 10.052 13.037 ( 3.138 -3.394 -5.309) 7.040 16.890 ( -14.856 -12.177 -2.319) 19.348 17.021 ( -16.442 -11.554 -1.026) 20.122 17.252 ( 3.689 -4.944 0.578) 6.196 17.385 ( -2.539 0.734 -2.511) 3.646 17.913 ( -4.364 2.610 0.004) 5.085 18.160 ( 1.990 3.789 -0.324) 4.292 18.319 ( 6.578 4.850 0.432) 8.184 18.520 ( 9.238 7.947 1.547) 12.284 21.087 ( 2.835 2.399 -0.729) 3.785 21.141 ( 5.414 1.098 -1.137) 5.640 21.874 ( 0.199 0.512 8.795) 8.812 21.992 ( -0.944 0.886 -5.323) 5.478 ======================= Grid point 211 (99/170) ======================= q-point: ( 0.18 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( 6.704 8.938 -12.166) 16.518 2.006 ( 6.966 10.231 -3.797) 12.947 2.129 ( 9.963 3.105 4.301) 11.287 2.246 ( 8.652 4.677 15.592) 18.435 2.961 ( -11.564 -1.674 2.707) 11.994 3.055 ( -6.431 -0.714 0.737) 6.512 3.075 ( 1.220 -3.832 -0.708) 4.084 3.163 ( 1.096 -8.497 -1.363) 8.675 3.294 ( -5.773 -5.778 -7.019) 10.769 3.526 ( -6.347 -1.039 -5.644) 8.557 3.621 ( 3.599 -7.264 0.265) 8.111 3.759 ( -7.299 1.077 -2.247) 7.713 3.845 ( 5.704 -1.309 3.801) 6.978 3.953 ( 6.075 5.085 -8.396) 11.543 4.109 ( 14.102 8.443 5.856) 17.448 4.149 ( 5.109 10.528 4.612) 12.578 4.433 ( -2.184 5.556 -4.678) 7.585 4.743 ( 2.112 2.715 -11.429) 11.935 4.794 ( -6.285 3.384 5.099) 8.772 4.979 ( 7.635 4.999 1.251) 9.212 5.139 ( -0.110 1.568 -2.566) 3.009 5.292 ( -0.515 3.954 7.918) 8.866 5.548 ( -0.914 -1.601 4.267) 4.649 5.694 ( -5.296 -4.435 -0.366) 6.918 6.073 ( -3.418 0.130 -0.562) 3.466 6.138 ( -3.034 3.777 1.860) 5.190 6.335 ( 3.327 -2.523 -12.315) 13.004 6.645 ( 0.084 -9.689 11.180) 14.794 7.200 ( -5.339 -3.713 -2.089) 6.830 7.404 ( -1.401 6.606 2.207) 7.104 7.439 ( -5.511 6.851 4.460) 9.859 7.625 ( -9.507 5.338 -2.126) 11.109 8.091 ( 13.227 2.828 -7.399) 15.417 8.246 ( 9.471 2.369 1.441) 9.869 9.318 ( 5.829 2.780 -2.913) 7.084 9.363 ( 2.491 1.286 3.468) 4.459 9.688 ( 5.059 3.105 2.744) 6.540 9.758 ( 1.802 1.429 -0.096) 2.302 10.333 ( 1.720 0.532 -3.791) 4.196 10.418 ( -1.788 3.608 3.594) 5.398 10.897 ( -10.215 -3.960 -5.718) 12.358 10.940 ( -7.048 -2.847 2.108) 7.888 11.429 ( -8.224 -2.489 5.722) 10.323 11.499 ( -4.808 -2.962 -3.560) 6.676 12.392 ( 8.775 3.813 -0.982) 9.618 12.411 ( 8.870 4.584 0.602) 10.002 13.081 ( 7.036 -5.426 -1.259) 8.974 13.122 ( 6.027 -3.683 2.893) 7.633 16.649 ( -11.467 -7.378 -1.217) 13.690 16.781 ( -14.317 -7.049 1.720) 16.051 17.138 ( -14.327 13.601 -1.655) 19.824 17.257 ( -14.861 8.951 5.463) 18.189 17.956 ( 8.949 -11.102 -0.191) 14.261 18.257 ( 9.790 -8.072 0.156) 12.690 18.440 ( 7.379 4.109 -1.512) 8.581 18.646 ( 4.995 5.286 0.090) 7.273 21.149 ( 4.818 1.988 0.086) 5.212 21.210 ( 5.659 0.954 -1.472) 5.925 21.904 ( -0.838 -0.383 -7.259) 7.317 21.964 ( -0.210 -0.630 6.364) 6.399 ======================= Grid point 212 (100/170) ======================= q-point: ( 0.27 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( 11.108 6.999 -13.544) 18.863 2.046 ( 12.369 10.116 -9.152) 18.414 2.349 ( 0.423 1.290 10.666) 10.752 2.521 ( 3.705 0.555 10.781) 11.413 2.841 ( -8.725 -0.757 1.595) 8.902 2.946 ( -5.834 1.212 5.739) 8.273 2.983 ( -6.474 -9.537 -9.588) 14.993 3.090 ( -0.793 -3.575 1.727) 4.048 3.277 ( -1.428 -1.448 -2.110) 2.930 3.334 ( -4.371 0.806 -1.721) 4.767 3.577 ( -9.794 -0.990 -2.617) 10.186 3.731 ( -1.986 -2.938 6.309) 7.238 3.969 ( 9.297 0.316 -7.303) 11.827 4.006 ( 14.992 -3.322 -3.498) 15.749 4.147 ( 4.336 -1.480 -7.676) 8.939 4.282 ( 6.747 9.550 -10.538) 15.741 4.480 ( 3.085 0.361 -7.817) 8.411 4.715 ( 5.201 6.353 5.888) 10.103 4.771 ( 3.656 4.513 -1.704) 6.053 5.068 ( 5.922 3.324 -7.269) 9.947 5.139 ( 4.285 6.835 -0.837) 8.110 5.386 ( -0.568 0.591 10.591) 10.623 5.518 ( -4.156 0.869 4.403) 6.117 5.730 ( 0.778 -1.690 5.564) 5.867 5.993 ( -7.053 0.388 -3.896) 8.067 6.061 ( -4.357 2.388 0.104) 4.969 6.255 ( -2.716 -1.565 -3.870) 4.981 6.643 ( -11.175 -10.875 5.397) 16.501 7.107 ( -4.823 -1.992 -0.409) 5.234 7.343 ( -5.147 10.346 0.610) 11.572 7.469 ( -0.458 2.967 4.807) 5.667 7.528 ( -5.647 7.376 6.113) 11.120 8.198 ( 12.390 3.729 -9.683) 16.161 8.401 ( 8.891 2.093 -0.406) 9.143 9.314 ( -2.484 -0.325 -1.721) 3.040 9.453 ( 9.286 1.876 -0.752) 9.503 9.756 ( 2.215 0.743 -3.126) 3.902 9.894 ( 9.325 1.148 7.174) 11.821 10.371 ( 5.164 -0.799 -1.675) 5.488 10.440 ( 0.622 2.015 2.091) 2.970 10.663 ( -10.342 -2.419 -5.236) 11.841 10.828 ( -9.017 -0.957 -0.068) 9.068 11.357 ( -8.275 -1.798 5.569) 10.135 11.381 ( -5.224 -2.075 -2.774) 6.268 12.426 ( 8.783 4.173 -9.112) 13.326 12.654 ( 8.025 3.375 10.180) 13.394 13.190 ( 4.866 -4.801 0.020) 6.836 13.218 ( 4.116 -4.504 2.423) 6.565 16.532 ( -7.062 -0.649 4.733) 8.526 16.617 ( -9.031 -0.697 4.048) 9.921 16.874 ( -15.964 16.623 -0.815) 23.062 17.075 ( -17.718 10.454 9.999) 22.874 18.125 ( 11.557 -12.954 -0.469) 17.367 18.416 ( 9.231 -8.464 -0.250) 12.526 18.502 ( 4.719 1.967 -4.263) 6.657 18.664 ( 0.883 1.799 -5.524) 5.876 21.218 ( 4.255 -0.626 -0.329) 4.314 21.310 ( 6.048 2.565 2.757) 7.124 21.808 ( 0.139 -1.934 -8.614) 8.830 22.001 ( -1.485 -2.516 2.497) 3.844 ======================= Grid point 213 (101/170) ======================= q-point: ( 0.36 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 12.960 2.269 -8.425) 15.624 2.190 ( 12.374 7.194 -3.946) 14.847 2.305 ( -9.791 2.743 2.577) 10.489 2.594 ( -3.638 1.924 7.136) 8.237 2.751 ( -5.292 -5.056 -6.953) 10.095 2.826 ( 2.218 -0.051 -1.055) 2.457 3.028 ( -4.048 -1.855 8.509) 9.604 3.112 ( 0.619 -3.516 -0.402) 3.592 3.160 ( -10.632 2.229 0.019) 10.863 3.246 ( -2.855 1.938 3.647) 5.021 3.474 ( -2.072 -2.601 1.442) 3.625 3.749 ( -4.230 -4.655 3.576) 7.235 3.991 ( 2.313 3.541 -15.416) 15.986 4.044 ( 5.589 2.374 -9.243) 11.059 4.240 ( 11.592 -9.626 -2.625) 15.295 4.357 ( 17.359 -3.608 -10.966) 20.847 4.482 ( 12.374 4.135 -4.620) 13.841 4.677 ( -0.313 0.215 -4.630) 4.645 4.952 ( 8.207 2.483 -0.902) 8.621 5.066 ( 4.702 6.616 -2.205) 8.411 5.217 ( 0.112 5.932 3.644) 6.963 5.462 ( -7.087 4.220 6.917) 10.765 5.556 ( 3.663 -2.793 2.095) 5.061 5.749 ( -8.092 -1.851 -5.039) 9.711 5.822 ( -2.961 -3.104 8.729) 9.727 5.980 ( -5.762 1.433 -3.588) 6.938 6.193 ( -1.883 5.369 0.108) 5.690 6.464 ( -14.134 -4.956 0.089) 14.978 7.063 ( -1.244 0.547 3.255) 3.527 7.294 ( -2.640 7.039 1.667) 7.700 7.502 ( -1.056 1.841 4.412) 4.895 7.548 ( -4.702 9.650 10.237) 14.833 8.265 ( 10.409 3.945 -10.734) 15.463 8.484 ( 3.934 1.641 -4.121) 5.929 9.284 ( 0.198 -1.151 0.586) 1.307 9.588 ( 6.513 -1.663 -0.535) 6.743 9.763 ( 4.846 -0.539 -3.372) 5.928 10.112 ( 10.254 0.752 3.807) 10.964 10.353 ( -8.227 -5.123 -4.355) 10.626 10.431 ( 0.958 1.947 -0.255) 2.185 10.578 ( 3.482 2.561 -0.344) 4.336 10.665 ( -10.037 0.363 -1.410) 10.142 11.285 ( -5.700 -1.343 1.284) 5.995 11.294 ( -5.528 -1.234 2.147) 6.057 12.496 ( 10.040 3.046 -4.327) 11.349 12.854 ( 2.802 2.292 8.901) 9.609 13.207 ( 0.916 -2.513 -2.058) 3.375 13.312 ( 2.683 -4.471 2.563) 5.810 16.452 ( -6.162 6.092 1.488) 8.792 16.625 ( -8.287 15.755 3.122) 18.074 16.676 ( -4.883 3.774 11.060) 12.665 16.946 ( -15.190 7.771 13.932) 22.028 18.275 ( 8.442 -8.600 -2.506) 12.309 18.504 ( 5.637 -3.941 -6.347) 9.359 18.516 ( 2.080 -1.393 -4.324) 4.997 18.574 ( 0.233 -1.845 -7.582) 7.807 21.290 ( 4.556 -2.359 1.134) 5.254 21.433 ( 3.018 0.902 5.074) 5.972 21.735 ( 3.095 -2.986 -8.180) 9.242 21.973 ( -3.218 -3.526 -0.746) 4.832 ======================= Grid point 214 (102/170) ======================= q-point: ( 0.45 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -4.445 0.754 3.268) 5.568 2.196 ( 7.054 -0.001 -0.090) 7.054 2.399 ( 9.435 5.848 -4.046) 11.815 2.537 ( -1.618 -1.867 -10.557) 10.842 2.639 ( -5.253 3.394 8.539) 10.585 2.874 ( -4.408 -0.180 1.711) 4.732 2.938 ( -4.495 2.580 1.021) 5.283 3.047 ( 2.162 2.969 -3.927) 5.377 3.131 ( -0.496 -6.217 7.202) 9.527 3.335 ( 0.471 -4.555 -0.495) 4.606 3.472 ( 1.181 0.150 3.006) 3.233 3.622 ( -7.393 0.393 -7.573) 10.590 3.900 ( 4.041 -1.703 -8.008) 9.130 3.974 ( 2.027 -2.457 -13.305) 13.681 4.358 ( 7.635 -2.385 -0.740) 8.033 4.450 ( 1.517 -4.188 -3.628) 5.744 4.681 ( 9.443 1.583 0.740) 9.603 4.801 ( 23.012 -8.566 -4.164) 24.905 4.954 ( -12.376 6.572 0.319) 14.016 5.113 ( 6.362 9.566 1.204) 11.551 5.277 ( -0.396 -2.174 1.193) 2.511 5.328 ( -10.348 -0.930 0.151) 10.391 5.452 ( -8.469 -2.206 0.725) 8.782 5.713 ( 1.918 -6.916 0.890) 7.232 5.782 ( -7.951 7.292 -2.622) 11.102 6.016 ( 10.170 1.961 3.226) 10.848 6.148 ( -4.103 3.187 -3.913) 6.504 6.247 ( -10.267 4.451 0.579) 11.205 7.148 ( 3.962 1.031 5.994) 7.258 7.286 ( -0.822 5.416 1.480) 5.675 7.548 ( -2.692 3.815 8.992) 10.132 7.590 ( -2.565 8.041 8.722) 12.137 8.290 ( 7.888 3.667 -10.690) 13.782 8.422 ( -2.310 0.666 -9.048) 9.362 9.330 ( 2.689 -1.648 3.059) 4.394 9.596 ( -1.391 -2.422 -3.534) 4.505 9.861 ( 8.111 -4.312 -0.116) 9.187 10.136 ( -9.244 -1.980 -4.580) 10.505 10.316 ( 7.871 -1.433 2.611) 8.416 10.439 ( -0.565 1.181 -0.615) 1.447 10.516 ( -5.133 3.483 -0.985) 6.281 10.629 ( 3.216 3.560 -1.616) 5.062 11.203 ( -8.355 -1.224 4.083) 9.380 11.262 ( 1.416 -0.572 -1.316) 2.016 12.645 ( 10.811 0.886 0.872) 10.882 12.887 ( -7.539 0.316 3.179) 8.188 13.230 ( 3.790 -0.567 0.458) 3.859 13.345 ( -1.140 -1.965 1.096) 2.523 16.409 ( -0.350 11.348 0.733) 11.377 16.487 ( -6.367 14.541 -0.282) 15.876 16.856 ( 2.032 4.823 17.695) 18.453 16.907 ( -10.546 5.228 15.734) 19.649 18.304 ( 3.039 -3.063 -8.551) 9.578 18.384 ( -0.381 0.469 -13.919) 13.932 18.538 ( 5.027 -4.633 -2.593) 7.312 18.563 ( -0.804 -4.680 -0.618) 4.789 21.379 ( 4.613 -4.558 1.449) 6.645 21.478 ( -2.420 -3.450 1.806) 4.585 21.754 ( 7.167 -1.757 -3.181) 8.036 21.889 ( -5.409 -2.786 -1.989) 6.401 ======================= Grid point 215 (103/170) ======================= q-point: (-0.45 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( -11.646 3.315 5.552) 13.321 2.244 ( -13.398 -1.865 -6.530) 15.020 2.354 ( 10.031 -1.476 0.263) 10.143 2.512 ( 2.566 3.815 -6.854) 8.253 2.658 ( -3.482 4.041 8.565) 10.090 2.876 ( 5.557 1.258 2.609) 6.267 3.005 ( 6.663 2.086 3.464) 7.794 3.051 ( 6.404 1.248 -8.422) 10.654 3.222 ( 0.723 -5.136 5.976) 7.913 3.283 ( -0.076 -2.474 -3.101) 3.968 3.436 ( -1.805 -0.155 -6.069) 6.334 3.552 ( 4.956 0.449 -4.683) 6.833 3.850 ( -2.354 -7.614 -6.683) 10.401 3.903 ( 4.295 -3.022 -5.468) 7.582 4.369 ( -7.747 -7.811 -2.579) 11.300 4.440 ( 2.832 4.028 0.243) 4.930 4.573 ( -27.768 0.992 0.192) 27.786 4.875 ( 9.510 6.081 3.027) 11.686 4.915 ( -16.615 0.928 -3.528) 17.010 5.147 ( 5.656 -9.257 3.623) 11.437 5.257 ( 1.181 2.462 0.870) 2.866 5.378 ( 5.828 6.782 5.047) 10.268 5.495 ( 8.468 -1.225 -1.026) 8.618 5.625 ( 2.365 1.236 -8.753) 9.151 5.786 ( -0.596 -3.871 7.040) 8.056 5.968 ( -6.348 2.735 -3.586) 7.787 6.131 ( -2.307 7.293 0.548) 7.669 6.272 ( 12.109 1.628 -1.083) 12.266 7.230 ( -1.523 1.956 2.587) 3.583 7.311 ( 3.263 3.243 -0.166) 4.604 7.580 ( -6.499 8.080 9.779) 14.253 7.712 ( 4.873 4.055 9.707) 11.594 8.236 ( -5.037 0.035 -10.164) 11.343 8.289 ( 4.774 2.927 -9.354) 10.902 9.420 ( 3.033 -1.187 4.229) 5.337 9.506 ( -3.514 -2.767 -4.801) 6.561 9.925 ( -10.619 -2.349 -1.292) 10.953 9.972 ( 1.620 -5.549 1.509) 5.975 10.350 ( -3.498 -0.283 0.442) 3.537 10.452 ( 4.132 0.896 -3.192) 5.298 10.515 ( 2.433 5.953 -0.210) 6.434 10.653 ( 3.871 3.434 -1.325) 5.342 11.143 ( -4.074 -0.619 3.936) 5.699 11.308 ( 5.729 -1.069 -0.816) 5.885 12.717 ( -12.456 -0.574 -0.725) 12.491 12.845 ( 9.268 -0.613 3.105) 9.794 13.292 ( -2.424 -0.282 0.657) 2.528 13.311 ( -0.003 -0.181 0.938) 0.956 16.433 ( -0.001 11.443 -0.155) 11.444 16.463 ( 6.099 14.416 0.714) 15.669 16.950 ( -5.339 3.235 15.175) 16.409 17.115 ( 7.592 6.260 14.653) 17.651 18.199 ( -1.023 -1.206 -10.793) 10.909 18.257 ( 1.070 0.775 -10.942) 11.022 18.502 ( -5.777 -6.685 -0.502) 8.849 18.581 ( 1.959 -2.954 -1.207) 3.745 21.424 ( -3.852 -6.202 -1.067) 7.379 21.460 ( 4.084 -5.985 0.337) 7.253 21.762 ( -8.034 -0.290 -1.765) 8.231 21.852 ( 6.321 -1.412 0.247) 6.481 ======================= Grid point 216 (104/170) ======================= q-point: (-0.36 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -21.785 5.318 2.542) 22.568 1.923 ( -20.068 0.667 -2.576) 20.243 2.502 ( 7.253 0.325 1.163) 7.353 2.532 ( 10.017 1.823 -3.719) 10.840 2.707 ( -1.270 2.693 6.329) 6.995 2.961 ( 1.458 1.684 -0.109) 2.230 3.027 ( 1.839 1.783 -9.153) 9.505 3.211 ( 10.881 2.800 -0.009) 11.236 3.277 ( 3.967 -3.379 3.928) 6.525 3.330 ( 5.223 -1.817 1.133) 5.645 3.416 ( 1.447 -2.490 1.921) 3.461 3.549 ( 4.342 2.731 -7.268) 8.896 3.733 ( -7.374 -5.028 -3.923) 9.749 3.902 ( -0.175 -3.168 -1.982) 3.741 4.108 ( -20.012 -8.912 -0.373) 21.910 4.200 ( -16.154 -5.202 1.302) 17.021 4.439 ( -1.978 5.897 -1.611) 6.425 4.706 ( -4.197 4.579 -0.683) 6.249 4.935 ( -6.575 7.759 -1.684) 10.309 5.102 ( -8.259 2.789 2.041) 8.953 5.335 ( -0.492 4.844 -2.378) 5.419 5.463 ( 6.111 -5.074 3.346) 8.619 5.540 ( -2.038 -0.906 2.075) 3.047 5.728 ( 12.348 4.260 1.264) 13.124 5.928 ( 10.004 1.467 -2.845) 10.504 5.956 ( 4.729 -3.298 8.606) 10.359 6.079 ( -2.223 4.660 -2.113) 5.578 6.444 ( 11.768 -3.327 -3.504) 12.722 7.196 ( -2.633 2.695 -0.821) 3.856 7.348 ( 2.007 0.720 -0.951) 2.335 7.572 ( -4.990 8.139 5.801) 11.171 7.893 ( 5.538 5.774 4.309) 9.087 8.054 ( -5.348 0.462 -5.463) 7.659 8.269 ( 1.721 1.456 -4.021) 4.610 9.398 ( -3.090 -2.766 -4.323) 5.991 9.492 ( -0.979 -0.788 3.497) 3.716 9.718 ( -11.367 -1.437 -0.648) 11.476 10.005 ( -2.287 -2.172 3.433) 4.662 10.312 ( -4.486 -0.134 3.827) 5.898 10.465 ( 2.937 -0.163 -4.320) 5.226 10.527 ( 3.646 6.698 -2.894) 8.157 10.743 ( 7.639 1.067 -0.944) 7.771 11.171 ( 1.997 -0.239 3.750) 4.256 11.410 ( 7.417 -1.596 -0.302) 7.593 12.478 ( -14.834 0.326 -2.129) 14.990 13.018 ( 6.572 -2.214 4.262) 8.140 13.179 ( -7.472 1.659 -2.998) 8.220 13.341 ( -0.822 -3.251 1.693) 3.757 16.482 ( 6.385 7.604 -0.104) 9.929 16.616 ( 12.158 16.343 0.748) 20.383 17.057 ( 0.359 1.871 9.976) 10.156 17.406 ( 14.119 6.892 6.067) 16.842 18.083 ( -2.782 0.246 -3.802) 4.718 18.157 ( -0.807 -0.041 -6.950) 6.997 18.375 ( -9.284 -9.617 -0.447) 13.374 18.561 ( -3.167 -2.049 -0.865) 3.870 21.339 ( -4.795 -6.427 -1.880) 8.236 21.519 ( 3.213 -5.820 -0.162) 6.650 21.601 ( -10.122 2.796 -1.139) 10.563 21.942 ( 4.309 -1.657 0.628) 4.659 ======================= Grid point 217 (105/170) ======================= q-point: (-0.27 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( -24.721 7.091 6.000) 26.408 1.593 ( -23.436 7.699 6.787) 25.585 2.619 ( 1.204 4.256 3.673) 5.749 2.698 ( 12.476 -0.943 -6.081) 13.911 2.754 ( 2.424 4.255 5.042) 7.028 2.870 ( -12.581 5.018 -3.626) 14.022 2.967 ( -0.550 1.432 2.344) 2.802 3.168 ( -15.790 -2.358 -0.150) 15.966 3.286 ( 1.613 1.136 -0.311) 1.997 3.414 ( 0.762 -1.067 -6.602) 6.731 3.507 ( 6.279 0.190 1.027) 6.365 3.603 ( 5.800 -0.299 -1.425) 5.979 3.659 ( 5.344 1.800 5.754) 8.057 3.883 ( 0.188 -7.037 0.233) 7.044 3.930 ( -6.749 -7.959 4.717) 11.452 4.079 ( -0.251 -5.317 -0.060) 5.323 4.401 ( -0.324 5.815 -0.678) 5.864 4.684 ( -1.837 -0.621 -5.361) 5.701 4.760 ( -5.693 6.176 0.886) 8.446 4.948 ( -10.153 6.781 -1.485) 12.299 5.191 ( -14.809 8.494 0.476) 17.078 5.512 ( 2.620 4.251 0.069) 4.994 5.688 ( 8.318 -3.984 2.757) 9.626 5.931 ( 12.381 2.067 -1.190) 12.609 5.954 ( -3.683 1.933 -0.642) 4.209 6.067 ( 2.125 3.931 2.148) 4.958 6.166 ( 8.709 -1.251 1.953) 9.012 6.581 ( 9.992 -13.435 0.309) 16.746 7.164 ( 1.024 1.529 -1.670) 2.485 7.365 ( 1.620 0.627 -0.379) 1.778 7.564 ( -2.088 8.052 3.181) 8.906 7.880 ( -4.118 1.492 -4.520) 6.294 8.009 ( 2.996 8.552 -4.221) 9.997 8.247 ( -4.778 -0.464 3.326) 5.841 9.324 ( -2.840 -3.188 -2.378) 4.887 9.399 ( -10.099 -0.158 1.296) 10.183 9.646 ( -0.225 2.083 1.928) 2.847 9.980 ( -4.490 2.427 2.036) 5.495 10.279 ( -5.900 -0.658 4.551) 7.480 10.475 ( 3.694 0.126 -2.524) 4.476 10.583 ( 6.629 3.591 -1.973) 7.793 10.862 ( 9.321 -0.807 -1.143) 9.425 11.271 ( 5.281 -0.229 2.987) 6.071 11.516 ( 6.481 -2.081 -0.885) 6.864 12.229 ( -14.280 1.511 -0.416) 14.366 13.000 ( -9.856 2.712 -3.957) 10.962 13.128 ( 1.774 -4.687 2.094) 5.431 13.316 ( -3.012 -6.688 -0.416) 7.346 16.625 ( 11.697 3.139 -0.285) 12.114 16.851 ( 16.540 17.221 0.260) 23.879 17.128 ( 3.085 0.723 -4.921) 5.853 17.644 ( 16.994 6.723 -9.909) 20.789 18.042 ( -4.371 -0.521 3.698) 5.749 18.122 ( -2.415 -2.140 9.186) 9.737 18.227 ( -8.665 -8.837 2.565) 12.639 18.462 ( -8.191 -2.863 -0.760) 8.710 21.234 ( -6.434 -3.478 -0.946) 7.375 21.419 ( -10.402 3.917 -1.083) 11.168 21.571 ( 2.648 -4.063 0.535) 4.880 22.000 ( 2.543 -1.541 0.415) 3.002 ======================= Grid point 218 (106/170) ======================= q-point: (-0.18 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.230 ( -18.925 12.803 15.499) 27.610 1.381 ( -19.731 15.076 17.375) 30.307 2.385 ( -36.593 21.703 20.046) 47.031 2.662 ( -2.997 0.936 -7.211) 7.865 2.763 ( -1.719 -4.077 -3.760) 5.807 2.927 ( 3.840 -3.934 1.376) 5.667 3.006 ( 0.510 1.812 -1.997) 2.744 3.073 ( 11.692 0.940 4.126) 12.434 3.307 ( 0.368 1.631 -2.261) 2.812 3.373 ( 3.099 -3.238 -4.254) 6.179 3.558 ( 2.519 1.140 0.135) 2.768 3.620 ( 3.744 -0.361 -2.183) 4.349 3.881 ( 3.232 -0.143 9.844) 10.362 3.939 ( -0.384 -7.939 6.832) 10.481 3.958 ( 6.208 -3.514 5.954) 9.292 4.123 ( 4.329 -6.241 -1.425) 7.728 4.365 ( -0.273 5.252 -6.553) 8.402 4.563 ( -5.952 3.307 4.712) 8.281 4.752 ( -10.698 9.253 -3.131) 14.487 4.857 ( 8.967 3.821 2.483) 10.059 4.977 ( -10.923 10.740 0.460) 15.325 5.523 ( -0.460 1.625 -0.909) 1.918 5.775 ( 2.164 2.233 -5.700) 6.493 5.840 ( -4.179 -0.852 -3.437) 5.478 6.037 ( -2.214 2.171 1.236) 3.338 6.146 ( 7.013 -1.678 -0.585) 7.235 6.253 ( 3.672 0.468 -0.875) 3.803 6.796 ( 10.312 -15.874 6.138) 19.900 7.192 ( 3.594 -1.013 -0.604) 3.783 7.406 ( 3.354 3.641 1.029) 5.056 7.575 ( -0.067 6.429 1.321) 6.564 7.757 ( -5.777 -0.210 -2.793) 6.420 7.972 ( 1.853 9.924 -9.172) 13.640 8.185 ( -7.703 0.603 4.670) 9.028 9.194 ( -9.791 1.865 2.170) 10.201 9.375 ( 3.139 -1.444 0.011) 3.455 9.674 ( 0.590 2.607 1.064) 2.877 9.910 ( -4.442 6.929 -1.876) 8.442 10.230 ( -4.844 -0.865 3.164) 5.850 10.520 ( 4.339 2.263 -1.756) 5.199 10.692 ( 7.581 -0.634 1.507) 7.755 11.011 ( 10.294 -1.645 -0.288) 10.429 11.379 ( 4.303 -0.856 1.888) 4.776 11.590 ( 5.404 -2.420 -1.798) 6.189 12.043 ( -11.660 2.579 4.114) 12.630 12.791 ( -9.002 2.981 -6.309) 11.390 13.076 ( -10.869 -12.078 0.087) 16.249 13.259 ( -1.270 -3.844 -3.154) 5.132 16.824 ( 13.836 -1.870 -1.805) 14.078 17.023 ( 3.335 1.025 -15.587) 15.973 17.123 ( 14.303 11.909 -0.455) 18.617 17.726 ( 11.906 5.965 -14.686) 19.824 17.937 ( -9.261 -10.852 0.388) 14.272 18.198 ( -2.316 -3.067 7.727) 8.630 18.289 ( -6.199 1.268 3.864) 7.414 18.341 ( -0.856 -0.161 13.283) 13.312 21.125 ( -7.587 2.057 1.913) 8.090 21.258 ( -7.604 2.157 -1.989) 8.151 21.623 ( 1.950 -2.380 2.428) 3.919 22.037 ( 1.443 -0.804 0.726) 1.804 ======================= Grid point 219 (107/170) ======================= q-point: (-0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( -8.870 17.922 22.848) 30.363 1.340 ( -12.231 19.288 20.301) 30.558 2.251 ( -19.984 20.179 41.750) 50.493 2.482 ( -5.280 2.881 -11.987) 13.411 2.605 ( -4.683 2.628 -12.070) 13.211 2.990 ( 2.681 -5.149 3.393) 6.724 3.043 ( 0.888 -0.191 2.905) 3.043 3.246 ( 1.321 -0.461 -4.770) 4.971 3.282 ( 6.373 0.274 -3.223) 7.147 3.421 ( 3.348 -7.771 3.427) 9.129 3.624 ( 4.461 -1.782 -3.396) 5.883 3.647 ( 1.479 -0.688 -0.437) 1.688 3.958 ( 1.653 -1.798 -4.663) 5.264 3.995 ( 6.810 -3.119 -1.723) 7.686 4.174 ( 3.247 -5.385 10.985) 12.658 4.208 ( 0.934 0.433 12.217) 12.261 4.336 ( 2.487 6.538 -1.663) 7.190 4.505 ( -4.509 8.582 -3.473) 10.298 4.613 ( -5.555 8.466 7.521) 12.613 4.885 ( -4.189 7.403 6.849) 10.921 5.027 ( 6.566 1.001 -2.895) 7.245 5.501 ( -0.524 -2.737 -0.459) 2.824 5.653 ( -1.782 4.614 -3.935) 6.321 5.800 ( 0.985 0.539 -5.074) 5.197 5.976 ( -6.649 -1.753 3.572) 7.749 6.175 ( -0.847 -3.797 -1.760) 4.270 6.314 ( 5.375 0.517 -3.084) 6.218 6.899 ( -1.072 -8.470 -5.219) 10.006 7.248 ( 3.696 -2.880 0.231) 4.691 7.473 ( 1.334 8.104 0.618) 8.237 7.582 ( 1.679 -0.771 0.487) 1.911 7.676 ( -3.041 1.300 1.778) 3.755 7.904 ( 3.190 8.394 -7.057) 11.421 8.128 ( -4.869 1.841 1.746) 5.490 9.103 ( -5.489 5.239 2.890) 8.120 9.437 ( 2.806 -1.995 -0.336) 3.459 9.649 ( -3.046 0.892 -1.763) 3.631 9.819 ( -2.077 9.739 -4.324) 10.856 10.245 ( 3.589 0.791 2.339) 4.356 10.549 ( 2.462 4.298 -3.447) 6.034 10.838 ( 5.482 -4.211 5.023) 8.545 11.163 ( 9.441 -1.829 -1.129) 9.683 11.429 ( -0.761 -2.388 2.151) 3.303 11.672 ( 6.992 -2.400 -1.696) 7.585 11.943 ( -9.791 2.534 8.297) 13.081 12.595 ( -5.294 3.311 -8.133) 10.254 12.860 ( -14.399 -10.923 3.576) 18.424 13.188 ( -2.166 -1.489 -5.244) 5.866 16.907 ( 8.565 -5.740 -7.424) 12.705 17.072 ( 12.926 -8.416 -1.490) 15.496 17.264 ( 0.900 -1.014 0.176) 1.367 17.648 ( -3.329 -4.708 -12.315) 13.598 17.896 ( 4.458 1.886 0.560) 4.873 18.162 ( -3.404 3.694 -0.539) 5.051 18.256 ( -0.711 4.084 2.995) 5.114 18.477 ( -3.363 5.314 6.205) 8.835 21.058 ( -4.184 4.963 3.415) 7.335 21.142 ( -4.338 -0.092 -1.898) 4.736 21.688 ( 1.115 -0.740 5.275) 5.442 22.060 ( 0.671 0.248 0.036) 0.716 ======================= Grid point 220 (108/170) ======================= q-point: ( 0.00 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -5.036 17.934 14.823) 23.805 1.841 ( -0.206 15.837 19.537) 25.150 2.331 ( -0.828 2.536 -12.926) 13.198 2.546 ( 0.838 8.349 -11.538) 14.266 2.881 ( -0.902 -7.141 0.753) 7.237 2.907 ( 4.198 0.758 8.638) 9.634 3.078 ( -2.071 -1.370 1.503) 2.902 3.166 ( -3.299 -0.940 3.602) 4.974 3.280 ( 6.956 1.272 1.549) 7.239 3.395 ( 4.008 -4.724 2.052) 6.526 3.456 ( -1.011 -4.243 -2.367) 4.963 3.644 ( -1.900 5.185 2.403) 6.022 3.838 ( -0.353 0.286 -2.239) 2.284 4.258 ( 2.723 5.291 8.541) 10.409 4.338 ( 2.508 11.588 4.659) 12.738 4.378 ( -0.484 0.384 8.335) 8.358 4.545 ( -3.968 9.557 -0.174) 10.349 4.624 ( 5.781 10.189 0.093) 11.716 4.845 ( -1.286 13.046 2.309) 13.311 4.964 ( -2.911 5.188 -4.410) 7.405 5.073 ( -1.988 3.682 6.866) 8.040 5.389 ( -0.537 -2.366 -4.984) 5.543 5.738 ( -1.465 -1.429 -0.688) 2.159 5.788 ( -1.123 5.386 -2.227) 5.935 5.848 ( 0.696 -5.497 6.191) 8.308 6.040 ( 0.656 -6.656 -2.874) 7.280 6.306 ( 1.087 -4.901 0.010) 5.021 6.679 ( -1.474 -4.816 -12.416) 13.399 7.265 ( 3.021 -1.920 1.138) 3.756 7.383 ( -5.482 -4.585 -3.667) 8.032 7.652 ( -0.174 -0.591 5.243) 5.279 7.825 ( 6.067 3.538 -0.741) 7.062 8.005 ( 0.731 5.266 1.689) 5.579 8.206 ( -1.531 12.194 -5.785) 13.583 9.191 ( -1.788 5.098 5.104) 7.432 9.401 ( -0.882 0.753 -2.199) 2.486 9.671 ( 0.281 3.890 4.107) 5.664 9.938 ( -0.668 11.553 -6.621) 13.333 10.406 ( 6.077 4.328 2.026) 7.731 10.605 ( -1.836 5.840 -6.314) 8.795 10.809 ( -2.504 -8.332 7.634) 11.575 11.173 ( 3.467 -4.543 -7.801) 9.671 11.335 ( -3.451 -6.388 5.286) 8.981 11.585 ( -1.448 -6.760 -5.120) 8.603 12.067 ( 1.037 5.242 12.976) 14.033 12.542 ( 0.451 4.730 -9.295) 10.439 12.710 ( 0.674 -4.627 9.144) 10.270 13.026 ( -1.122 -4.518 -6.849) 8.282 16.848 ( 7.058 -8.849 -2.833) 11.668 16.903 ( -5.961 -13.100 -1.279) 14.450 16.996 ( -4.086 -11.376 0.324) 12.092 17.219 ( -0.395 -10.944 -12.856) 16.888 18.159 ( 0.867 6.672 5.024) 8.398 18.273 ( 0.663 6.196 0.436) 6.247 18.499 ( 6.678 8.194 1.139) 10.632 18.529 ( -6.898 7.765 -0.228) 10.389 21.102 ( 1.196 1.622 -1.156) 2.323 21.158 ( 0.389 4.486 -1.895) 4.886 21.794 ( 0.362 1.903 9.589) 9.783 22.068 ( -0.252 0.802 -1.847) 2.029 ======================= Grid point 221 (109/170) ======================= q-point: ( 0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( 3.995 10.852 17.696) 21.140 2.068 ( 2.171 10.440 17.759) 20.715 2.205 ( 2.881 6.009 -11.842) 13.588 2.428 ( 3.040 11.986 -15.337) 19.702 2.874 ( -2.105 -10.658 1.614) 10.983 2.983 ( 1.628 -9.348 -0.585) 9.506 3.015 ( -2.737 -8.774 -4.156) 10.087 3.127 ( -1.540 1.652 -0.032) 2.259 3.340 ( -2.996 -5.778 -1.841) 6.764 3.413 ( 0.099 -3.895 0.495) 3.928 3.575 ( -3.262 -0.013 -4.623) 5.658 3.643 ( 7.913 1.760 8.788) 11.956 3.947 ( 6.449 17.301 17.011) 25.105 4.156 ( -17.062 4.487 -0.368) 17.646 4.250 ( -3.055 12.774 -9.198) 16.035 4.399 ( 0.883 14.527 -0.024) 14.553 4.632 ( 2.773 4.992 -2.613) 6.280 4.759 ( 8.796 2.729 1.325) 9.304 4.848 ( -0.165 6.645 5.357) 8.537 4.982 ( 5.996 9.917 0.765) 11.614 5.105 ( -5.279 -1.287 8.012) 9.681 5.341 ( 1.530 0.237 -5.210) 5.435 5.650 ( -6.880 1.866 0.605) 7.154 5.703 ( -5.593 2.571 0.212) 6.160 6.004 ( 7.044 -3.705 4.387) 9.088 6.060 ( 5.093 -5.944 -2.929) 8.358 6.343 ( -1.767 -8.783 7.522) 11.698 6.483 ( -3.276 -3.740 -14.955) 15.760 7.235 ( -5.778 -4.144 -1.493) 7.265 7.362 ( 3.392 -1.604 1.625) 4.089 7.662 ( -2.605 5.267 2.231) 6.285 7.888 ( 0.757 -0.363 -5.472) 5.536 8.043 ( 3.176 9.552 2.477) 10.366 8.181 ( 6.484 6.998 -2.664) 9.905 9.267 ( 2.719 3.492 7.109) 8.374 9.374 ( 1.794 3.843 -2.987) 5.188 9.738 ( 0.123 4.485 5.731) 7.279 9.856 ( 0.158 10.987 -6.995) 13.026 10.461 ( -3.353 5.350 -3.040) 7.008 10.495 ( -1.220 4.810 0.090) 4.963 10.846 ( -3.631 -8.787 7.345) 12.014 11.038 ( -6.352 -4.573 -8.858) 11.820 11.367 ( -3.461 -6.356 7.320) 10.294 11.501 ( -2.118 -6.954 -4.525) 8.563 12.266 ( 6.132 5.651 11.406) 14.129 12.488 ( 6.771 5.248 -10.856) 13.829 12.860 ( 5.524 -5.968 6.705) 10.540 12.959 ( 2.562 -4.379 -6.059) 7.902 16.702 ( -9.820 -7.510 -2.828) 12.682 16.830 ( -11.326 -7.919 -0.779) 13.841 17.054 ( 13.391 -12.777 1.158) 18.545 17.267 ( 11.089 -11.276 -3.453) 16.188 18.062 ( -11.913 10.146 0.378) 15.653 18.274 ( -10.478 8.242 -0.648) 13.346 18.419 ( 3.984 4.150 0.923) 5.826 18.646 ( 5.880 5.159 1.770) 8.020 21.141 ( 4.314 2.640 -0.156) 5.060 21.166 ( 3.913 1.692 -3.177) 5.316 21.890 ( -1.501 1.259 8.993) 9.204 22.011 ( -2.286 0.939 -4.632) 5.250 ======================= Grid point 222 (110/170) ======================= q-point: ( 0.18 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 7.514 9.167 -1.470) 11.943 2.187 ( 5.685 6.854 8.569) 12.358 2.243 ( 3.461 9.708 -3.671) 10.941 2.346 ( 3.751 6.195 2.013) 7.517 2.843 ( -4.747 -9.530 2.946) 11.047 2.912 ( -1.775 -10.128 -6.082) 11.947 2.995 ( -3.443 -5.021 3.089) 6.827 3.102 ( -2.126 -0.230 0.480) 2.192 3.220 ( -6.405 -3.770 -3.917) 8.401 3.468 ( 0.244 -4.736 -3.680) 6.003 3.477 ( 4.441 -5.967 -2.841) 7.963 3.731 ( -4.399 -4.705 1.293) 6.569 3.886 ( -6.312 7.377 1.307) 9.796 4.059 ( -8.752 7.209 -3.567) 11.886 4.353 ( 8.407 15.602 -5.421) 18.534 4.429 ( 11.267 17.144 6.785) 21.608 4.570 ( -1.059 8.570 -5.633) 10.310 4.802 ( 1.529 2.596 -6.987) 7.609 4.900 ( -2.595 6.898 5.030) 8.923 5.074 ( 4.011 4.585 1.168) 6.202 5.195 ( 5.425 4.350 4.208) 8.128 5.275 ( -1.504 -3.923 -1.628) 4.506 5.585 ( -4.230 4.984 3.808) 7.565 5.679 ( -0.334 2.327 2.647) 3.540 6.054 ( -0.689 -2.883 -1.193) 3.195 6.162 ( 4.097 -1.576 3.609) 5.683 6.255 ( -4.478 -5.789 -14.075) 15.864 6.396 ( -4.849 -15.394 9.825) 18.895 7.142 ( -3.873 -1.987 -0.946) 4.454 7.435 ( 2.020 -0.920 3.117) 3.826 7.640 ( -2.998 10.610 1.149) 11.085 7.778 ( -5.209 9.103 -1.580) 10.606 8.157 ( 10.555 4.276 -3.991) 12.067 8.304 ( 9.163 3.310 0.500) 9.755 9.374 ( 1.119 2.575 -1.160) 3.038 9.403 ( 5.117 2.765 1.974) 6.142 9.785 ( 0.946 5.977 3.615) 7.050 9.814 ( 0.666 6.228 -1.797) 6.516 10.364 ( 0.794 2.552 -5.996) 6.565 10.496 ( -4.397 4.324 5.531) 8.284 10.803 ( -8.983 -5.728 -4.452) 11.546 10.872 ( -3.458 -3.603 0.801) 5.058 11.358 ( -6.806 -4.976 5.772) 10.218 11.413 ( -3.524 -6.001 -3.359) 7.728 12.487 ( 8.404 5.617 -0.105) 10.109 12.514 ( 8.938 5.653 -0.398) 10.583 12.959 ( 5.918 -6.602 -1.578) 9.006 13.028 ( 5.730 -5.766 2.816) 8.603 16.566 ( -5.339 -1.551 1.331) 5.717 16.684 ( -8.054 -2.748 2.152) 8.778 17.245 ( 6.346 -4.652 1.229) 7.964 17.362 ( -0.053 -0.091 1.963) 1.966 17.885 ( -7.561 5.448 -0.679) 9.343 18.138 ( -2.146 -0.782 -0.053) 2.285 18.498 ( 4.390 1.177 -1.387) 4.752 18.712 ( 1.526 1.601 -0.875) 2.378 21.194 ( 3.737 2.073 -2.178) 4.796 21.234 ( 6.190 1.817 0.853) 6.508 21.892 ( -3.401 -0.854 -6.165) 7.092 21.946 ( -2.981 -1.180 5.090) 6.016 ======================= Grid point 223 (111/170) ======================= q-point: ( 0.27 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 4.716 11.678 -14.520) 19.221 2.233 ( 9.514 8.616 -6.063) 14.196 2.372 ( -1.478 0.886 8.627) 8.798 2.540 ( 5.372 0.982 10.343) 11.696 2.783 ( -4.452 -7.030 -3.957) 9.214 2.828 ( -4.411 -1.967 2.962) 5.666 2.970 ( -8.148 -1.962 5.292) 9.912 2.995 ( -3.658 -4.945 1.792) 6.407 3.196 ( 3.278 -4.905 -0.116) 5.901 3.359 ( -3.739 0.207 -4.625) 5.951 3.554 ( 0.454 -4.101 -2.672) 4.916 3.673 ( -3.743 -3.155 4.419) 6.595 3.844 ( -2.795 -3.269 0.246) 4.308 3.965 ( 1.916 -3.209 -0.123) 3.740 4.280 ( 8.102 13.314 -19.705) 25.124 4.447 ( 0.988 6.956 -14.476) 16.091 4.612 ( 1.842 11.103 -5.904) 12.709 4.838 ( 0.749 1.924 -2.788) 3.470 4.890 ( 3.792 11.200 4.317) 12.588 5.069 ( 1.381 -2.589 -2.379) 3.778 5.272 ( 4.799 7.255 5.528) 10.306 5.458 ( 8.949 6.273 9.614) 14.556 5.564 ( -5.081 1.566 3.705) 6.481 5.682 ( -3.350 -1.401 2.828) 4.602 5.930 ( -10.041 -7.766 -9.753) 16.008 6.085 ( -2.433 -0.348 -1.504) 2.881 6.250 ( 1.670 1.010 3.145) 3.701 6.399 ( -5.207 -13.004 5.199) 14.941 7.093 ( -2.290 0.964 0.813) 2.615 7.476 ( -0.326 0.210 0.824) 0.910 7.581 ( -3.931 12.497 0.754) 13.122 7.752 ( -3.077 13.756 6.968) 15.724 8.267 ( 11.481 2.814 -7.749) 14.134 8.450 ( 8.848 2.510 -1.147) 9.268 9.324 ( -2.620 1.541 -3.562) 4.683 9.486 ( 5.022 1.164 -0.973) 5.246 9.790 ( -0.436 3.269 -2.743) 4.290 9.918 ( 6.061 1.428 8.361) 10.425 10.350 ( 3.670 -1.840 -6.384) 7.590 10.485 ( -2.833 3.389 3.185) 5.446 10.616 ( -7.727 -2.798 -1.033) 8.282 10.820 ( -4.436 0.736 -1.124) 4.634 11.300 ( -6.533 -4.401 3.914) 8.796 11.325 ( -4.539 -3.622 -0.866) 5.871 12.526 ( 8.397 5.818 -9.298) 13.814 12.735 ( 7.063 4.745 9.545) 12.787 13.070 ( 7.843 -6.800 0.434) 10.389 13.120 ( 2.823 -5.726 2.057) 6.707 16.563 ( -2.387 3.374 6.581) 7.772 16.635 ( -3.063 2.773 6.638) 7.819 17.204 ( -9.295 15.446 -1.306) 18.074 17.310 ( -13.067 12.598 8.008) 19.839 17.893 ( 9.013 -9.442 -0.486) 13.062 18.214 ( 9.094 -10.673 0.531) 14.032 18.518 ( 2.179 -0.784 -4.260) 4.849 18.671 ( -1.438 -0.998 -6.453) 6.686 21.225 ( 2.911 1.084 -1.673) 3.528 21.348 ( 4.938 1.460 3.205) 6.066 21.757 ( -2.468 -3.209 -8.557) 9.467 21.934 ( -4.124 -4.402 2.555) 6.551 ======================= Grid point 224 (112/170) ======================= q-point: ( 0.36 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( 5.750 4.014 -10.090) 12.287 2.282 ( -4.418 2.677 1.330) 5.334 2.410 ( 9.532 7.166 -3.705) 12.487 2.635 ( -5.550 -0.957 -4.647) 7.302 2.670 ( -1.344 0.742 6.505) 6.684 2.830 ( 2.747 -0.090 0.182) 2.754 2.969 ( -4.240 -3.907 8.762) 10.489 3.032 ( -0.482 -4.719 7.133) 8.566 3.224 ( 2.272 -2.743 -2.491) 4.346 3.224 ( -13.148 2.654 0.721) 13.432 3.458 ( -3.793 0.605 -0.121) 3.843 3.662 ( -3.815 -3.914 3.380) 6.427 3.895 ( 6.670 -11.967 -4.646) 14.467 4.024 ( 6.948 -6.897 -4.312) 10.697 4.192 ( 0.670 5.337 -14.435) 15.404 4.325 ( 15.382 2.148 -18.316) 24.015 4.559 ( -0.804 0.309 -7.852) 7.899 4.721 ( -1.082 6.674 -0.958) 6.828 5.053 ( 8.589 7.890 0.712) 11.684 5.171 ( 4.393 2.811 7.330) 8.996 5.338 ( -7.123 3.164 2.211) 8.101 5.488 ( -6.091 -2.458 0.270) 6.573 5.540 ( -4.309 5.018 -4.949) 8.261 5.675 ( -8.598 -4.378 1.044) 9.705 5.802 ( 10.490 1.160 8.260) 13.402 6.028 ( -4.499 2.167 -1.310) 5.163 6.281 ( -2.498 2.555 1.527) 3.886 6.359 ( -2.356 -4.287 -0.640) 4.933 7.100 ( 0.333 3.695 4.426) 5.775 7.446 ( -0.735 7.036 -2.515) 7.509 7.572 ( -2.562 6.518 5.711) 9.037 7.789 ( -4.284 14.608 9.199) 17.787 8.342 ( 10.248 2.927 -9.956) 14.585 8.519 ( 3.783 1.755 -5.881) 7.209 9.268 ( -0.463 -0.109 -0.739) 0.879 9.542 ( 3.346 -3.155 -1.556) 4.855 9.755 ( 0.779 0.020 -3.038) 3.137 10.109 ( 5.496 -1.877 8.057) 9.932 10.256 ( -3.364 -3.510 -8.616) 9.893 10.496 ( 1.569 4.927 -0.137) 5.172 10.578 ( -1.618 -2.591 3.995) 5.029 10.724 ( -3.360 5.559 -2.773) 7.063 11.246 ( -7.704 -3.008 4.883) 9.604 11.256 ( -1.630 -2.587 -1.428) 3.375 12.572 ( 8.477 4.631 -5.646) 11.188 12.901 ( 0.958 2.184 6.773) 7.181 13.147 ( 3.292 -3.450 -0.105) 4.769 13.219 ( 4.763 -4.593 3.798) 7.630 16.591 ( -0.469 7.796 4.181) 8.859 16.742 ( -1.016 4.820 14.073) 14.910 17.033 ( -9.035 23.531 0.437) 25.210 17.177 ( -15.260 16.193 10.550) 24.625 18.074 ( 12.388 -11.411 -0.522) 16.850 18.363 ( 7.998 -10.143 -0.003) 12.917 18.481 ( 0.659 -2.997 -6.040) 6.775 18.543 ( -1.776 -1.168 -10.945) 11.149 21.246 ( 2.452 -2.304 -2.142) 3.989 21.424 ( -0.614 -2.381 1.730) 3.007 21.665 ( 2.668 -3.580 -5.657) 7.207 21.883 ( -4.296 -5.541 0.820) 7.059 ======================= Grid point 225 (113/170) ======================= q-point: ( 0.45 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( 2.625 -1.844 -1.249) 3.443 2.236 ( -0.830 4.304 2.814) 5.208 2.446 ( -8.273 -1.784 -7.588) 11.367 2.561 ( 14.498 4.689 -9.204) 17.801 2.722 ( -3.513 4.684 8.541) 10.355 2.886 ( 0.578 0.680 2.173) 2.349 3.000 ( -7.699 0.369 6.230) 9.911 3.021 ( -2.812 -0.384 1.200) 3.081 3.072 ( -0.176 -0.774 2.600) 2.718 3.242 ( 1.974 -4.604 -2.202) 5.472 3.446 ( -0.795 -3.418 0.796) 3.598 3.609 ( -4.602 -1.018 -0.294) 4.722 3.872 ( 1.486 -6.610 -15.654) 17.057 3.914 ( 2.187 1.230 -12.291) 12.544 4.219 ( 8.193 -11.470 -2.157) 14.259 4.386 ( -0.670 -3.745 -5.635) 6.799 4.561 ( 19.852 -12.331 -5.568) 24.024 4.801 ( 3.731 7.942 6.505) 10.923 5.003 ( -20.597 -5.054 -2.972) 21.415 5.202 ( -6.928 1.888 1.084) 7.262 5.288 ( 8.335 5.249 2.235) 10.100 5.423 ( -0.064 5.613 2.423) 6.114 5.470 ( -0.229 9.246 -2.044) 9.472 5.650 ( -2.516 -0.432 5.442) 6.011 5.911 ( -5.878 5.528 -4.197) 9.095 6.056 ( 10.764 2.218 4.477) 11.867 6.181 ( -5.772 -0.066 -4.805) 7.510 6.323 ( -2.949 3.355 0.561) 4.502 7.202 ( 3.269 4.645 7.013) 9.025 7.422 ( 0.825 8.589 -2.078) 8.875 7.616 ( -1.426 3.828 8.559) 9.484 7.813 ( -5.009 13.651 8.565) 16.876 8.370 ( 7.881 2.811 -10.924) 13.760 8.430 ( -2.445 1.130 -10.828) 11.158 9.299 ( 2.877 -1.312 2.331) 3.928 9.531 ( -1.780 -4.180 -2.998) 5.444 9.778 ( 4.868 -3.944 -0.622) 6.296 10.053 ( -9.971 -6.076 -3.492) 12.187 10.307 ( 8.218 0.688 1.675) 8.415 10.492 ( -1.958 4.195 -0.238) 4.636 10.585 ( 0.546 2.609 0.086) 2.667 10.706 ( 1.752 4.794 0.191) 5.108 11.170 ( -7.354 -2.269 3.736) 8.554 11.240 ( 1.360 -1.819 -1.267) 2.601 12.672 ( 8.648 1.854 -1.040) 8.905 12.883 ( -7.088 -0.958 0.246) 7.156 13.227 ( 3.523 0.425 3.485) 4.974 13.306 ( 1.065 -1.711 3.069) 3.671 16.657 ( 3.884 12.431 2.962) 13.357 16.771 ( -8.032 11.483 4.137) 14.611 17.048 ( -2.330 16.701 13.433) 21.559 17.100 ( -6.191 16.706 11.580) 21.249 18.205 ( 5.204 -7.195 -4.032) 9.753 18.390 ( -0.154 -0.355 -11.012) 11.019 18.421 ( -2.327 -8.601 0.003) 8.910 18.460 ( 6.199 -4.075 -5.722) 9.369 21.262 ( 3.433 -7.602 -3.019) 8.870 21.363 ( -3.750 -8.564 -3.780) 10.084 21.719 ( 5.579 -1.570 0.796) 5.850 21.823 ( -4.522 -3.752 0.790) 5.929 ======================= Grid point 226 (114/170) ======================= q-point: (-0.45 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -6.064 3.104 5.540) 8.780 2.195 ( -12.104 -3.122 -6.697) 14.181 2.321 ( 7.711 -0.351 -0.055) 7.720 2.587 ( 2.151 3.438 -8.059) 9.022 2.743 ( -4.533 4.110 6.568) 8.977 2.926 ( 4.522 3.751 3.073) 6.631 3.017 ( 2.033 -3.738 -1.385) 4.475 3.050 ( 6.647 1.929 2.477) 7.351 3.163 ( 4.432 -1.043 4.726) 6.563 3.231 ( 1.029 -3.071 -2.249) 3.943 3.397 ( -1.908 -4.245 -4.198) 6.268 3.571 ( 3.663 1.563 -4.563) 6.057 3.731 ( -0.261 -3.820 -8.021) 8.888 3.855 ( 3.171 -2.022 -9.098) 9.844 4.154 ( -11.436 -13.262 0.176) 17.513 4.428 ( 7.490 -5.976 -4.148) 10.442 4.539 ( -24.333 -5.571 -4.462) 25.359 4.848 ( 15.080 -11.450 1.936) 19.033 5.024 ( 3.959 8.801 6.594) 11.688 5.046 ( -4.367 3.611 0.295) 5.674 5.328 ( -7.155 5.859 -1.071) 9.310 5.473 ( 7.590 2.785 1.305) 8.189 5.583 ( 3.526 9.850 2.432) 10.741 5.654 ( 0.159 1.456 1.945) 2.434 5.799 ( -2.268 5.226 1.274) 5.838 6.023 ( -3.111 2.381 -6.313) 7.430 6.230 ( -0.071 2.289 1.861) 2.951 6.295 ( 4.409 1.194 -0.969) 4.670 7.292 ( -1.097 4.708 4.247) 6.435 7.418 ( 1.511 7.799 -2.592) 8.356 7.718 ( -2.166 4.252 11.842) 12.768 7.843 ( 0.832 10.335 6.661) 12.323 8.235 ( -5.277 -0.336 -10.389) 11.658 8.364 ( 5.716 4.749 -10.385) 12.770 9.390 ( 3.555 -1.873 3.238) 5.161 9.442 ( -3.264 -3.448 -4.175) 6.323 9.842 ( -8.392 -6.266 -1.266) 10.549 9.877 ( 2.116 -3.726 1.023) 4.405 10.368 ( -1.632 2.208 -0.076) 2.746 10.484 ( 3.020 2.578 -3.201) 5.100 10.627 ( 2.972 5.366 2.130) 6.494 10.722 ( 0.708 3.246 -0.812) 3.420 11.124 ( -2.943 -1.280 3.735) 4.924 11.275 ( 4.853 -2.410 -1.132) 5.535 12.710 ( -10.579 -0.130 -1.385) 10.670 12.823 ( 7.274 -1.604 1.169) 7.540 13.294 ( -0.788 0.621 3.162) 3.317 13.314 ( -2.859 0.616 1.360) 3.225 16.687 ( -4.601 13.377 1.683) 14.246 16.786 ( 8.643 16.032 1.282) 18.259 17.073 ( -7.612 11.580 14.433) 20.009 17.313 ( 9.710 14.782 11.022) 20.840 18.154 ( -2.478 -3.904 -5.120) 6.899 18.266 ( -1.774 -0.809 -9.188) 9.392 18.362 ( -5.279 -6.577 -1.564) 8.578 18.496 ( 3.649 -5.265 -3.419) 7.261 21.265 ( -2.355 -10.260 -4.295) 11.369 21.297 ( 5.045 -10.737 -2.519) 12.128 21.750 ( -5.951 -0.815 0.549) 6.032 21.818 ( 4.687 -1.978 1.752) 5.381 ======================= Grid point 227 (115/170) ======================= q-point: (-0.36 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.892 ( -16.257 2.427 -2.572) 16.637 2.002 ( -15.221 8.838 4.095) 18.071 2.473 ( 10.336 -2.978 0.997) 10.802 2.565 ( 5.989 1.317 -5.442) 8.199 2.748 ( -2.266 0.923 5.013) 5.578 2.993 ( 1.051 -0.854 0.305) 1.388 3.021 ( 0.779 0.105 -5.117) 5.177 3.224 ( 7.680 -2.854 0.876) 8.240 3.274 ( 7.948 1.095 1.826) 8.228 3.316 ( 9.356 1.238 0.106) 9.438 3.357 ( 1.306 -4.050 1.625) 4.555 3.596 ( 7.309 1.477 -6.191) 9.692 3.677 ( -3.001 2.346 1.085) 3.961 3.816 ( 1.344 -5.340 -4.363) 7.026 3.940 ( -17.230 -7.722 -1.147) 18.916 4.101 ( -19.186 -4.784 -0.272) 19.776 4.498 ( 4.606 -1.145 -5.993) 7.644 4.839 ( -6.878 9.105 -1.054) 11.459 5.031 ( -8.033 0.060 2.179) 8.324 5.191 ( 2.299 7.965 2.511) 8.662 5.326 ( 9.734 -6.913 0.921) 11.975 5.498 ( -2.952 9.951 -0.136) 10.380 5.521 ( -1.000 -0.034 -0.109) 1.006 5.830 ( 9.113 -3.660 4.903) 10.976 5.881 ( 6.250 6.093 3.952) 9.582 5.975 ( 1.953 1.650 0.669) 2.642 6.163 ( -3.118 3.504 -3.747) 6.003 6.370 ( 3.412 -3.549 -2.630) 5.582 7.270 ( -3.768 4.894 0.201) 6.179 7.404 ( 0.006 5.156 -1.622) 5.405 7.747 ( -2.918 8.789 3.832) 10.023 8.023 ( 5.994 7.089 9.579) 13.339 8.062 ( -5.480 0.417 -4.094) 6.853 8.325 ( 2.639 4.452 -8.795) 10.205 9.335 ( -3.083 -3.344 -3.826) 5.943 9.459 ( -1.979 -2.798 2.041) 3.989 9.684 ( -5.804 -1.629 0.218) 6.032 9.961 ( 1.708 -2.664 4.262) 5.308 10.321 ( -3.960 1.332 0.673) 4.232 10.475 ( 2.229 2.013 -5.092) 5.912 10.675 ( 1.828 7.877 0.067) 8.087 10.754 ( 4.586 -0.170 -1.162) 4.734 11.162 ( 2.529 -0.676 3.323) 4.231 11.360 ( 6.611 -3.670 -0.512) 7.579 12.496 ( -13.287 1.730 -1.632) 13.498 12.952 ( 5.032 -4.649 2.639) 7.341 13.224 ( -7.382 2.737 -1.037) 7.940 13.288 ( -4.376 -1.737 1.300) 4.884 16.665 ( 0.360 10.671 0.644) 10.696 16.961 ( 11.685 15.280 0.624) 19.246 17.144 ( -1.786 9.790 10.640) 14.569 17.596 ( 15.356 12.620 3.147) 20.124 18.069 ( -6.509 -3.974 3.405) 8.352 18.124 ( -5.380 -3.196 -6.085) 8.728 18.235 ( -5.281 -2.624 -4.117) 7.192 18.466 ( -3.181 -7.089 -3.250) 8.422 21.205 ( -0.399 -7.587 -2.613) 8.035 21.364 ( 5.593 -10.126 -0.667) 11.587 21.642 ( -8.066 1.739 -0.329) 8.258 21.899 ( 3.713 -2.779 0.808) 4.708 ======================= Grid point 228 (116/170) ======================= q-point: (-0.27 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( -14.781 11.279 4.886) 19.224 1.803 ( -17.201 14.127 8.947) 23.989 2.611 ( 5.297 -1.985 -0.345) 5.667 2.657 ( 9.552 -3.915 -3.530) 10.910 2.794 ( 3.165 -0.311 3.115) 4.452 2.959 ( 1.599 -0.239 -6.610) 6.805 2.994 ( -1.009 -0.007 0.086) 1.012 3.247 ( -11.000 6.518 -0.894) 12.817 3.303 ( 1.137 -2.531 -0.578) 2.835 3.367 ( 0.487 -0.099 -6.788) 6.806 3.528 ( -5.010 4.322 8.659) 10.897 3.593 ( 3.532 0.321 2.167) 4.156 3.690 ( 7.127 2.120 4.857) 8.882 3.767 ( 1.212 -5.870 -0.303) 6.002 3.812 ( -1.003 -0.855 3.753) 3.977 3.966 ( 0.820 -6.898 -3.250) 7.669 4.498 ( 2.899 3.778 -2.519) 5.387 4.743 ( -4.486 7.497 -2.834) 9.185 4.895 ( -5.689 7.655 2.185) 9.784 5.110 ( -9.117 9.972 -0.557) 13.523 5.378 ( -9.845 10.181 0.848) 14.188 5.525 ( 4.692 -6.977 2.090) 8.664 5.604 ( 8.895 -1.110 1.116) 9.034 5.952 ( 3.391 -4.031 -7.138) 8.871 6.011 ( 8.020 3.819 -4.827) 10.109 6.066 ( -0.342 -7.321 7.444) 10.446 6.165 ( 7.784 3.533 7.862) 11.614 6.334 ( -0.761 -7.151 -3.957) 8.208 7.213 ( -1.176 3.828 -2.356) 4.646 7.400 ( 0.108 2.587 1.503) 2.994 7.748 ( 0.756 10.268 -0.518) 10.309 7.917 ( -8.748 2.000 -0.486) 8.987 8.206 ( 5.643 9.945 2.849) 11.784 8.249 ( -3.628 1.859 -3.494) 5.369 9.265 ( -2.207 -2.623 -1.707) 3.830 9.381 ( -7.151 -1.634 2.359) 7.705 9.682 ( 1.181 1.761 2.085) 2.974 10.020 ( -0.027 0.679 4.264) 4.318 10.259 ( -4.106 -1.136 -0.437) 4.282 10.469 ( 3.731 1.462 -3.653) 5.422 10.715 ( 3.129 8.726 -0.056) 9.270 10.827 ( 7.524 -2.941 -1.871) 8.293 11.260 ( 5.618 -1.136 1.648) 5.964 11.453 ( 5.771 -4.628 -0.951) 7.458 12.278 ( -13.490 3.795 1.208) 14.066 13.001 ( -3.404 -7.583 1.038) 8.377 13.065 ( -9.692 3.355 -2.474) 10.550 13.211 ( -4.202 -3.822 -0.595) 5.711 16.707 ( 4.534 5.165 -0.552) 6.894 17.128 ( 7.333 5.424 -1.950) 9.327 17.210 ( 2.471 11.061 -0.511) 11.345 17.800 ( 13.489 7.904 -9.508) 18.298 17.933 ( -7.164 -6.777 -5.229) 11.162 18.111 ( -2.841 1.678 11.068) 11.549 18.173 ( -0.530 0.702 7.273) 7.326 18.338 ( -7.636 -8.407 -2.202) 11.569 21.188 ( 0.121 -1.945 -0.632) 2.049 21.449 ( 2.715 -5.637 2.404) 6.703 21.497 ( -7.408 2.054 -1.698) 7.872 21.956 ( 3.214 -3.128 0.072) 4.486 ======================= Grid point 229 (117/170) ======================= q-point: (-0.18 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( -8.214 20.271 12.999) 25.443 1.696 ( -13.042 18.006 15.279) 26.977 2.605 ( -2.677 -4.667 -4.088) 6.757 2.696 ( -1.358 -1.191 -2.328) 2.947 2.865 ( -14.144 16.806 -0.254) 21.967 2.888 ( 2.464 1.066 -0.035) 2.685 3.016 ( 6.388 -1.420 -0.137) 6.546 3.052 ( -1.615 -0.882 7.350) 7.577 3.265 ( -0.042 -6.083 -6.783) 9.111 3.378 ( 2.966 2.675 -2.553) 4.740 3.523 ( -0.085 -1.078 1.065) 1.518 3.639 ( 2.330 -0.843 -3.401) 4.208 3.776 ( 0.866 -7.779 -0.217) 7.830 3.904 ( 4.874 4.825 5.741) 8.944 3.941 ( 6.687 1.454 12.781) 14.498 4.024 ( 4.794 -3.277 6.780) 8.927 4.497 ( -0.302 9.078 -1.605) 9.224 4.683 ( -2.082 9.160 2.873) 9.823 4.951 ( 6.706 7.332 0.881) 9.975 4.961 ( -6.743 10.330 -0.351) 12.341 5.214 ( -10.632 13.710 0.079) 17.349 5.531 ( -1.739 -0.870 -2.930) 3.516 5.742 ( 4.632 -5.740 2.064) 7.659 5.842 ( -2.194 -0.937 -10.331) 10.602 6.012 ( -7.604 -6.190 2.397) 10.094 6.085 ( 3.288 -4.851 -4.840) 7.601 6.262 ( 1.919 0.662 0.449) 2.079 6.525 ( 15.625 -9.658 6.275) 19.412 7.189 ( 1.469 1.217 -2.418) 3.080 7.447 ( 1.858 0.228 3.760) 4.200 7.719 ( -3.530 5.871 -5.800) 8.976 7.795 ( -5.644 5.511 3.803) 8.757 8.118 ( -5.387 3.418 -4.928) 8.061 8.282 ( 0.911 10.736 1.061) 10.827 9.219 ( -4.113 0.952 2.626) 4.972 9.352 ( -0.247 -0.734 2.534) 2.650 9.718 ( 0.077 2.246 1.084) 2.495 10.047 ( -0.323 5.673 0.290) 5.690 10.204 ( -0.861 -1.514 -0.220) 1.755 10.522 ( 5.939 -0.410 -0.569) 5.980 10.761 ( 3.715 7.039 -1.785) 8.156 10.957 ( 9.569 -3.935 0.169) 10.348 11.347 ( 4.307 -2.874 -1.223) 5.320 11.524 ( 5.529 -4.504 -1.315) 7.252 12.112 ( -12.628 4.748 5.890) 14.721 12.849 ( -10.839 -1.713 -2.705) 11.302 12.878 ( -12.693 -3.280 -0.855) 13.138 13.171 ( -0.447 -5.188 -2.072) 5.605 16.784 ( 6.704 -2.000 -1.916) 7.253 17.037 ( -2.495 1.301 -15.459) 15.714 17.232 ( -3.022 -3.008 0.727) 4.325 17.764 ( -5.846 -5.665 -9.694) 12.659 17.878 ( 8.681 6.683 -5.348) 12.191 18.151 ( 3.445 0.929 0.801) 3.657 18.263 ( -3.394 -2.726 8.933) 9.937 18.397 ( 6.868 5.200 12.613) 15.274 21.175 ( -1.473 2.003 -0.564) 2.549 21.328 ( -9.373 5.772 -0.501) 11.018 21.559 ( 4.067 -3.929 4.181) 7.033 22.009 ( 3.118 -2.281 0.580) 3.907 ======================= Grid point 230 (118/170) ======================= q-point: (-0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( -4.580 22.784 16.801) 28.677 1.703 ( -8.503 18.473 14.917) 25.220 2.485 ( -2.894 -1.771 -8.645) 9.287 2.628 ( -3.649 6.452 2.168) 7.723 2.747 ( -5.474 15.562 9.387) 18.980 2.896 ( 0.310 -1.587 -2.133) 2.677 3.047 ( -1.567 1.293 5.644) 5.999 3.188 ( -0.476 -6.756 -5.401) 8.663 3.246 ( 9.419 -7.004 2.054) 11.916 3.335 ( 0.307 1.169 -6.062) 6.181 3.522 ( 0.118 -7.486 -4.993) 8.999 3.629 ( 0.104 1.879 0.312) 1.907 3.841 ( 4.729 -8.731 0.034) 9.930 4.039 ( 9.040 8.347 2.717) 12.600 4.165 ( 5.327 3.077 12.651) 14.068 4.231 ( -1.335 1.649 20.068) 20.180 4.520 ( 3.155 12.227 1.589) 12.727 4.671 ( -3.696 9.738 0.411) 10.424 4.856 ( -3.069 14.549 -0.776) 14.890 5.057 ( -1.935 6.551 -1.326) 6.959 5.078 ( -2.422 8.598 -0.046) 8.933 5.451 ( -1.091 -2.270 -5.046) 5.639 5.723 ( 0.740 1.647 -4.988) 5.305 5.798 ( 1.207 -1.299 -0.303) 1.799 5.894 ( -9.373 -6.506 3.868) 12.048 6.080 ( -0.751 -6.185 -1.707) 6.460 6.292 ( 3.166 -2.831 -2.810) 5.092 6.739 ( 7.789 -8.297 -4.299) 12.165 7.209 ( 3.350 -0.954 -0.904) 3.599 7.500 ( -0.783 -5.695 -2.218) 6.161 7.591 ( -5.013 3.343 4.520) 7.533 7.785 ( 0.392 6.518 -0.019) 6.530 8.011 ( -2.771 4.748 -1.170) 5.621 8.275 ( -0.417 11.945 -2.928) 12.305 9.193 ( -3.876 4.175 3.801) 6.849 9.399 ( 1.436 -1.527 2.310) 3.119 9.683 ( -3.382 2.725 -0.949) 4.446 10.013 ( -0.714 9.715 -4.508) 10.734 10.268 ( 7.293 1.568 1.659) 7.642 10.617 ( 4.548 0.611 0.330) 4.601 10.783 ( 1.026 1.278 -0.819) 1.833 11.104 ( 9.021 -4.602 -1.166) 10.194 11.360 ( -0.525 -5.029 -1.161) 5.188 11.603 ( 5.866 -4.975 -2.832) 8.197 12.010 ( -10.771 4.705 10.473) 15.743 12.675 ( -5.206 4.707 -7.061) 9.956 12.692 ( -11.004 -6.486 6.650) 14.401 13.118 ( -1.553 -5.240 -4.930) 7.360 16.828 ( 3.010 -3.904 -9.448) 10.657 16.899 ( 4.723 -8.623 -2.798) 10.222 17.119 ( -9.555 -10.118 -1.110) 13.961 17.493 ( -10.632 -10.687 -13.398) 20.168 18.005 ( 8.681 6.777 2.847) 11.375 18.252 ( 4.275 5.062 1.744) 6.851 18.351 ( 5.522 5.345 3.067) 8.274 18.576 ( 0.690 5.070 5.845) 7.768 21.129 ( -2.172 1.573 -1.601) 3.123 21.205 ( -5.032 6.810 -0.496) 8.481 21.676 ( 2.369 -0.115 7.626) 7.986 22.059 ( 2.108 -0.587 0.408) 2.226 ======================= Grid point 231 (119/170) ======================= q-point: ( 0.00 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( -5.335 9.411 5.801) 12.275 2.127 ( -2.694 13.740 12.875) 19.021 2.361 ( -0.340 1.760 -10.105) 10.263 2.645 ( 3.209 0.062 -6.358) 7.122 2.773 ( 1.843 -4.669 -1.636) 5.279 2.831 ( -2.383 -2.393 -2.601) 4.263 2.956 ( -0.730 -3.452 -6.360) 7.273 3.120 ( 4.363 -7.391 -9.871) 13.081 3.207 ( -1.880 -6.675 4.846) 8.460 3.307 ( 1.334 -6.386 1.693) 6.740 3.500 ( 7.741 5.572 7.122) 11.904 3.739 ( 0.397 -0.805 -2.169) 2.347 4.100 ( 0.117 26.734 19.754) 33.240 4.322 ( -0.258 2.480 8.792) 9.139 4.359 ( -0.335 -1.455 9.832) 9.945 4.555 ( 2.061 12.452 12.888) 18.039 4.803 ( -5.741 14.956 -4.694) 16.693 4.834 ( 0.415 9.814 5.648) 11.331 5.035 ( -5.234 7.359 -0.125) 9.031 5.107 ( -0.884 3.689 -1.604) 4.119 5.211 ( 2.126 14.056 -7.264) 15.965 5.384 ( 3.247 3.205 -5.545) 7.181 5.671 ( -5.662 -9.368 4.656) 11.895 5.732 ( -0.570 -3.140 5.755) 6.580 5.849 ( 5.919 -6.246 -2.329) 8.915 5.933 ( -0.084 1.002 -1.132) 1.515 6.171 ( -0.397 -7.823 -3.385) 8.533 6.518 ( -0.315 -11.857 -12.646) 17.338 7.245 ( 1.460 -0.177 0.221) 1.488 7.296 ( -4.694 -3.723 -1.931) 6.295 7.618 ( 0.770 -2.088 4.428) 4.955 7.788 ( 4.737 -5.241 -3.447) 7.860 8.196 ( -0.597 11.679 2.538) 11.966 8.405 ( -0.642 7.491 -7.172) 10.390 9.283 ( -2.054 4.488 5.447) 7.350 9.407 ( -0.466 -0.089 1.831) 1.892 9.796 ( -0.362 8.988 7.529) 11.730 10.158 ( 0.425 10.044 -2.381) 10.331 10.492 ( 11.084 3.462 -0.163) 11.613 10.637 ( -3.947 -2.957 5.438) 7.341 10.757 ( -6.338 5.304 -6.228) 10.348 11.054 ( 5.497 -7.973 -7.979) 12.548 11.202 ( -3.261 -6.869 2.732) 8.080 11.433 ( -2.066 -8.907 -5.575) 10.709 12.181 ( 0.725 6.688 11.748) 13.538 12.568 ( 0.293 -3.668 -0.341) 3.695 12.688 ( 0.158 3.470 0.311) 3.487 12.935 ( -0.530 -4.711 -5.784) 7.479 16.671 ( 2.154 -9.211 -1.203) 9.536 16.685 ( -2.923 -9.557 -1.570) 10.117 16.860 ( -2.586 -2.915 -5.134) 6.445 17.035 ( -0.626 -8.143 -13.116) 15.451 18.258 ( 1.259 3.967 6.507) 7.724 18.342 ( 0.566 1.512 3.400) 3.764 18.636 ( 4.805 5.885 1.014) 7.665 18.657 ( -4.449 5.282 0.035) 6.906 21.142 ( 1.379 2.445 -1.520) 3.192 21.222 ( -0.351 1.865 -4.533) 4.915 21.853 ( 0.211 4.231 9.685) 10.571 22.069 ( -0.079 -0.954 -0.057) 0.959 ======================= Grid point 232 (120/170) ======================= q-point: ( 0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( 1.819 4.953 11.151) 12.337 2.205 ( -1.997 1.063 6.080) 6.488 2.311 ( 4.032 7.659 -1.611) 8.804 2.599 ( 3.237 3.596 -10.688) 11.732 2.770 ( -2.391 -0.873 -2.150) 3.332 2.797 ( 1.784 -3.050 -0.235) 3.542 2.900 ( -0.324 -3.774 -1.790) 4.190 3.080 ( 3.011 -6.194 -7.496) 10.180 3.198 ( -4.790 -7.842 2.139) 9.435 3.320 ( 1.498 -6.790 -0.491) 6.971 3.607 ( -6.770 2.974 -6.415) 9.789 3.675 ( 1.296 1.527 3.247) 3.815 4.223 ( -12.381 4.211 1.797) 13.201 4.391 ( 5.642 24.170 23.231) 33.996 4.503 ( -10.776 13.720 -0.308) 17.448 4.596 ( 5.985 -2.055 3.834) 7.399 4.723 ( 2.720 13.414 -3.296) 14.078 4.887 ( -3.970 8.772 3.064) 10.104 4.976 ( -2.078 6.271 6.184) 9.049 5.094 ( 0.477 1.780 1.646) 2.471 5.238 ( 7.277 14.312 -3.864) 16.514 5.356 ( 2.248 3.476 -10.568) 11.349 5.619 ( -5.890 -4.558 5.990) 9.558 5.811 ( -1.120 3.280 5.393) 6.411 5.883 ( 3.149 -9.950 -3.167) 10.906 5.960 ( 5.933 -1.989 1.094) 6.353 6.140 ( -4.594 -11.090 3.478) 12.498 6.328 ( -3.240 -12.071 -15.005) 19.528 7.181 ( -4.381 -1.029 -0.485) 4.527 7.320 ( 3.249 -2.573 1.787) 4.513 7.704 ( 5.698 0.205 1.042) 5.796 7.848 ( 7.511 -3.521 -4.598) 9.484 8.229 ( -0.297 9.098 4.143) 10.001 8.327 ( 0.970 7.014 -5.300) 8.844 9.336 ( 0.675 3.559 6.098) 7.093 9.422 ( 1.245 1.148 0.023) 1.694 9.881 ( -1.149 10.544 8.669) 13.698 10.098 ( 0.266 13.621 -8.927) 16.288 10.564 ( -5.150 3.592 -8.453) 10.530 10.600 ( -8.270 3.969 8.240) 12.331 10.667 ( 4.619 -6.602 3.670) 8.854 10.947 ( -4.184 -4.581 -9.739) 11.547 11.228 ( -2.049 -7.906 6.882) 10.680 11.343 ( -1.991 -9.434 -4.468) 10.627 12.368 ( 6.340 5.038 10.737) 13.449 12.567 ( 7.263 2.026 -9.310) 11.981 12.764 ( 2.840 -3.042 6.094) 7.379 12.882 ( 2.535 -3.552 -5.767) 7.232 16.601 ( -2.877 -3.221 -2.392) 4.937 16.723 ( -1.457 -3.835 -1.016) 4.226 16.832 ( 9.105 -9.347 0.246) 13.051 17.035 ( 11.189 -11.789 -4.182) 16.783 18.237 ( -7.865 7.706 1.236) 11.080 18.408 ( 0.511 3.305 1.065) 3.509 18.497 ( -9.948 6.054 -0.147) 11.646 18.713 ( 1.239 1.771 1.334) 2.540 21.176 ( 3.979 1.430 -0.869) 4.316 21.203 ( 3.619 1.610 -3.099) 5.029 21.923 ( -3.715 2.137 7.726) 8.834 22.020 ( -3.974 -0.065 -2.720) 4.816 ======================= Grid point 233 (121/170) ======================= q-point: ( 0.18 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( 2.459 -1.528 3.532) 4.567 2.263 ( 6.479 1.691 12.279) 13.986 2.391 ( 2.910 5.433 2.934) 6.826 2.508 ( 1.117 8.909 -12.471) 15.367 2.714 ( -1.698 -1.489 -0.549) 2.324 2.811 ( -0.722 1.493 1.008) 1.941 2.896 ( -1.452 -5.212 2.173) 5.831 3.051 ( 0.625 -5.339 -2.532) 5.942 3.100 ( -6.488 -7.906 -3.231) 10.726 3.349 ( 2.613 -6.966 -1.381) 7.568 3.443 ( -2.615 0.820 -6.397) 6.960 3.631 ( -5.685 -5.171 -0.858) 7.732 4.078 ( -8.657 11.864 2.385) 14.879 4.246 ( -16.086 12.082 -2.413) 20.262 4.648 ( 1.749 12.565 -6.580) 14.291 4.694 ( 0.303 3.918 -9.597) 10.370 4.726 ( 6.719 6.485 13.072) 16.065 4.836 ( -1.145 7.421 -0.031) 7.509 5.023 ( -1.464 5.568 6.089) 8.380 5.165 ( -2.711 6.264 -2.352) 7.219 5.230 ( 3.098 2.051 -0.764) 3.793 5.351 ( 7.798 9.459 1.979) 12.418 5.630 ( -3.563 -1.726 6.822) 7.888 5.751 ( -3.310 2.973 -5.089) 6.760 5.945 ( 1.358 -7.790 -3.666) 8.716 6.059 ( 4.473 -10.164 -9.111) 14.364 6.117 ( -3.481 -9.769 13.209) 16.794 6.153 ( -1.227 -5.373 -1.843) 5.811 7.139 ( -1.245 1.806 0.618) 2.279 7.393 ( 2.423 -3.390 2.855) 5.051 7.801 ( 5.169 6.220 -0.887) 8.136 7.908 ( 6.137 3.790 -2.709) 7.705 8.255 ( 1.865 5.734 -0.591) 6.059 8.360 ( 5.481 2.430 0.904) 6.063 9.413 ( 0.795 1.586 1.643) 2.418 9.445 ( 2.779 1.250 -0.120) 3.049 9.923 ( -4.909 9.745 7.418) 13.194 9.996 ( -0.306 11.098 -8.278) 13.849 10.403 ( -1.994 0.341 -8.927) 9.153 10.556 ( -9.113 -0.639 9.767) 13.373 10.701 ( -3.385 -2.182 -5.523) 6.835 10.836 ( 0.806 0.331 0.760) 1.156 11.241 ( -4.918 -7.198 3.794) 9.508 11.277 ( -1.836 -7.933 -0.876) 8.190 12.588 ( 8.584 4.643 -0.446) 9.770 12.610 ( 9.586 4.119 -0.084) 10.434 12.853 ( 4.039 -4.203 0.424) 5.845 12.918 ( 5.163 -5.418 0.702) 7.517 16.580 ( 0.086 2.773 2.941) 4.043 16.681 ( -2.214 2.225 1.885) 3.661 17.067 ( 16.366 -11.134 1.642) 19.862 17.230 ( 14.198 -11.500 1.253) 18.314 18.075 ( -11.870 11.578 -1.274) 16.630 18.247 ( -12.650 10.099 -0.171) 16.187 18.487 ( 2.043 -2.213 -1.441) 3.339 18.706 ( -2.077 -2.281 -1.298) 3.347 21.222 ( 4.554 1.282 -2.656) 5.425 21.271 ( 4.750 1.407 1.703) 5.238 21.877 ( -6.812 -0.590 -3.917) 7.880 21.920 ( -6.394 -1.486 2.973) 7.206 ======================= Grid point 234 (122/170) ======================= q-point: ( 0.27 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( 0.018 0.511 -3.148) 3.189 2.363 ( -1.852 5.955 -5.425) 8.265 2.446 ( 4.850 9.194 -2.105) 10.606 2.520 ( 7.164 -2.279 7.291) 10.473 2.727 ( -0.254 0.060 4.313) 4.321 2.813 ( -2.187 1.846 5.272) 5.999 2.887 ( -3.560 -3.846 2.610) 5.854 2.926 ( -8.304 -4.610 0.215) 9.501 3.085 ( 4.502 -6.962 -2.419) 8.636 3.331 ( -0.459 -5.430 -3.899) 6.701 3.410 ( 3.451 -5.589 -2.449) 7.010 3.586 ( -0.721 -5.670 1.766) 5.982 3.941 ( -12.987 10.851 -1.116) 16.960 3.992 ( -9.883 6.321 -0.950) 11.770 4.506 ( -6.041 -2.413 -15.150) 16.488 4.559 ( 1.650 14.394 -12.807) 19.337 4.697 ( -6.014 -3.938 -6.117) 9.439 4.949 ( 1.038 10.972 -5.861) 12.482 5.048 ( 2.415 1.886 5.497) 6.293 5.093 ( 4.219 8.641 3.525) 10.242 5.384 ( 0.417 2.634 7.309) 7.781 5.514 ( 2.492 0.553 6.486) 6.970 5.598 ( -0.042 2.147 0.280) 2.165 5.663 ( -6.985 -6.589 4.353) 10.543 5.775 ( -0.893 -1.822 -14.340) 14.482 6.043 ( 2.456 -3.981 -4.011) 6.162 6.215 ( 0.696 -5.238 7.878) 9.486 6.260 ( 4.526 -0.529 5.507) 7.147 7.148 ( 0.300 4.717 2.268) 5.243 7.455 ( 1.680 -2.424 2.709) 4.005 7.814 ( -0.678 11.429 -1.920) 11.609 8.002 ( 4.133 11.502 3.240) 12.644 8.290 ( 5.902 -0.261 -4.414) 7.375 8.474 ( 7.345 -0.446 -0.378) 7.368 9.366 ( -2.885 2.415 -4.408) 5.795 9.486 ( 1.578 -1.193 -1.323) 2.380 9.886 ( -5.472 6.595 -2.712) 8.989 9.961 ( 1.111 3.401 5.772) 6.791 10.305 ( 0.972 -2.501 -8.814) 9.214 10.516 ( -8.209 -5.214 6.602) 11.754 10.606 ( 0.673 6.613 -2.510) 7.105 10.865 ( -0.325 3.626 0.660) 3.700 11.191 ( -3.680 -6.754 1.628) 7.862 11.244 ( -3.951 -4.930 1.881) 6.592 12.633 ( 8.251 5.314 -9.266) 13.497 12.822 ( 5.833 4.191 8.432) 11.077 12.951 ( 8.434 -5.820 -0.561) 10.263 13.013 ( 3.895 -4.974 4.186) 7.579 16.648 ( 0.693 5.377 6.447) 8.423 16.717 ( 0.026 5.355 8.566) 10.102 17.333 ( 14.693 -2.453 -0.434) 14.902 17.455 ( 6.960 -0.094 6.689) 9.654 17.878 ( -8.704 8.610 -1.780) 12.372 18.111 ( -3.384 2.390 0.769) 4.214 18.473 ( 0.409 -3.814 -4.688) 6.058 18.626 ( -3.050 -3.786 -5.294) 7.188 21.248 ( 1.971 1.296 -2.957) 3.783 21.360 ( 2.860 -0.469 2.006) 3.525 21.703 ( -5.932 -1.850 -6.598) 9.064 21.842 ( -7.048 -4.959 2.370) 8.938 ======================= Grid point 235 (123/170) ======================= q-point: ( 0.36 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( -2.111 4.657 -9.555) 10.837 2.332 ( -2.703 2.697 1.923) 4.275 2.509 ( 8.062 2.405 -5.604) 10.109 2.607 ( -1.592 0.806 -2.681) 3.220 2.761 ( -0.011 6.672 4.727) 8.176 2.805 ( 1.885 -2.201 -0.588) 2.957 2.910 ( -2.265 -1.694 6.135) 6.756 2.944 ( -1.065 -4.358 13.878) 14.585 3.114 ( 1.902 -6.822 -2.436) 7.489 3.279 ( -2.188 -0.802 -2.091) 3.131 3.424 ( -3.451 -4.266 -0.727) 5.535 3.583 ( -2.036 -4.604 2.461) 5.603 3.772 ( -2.159 1.304 -2.420) 3.495 3.906 ( 1.272 -2.119 -2.450) 3.480 4.202 ( -7.598 -5.235 -17.962) 20.193 4.421 ( -6.347 -1.933 -7.072) 9.698 4.500 ( 0.108 2.762 -17.151) 17.372 4.912 ( 0.979 10.646 0.976) 10.736 5.114 ( -5.282 -5.342 -0.761) 7.551 5.220 ( 7.063 2.884 -3.501) 8.394 5.296 ( -7.337 -0.020 5.526) 9.185 5.535 ( -1.280 5.846 4.511) 7.494 5.611 ( -1.893 -2.134 5.264) 5.987 5.693 ( 1.443 8.710 -4.875) 10.086 5.819 ( 10.304 -0.343 7.372) 12.674 6.034 ( 0.171 -1.964 -1.535) 2.499 6.261 ( -0.601 -0.483 -0.501) 0.919 6.358 ( 2.024 0.884 2.105) 3.052 7.203 ( 1.703 6.811 5.328) 8.814 7.511 ( 1.957 0.205 2.368) 3.079 7.764 ( -3.085 12.263 -0.997) 12.685 8.070 ( -2.671 14.282 6.286) 15.831 8.336 ( 8.681 -3.735 -8.635) 12.802 8.540 ( 4.167 -0.189 -5.601) 6.984 9.284 ( -1.504 1.591 -2.176) 3.087 9.470 ( 0.144 -4.268 -2.630) 5.015 9.778 ( -3.468 2.628 -3.160) 5.378 10.037 ( -2.587 -4.698 3.922) 6.645 10.244 ( 3.770 1.570 -4.745) 6.261 10.497 ( -2.416 -4.929 6.327) 8.376 10.627 ( 3.376 8.003 -2.351) 8.999 10.838 ( -2.232 5.870 -0.647) 6.313 11.167 ( -4.017 -5.190 3.518) 7.447 11.198 ( -2.495 -3.567 0.053) 4.354 12.661 ( 6.740 4.621 -6.396) 10.377 12.910 ( -0.858 -1.878 0.669) 2.171 13.100 ( 6.887 -0.855 5.207) 8.676 13.153 ( 5.726 -2.244 6.024) 8.609 16.735 ( 1.556 7.211 6.681) 9.953 16.840 ( -1.370 4.915 13.047) 14.009 17.450 ( 1.582 17.927 -0.149) 17.997 17.523 ( -9.013 18.553 7.903) 22.088 17.880 ( 11.056 -7.804 -0.140) 13.534 18.168 ( 6.781 -8.379 1.617) 10.900 18.401 ( -0.981 -5.243 -6.714) 8.574 18.511 ( -2.132 -2.763 -7.623) 8.384 21.201 ( -1.309 -2.272 -6.227) 6.757 21.336 ( -4.498 -6.329 -5.437) 9.479 21.625 ( 1.607 -0.456 0.391) 1.715 21.776 ( -4.562 -5.314 2.975) 7.610 ======================= Grid point 236 (124/170) ======================= q-point: ( 0.45 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( 0.633 0.675 -3.709) 3.823 2.305 ( -3.783 -0.584 -1.077) 3.977 2.430 ( -3.753 3.592 -6.243) 8.122 2.626 ( 8.095 1.487 -6.219) 10.316 2.817 ( -1.487 5.200 5.052) 7.402 2.876 ( 4.563 -1.192 1.809) 5.051 2.970 ( 0.390 0.051 7.159) 7.170 3.043 ( -1.893 -1.387 6.678) 7.079 3.075 ( -4.316 -1.053 0.745) 4.504 3.206 ( -1.879 3.538 -2.386) 4.663 3.344 ( -2.775 -6.749 -0.797) 7.341 3.584 ( -0.465 -2.869 -0.350) 2.927 3.755 ( 2.838 -3.924 -8.465) 9.752 3.895 ( 1.862 -3.805 -10.129) 10.980 4.013 ( 1.534 -9.085 -2.185) 9.470 4.204 ( -8.062 -13.819 -3.957) 16.481 4.430 ( 12.613 -1.369 -13.569) 18.576 4.779 ( -16.927 -10.753 -8.902) 21.941 5.034 ( 3.610 10.274 5.181) 12.059 5.280 ( -4.046 5.020 4.151) 7.668 5.361 ( 8.127 3.967 1.939) 9.249 5.599 ( -7.735 7.434 7.519) 13.101 5.622 ( 0.850 4.578 5.809) 7.444 5.692 ( 4.708 7.459 -2.840) 9.266 5.969 ( 2.364 0.585 -5.222) 5.762 6.069 ( 3.196 -2.837 8.240) 9.282 6.191 ( -1.754 3.404 -6.792) 7.798 6.367 ( -1.676 0.969 -0.350) 1.968 7.316 ( 2.504 6.996 7.887) 10.836 7.566 ( 1.724 4.037 1.754) 4.727 7.718 ( -2.123 8.470 1.432) 8.848 8.062 ( -5.316 10.963 4.431) 12.965 8.342 ( 3.961 -3.268 -10.396) 11.595 8.490 ( 1.976 2.700 -9.149) 9.741 9.287 ( 2.407 0.155 1.183) 2.686 9.446 ( -0.691 -4.588 -2.140) 5.109 9.725 ( 0.706 -1.264 -1.451) 2.049 9.930 ( -8.301 -6.431 -3.277) 11.000 10.343 ( 7.182 3.103 2.248) 8.140 10.557 ( -1.173 0.151 6.979) 7.079 10.632 ( 3.688 4.789 -5.420) 8.119 10.802 ( -1.949 4.499 -0.205) 4.908 11.120 ( -5.457 -2.716 3.457) 7.008 11.192 ( 1.626 -3.113 -0.923) 3.632 12.710 ( 5.780 2.110 -2.610) 6.684 12.850 ( -5.063 -2.307 -1.997) 5.912 13.246 ( 3.110 1.358 5.958) 6.857 13.286 ( 2.496 -0.454 5.239) 5.821 16.846 ( 2.529 7.821 7.280) 10.980 16.921 ( -4.598 5.657 9.645) 12.090 17.430 ( -8.020 21.417 6.482) 23.770 17.503 ( 1.753 21.779 4.127) 22.236 18.061 ( 7.635 -6.748 -0.327) 10.195 18.245 ( -2.035 -8.430 1.409) 8.786 18.343 ( 3.648 -4.888 -5.956) 8.525 18.410 ( 1.317 -2.055 -7.255) 7.654 21.105 ( 0.492 -8.132 -7.883) 11.336 21.173 ( -4.185 -10.401 -8.599) 14.129 21.698 ( 3.247 -0.655 3.436) 4.773 21.757 ( -3.036 -2.999 3.382) 5.445 ======================= Grid point 237 (125/170) ======================= q-point: (-0.45 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( 1.678 -1.713 1.663) 2.918 2.138 ( -6.123 -2.730 -5.144) 8.450 2.391 ( -0.143 6.796 -0.978) 6.868 2.626 ( 1.729 0.568 -7.168) 7.395 2.805 ( -6.165 2.276 3.909) 7.646 2.930 ( -0.084 -2.593 1.055) 2.801 3.029 ( 1.198 1.288 0.261) 1.778 3.069 ( 4.771 3.073 5.006) 7.568 3.155 ( 5.448 -0.648 5.844) 8.016 3.185 ( -0.728 -0.636 -0.022) 0.967 3.299 ( 1.699 -4.654 -4.649) 6.794 3.562 ( 4.920 -3.432 -8.315) 10.253 3.720 ( 3.052 2.318 -1.614) 4.158 3.823 ( -0.702 -1.538 -8.251) 8.423 3.926 ( -7.604 -9.249 0.650) 11.992 4.230 ( 12.365 -13.318 -4.542) 18.732 4.396 ( -17.778 -7.779 -8.919) 21.356 4.598 ( 17.470 -13.441 -1.662) 22.105 5.162 ( -0.824 8.282 5.593) 10.027 5.227 ( -1.698 11.175 1.966) 11.473 5.463 ( -5.289 5.933 0.185) 7.950 5.524 ( 0.425 2.235 1.538) 2.746 5.672 ( -4.317 1.656 5.521) 7.201 5.785 ( 3.229 10.080 5.400) 11.883 5.907 ( -0.781 3.363 -3.508) 4.922 6.061 ( -0.719 2.279 -6.420) 6.850 6.224 ( 2.266 -1.525 3.993) 4.837 6.320 ( -0.814 0.573 -3.094) 3.250 7.403 ( -2.706 6.576 6.128) 9.387 7.579 ( -0.814 7.432 -1.302) 7.589 7.765 ( 1.686 2.415 7.553) 8.107 8.028 ( 0.351 6.045 -1.464) 6.230 8.238 ( -4.168 2.294 -4.946) 6.863 8.445 ( 4.146 2.855 -8.797) 10.136 9.353 ( 1.089 -1.697 0.939) 2.224 9.389 ( -0.705 -2.059 -2.446) 3.274 9.735 ( -5.052 -4.435 -0.090) 6.723 9.803 ( 2.210 -4.107 -0.905) 4.751 10.439 ( 0.236 5.261 1.022) 5.364 10.551 ( 0.772 4.363 -3.040) 5.374 10.698 ( 4.470 1.473 3.063) 5.616 10.758 ( -2.316 0.270 -0.919) 2.507 11.102 ( -1.255 -0.653 3.240) 3.535 11.220 ( 3.432 -3.242 -1.227) 4.878 12.712 ( -8.038 0.409 -1.851) 8.258 12.788 ( 4.130 -2.016 0.008) 4.596 13.314 ( -1.641 1.415 3.977) 4.529 13.333 ( -2.479 1.146 2.914) 3.994 16.903 ( -5.449 9.240 5.201) 11.921 16.986 ( 3.539 6.448 6.620) 9.896 17.404 ( -4.411 19.605 7.025) 21.288 17.641 ( 8.990 17.223 4.081) 19.852 18.055 ( -7.199 -5.318 2.118) 9.197 18.183 ( -4.999 -5.421 -1.896) 7.614 18.314 ( 0.855 -0.551 -5.578) 5.670 18.403 ( 3.192 -4.270 -5.519) 7.673 21.055 ( 0.991 -10.968 -6.908) 13.000 21.077 ( 5.560 -11.472 -5.599) 13.923 21.736 ( -3.838 -0.504 2.108) 4.407 21.781 ( 2.735 -1.851 2.688) 4.258 ======================= Grid point 238 (126/170) ======================= q-point: (-0.36 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( -7.227 4.802 -1.497) 8.805 2.181 ( -5.736 7.677 5.125) 10.868 2.411 ( 7.903 -2.520 -1.068) 8.364 2.581 ( 2.010 0.368 -4.136) 4.614 2.745 ( -4.444 -0.400 2.313) 5.026 2.930 ( -0.214 -3.827 -0.689) 3.895 3.040 ( -1.362 -1.224 -1.520) 2.380 3.143 ( 0.878 -4.552 -1.172) 4.782 3.251 ( 5.155 -2.933 5.834) 8.319 3.275 ( 4.556 -0.508 0.963) 4.684 3.373 ( 11.285 2.442 -0.852) 11.578 3.593 ( 8.241 -1.472 -4.566) 9.535 3.743 ( -2.058 -1.041 -0.603) 2.384 3.747 ( 2.101 -1.709 -5.542) 6.168 3.871 ( 0.158 1.926 2.566) 3.213 4.047 ( -14.547 1.867 -5.524) 15.672 4.388 ( 12.376 -9.749 -4.039) 16.264 4.869 ( 13.001 -13.571 4.150) 19.247 5.056 ( -7.693 10.245 -1.474) 12.897 5.299 ( -5.164 5.262 -4.600) 8.690 5.355 ( 1.620 6.460 6.230) 9.120 5.532 ( -1.998 2.402 -1.024) 3.288 5.648 ( -7.628 0.724 9.448) 12.165 5.778 ( -2.122 3.707 -3.493) 5.518 5.971 ( 2.731 -0.909 3.367) 4.430 6.037 ( 5.320 6.765 -2.487) 8.958 6.204 ( -2.359 0.817 -3.367) 4.191 6.320 ( 0.629 -2.025 0.163) 2.127 7.375 ( -5.539 6.051 2.289) 8.517 7.518 ( -4.317 5.518 -1.371) 7.139 7.865 ( 2.430 3.854 2.769) 5.332 8.051 ( 0.308 -0.827 -2.810) 2.945 8.180 ( -0.111 8.433 6.903) 10.899 8.406 ( 2.527 2.867 -8.074) 8.933 9.288 ( -3.010 -1.333 -2.513) 4.141 9.393 ( -2.906 -3.826 0.381) 4.820 9.672 ( -0.191 0.632 1.275) 1.436 9.892 ( 4.260 -4.616 2.913) 6.924 10.374 ( -4.711 4.314 -2.541) 6.875 10.544 ( 1.035 4.694 -2.810) 5.568 10.729 ( 2.063 -1.922 -1.795) 3.342 10.806 ( 3.858 5.018 2.365) 6.757 11.145 ( 2.482 -1.046 2.322) 3.556 11.274 ( 4.724 -5.102 -0.749) 6.994 12.546 ( -10.604 3.519 -0.812) 11.202 12.848 ( 1.400 -5.958 1.827) 6.387 13.273 ( -6.882 2.206 -0.099) 7.227 13.280 ( -6.053 0.639 0.986) 6.166 16.864 ( -3.956 9.921 1.739) 10.821 17.113 ( 3.967 3.993 4.602) 7.271 17.426 ( -3.808 14.080 5.954) 15.754 17.811 ( 6.950 3.697 -2.887) 8.385 17.970 ( -5.719 1.759 6.798) 9.056 18.106 ( -2.232 0.588 2.402) 3.331 18.230 ( -2.598 0.625 -6.006) 6.574 18.335 ( -2.862 -5.623 -7.379) 9.709 21.058 ( 5.983 -7.396 -2.899) 9.945 21.156 ( 8.878 -10.896 -1.464) 14.131 21.677 ( -5.529 2.081 0.377) 5.919 21.840 ( 2.351 -3.252 0.901) 4.113 ======================= Grid point 239 (127/170) ======================= q-point: (-0.27 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( -3.747 13.800 5.589) 15.354 2.093 ( -9.760 15.109 5.796) 18.898 2.556 ( 7.652 -6.262 -0.570) 9.904 2.606 ( 3.666 1.268 -1.336) 4.102 2.738 ( 1.346 -4.239 2.046) 4.896 2.907 ( 1.179 -4.613 -3.435) 5.871 2.980 ( -3.143 -1.636 -0.227) 3.550 3.171 ( 2.688 -8.097 -1.525) 8.667 3.247 ( -0.126 -1.743 -5.738) 5.998 3.380 ( 0.955 -0.118 -1.956) 2.180 3.537 ( 6.346 -2.414 1.210) 6.897 3.592 ( -7.772 -6.789 -2.974) 10.739 3.728 ( 7.687 0.773 7.277) 10.614 3.813 ( 4.582 -5.393 -0.610) 7.103 3.880 ( 2.705 12.545 -0.234) 12.836 3.966 ( 2.102 18.784 6.208) 19.895 4.537 ( 9.767 -0.601 0.540) 9.801 4.937 ( -5.123 11.019 -1.182) 12.209 5.019 ( -0.548 2.311 4.335) 4.943 5.233 ( 2.437 -3.004 -3.791) 5.416 5.374 ( -2.889 3.090 4.286) 6.022 5.555 ( 4.353 -4.074 -0.140) 5.964 5.591 ( -7.654 6.727 1.248) 10.266 5.735 ( -2.377 -10.581 1.497) 10.948 5.976 ( -1.180 -2.980 -2.881) 4.310 6.073 ( 2.144 1.347 -7.138) 7.574 6.221 ( 7.736 2.405 2.150) 8.381 6.307 ( -3.115 0.876 2.013) 3.811 7.304 ( -3.549 5.393 -1.623) 6.657 7.448 ( -4.064 2.072 1.825) 4.914 7.912 ( 3.612 6.073 -3.419) 7.849 7.946 ( -10.126 1.026 1.533) 10.293 8.274 ( -4.542 3.448 4.785) 7.444 8.391 ( 7.986 6.113 -4.184) 10.893 9.237 ( -1.453 -0.163 -0.003) 1.462 9.340 ( -4.028 -2.553 2.869) 5.565 9.722 ( 2.217 2.650 2.409) 4.212 9.974 ( 0.997 -4.955 4.306) 6.640 10.282 ( -1.629 3.923 -3.915) 5.777 10.536 ( 2.199 3.929 -2.237) 5.028 10.764 ( 5.283 -2.309 -2.742) 6.385 10.881 ( 3.801 7.959 0.809) 8.857 11.216 ( 4.535 -3.700 -0.466) 5.872 11.345 ( 4.889 -6.274 -0.149) 7.955 12.374 ( -11.818 6.275 2.116) 13.547 12.846 ( -5.416 -8.595 2.028) 10.360 13.125 ( -9.338 2.646 -2.945) 10.143 13.170 ( -6.372 -0.781 -1.378) 6.566 16.817 ( -2.780 6.489 -0.678) 7.092 17.187 ( 2.620 0.785 -1.840) 3.296 17.327 ( -14.878 1.627 0.921) 14.995 17.777 ( -5.162 -6.707 -0.225) 8.466 18.011 ( 8.400 8.647 -10.691) 16.113 18.126 ( -3.080 0.298 1.452) 3.418 18.197 ( -2.537 -0.380 2.388) 3.505 18.263 ( 7.807 3.790 5.639) 10.350 21.148 ( 5.917 -2.147 0.126) 6.295 21.305 ( 8.914 -7.897 2.178) 12.107 21.577 ( -6.576 5.212 -0.479) 8.405 21.883 ( 3.060 -4.487 -0.201) 5.435 ======================= Grid point 240 (128/170) ======================= q-point: (-0.18 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -2.183 18.079 9.432) 20.508 2.054 ( -5.457 18.839 9.684) 21.874 2.567 ( -2.169 1.197 -5.332) 5.880 2.625 ( 2.430 -4.398 -1.377) 5.210 2.865 ( 7.372 -6.881 4.170) 10.913 2.890 ( 0.468 -5.560 -5.325) 7.713 2.951 ( 1.538 -2.531 -1.503) 3.321 3.134 ( -7.650 -1.175 2.788) 8.227 3.153 ( -0.330 -1.816 -6.910) 7.152 3.361 ( 2.239 -5.679 -0.468) 6.122 3.447 ( 2.548 -5.229 -16.590) 17.580 3.586 ( -1.288 -7.719 2.287) 8.153 3.862 ( -0.840 14.243 6.712) 15.768 3.984 ( 5.188 1.218 17.859) 18.637 4.017 ( 4.556 9.126 9.778) 14.129 4.130 ( 9.138 17.080 6.097) 20.307 4.676 ( 4.506 7.729 2.320) 9.243 4.880 ( -1.353 10.142 0.579) 10.248 5.071 ( 3.223 5.966 2.230) 7.138 5.166 ( -3.053 9.188 -3.092) 10.164 5.441 ( -0.078 -0.150 -0.241) 0.294 5.484 ( -4.515 2.774 1.451) 5.494 5.599 ( 1.651 -7.436 1.522) 7.768 5.686 ( -3.214 -12.285 -1.238) 12.759 5.893 ( -5.019 -4.416 -1.767) 6.915 6.018 ( 2.655 -2.195 -9.110) 9.740 6.269 ( -1.363 0.132 -0.785) 1.579 6.420 ( 11.630 -3.509 1.814) 12.283 7.240 ( -0.959 3.983 -2.969) 5.060 7.429 ( -2.369 -1.625 2.891) 4.075 7.770 ( -12.389 1.392 0.765) 12.490 7.896 ( -1.830 1.281 -4.063) 4.637 8.211 ( -4.213 8.462 1.382) 9.553 8.473 ( 4.954 7.001 -2.979) 9.080 9.242 ( -0.845 1.747 3.601) 4.091 9.343 ( -1.390 -0.508 4.656) 4.886 9.766 ( -0.763 2.852 2.336) 3.765 10.031 ( -0.578 -5.884 7.227) 9.337 10.262 ( 5.577 7.167 -4.977) 10.356 10.563 ( 3.699 4.226 -1.715) 5.872 10.831 ( 6.927 -3.507 -3.150) 8.379 10.948 ( 4.157 6.825 -0.312) 7.997 11.254 ( 2.761 -6.890 -3.441) 8.181 11.425 ( 5.831 -5.824 -0.916) 8.292 12.227 ( -12.383 7.462 5.885) 15.609 12.719 ( -12.485 -7.172 2.788) 14.666 12.934 ( -8.665 3.239 -5.059) 10.543 13.079 ( -2.679 -4.051 -2.496) 5.461 16.763 ( -2.322 0.122 -1.535) 2.786 17.033 ( -17.977 -5.278 -3.118) 18.993 17.140 ( -0.131 -0.274 -10.266) 10.271 17.594 ( -10.609 -11.310 -10.539) 18.749 18.000 ( 3.991 5.582 -0.586) 6.887 18.211 ( -1.749 -2.506 9.727) 10.195 18.272 ( 13.166 9.328 0.052) 16.135 18.494 ( 9.623 4.137 6.209) 12.176 21.201 ( 0.513 1.324 -0.614) 1.547 21.404 ( -1.786 -1.958 -2.518) 3.656 21.541 ( 3.213 5.596 6.861) 9.419 21.945 ( 4.593 -4.431 0.775) 6.429 ======================= Grid point 241 (129/170) ======================= q-point: (-0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( -3.891 14.494 9.746) 17.895 2.075 ( -5.921 19.221 7.436) 21.442 2.474 ( -1.392 2.744 -6.341) 7.048 2.637 ( 2.532 -3.556 -2.080) 4.835 2.796 ( -0.432 -4.967 -5.471) 7.402 2.906 ( -1.517 -1.426 -4.112) 4.609 3.036 ( 1.270 -5.902 -3.296) 6.878 3.086 ( 4.476 -8.192 -0.766) 9.366 3.153 ( -0.440 3.772 11.022) 11.658 3.277 ( 1.751 -8.717 -12.596) 15.418 3.422 ( 2.353 -0.831 -2.183) 3.316 3.646 ( 6.226 -7.451 3.208) 10.226 3.942 ( -2.028 22.019 12.813) 25.556 4.184 ( 2.690 8.679 8.890) 12.712 4.241 ( -1.362 -0.407 20.232) 20.282 4.343 ( 7.649 14.844 8.953) 18.947 4.756 ( 2.097 10.834 4.486) 11.912 4.875 ( -1.061 10.437 0.056) 10.490 5.083 ( 0.348 9.138 -2.534) 9.489 5.143 ( -0.280 4.583 -1.685) 4.891 5.332 ( -5.243 12.244 -5.603) 14.450 5.425 ( -2.297 0.825 -3.902) 4.602 5.661 ( -0.575 -7.848 3.451) 8.592 5.690 ( 0.150 -9.451 7.143) 11.848 5.812 ( 0.007 -3.170 -3.213) 4.514 5.962 ( 0.751 -4.391 -5.489) 7.069 6.227 ( -1.060 -3.175 -3.564) 4.890 6.567 ( 8.423 -10.101 -6.533) 14.685 7.219 ( 1.798 1.948 -1.994) 3.317 7.400 ( -4.144 -4.492 -0.774) 6.160 7.619 ( -8.738 0.451 4.884) 10.021 7.805 ( -1.886 -3.559 -3.994) 5.673 8.189 ( -1.236 12.448 1.475) 12.596 8.474 ( 1.592 7.202 -5.821) 9.397 9.267 ( -2.351 3.658 4.782) 6.463 9.383 ( -0.472 -0.434 4.237) 4.286 9.757 ( -2.568 5.214 3.357) 6.712 10.125 ( 0.132 -0.411 7.719) 7.731 10.337 ( 11.341 7.596 -5.349) 14.661 10.609 ( 2.194 1.395 1.222) 2.873 10.870 ( 1.188 3.869 -4.568) 6.103 11.002 ( 6.074 -4.330 -3.165) 8.103 11.238 ( -0.016 -7.264 -2.741) 7.764 11.484 ( 3.743 -7.447 -4.069) 9.275 12.129 ( -9.595 7.834 9.664) 15.711 12.588 ( -8.554 -5.370 5.761) 11.627 12.764 ( -4.737 4.498 -5.705) 8.673 13.011 ( -1.668 -5.557 -4.225) 7.177 16.718 ( -1.507 -6.289 -1.686) 6.683 16.764 ( -9.641 -6.799 -3.127) 12.205 16.993 ( -3.039 -2.060 -10.074) 10.722 17.284 ( -8.922 -10.405 -15.137) 20.420 18.118 ( 5.213 5.019 6.482) 9.715 18.290 ( -0.927 -0.576 7.772) 7.849 18.484 ( 12.234 7.803 -0.022) 14.511 18.658 ( 3.644 3.052 3.039) 5.641 21.168 ( -1.569 2.683 -2.049) 3.723 21.305 ( -3.711 2.347 -4.083) 5.996 21.711 ( 3.987 4.308 9.646) 11.292 22.029 ( 3.618 -2.765 1.497) 4.793 ======================= Grid point 242 (130/170) ======================= q-point: ( 0.00 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.107 ( -3.716 5.916 -3.501) 7.815 2.233 ( -4.602 -5.107 -5.903) 9.062 2.447 ( -0.198 8.832 0.608) 8.855 2.589 ( 0.504 -4.102 1.324) 4.340 2.780 ( 0.260 1.710 -6.255) 6.490 2.833 ( 1.595 7.501 3.380) 8.380 2.902 ( 2.391 -7.446 -8.514) 11.560 3.001 ( 2.129 -7.549 3.479) 8.581 3.096 ( -1.020 1.340 -4.836) 5.121 3.189 ( -0.887 -5.970 -1.431) 6.203 3.607 ( 8.390 5.457 6.503) 11.936 3.696 ( 5.777 -3.533 3.079) 7.439 4.281 ( 0.536 0.698 10.649) 10.685 4.308 ( -4.629 -2.182 9.783) 11.040 4.694 ( -5.278 21.709 11.966) 25.344 4.806 ( 4.489 13.887 10.748) 18.126 4.903 ( -6.754 -1.792 11.742) 13.664 5.006 ( 0.877 1.968 2.537) 3.328 5.192 ( -6.247 6.327 -5.047) 10.224 5.202 ( -1.222 9.283 -0.613) 9.383 5.323 ( 4.111 -0.437 -0.990) 4.251 5.431 ( -1.365 -12.331 1.992) 12.566 5.517 ( -1.550 0.195 1.562) 2.209 5.650 ( 2.888 -11.610 -1.947) 12.121 5.753 ( 3.158 12.409 -2.600) 13.065 5.961 ( 5.272 -3.911 -1.376) 6.707 6.090 ( -2.622 2.180 -8.372) 9.040 6.257 ( -1.132 -13.781 -13.563) 19.369 7.248 ( -2.389 0.201 0.098) 2.399 7.254 ( -2.802 -0.790 -0.073) 2.912 7.605 ( 2.196 1.445 1.205) 2.892 7.677 ( 3.908 -5.576 -2.041) 7.108 8.387 ( -0.568 7.706 -1.547) 7.880 8.470 ( -0.331 -0.686 -5.497) 5.550 9.356 ( -1.803 3.030 5.131) 6.226 9.396 ( -1.267 -1.192 4.067) 4.423 9.995 ( 0.450 11.340 11.279) 16.001 10.191 ( 1.511 -7.401 11.892) 14.088 10.583 ( 5.243 9.145 -11.718) 15.761 10.684 ( 0.420 3.537 1.235) 3.769 10.815 ( -5.433 -0.968 -6.221) 8.316 10.888 ( 5.058 -8.126 -2.335) 9.852 11.136 ( -2.347 2.083 -2.716) 4.150 11.259 ( -2.471 -8.901 -5.722) 10.866 12.318 ( 0.092 7.590 8.246) 11.208 12.460 ( -0.222 -6.963 4.712) 8.410 12.771 ( 0.242 4.444 -3.603) 5.726 12.852 ( 0.060 -4.158 -4.518) 6.141 16.546 ( -0.385 -3.359 -0.655) 3.443 16.552 ( -1.103 -3.917 -0.873) 4.162 16.852 ( -1.487 1.571 -9.413) 9.658 16.913 ( -1.076 -4.773 -11.846) 12.817 18.316 ( 1.178 2.241 6.530) 7.003 18.346 ( 0.838 -0.826 5.463) 5.588 18.715 ( 2.015 2.368 0.716) 3.191 18.723 ( -1.300 1.590 0.370) 2.087 21.190 ( 0.680 2.467 -2.637) 3.674 21.227 ( -0.101 -1.123 -4.174) 4.324 21.945 ( 0.045 4.992 6.772) 8.413 22.027 ( -0.015 -3.402 2.950) 4.502 ======================= Grid point 243 (131/170) ======================= q-point: ( 0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( 1.660 1.471 3.551) 4.187 2.149 ( 0.516 -4.632 -2.226) 5.165 2.475 ( 0.361 8.467 3.070) 9.014 2.606 ( 0.442 -3.390 0.468) 3.450 2.733 ( 1.609 2.231 -4.511) 5.284 2.852 ( 3.962 -4.219 -6.555) 8.744 2.889 ( -1.198 4.958 2.516) 5.687 3.026 ( 2.408 4.429 -5.323) 7.331 3.045 ( -4.555 -7.391 2.661) 9.080 3.174 ( 2.524 -8.139 -2.145) 8.788 3.661 ( -7.042 2.453 -4.720) 8.826 3.690 ( -4.103 -0.330 -1.054) 4.249 4.317 ( -1.977 6.088 4.834) 8.021 4.451 ( 6.089 -7.486 6.420) 11.590 4.718 ( -10.210 9.903 8.477) 16.558 4.802 ( -10.373 4.272 5.272) 12.396 4.970 ( -3.043 12.766 3.194) 13.507 5.047 ( -5.540 9.932 11.778) 16.373 5.070 ( -3.786 3.945 2.094) 5.855 5.189 ( 3.602 7.568 -0.595) 8.403 5.379 ( 2.432 0.897 -3.027) 3.985 5.446 ( -1.062 -11.294 6.160) 12.908 5.556 ( 5.418 6.178 -2.562) 8.608 5.646 ( 1.594 -6.306 -1.045) 6.588 5.823 ( 5.504 0.311 1.872) 5.822 5.971 ( -2.269 2.201 -5.156) 6.048 6.008 ( -0.042 -2.892 -0.561) 2.946 6.050 ( -1.294 -15.797 -16.042) 22.551 7.199 ( -2.165 2.625 0.965) 3.537 7.263 ( 0.613 -3.513 1.786) 3.988 7.714 ( 10.530 1.609 -0.883) 10.689 7.771 ( 10.761 -4.077 -3.023) 11.898 8.368 ( -1.270 5.074 0.793) 5.290 8.408 ( -0.946 1.084 -3.295) 3.596 9.394 ( -0.317 2.412 4.726) 5.315 9.425 ( -0.023 -0.773 2.842) 2.946 10.115 ( -1.384 13.230 10.675) 17.056 10.306 ( 1.161 1.405 2.151) 2.820 10.457 ( -7.485 -2.123 -2.818) 8.275 10.570 ( -5.631 -5.102 -11.708) 13.958 10.785 ( 2.045 8.527 1.725) 8.937 10.891 ( -0.661 -1.976 -4.574) 5.026 11.100 ( -1.553 -3.559 3.511) 5.235 11.163 ( -2.510 -8.430 -3.394) 9.428 12.459 ( 6.120 4.580 7.393) 10.635 12.542 ( 6.422 -3.790 0.512) 7.474 12.767 ( 2.497 2.421 -1.353) 3.732 12.821 ( 2.661 -2.990 -4.823) 6.268 16.578 ( 5.197 0.891 -0.812) 5.334 16.636 ( 11.554 -4.935 0.297) 12.567 16.760 ( -1.345 1.549 -3.268) 3.859 16.848 ( 5.324 -7.440 -4.354) 10.132 18.351 ( -2.561 4.440 1.790) 5.429 18.410 ( 1.551 -1.844 1.969) 3.112 18.627 ( -9.601 6.115 -0.289) 11.387 18.709 ( -4.074 -2.285 0.504) 4.699 21.202 ( 3.369 1.196 -1.550) 3.897 21.216 ( 3.555 -0.176 -2.289) 4.232 21.967 ( -5.176 2.372 4.502) 7.258 22.006 ( -5.184 -1.493 0.538) 5.422 ======================= Grid point 244 (132/170) ======================= q-point: ( 0.18 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 3.345 -1.480 3.611) 5.140 2.220 ( 5.430 -3.785 7.619) 10.093 2.515 ( 0.903 7.530 2.393) 7.952 2.618 ( 0.594 0.253 0.855) 1.071 2.737 ( 2.401 2.695 -0.809) 3.699 2.842 ( -4.196 1.118 -0.949) 4.445 2.864 ( 4.241 -3.614 -5.688) 7.962 2.962 ( -6.538 -6.285 -1.157) 9.142 3.008 ( 0.337 7.529 -2.606) 7.975 3.193 ( 1.015 -9.458 -1.932) 9.707 3.480 ( -5.488 2.748 -5.358) 8.147 3.544 ( -6.549 -3.964 -3.546) 8.437 4.313 ( -5.162 12.308 1.874) 13.477 4.468 ( -12.941 6.265 -2.071) 14.526 4.575 ( -5.728 -4.595 -0.253) 7.348 4.695 ( -13.467 -6.612 3.679) 15.447 4.910 ( -0.926 10.576 -3.329) 11.127 5.022 ( -0.818 0.795 1.986) 2.290 5.152 ( 0.694 12.055 8.913) 15.008 5.295 ( -0.146 1.389 5.652) 5.822 5.313 ( -1.351 8.109 -5.841) 10.084 5.477 ( -0.409 -4.664 1.279) 4.853 5.552 ( -0.482 1.598 -1.413) 2.187 5.666 ( -4.092 -8.547 -4.605) 10.536 5.843 ( 4.167 -1.234 -9.664) 10.597 5.930 ( 6.798 -6.661 -6.897) 11.753 6.000 ( 3.989 1.126 10.477) 11.267 6.068 ( 3.942 -4.171 3.997) 6.994 7.206 ( 0.807 4.979 2.043) 5.442 7.309 ( 1.964 -5.280 2.757) 6.272 7.887 ( 12.615 3.204 -2.639) 13.280 7.929 ( 13.536 -1.043 -3.208) 13.950 8.351 ( -2.626 3.745 1.165) 4.720 8.387 ( -0.041 -0.009 1.282) 1.282 9.437 ( 0.165 1.039 1.684) 1.985 9.452 ( 0.770 -0.390 0.839) 1.204 10.141 ( -8.494 11.987 4.916) 15.492 10.201 ( -4.753 9.588 -9.253) 14.147 10.348 ( -3.507 -5.751 -7.021) 9.729 10.419 ( -5.096 -10.424 4.281) 12.367 10.785 ( -1.162 7.477 -2.653) 8.019 10.867 ( 1.167 0.759 1.839) 2.307 11.107 ( -2.374 -4.930 0.586) 5.503 11.134 ( -0.825 -6.255 3.536) 7.233 12.653 ( 9.615 2.048 -0.429) 9.840 12.662 ( 10.246 1.203 1.752) 10.464 12.808 ( 2.668 -0.447 0.691) 2.792 12.834 ( 3.853 -3.100 -1.299) 5.113 16.663 ( 3.243 5.684 3.389) 7.370 16.740 ( -0.738 1.251 2.997) 3.330 16.898 ( 20.198 -3.364 0.680) 20.487 17.005 ( 16.719 -10.728 0.829) 19.882 18.273 ( -7.596 8.804 -1.561) 11.732 18.400 ( -7.333 -2.924 -1.015) 7.959 18.467 ( -5.122 7.874 -1.073) 9.455 18.623 ( -5.643 -6.546 -1.105) 8.713 21.250 ( 4.375 1.638 -1.264) 4.840 21.276 ( 4.374 -0.797 0.426) 4.466 21.875 ( -9.127 0.468 -1.396) 9.244 21.893 ( -8.879 -1.301 0.834) 9.012 ======================= Grid point 245 (133/170) ======================= q-point: ( 0.27 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( 1.979 1.196 2.767) 3.606 2.348 ( 1.167 -4.834 2.257) 5.461 2.584 ( 3.585 7.341 4.727) 9.438 2.636 ( 0.538 8.125 -3.655) 8.925 2.725 ( -2.609 -2.300 4.204) 5.457 2.796 ( -4.041 -5.683 -0.866) 7.026 2.828 ( 1.555 0.780 -1.575) 2.346 2.909 ( 3.650 -2.442 -3.040) 5.341 2.986 ( -1.128 3.275 1.166) 3.655 3.150 ( -1.754 -10.342 -2.737) 10.841 3.409 ( 0.626 2.595 -1.715) 3.173 3.482 ( 0.342 -4.875 -0.289) 4.896 4.163 ( -14.213 10.587 -4.741) 18.346 4.193 ( -14.647 14.535 -0.186) 20.636 4.373 ( -12.516 -9.553 -9.536) 18.408 4.487 ( -16.378 -13.932 1.189) 21.535 4.860 ( 1.177 13.875 -9.940) 17.109 5.056 ( 1.013 -4.605 0.293) 4.725 5.130 ( -2.355 8.092 -8.942) 12.288 5.240 ( 1.569 2.356 -3.478) 4.485 5.347 ( -4.376 -0.137 1.618) 4.667 5.474 ( 0.712 -7.287 5.079) 8.911 5.566 ( 0.458 1.370 5.482) 5.669 5.601 ( 1.527 -1.679 4.729) 5.245 5.844 ( 5.740 5.915 -7.383) 11.065 5.955 ( 5.292 -5.186 -6.104) 9.600 6.186 ( 5.121 1.308 7.891) 9.498 6.229 ( 5.862 -2.413 6.893) 9.365 7.260 ( 2.040 6.617 3.371) 7.701 7.380 ( 2.514 -5.444 3.545) 6.966 8.006 ( 6.383 8.531 -3.864) 11.334 8.117 ( 14.378 -1.479 -4.196) 15.051 8.317 ( -4.015 5.099 2.247) 6.868 8.425 ( 2.809 -4.628 1.514) 5.621 9.408 ( -2.423 2.105 -3.393) 4.671 9.450 ( -0.961 -2.270 -2.174) 3.287 10.011 ( -8.174 4.980 -5.145) 10.867 10.031 ( -6.095 2.731 0.788) 6.725 10.282 ( 1.390 1.331 -4.245) 4.661 10.381 ( -4.510 -7.696 3.307) 9.513 10.771 ( 1.308 9.490 -0.081) 9.580 10.908 ( 0.684 -2.082 1.823) 2.851 11.084 ( -2.051 -1.708 1.451) 3.038 11.143 ( -2.597 -5.361 2.763) 6.567 12.730 ( 7.782 5.157 -7.774) 12.149 12.834 ( 6.247 -5.606 -5.184) 9.866 12.894 ( 7.067 2.696 8.836) 11.631 12.943 ( 5.399 -2.667 7.300) 9.463 16.755 ( 1.216 5.140 6.923) 8.708 16.798 ( -0.373 1.619 8.729) 8.886 17.264 ( 24.278 -0.932 1.111) 24.321 17.345 ( 21.230 -7.871 4.117) 23.013 18.095 ( -11.083 11.360 -2.414) 16.054 18.219 ( -10.956 2.109 -0.454) 11.166 18.409 ( -1.493 0.584 -4.041) 4.347 18.522 ( -4.029 -7.123 -3.255) 8.807 21.280 ( 1.063 2.159 -3.264) 4.055 21.328 ( 1.140 -2.580 -1.446) 3.170 21.701 ( -8.324 1.568 -2.092) 8.725 21.755 ( -8.703 -3.944 1.145) 9.624 ======================= Grid point 246 (134/170) ======================= q-point: ( 0.36 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( -3.892 4.824 -5.575) 8.337 2.335 ( -2.802 -3.073 -0.778) 4.231 2.570 ( 3.394 5.179 -7.236) 9.524 2.638 ( -2.354 0.030 -2.185) 3.212 2.766 ( 6.305 0.673 1.864) 6.609 2.846 ( 1.417 -5.564 10.411) 11.889 2.910 ( -0.896 1.270 4.511) 4.771 2.913 ( 2.955 5.979 2.324) 7.063 3.003 ( 0.852 -2.104 0.684) 2.371 3.134 ( 3.782 -10.527 -1.806) 11.331 3.423 ( -0.423 2.811 1.268) 3.112 3.495 ( -0.610 -4.562 1.452) 4.826 3.876 ( -10.898 8.149 -6.237) 14.969 3.984 ( -10.761 9.373 -1.260) 14.326 4.050 ( -11.032 -9.482 -12.628) 19.263 4.213 ( -16.949 -13.441 -1.596) 21.691 4.681 ( -1.240 11.067 -19.509) 22.464 4.902 ( -8.937 -11.738 -14.577) 20.740 5.114 ( 3.148 7.546 1.798) 8.372 5.213 ( 4.136 -2.405 0.935) 4.875 5.410 ( 0.230 7.721 6.669) 10.205 5.539 ( -1.217 -5.252 6.640) 8.553 5.660 ( 2.789 6.269 8.134) 10.641 5.766 ( 6.668 -4.427 7.816) 11.188 5.854 ( 4.628 7.061 -5.730) 10.204 5.966 ( 3.794 -4.747 -4.994) 7.865 6.296 ( 1.773 3.094 1.371) 3.821 6.348 ( 2.182 -1.928 2.344) 3.738 7.344 ( 2.417 7.470 5.516) 9.595 7.465 ( 2.525 -4.785 4.817) 7.243 8.000 ( -0.449 12.036 -4.650) 12.911 8.203 ( 0.850 -8.554 -5.706) 10.318 8.322 ( 4.466 10.589 0.650) 11.510 8.485 ( 4.332 -5.878 -2.528) 7.727 9.325 ( -2.093 2.726 -2.874) 4.480 9.389 ( -1.595 -3.996 -3.031) 5.263 9.853 ( -6.124 4.903 -3.536) 8.605 9.948 ( -5.651 -4.824 -1.615) 7.603 10.299 ( 4.031 4.108 0.968) 5.837 10.394 ( 1.242 -5.540 4.580) 7.295 10.793 ( 1.206 8.806 -1.260) 8.977 10.908 ( -1.955 -0.800 -0.458) 2.161 11.080 ( -1.290 -1.716 2.541) 3.326 11.123 ( -2.305 -4.094 1.560) 4.951 12.749 ( 4.526 4.690 -5.760) 8.698 12.840 ( 1.571 -4.724 -3.914) 6.333 13.107 ( 6.805 0.994 8.212) 10.711 13.126 ( 6.179 -0.975 7.785) 9.987 16.856 ( 0.591 4.996 8.809) 10.144 16.901 ( -1.293 0.691 11.286) 11.381 17.638 ( 19.131 3.938 0.558) 19.540 17.714 ( 18.083 -3.150 5.217) 19.082 17.907 ( -9.602 13.160 -1.135) 16.330 18.093 ( -3.246 -3.437 0.365) 4.742 18.323 ( -3.299 0.375 -4.199) 5.353 18.424 ( -3.223 -6.401 -4.232) 8.323 21.176 ( -4.887 0.140 -9.268) 10.478 21.222 ( -6.176 -4.721 -9.332) 12.145 21.640 ( -0.899 1.762 3.690) 4.187 21.691 ( -3.265 -3.606 4.290) 6.485 ======================= Grid point 247 (135/170) ======================= q-point: ( 0.45 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( -2.970 4.386 -5.447) 7.598 2.222 ( -5.615 -5.822 -5.954) 10.044 2.554 ( 2.206 6.461 -4.111) 7.969 2.627 ( 4.247 -1.379 -4.978) 6.687 2.868 ( 2.864 0.520 0.868) 3.037 2.881 ( -2.842 0.631 1.825) 3.436 2.971 ( 0.807 0.255 7.107) 7.157 3.011 ( 0.425 -3.102 6.881) 7.560 3.071 ( 5.484 4.515 1.936) 7.362 3.193 ( 3.415 -7.452 -0.423) 8.208 3.347 ( -8.190 7.928 -0.395) 11.406 3.487 ( -2.064 -6.525 -0.720) 6.881 3.746 ( 0.967 2.365 -4.595) 5.258 3.824 ( -0.793 -4.142 -6.520) 7.765 3.882 ( -0.947 -2.137 -0.711) 2.444 3.969 ( -9.642 -9.484 -1.352) 13.592 4.457 ( 0.874 3.913 -18.448) 18.879 4.580 ( -9.260 -8.970 -15.901) 20.471 5.222 ( 4.363 8.523 5.803) 11.196 5.329 ( 5.101 -1.932 5.140) 7.495 5.457 ( -2.374 6.682 4.713) 8.515 5.571 ( -4.673 -4.474 6.717) 9.326 5.798 ( 0.132 8.560 8.239) 11.881 5.836 ( 4.683 5.975 -6.114) 9.747 5.944 ( 6.297 -2.883 -3.023) 7.557 5.969 ( 1.065 -6.300 4.242) 7.670 6.283 ( -1.115 4.915 -3.022) 5.876 6.354 ( -1.372 -2.314 -1.302) 2.988 7.453 ( 1.451 6.930 7.953) 10.648 7.559 ( 0.739 -3.670 6.961) 7.904 7.922 ( -0.814 11.349 -6.162) 12.939 8.106 ( -2.518 -6.689 -6.762) 9.839 8.375 ( 2.305 6.985 -2.495) 7.767 8.486 ( 1.794 -3.365 -5.311) 6.538 9.307 ( 1.660 2.026 0.058) 2.620 9.364 ( 0.868 -3.821 -1.042) 4.054 9.738 ( -3.471 2.647 -2.899) 5.240 9.817 ( -6.251 -5.309 -3.629) 8.968 10.420 ( 6.577 4.717 4.229) 9.132 10.508 ( 4.960 -4.167 6.264) 9.011 10.753 ( -2.568 6.520 -4.197) 8.168 10.839 ( -4.679 -1.478 -2.312) 5.425 11.089 ( -1.036 0.264 2.816) 3.012 11.129 ( 1.261 -3.220 0.709) 3.530 12.752 ( 2.232 2.368 -3.134) 4.518 12.801 ( -1.633 -2.694 -2.934) 4.305 13.270 ( 2.928 1.033 6.891) 7.559 13.282 ( 2.921 -0.240 6.599) 7.221 16.962 ( 0.000 4.204 9.418) 10.314 16.992 ( -2.568 1.320 10.339) 10.735 17.769 ( -4.826 10.693 -1.197) 11.792 17.795 ( 3.002 6.522 -1.381) 7.312 18.008 ( 9.726 3.416 3.887) 11.017 18.141 ( 2.670 -4.565 1.490) 5.494 18.247 ( -0.033 -1.175 -0.662) 1.349 18.339 ( -1.363 -5.791 -3.046) 6.683 20.988 ( -2.453 -3.165 -11.176) 11.872 21.011 ( -3.997 -5.559 -11.377) 13.278 21.695 ( 0.929 0.343 4.528) 4.635 21.713 ( -1.174 -1.619 4.585) 5.002 ======================= Grid point 248 (136/170) ======================= q-point: (-0.45 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( 1.922 -0.361 -1.658) 2.564 2.095 ( -0.574 -1.622 -3.783) 4.156 2.522 ( -1.350 6.027 -3.585) 7.141 2.607 ( 0.674 -2.746 -5.824) 6.474 2.841 ( -4.686 2.043 1.920) 5.461 2.884 ( -2.176 -2.344 1.666) 3.606 3.022 ( -2.087 1.132 2.237) 3.262 3.092 ( -0.720 -5.218 2.295) 5.746 3.160 ( 4.782 3.394 1.098) 5.965 3.192 ( -0.081 0.078 3.015) 3.017 3.309 ( 5.283 6.126 -1.333) 8.198 3.454 ( 3.973 -7.459 -3.979) 9.341 3.763 ( 1.479 1.184 -1.597) 2.477 3.794 ( 1.398 -1.988 -5.505) 6.018 3.858 ( 1.433 3.234 2.483) 4.322 3.993 ( 8.311 -10.328 -0.765) 13.279 4.296 ( -4.943 -1.379 -12.895) 13.879 4.373 ( 10.075 -9.052 -8.831) 16.169 5.334 ( -1.965 9.047 6.014) 11.040 5.419 ( -0.700 7.837 2.716) 8.324 5.479 ( -0.168 -4.249 6.394) 7.679 5.522 ( -6.777 -2.187 1.339) 7.246 5.760 ( -2.964 6.651 -3.094) 7.912 5.874 ( -0.941 -4.207 -3.114) 5.318 5.965 ( 1.888 7.065 4.104) 8.386 6.071 ( 1.792 -3.132 4.090) 5.454 6.236 ( -0.353 3.440 -2.224) 4.112 6.302 ( -1.042 -2.503 -3.785) 4.656 7.528 ( -4.267 6.145 7.752) 10.773 7.619 ( -4.599 -2.731 7.559) 9.260 7.877 ( 4.494 8.341 -5.452) 10.932 8.017 ( 3.060 -5.381 -8.455) 10.479 8.349 ( -2.617 7.121 -0.283) 7.592 8.449 ( 0.656 -2.715 -4.541) 5.331 9.338 ( -0.155 0.222 -0.456) 0.530 9.357 ( 0.095 -1.499 -1.519) 2.136 9.691 ( -1.374 0.026 -0.611) 1.505 9.728 ( 1.593 -3.434 -1.462) 4.058 10.558 ( 2.681 6.762 2.595) 7.723 10.642 ( -0.947 4.621 -0.516) 4.745 10.671 ( 4.136 -3.830 1.423) 5.814 10.728 ( -3.789 -3.367 -2.044) 5.466 11.112 ( 0.490 1.702 1.760) 2.497 11.159 ( 1.928 -2.987 -0.230) 3.563 12.726 ( -4.384 1.006 -1.533) 4.752 12.751 ( -0.047 -1.691 -0.806) 1.874 13.340 ( -2.047 1.054 4.179) 4.771 13.348 ( -2.087 0.270 3.856) 4.393 17.037 ( -3.326 4.589 7.360) 9.289 17.065 ( -0.120 1.644 8.083) 8.250 17.697 ( -4.688 9.749 0.979) 10.862 17.803 ( -0.028 -1.763 -2.268) 2.873 18.067 ( -3.491 6.803 4.956) 9.112 18.132 ( -1.830 -0.151 0.010) 1.836 18.291 ( 2.076 -1.131 -1.563) 2.834 18.328 ( 1.498 -3.851 -2.834) 5.011 20.893 ( 4.133 -4.770 -8.430) 10.531 20.903 ( 5.560 -5.686 -8.078) 11.336 21.735 ( -1.579 0.372 2.865) 3.292 21.751 ( 0.643 -1.268 3.013) 3.332 ======================= Grid point 249 (137/170) ======================= q-point: (-0.36 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.072 ( 2.193 7.112 0.741) 7.480 2.198 ( 7.240 -5.073 4.022) 9.712 2.449 ( -1.932 5.580 -3.747) 6.993 2.549 ( -0.671 -4.109 -3.081) 5.179 2.786 ( -3.524 4.827 1.673) 6.206 2.866 ( -2.073 -2.931 1.554) 3.912 2.985 ( -3.252 -2.250 -0.291) 3.965 3.027 ( -5.665 -6.450 1.014) 8.644 3.260 ( 7.545 3.034 -2.164) 8.415 3.298 ( 5.260 0.160 2.409) 5.788 3.424 ( 7.709 4.342 1.165) 8.924 3.529 ( 6.301 -5.250 1.208) 8.290 3.696 ( -2.967 -1.527 -9.152) 9.742 3.710 ( -1.610 -2.555 -6.373) 7.052 3.949 ( 7.579 7.938 0.547) 10.989 4.158 ( 14.787 -12.049 -1.071) 19.105 4.236 ( 6.715 14.142 -0.150) 15.656 4.553 ( 14.631 -17.730 1.601) 23.043 5.249 ( -8.141 9.098 -0.514) 12.219 5.368 ( -8.146 -1.996 -3.194) 8.975 5.470 ( -1.398 6.865 5.316) 8.794 5.554 ( -1.602 -1.721 6.285) 6.710 5.664 ( -7.717 4.535 0.617) 8.972 5.782 ( -4.385 -5.747 -4.582) 8.558 6.022 ( 0.570 6.370 -0.075) 6.395 6.110 ( 1.508 -0.855 -2.081) 2.709 6.217 ( -0.069 2.143 -0.079) 2.146 6.276 ( 0.678 -2.932 0.890) 3.138 7.490 ( -7.468 5.597 3.703) 10.040 7.564 ( -8.173 -1.263 2.462) 8.629 7.937 ( 5.933 4.378 -1.510) 7.526 8.015 ( 3.348 -3.164 -4.022) 6.115 8.326 ( -1.034 6.406 2.945) 7.125 8.411 ( 0.246 -2.323 -3.049) 3.841 9.287 ( -2.743 1.087 -1.395) 3.264 9.326 ( -2.856 -2.936 -0.656) 4.148 9.712 ( 3.456 3.483 1.284) 5.072 9.796 ( 4.752 -5.084 1.531) 7.125 10.476 ( -4.928 6.022 -4.045) 8.770 10.577 ( -3.748 -3.230 -3.802) 6.240 10.744 ( 5.978 5.046 1.453) 7.957 10.836 ( 6.729 -2.448 3.595) 8.012 11.138 ( 1.206 0.917 0.348) 1.555 11.185 ( 2.223 -3.800 -0.493) 4.430 12.628 ( -6.955 5.028 0.165) 8.583 12.733 ( -2.794 -5.966 1.087) 6.676 13.297 ( -6.566 0.843 0.704) 6.657 13.301 ( -6.673 0.625 0.365) 6.712 17.035 ( -4.247 7.785 2.800) 9.300 17.136 ( -0.255 -2.116 4.184) 4.696 17.602 ( -12.139 6.159 3.944) 14.172 17.726 ( -8.749 -6.964 2.601) 11.481 18.118 ( 4.947 6.756 -1.133) 8.450 18.154 ( 4.437 2.961 4.207) 6.794 18.238 ( -3.005 0.175 -5.481) 6.253 18.263 ( -2.793 -2.382 -5.696) 6.776 20.954 ( 10.822 -2.491 -2.776) 11.446 20.987 ( 11.550 -5.933 -2.287) 13.185 21.722 ( -2.499 2.714 0.770) 3.769 21.779 ( 0.242 -3.155 0.900) 3.290 ======================= Grid point 250 (138/170) ======================= q-point: (-0.27 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 3.658 13.631 5.005) 14.974 2.327 ( 0.317 5.115 4.565) 6.863 2.426 ( 4.520 -3.755 -1.288) 6.015 2.547 ( 2.817 -7.592 1.225) 8.190 2.775 ( -0.357 7.636 -1.838) 7.863 2.847 ( -1.479 -0.506 1.568) 2.214 2.908 ( -4.946 -4.342 -0.618) 6.610 2.991 ( -0.912 -10.078 1.145) 10.183 3.287 ( 2.930 5.129 -9.275) 10.996 3.385 ( 5.090 -0.979 -1.526) 5.403 3.445 ( -4.372 -4.527 -12.203) 13.731 3.481 ( -3.666 -4.160 -0.410) 5.561 3.726 ( 7.177 0.117 8.584) 11.190 3.747 ( 7.330 -1.834 6.056) 9.683 4.137 ( 13.832 15.171 1.550) 20.588 4.374 ( 6.326 11.796 4.965) 14.277 4.435 ( 17.091 -1.262 2.386) 17.302 4.800 ( 10.699 -19.267 5.391) 22.688 5.139 ( -3.905 8.324 -0.591) 9.213 5.232 ( -3.124 -0.320 -4.047) 5.122 5.479 ( -4.195 3.345 5.425) 7.630 5.524 ( -7.957 6.585 -1.295) 10.410 5.582 ( -4.490 -5.375 5.266) 8.763 5.653 ( -5.843 -4.680 -3.067) 8.090 5.975 ( -1.303 3.786 -6.108) 7.303 6.056 ( 0.279 -3.165 -8.306) 8.893 6.269 ( 3.174 2.527 2.360) 4.694 6.306 ( -0.540 -1.167 3.101) 3.357 7.403 ( -5.772 4.589 0.237) 7.378 7.461 ( -6.751 -1.136 1.448) 6.997 7.961 ( -6.642 0.762 0.095) 6.687 7.969 ( -1.206 0.491 -3.184) 3.439 8.364 ( 0.321 5.204 2.243) 5.676 8.434 ( 6.357 -1.316 -0.798) 6.541 9.253 ( -1.115 1.551 1.431) 2.387 9.291 ( -1.817 -2.417 2.403) 3.863 9.785 ( 2.091 3.959 2.624) 5.189 9.872 ( 1.121 -5.187 2.991) 6.091 10.390 ( 0.320 6.908 -3.638) 7.814 10.519 ( 1.847 -5.615 -2.808) 6.544 10.825 ( 4.244 8.138 -1.822) 9.357 10.962 ( 6.063 -2.435 0.329) 6.542 11.154 ( 1.619 0.406 -1.287) 2.108 11.232 ( 3.845 -5.561 0.423) 6.774 12.513 ( -9.304 8.172 2.298) 12.595 12.678 ( -6.913 -8.939 2.252) 11.522 13.160 ( -8.979 1.025 -2.644) 9.416 13.167 ( -8.165 0.090 -2.125) 8.438 16.954 ( -7.683 7.813 -0.619) 10.975 17.106 ( -7.641 -7.626 -0.615) 10.813 17.417 ( -12.456 8.048 -0.107) 14.830 17.601 ( -10.455 -10.552 0.342) 14.858 18.105 ( -1.372 2.046 -6.809) 7.241 18.131 ( -1.490 -0.677 -1.147) 1.999 18.270 ( 7.876 6.250 1.374) 10.148 18.329 ( 10.094 0.786 3.577) 10.738 21.126 ( 10.104 0.394 1.230) 10.186 21.177 ( 11.304 -5.026 2.023) 12.535 21.683 ( -2.168 5.702 -0.279) 6.107 21.789 ( 1.291 -5.346 -0.293) 5.507 ======================= Grid point 251 (139/170) ======================= q-point: (-0.18 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( 0.442 13.882 2.519) 14.116 2.391 ( 1.361 16.270 6.844) 17.703 2.474 ( 2.504 -9.540 -2.695) 10.225 2.679 ( 2.777 -9.886 1.511) 10.379 2.684 ( 0.458 4.720 -0.561) 4.775 2.805 ( -3.813 -4.580 -3.502) 6.912 2.882 ( 2.209 -0.114 -1.131) 2.484 3.002 ( 0.817 -9.105 -0.399) 9.150 3.196 ( -2.740 2.995 -3.779) 5.546 3.252 ( -3.322 -3.417 -7.737) 9.087 3.408 ( 4.969 -0.160 -7.755) 9.212 3.453 ( 0.330 -5.204 -0.356) 5.226 3.953 ( 4.591 1.629 13.507) 14.358 3.979 ( 4.572 -1.006 16.885) 17.522 4.369 ( 11.054 19.067 3.649) 22.340 4.537 ( 4.454 20.082 9.566) 22.686 4.694 ( 11.063 -4.435 1.956) 12.079 4.950 ( -0.363 -9.076 5.163) 10.448 5.159 ( 3.790 2.047 2.064) 4.776 5.200 ( 6.663 -3.571 -3.503) 8.332 5.383 ( -6.843 5.880 -1.634) 9.169 5.478 ( -2.366 0.011 2.814) 3.676 5.531 ( -4.373 -4.801 0.754) 6.538 5.577 ( -2.290 -3.905 0.699) 4.580 5.874 ( -3.013 4.027 -4.992) 7.086 5.967 ( 0.520 -3.978 -8.112) 9.050 6.288 ( -0.864 2.264 -2.242) 3.302 6.351 ( 4.114 -3.851 -1.275) 5.777 7.324 ( -3.303 4.305 -1.438) 5.613 7.390 ( -4.462 -2.631 1.206) 5.318 7.801 ( -11.985 2.221 0.248) 12.191 7.859 ( -8.081 -3.528 -2.814) 9.256 8.398 ( 2.054 9.256 -0.149) 9.482 8.516 ( 4.822 -2.423 -2.485) 5.942 9.283 ( 0.179 2.317 4.511) 5.074 9.323 ( -0.145 -1.700 4.978) 5.262 9.828 ( -1.260 3.825 4.692) 6.183 9.916 ( -0.710 -5.470 6.828) 8.777 10.418 ( 7.238 8.761 -2.821) 11.709 10.570 ( 6.918 -5.764 -1.709) 9.166 10.843 ( 2.560 7.568 -3.846) 8.867 11.014 ( 3.000 -6.133 -4.543) 8.201 11.172 ( 2.561 3.921 -1.397) 4.888 11.301 ( 4.795 -7.189 -1.264) 8.734 12.390 ( -10.902 9.317 4.629) 15.069 12.567 ( -10.540 -8.907 3.510) 14.239 12.985 ( -7.725 2.158 -4.247) 9.076 13.023 ( -5.762 -2.110 -3.339) 6.986 16.796 ( -10.670 3.428 -0.563) 11.221 16.895 ( -16.950 -6.836 0.534) 18.285 17.219 ( -3.680 6.728 -13.473) 15.502 17.382 ( -8.445 -10.260 -12.018) 17.917 18.090 ( 0.838 4.014 4.860) 6.359 18.157 ( -0.667 -3.109 8.308) 8.896 18.441 ( 11.810 7.312 -0.007) 13.890 18.525 ( 10.389 -1.290 1.954) 10.650 21.242 ( 2.682 3.166 0.195) 4.154 21.320 ( 3.198 -4.891 0.217) 5.848 21.693 ( 3.140 8.414 3.141) 9.514 21.839 ( 4.706 -6.723 1.554) 8.352 ======================= Grid point 252 (140/170) ======================= q-point: (-0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( -3.347 10.354 -3.072) 11.307 2.363 ( -5.712 6.170 -1.856) 8.610 2.495 ( 0.176 -3.680 -4.282) 5.649 2.577 ( -2.326 1.399 -0.982) 2.886 2.758 ( 2.384 2.199 3.073) 4.468 2.848 ( 0.088 0.288 -4.498) 4.508 2.892 ( 5.744 -8.132 3.665) 10.609 2.973 ( 1.389 -8.168 -7.842) 11.408 3.166 ( -0.037 -0.147 -5.607) 5.609 3.183 ( -0.736 -0.171 4.764) 4.823 3.434 ( 5.926 2.121 -0.658) 6.329 3.513 ( 7.289 -5.968 3.590) 10.082 4.148 ( 0.085 3.853 14.418) 14.924 4.207 ( -0.817 -2.614 17.303) 17.518 4.573 ( 6.245 22.392 9.371) 25.065 4.673 ( -0.882 19.907 8.152) 21.530 4.833 ( 3.890 -4.902 4.268) 7.575 4.972 ( -1.502 -3.799 3.886) 5.638 5.200 ( 2.916 3.198 -1.433) 4.559 5.286 ( -1.630 11.127 -3.186) 11.689 5.321 ( 1.368 -8.977 2.029) 9.305 5.429 ( -2.335 -4.108 -0.644) 4.769 5.531 ( -1.870 -3.500 3.737) 5.451 5.588 ( 4.624 -5.497 -1.279) 7.296 5.786 ( -2.389 7.061 -2.723) 7.936 5.916 ( 3.476 -3.528 -5.327) 7.274 6.215 ( -2.159 3.340 -6.475) 7.599 6.362 ( 3.538 -10.706 -8.715) 14.251 7.272 ( -1.235 3.177 -1.529) 3.736 7.330 ( -4.289 -3.085 -0.297) 5.292 7.638 ( -8.537 2.226 1.850) 9.015 7.712 ( -5.482 -5.135 -1.957) 7.762 8.408 ( 0.707 9.485 -1.903) 9.700 8.522 ( 1.678 -2.026 -5.151) 5.784 9.330 ( -1.407 2.827 4.993) 5.908 9.369 ( -1.155 -1.295 4.770) 5.076 9.880 ( -0.637 7.527 8.683) 11.509 10.029 ( 1.586 -7.588 11.733) 14.063 10.524 ( 10.239 10.243 -4.392) 15.134 10.658 ( 5.051 -0.605 -1.562) 5.322 10.842 ( 2.643 0.255 -2.510) 3.653 10.958 ( -1.186 -6.499 -7.867) 10.273 11.182 ( 1.166 4.675 -3.115) 5.738 11.328 ( 1.981 -8.641 -4.635) 10.004 12.296 ( -8.067 9.259 7.062) 14.166 12.463 ( -7.698 -7.909 5.460) 12.314 12.843 ( -3.833 3.904 -4.435) 7.043 12.918 ( -2.619 -4.187 -3.868) 6.273 16.636 ( -8.418 -1.865 -0.125) 8.623 16.654 ( -12.136 -3.785 -0.194) 12.714 17.014 ( -1.736 3.485 -14.975) 15.473 17.115 ( -4.684 -7.148 -15.835) 17.994 18.199 ( 2.203 3.603 8.586) 9.568 18.257 ( 0.169 -2.530 9.126) 9.471 18.614 ( 9.371 5.372 0.074) 10.801 18.677 ( 6.136 -1.151 1.085) 6.337 21.229 ( -1.208 3.635 -2.486) 4.567 21.294 ( -2.014 -2.680 -3.619) 4.934 21.827 ( 4.544 7.042 6.990) 10.913 21.950 ( 4.487 -5.496 3.671) 7.988 ======================= Grid point 297 (141/170) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 85 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 0.707 0.000 -21.612) 21.624 1.757 ( -0.707 0.000 21.612) 21.624 1.878 ( -0.851 0.000 -21.986) 22.002 1.878 ( 0.851 0.000 21.986) 22.002 3.113 ( 2.309 0.000 -1.204) 2.605 3.113 ( -2.309 0.000 1.204) 2.605 3.295 ( 4.553 0.000 -4.845) 6.649 3.295 ( -4.553 0.000 4.845) 6.649 3.454 ( -9.382 0.000 -30.495) 31.906 3.454 ( 9.382 0.000 30.495) 31.906 3.560 ( -0.612 0.000 -5.265) 5.301 3.560 ( 0.612 0.000 5.265) 5.301 3.734 ( -0.205 0.000 -6.170) 6.173 3.734 ( 0.205 0.000 6.170) 6.173 4.183 ( -3.858 0.000 -3.850) 5.451 4.183 ( 3.858 0.000 3.850) 5.451 4.532 ( -8.026 0.000 -2.947) 8.550 4.532 ( 8.026 0.000 2.947) 8.550 4.777 ( -2.352 0.000 -6.994) 7.379 4.777 ( 2.352 0.000 6.994) 7.379 5.246 ( -1.830 0.000 -15.962) 16.066 5.246 ( 1.830 0.000 15.962) 16.066 5.831 ( 21.427 0.000 -9.313) 23.363 5.831 ( -21.427 0.000 9.313) 23.363 6.133 ( -1.266 0.000 -7.383) 7.491 6.133 ( 1.266 0.000 7.383) 7.491 6.323 ( -16.456 0.000 -10.099) 19.308 6.323 ( 16.456 0.000 10.099) 19.308 7.351 ( -0.929 0.000 -0.354) 0.994 7.351 ( 0.929 0.000 0.354) 0.994 7.673 ( 11.350 0.000 -6.494) 13.076 7.673 ( -11.350 0.000 6.494) 13.076 7.926 ( -10.321 0.000 -5.040) 11.486 7.926 ( 10.321 0.000 5.040) 11.486 9.200 ( -2.377 0.000 -8.538) 8.862 9.200 ( 2.377 0.000 8.538) 8.862 9.661 ( 2.545 0.000 -1.167) 2.799 9.661 ( -2.545 0.000 1.167) 2.799 10.386 ( -2.237 0.000 -4.064) 4.639 10.386 ( 2.237 0.000 4.064) 4.639 11.147 ( 0.406 0.000 -6.492) 6.504 11.147 ( -0.406 0.000 6.492) 6.504 11.602 ( 0.536 0.000 -6.381) 6.404 11.602 ( -0.536 0.000 6.381) 6.404 12.185 ( 0.345 0.000 -12.150) 12.155 12.185 ( -0.345 0.000 12.150) 12.155 12.992 ( -0.532 0.000 -5.793) 5.817 12.992 ( 0.532 0.000 5.793) 5.817 17.261 ( -2.531 0.000 -2.036) 3.248 17.261 ( 2.531 0.000 2.036) 3.248 17.391 ( -7.774 0.000 -4.372) 8.919 17.391 ( 7.774 0.000 4.372) 8.919 17.911 ( 2.185 0.000 -1.010) 2.407 17.911 ( -2.185 0.000 1.010) 2.407 18.279 ( -3.735 0.000 -1.496) 4.024 18.279 ( 3.735 0.000 1.496) 4.024 21.062 ( -2.540 0.000 -0.262) 2.553 21.062 ( 2.540 0.000 0.262) 2.553 21.931 ( -0.689 0.000 -7.344) 7.377 21.931 ( 0.689 0.000 7.344) 7.377 ======================= Grid point 299 (142/170) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( 8.980 0.000 -22.837) 24.540 1.608 ( 5.466 0.000 -24.584) 25.184 2.094 ( 7.492 0.000 19.550) 20.937 2.210 ( 8.205 0.000 20.636) 22.207 3.017 ( 7.358 0.000 -37.738) 38.448 3.086 ( -0.163 0.000 -2.130) 2.136 3.134 ( -2.242 0.000 0.383) 2.275 3.228 ( -8.834 0.000 3.153) 9.380 3.258 ( 0.091 0.000 -7.345) 7.345 3.548 ( 2.977 0.000 -1.166) 3.198 3.609 ( -3.555 0.000 1.119) 3.727 3.688 ( 1.134 0.000 -3.980) 4.138 3.840 ( 3.344 0.000 8.195) 8.851 3.937 ( -2.911 0.000 7.971) 8.486 3.971 ( 2.043 0.000 14.636) 14.778 4.197 ( -5.059 0.000 4.218) 6.587 4.382 ( -3.503 0.000 -6.497) 7.382 4.577 ( 0.885 0.000 -8.684) 8.729 4.756 ( 7.475 0.000 -7.207) 10.383 4.927 ( -1.024 0.000 6.443) 6.524 5.044 ( -1.541 0.000 -13.506) 13.594 5.396 ( -3.526 0.000 13.539) 13.991 5.651 ( -6.168 0.000 6.744) 9.139 5.810 ( -4.150 0.000 -18.879) 19.330 6.088 ( 3.383 0.000 -6.661) 7.471 6.158 ( 1.989 0.000 3.690) 4.192 6.191 ( -3.616 0.000 6.230) 7.203 6.734 ( 13.886 0.000 15.165) 20.562 7.321 ( -2.786 0.000 0.847) 2.912 7.339 ( -2.950 0.000 -0.787) 3.054 7.577 ( -9.375 0.000 6.884) 11.632 7.705 ( -8.913 0.000 -4.857) 10.150 7.778 ( 10.554 0.000 -6.337) 12.310 8.111 ( 7.814 0.000 2.398) 8.174 9.140 ( 5.006 0.000 -5.807) 7.667 9.364 ( 3.833 0.000 7.580) 8.494 9.647 ( 0.496 0.000 2.023) 2.083 9.683 ( 2.259 0.000 -1.944) 2.980 10.295 ( -2.226 0.000 -3.797) 4.401 10.435 ( -1.228 0.000 3.468) 3.679 11.015 ( -6.785 0.000 -6.946) 9.710 11.132 ( -7.983 0.000 3.889) 8.880 11.539 ( -0.833 0.000 -4.786) 4.858 11.624 ( -6.115 0.000 5.231) 8.048 12.114 ( 7.539 0.000 -11.509) 13.758 12.354 ( 5.005 0.000 11.450) 12.496 13.001 ( 8.243 0.000 -2.182) 8.527 13.099 ( 4.470 0.000 4.578) 6.399 17.036 ( -17.105 0.000 -3.278) 17.416 17.159 ( -13.997 0.000 0.643) 14.012 17.165 ( -16.722 0.000 -0.316) 16.725 17.446 ( -9.777 0.000 9.163) 13.400 17.993 ( 9.312 0.000 0.642) 9.334 18.034 ( 12.470 0.000 -0.790) 12.495 18.305 ( 7.524 0.000 -2.170) 7.830 18.423 ( 9.684 0.000 1.188) 9.756 21.057 ( 2.938 0.000 -0.503) 2.981 21.122 ( 4.120 0.000 0.170) 4.124 21.836 ( -0.411 0.000 -8.220) 8.230 22.011 ( 0.669 0.000 4.785) 4.832 ======================= Grid point 300 (143/170) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.518 ( 15.136 0.000 -20.120) 25.178 1.540 ( 16.236 0.000 -17.792) 24.087 2.395 ( 5.404 0.000 14.997) 15.941 2.534 ( 7.342 0.000 11.995) 14.063 2.887 ( 22.543 0.000 -25.438) 33.989 3.025 ( -7.189 0.000 -4.247) 8.350 3.066 ( -3.075 0.000 -5.821) 6.583 3.113 ( -5.583 0.000 -0.266) 5.589 3.227 ( 3.819 0.000 -0.634) 3.872 3.378 ( -15.542 0.000 -3.548) 15.941 3.583 ( 1.529 0.000 -0.265) 1.552 3.655 ( -0.560 0.000 -5.707) 5.734 3.859 ( -2.859 0.000 7.218) 7.764 4.017 ( 5.460 0.000 5.103) 7.474 4.131 ( -9.362 0.000 4.094) 10.218 4.218 ( -3.675 0.000 -4.180) 5.566 4.396 ( -1.803 0.000 -17.288) 17.382 4.449 ( 17.160 0.000 11.810) 20.831 4.790 ( 9.330 0.000 -12.294) 15.433 4.831 ( -10.282 0.000 1.189) 10.350 4.944 ( 4.729 0.000 -7.490) 8.858 5.531 ( 0.090 0.000 12.818) 12.818 5.581 ( -4.771 0.000 -6.878) 8.371 5.743 ( 4.100 0.000 7.338) 8.406 6.042 ( -1.368 0.000 -1.354) 1.924 6.143 ( -8.584 0.000 2.245) 8.873 6.239 ( 2.531 0.000 -1.456) 2.920 6.959 ( -4.108 0.000 6.921) 8.048 7.234 ( -6.939 0.000 -2.492) 7.373 7.298 ( -2.535 0.000 3.031) 3.951 7.562 ( -4.416 0.000 10.832) 11.698 7.570 ( -4.876 0.000 0.009) 4.876 7.872 ( 11.083 0.000 -7.706) 13.498 8.239 ( 8.192 0.000 -0.905) 8.242 9.223 ( 11.486 0.000 -3.224) 11.930 9.384 ( -4.647 0.000 0.364) 4.661 9.688 ( 1.676 0.000 -2.754) 3.224 9.780 ( 8.784 0.000 5.003) 10.109 10.285 ( 5.131 0.000 -1.513) 5.349 10.435 ( -2.455 0.000 2.546) 3.537 10.806 ( -10.047 0.000 -6.183) 11.797 11.012 ( -10.304 0.000 1.377) 10.395 11.454 ( -4.252 0.000 -3.542) 5.534 11.550 ( -7.961 0.000 4.031) 8.923 12.145 ( 10.077 0.000 -9.042) 13.539 12.583 ( 8.327 0.000 10.438) 13.353 13.178 ( 10.366 0.000 4.179) 11.176 13.198 ( 2.903 0.000 1.678) 3.353 16.797 ( -12.047 0.000 3.630) 12.582 16.891 ( -16.846 0.000 1.484) 16.912 16.911 ( -17.052 0.000 0.378) 17.056 17.356 ( -15.983 0.000 13.832) 21.137 18.151 ( 9.394 0.000 -1.096) 9.457 18.231 ( 12.600 0.000 -0.670) 12.617 18.393 ( 7.490 0.000 -4.495) 8.735 18.524 ( 4.171 0.000 -5.188) 6.657 21.149 ( 8.803 0.000 0.073) 8.803 21.188 ( 3.725 0.000 1.070) 3.875 21.742 ( -0.262 0.000 -7.541) 7.546 22.049 ( -0.268 0.000 1.229) 1.258 ======================= Grid point 301 (144/170) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.637 ( 20.555 0.000 -10.517) 23.089 1.677 ( 22.660 0.000 -13.718) 26.489 2.548 ( -6.853 0.000 9.249) 11.511 2.678 ( 2.149 0.000 2.128) 3.025 2.789 ( -9.176 0.000 -2.929) 9.632 2.873 ( -3.070 0.000 -9.095) 9.599 3.030 ( -0.666 0.000 -6.929) 6.961 3.158 ( 10.965 0.000 6.048) 12.522 3.241 ( -5.381 0.000 6.811) 8.680 3.367 ( 13.528 0.000 -1.630) 13.626 3.485 ( -6.471 0.000 -8.394) 10.599 3.592 ( 2.670 0.000 -3.373) 4.302 3.902 ( -1.739 0.000 5.519) 5.787 3.913 ( -6.972 0.000 -14.788) 16.349 4.096 ( 4.233 0.000 1.261) 4.417 4.236 ( 2.796 0.000 -12.980) 13.278 4.287 ( 6.514 0.000 5.755) 8.692 4.714 ( -5.180 0.000 -0.115) 5.181 4.737 ( 10.654 0.000 -5.621) 12.045 4.830 ( 10.024 0.000 -1.416) 10.123 5.065 ( 13.996 0.000 1.813) 14.113 5.498 ( -0.779 0.000 -1.887) 2.041 5.611 ( -5.777 0.000 9.860) 11.428 5.871 ( -0.072 0.000 5.024) 5.024 5.997 ( -6.506 0.000 -2.797) 7.082 6.014 ( -3.695 0.000 2.033) 4.218 6.184 ( -6.109 0.000 -2.440) 6.578 6.790 ( -16.637 0.000 -2.639) 16.845 7.124 ( -4.357 0.000 0.563) 4.394 7.303 ( -2.263 0.000 4.032) 4.624 7.530 ( -1.229 0.000 1.020) 1.597 7.636 ( -4.298 0.000 12.749) 13.454 7.956 ( 10.372 0.000 -7.583) 12.848 8.347 ( 7.459 0.000 -3.509) 8.243 9.324 ( -2.520 0.000 1.180) 2.782 9.412 ( 14.598 0.000 -1.001) 14.632 9.678 ( 1.665 0.000 -3.382) 3.770 9.960 ( 9.251 0.000 1.282) 9.339 10.379 ( 7.508 0.000 -2.153) 7.811 10.422 ( -1.654 0.000 1.092) 1.982 10.580 ( -10.999 0.000 -3.747) 11.620 10.852 ( -11.189 0.000 0.705) 11.212 11.340 ( -5.010 0.000 -3.138) 5.912 11.481 ( -7.460 0.000 4.456) 8.689 12.242 ( 12.353 0.000 -4.343) 13.094 12.827 ( 8.139 0.000 9.388) 12.424 13.215 ( -0.670 0.000 -1.699) 1.827 13.345 ( 4.108 0.000 3.864) 5.640 16.595 ( -14.958 0.000 0.280) 14.961 16.656 ( -15.130 0.000 0.076) 15.130 16.841 ( -4.104 0.000 15.460) 15.996 17.271 ( -16.403 0.000 16.867) 23.528 18.223 ( 5.066 0.000 -7.177) 8.785 18.389 ( 7.078 0.000 -4.654) 8.471 18.444 ( 2.078 0.000 -10.466) 10.670 18.459 ( 7.041 0.000 -3.082) 7.686 21.274 ( 4.553 0.000 2.656) 5.271 21.322 ( 11.495 0.000 1.478) 11.590 21.665 ( -0.139 0.000 -5.932) 5.934 22.033 ( -1.754 0.000 -0.958) 1.999 ======================= Grid point 302 (145/170) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( 19.760 0.000 -2.373) 19.902 1.925 ( 25.125 0.000 -10.883) 27.380 2.387 ( -15.865 0.000 6.228) 17.043 2.598 ( -7.043 0.000 -6.917) 9.872 2.781 ( 5.503 0.000 -2.852) 6.198 2.811 ( -5.373 0.000 8.736) 10.256 2.964 ( -0.679 0.000 -2.858) 2.938 3.141 ( -13.412 0.000 1.074) 13.455 3.284 ( -1.211 0.000 8.544) 8.629 3.408 ( -2.964 0.000 1.905) 3.524 3.475 ( 0.270 0.000 -0.925) 0.964 3.602 ( -8.940 0.000 -15.755) 18.115 3.730 ( 17.006 0.000 -5.193) 17.782 3.931 ( -0.155 0.000 1.745) 1.752 4.255 ( 12.254 0.000 -4.405) 13.021 4.293 ( 22.912 0.000 -3.030) 23.112 4.397 ( 3.927 0.000 -1.511) 4.208 4.661 ( -0.454 0.000 -0.364) 0.582 4.836 ( 8.419 0.000 -1.439) 8.541 4.994 ( 7.428 0.000 3.874) 8.378 5.245 ( 1.353 0.000 2.497) 2.840 5.557 ( 13.778 0.000 -2.185) 13.950 5.579 ( -9.752 0.000 6.849) 11.917 5.737 ( -9.696 0.000 -6.134) 11.474 5.870 ( -19.340 0.000 1.908) 19.434 5.997 ( 2.069 0.000 0.768) 2.207 6.089 ( -0.752 0.000 -1.837) 1.985 6.468 ( -18.922 0.000 -2.810) 19.130 7.127 ( 1.812 0.000 3.185) 3.665 7.305 ( -2.747 0.000 3.269) 4.270 7.552 ( 2.339 0.000 1.343) 2.697 7.691 ( -6.187 0.000 12.024) 13.522 8.031 ( 8.708 0.000 -5.915) 10.527 8.356 ( 0.862 0.000 -7.315) 7.366 9.345 ( 1.641 0.000 3.439) 3.810 9.572 ( 3.833 0.000 -3.034) 4.888 9.729 ( 11.373 0.000 -0.423) 11.381 10.087 ( 7.000 0.000 -2.767) 7.527 10.402 ( -8.950 0.000 1.890) 9.147 10.405 ( -1.100 0.000 -0.563) 1.235 10.450 ( 6.335 0.000 -5.139) 8.158 10.691 ( -10.837 0.000 2.178) 11.054 11.246 ( -2.004 0.000 -3.123) 3.710 11.394 ( -8.849 0.000 2.969) 9.333 12.438 ( 14.469 0.000 0.768) 14.489 13.011 ( -0.153 0.000 7.738) 7.739 13.164 ( 1.436 0.000 -4.019) 4.268 13.393 ( -0.547 0.000 0.608) 0.818 16.401 ( -9.764 0.000 0.456) 9.775 16.451 ( -10.562 0.000 -0.275) 10.566 16.976 ( -1.881 0.000 14.745) 14.864 17.207 ( -14.625 0.000 15.524) 21.328 18.181 ( 3.494 0.000 -10.694) 11.250 18.246 ( -0.161 0.000 -14.239) 14.240 18.526 ( 5.996 0.000 -0.531) 6.019 18.538 ( 5.004 0.000 -0.722) 5.056 21.380 ( 4.808 0.000 2.631) 5.481 21.517 ( 8.081 0.000 3.643) 8.864 21.613 ( 2.485 0.000 -5.180) 5.745 21.975 ( -4.042 0.000 -1.307) 4.249 ======================= Grid point 303 (146/170) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( 14.119 0.000 2.661) 14.367 2.175 ( 19.473 0.000 -10.827) 22.280 2.277 ( -10.078 0.000 9.618) 13.931 2.397 ( -10.035 0.000 -4.388) 10.952 2.817 ( -7.646 0.000 10.709) 13.158 2.819 ( 6.940 0.000 -8.879) 11.269 2.939 ( 0.382 0.000 -1.387) 1.439 2.975 ( -10.244 0.000 5.255) 11.514 3.296 ( -3.038 0.000 -4.329) 5.288 3.305 ( -3.094 0.000 -4.942) 5.831 3.415 ( -0.288 0.000 4.062) 4.072 3.478 ( -0.168 0.000 -3.273) 3.277 3.878 ( 4.386 0.000 2.553) 5.075 3.933 ( -0.078 0.000 -1.504) 1.506 4.388 ( 3.280 0.000 0.903) 3.402 4.408 ( 1.559 0.000 -2.754) 3.164 4.616 ( 16.981 0.000 -3.065) 17.256 4.831 ( -8.791 0.000 -1.948) 9.004 4.851 ( 27.295 0.000 0.794) 27.307 5.138 ( -2.463 0.000 9.168) 9.493 5.302 ( 8.351 0.000 -1.839) 8.551 5.462 ( -13.291 0.000 4.475) 14.024 5.502 ( -20.193 0.000 2.693) 20.372 5.516 ( -4.406 0.000 -11.407) 12.228 5.838 ( 16.082 0.000 1.394) 16.142 6.018 ( 0.308 0.000 -1.834) 1.860 6.074 ( 1.980 0.000 -3.488) 4.011 6.163 ( -18.663 0.000 3.023) 18.906 7.215 ( 4.719 0.000 1.426) 4.930 7.282 ( -3.772 0.000 1.511) 4.064 7.627 ( 6.114 0.000 -0.667) 6.150 7.695 ( -7.495 0.000 7.644) 10.705 8.112 ( 6.669 0.000 -0.458) 6.685 8.238 ( -4.322 0.000 -6.897) 8.139 9.433 ( 3.035 0.000 4.836) 5.709 9.528 ( -1.754 0.000 -4.889) 5.194 9.934 ( 11.348 0.000 1.085) 11.400 10.079 ( -4.098 0.000 -2.520) 4.810 10.359 ( 0.117 0.000 1.237) 1.242 10.379 ( -1.274 0.000 -0.253) 1.299 10.489 ( 6.220 0.000 -4.392) 7.614 10.567 ( -9.033 0.000 3.547) 9.705 11.222 ( 3.453 0.000 -2.996) 4.572 11.285 ( -8.020 0.000 2.535) 8.411 12.687 ( 13.995 0.000 2.669) 14.247 12.915 ( -11.529 0.000 -1.372) 11.610 13.252 ( 6.454 0.000 2.089) 6.783 13.353 ( -3.611 0.000 -1.548) 3.929 16.307 ( -2.801 0.000 0.684) 2.884 16.327 ( -4.313 0.000 -0.592) 4.354 17.081 ( 2.500 0.000 3.693) 4.459 17.148 ( -9.598 0.000 8.244) 12.652 18.129 ( 2.484 0.000 -6.235) 6.711 18.138 ( -0.477 0.000 -4.211) 4.238 18.585 ( 2.189 0.000 -0.359) 2.219 18.587 ( 1.578 0.000 0.065) 1.580 21.472 ( 3.981 0.000 1.454) 4.238 21.537 ( -2.902 0.000 -0.503) 2.946 21.729 ( 10.255 0.000 0.400) 10.262 21.875 ( -7.076 0.000 -1.113) 7.163 ======================= Grid point 309 (147/170) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( 0.473 8.391 -21.844) 23.405 1.847 ( -0.473 8.391 21.844) 23.405 2.003 ( -1.883 11.418 -21.864) 24.738 2.003 ( 1.883 11.418 21.864) 24.738 3.075 ( -1.713 -3.746 -3.846) 5.636 3.075 ( 1.713 -3.746 3.846) 5.636 3.223 ( -0.054 -7.911 -5.490) 9.630 3.223 ( 0.054 -7.911 5.490) 9.630 3.471 ( -2.278 -1.998 -9.608) 10.074 3.471 ( 2.278 -1.998 9.608) 10.074 3.544 ( -4.047 2.437 -16.019) 16.702 3.544 ( 4.047 2.437 16.019) 16.702 3.787 ( 0.555 7.208 -8.206) 10.936 3.787 ( -0.555 7.208 8.206) 10.936 4.251 ( -4.754 6.665 -4.207) 9.205 4.251 ( 4.754 6.665 4.207) 9.205 4.567 ( -7.378 2.766 -2.093) 8.153 4.567 ( 7.378 2.766 2.093) 8.153 4.796 ( -0.240 2.590 -5.776) 6.335 4.796 ( 0.240 2.590 5.776) 6.335 5.268 ( -1.978 1.427 -13.812) 14.026 5.268 ( 1.978 1.427 13.812) 14.026 5.759 ( 5.677 -4.683 -4.284) 8.515 5.759 ( -5.677 -4.683 4.284) 8.515 6.062 ( 1.453 -4.626 -5.311) 7.191 6.062 ( -1.453 -4.626 5.311) 7.191 6.412 ( -8.003 4.456 -10.103) 13.637 6.412 ( 8.003 4.456 10.103) 13.637 7.353 ( -3.195 -0.873 -3.052) 4.504 7.353 ( 3.195 -0.873 3.052) 4.504 7.713 ( 10.882 4.059 -5.056) 12.667 7.713 ( -10.882 4.059 5.056) 12.667 7.955 ( -9.654 3.438 -3.632) 10.873 7.955 ( 9.654 3.438 3.632) 10.873 9.235 ( -1.405 3.393 -7.721) 8.550 9.235 ( 1.405 3.393 7.721) 8.550 9.688 ( -1.603 3.104 -2.540) 4.319 9.688 ( 1.603 3.104 2.540) 4.319 10.410 ( -2.918 2.531 -4.380) 5.840 10.410 ( 2.918 2.531 4.380) 5.840 11.102 ( 0.624 -4.403 -7.294) 8.543 11.102 ( -0.624 -4.403 7.294) 8.543 11.567 ( 0.552 -3.687 -6.462) 7.460 11.567 ( -0.552 -3.687 6.462) 7.460 12.228 ( 0.217 4.172 -12.051) 12.754 12.228 ( -0.217 4.172 12.051) 12.754 12.957 ( -0.952 -3.404 -6.761) 7.629 12.957 ( 0.952 -3.404 6.761) 7.629 17.102 ( -13.189 -13.068 -3.216) 18.843 17.102 ( 13.189 -13.068 3.216) 18.843 17.270 ( -9.060 -10.937 -2.511) 14.423 17.270 ( 9.060 -10.937 2.511) 14.423 18.055 ( -8.970 11.125 -1.134) 14.336 18.055 ( 8.970 11.125 1.134) 14.336 18.363 ( -10.405 7.521 -0.913) 12.871 18.363 ( 10.405 7.521 0.913) 12.871 21.077 ( -0.495 1.412 -0.141) 1.502 21.077 ( 0.495 1.412 0.141) 1.502 21.944 ( -0.619 1.238 -7.474) 7.601 21.944 ( 0.619 1.238 7.474) 7.601 ======================= Grid point 311 (148/170) ======================= q-point: ( 0.09 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( 7.699 11.652 -20.402) 24.724 1.769 ( 4.673 14.159 -21.613) 26.257 2.135 ( 6.305 4.427 19.260) 20.743 2.293 ( 5.900 6.913 18.218) 20.359 2.989 ( 2.235 -2.906 -14.488) 14.945 3.095 ( -5.387 -4.385 -7.150) 9.969 3.141 ( 1.766 -1.357 3.113) 3.827 3.184 ( -2.299 -1.497 -7.824) 8.291 3.236 ( -3.037 1.241 -6.444) 7.231 3.480 ( 2.025 -4.875 -4.656) 7.038 3.557 ( 0.647 -5.764 3.462) 6.755 3.672 ( 2.047 -0.411 -4.200) 4.691 3.830 ( 3.373 -0.146 5.174) 6.178 3.991 ( -10.998 4.892 1.380) 12.116 4.072 ( 5.697 10.134 15.353) 19.258 4.261 ( -6.489 6.350 3.592) 9.764 4.428 ( -3.321 4.658 -6.835) 8.913 4.601 ( 2.350 2.602 -9.307) 9.946 4.808 ( 8.108 5.431 -6.962) 11.987 4.920 ( 0.454 0.162 6.322) 6.340 5.085 ( -1.956 3.536 -11.196) 11.903 5.405 ( -1.886 -0.929 10.238) 10.451 5.618 ( -5.240 -1.271 2.821) 6.085 5.759 ( -3.321 -2.626 -4.790) 6.393 6.062 ( 3.843 -2.230 -4.433) 6.277 6.134 ( 5.310 -2.302 2.251) 6.210 6.262 ( -5.446 3.703 -0.418) 6.599 6.692 ( 7.572 -4.566 13.168) 15.862 7.264 ( -4.639 -3.094 -1.666) 5.820 7.428 ( 1.344 3.430 3.630) 5.171 7.588 ( -9.124 3.326 1.417) 9.814 7.757 ( -5.346 3.540 -3.006) 7.081 7.838 ( 7.034 6.593 -3.530) 10.267 8.125 ( 7.703 1.967 1.823) 8.157 9.190 ( 4.697 4.622 -5.200) 8.394 9.371 ( 3.023 0.754 6.437) 7.151 9.646 ( 0.777 1.397 -1.254) 2.032 9.744 ( 1.790 5.289 2.577) 6.150 10.305 ( -3.107 1.130 -4.009) 5.196 10.473 ( -0.645 3.871 3.793) 5.458 10.969 ( -6.450 -4.469 -7.251) 10.684 11.098 ( -7.815 -3.463 4.876) 9.841 11.505 ( -0.636 -3.561 -4.730) 5.954 11.595 ( -5.622 -3.092 5.514) 8.460 12.156 ( 7.643 4.016 -11.762) 14.591 12.396 ( 5.050 4.111 11.041) 12.818 12.938 ( 7.159 -5.593 -4.323) 10.061 13.077 ( 4.397 -2.687 5.626) 7.629 16.842 ( -14.014 -10.731 -0.588) 17.660 17.041 ( -15.387 -9.887 1.767) 18.375 17.263 ( -0.063 -1.293 0.318) 1.333 17.435 ( 1.563 -3.669 7.275) 8.296 17.909 ( -4.607 2.263 -0.464) 5.154 18.156 ( 2.644 3.420 0.007) 4.323 18.303 ( 5.724 5.042 -1.677) 7.810 18.536 ( 8.799 7.288 -0.443) 11.434 21.088 ( 2.740 2.767 -0.037) 3.895 21.122 ( 4.356 0.330 -0.001) 4.368 21.841 ( -0.846 0.636 -8.637) 8.701 22.017 ( 0.004 0.571 4.657) 4.692 ======================= Grid point 312 (149/170) ======================= q-point: ( 0.18 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( 11.909 11.142 -19.767) 25.626 1.719 ( 13.931 13.717 -15.496) 24.947 2.421 ( 4.878 2.683 14.465) 15.499 2.561 ( 5.235 1.598 12.935) 14.045 2.884 ( 8.068 -1.443 -17.149) 19.006 3.002 ( -1.353 -4.610 -3.486) 5.936 3.060 ( -5.861 3.146 -6.191) 9.087 3.121 ( -3.522 -0.861 1.055) 3.776 3.216 ( 5.253 0.327 1.029) 5.363 3.371 ( -8.312 -1.994 -5.907) 10.390 3.553 ( 0.913 -1.732 -1.456) 2.440 3.669 ( 2.350 1.702 -5.981) 6.647 3.842 ( -4.540 -1.473 5.094) 6.981 3.973 ( 4.281 -5.372 4.969) 8.478 4.121 ( -8.984 -2.769 -1.979) 9.607 4.236 ( -4.547 4.762 -8.121) 10.455 4.359 ( 3.190 4.014 -5.518) 7.532 4.600 ( 9.806 9.297 2.574) 13.756 4.814 ( 0.525 3.511 -8.175) 8.913 4.886 ( -1.132 4.511 -2.963) 5.515 5.025 ( 6.303 7.760 -4.470) 10.951 5.474 ( -0.892 -4.041 5.151) 6.607 5.626 ( -1.142 3.565 6.180) 7.226 5.748 ( 1.522 -0.218 5.107) 5.334 6.053 ( -1.181 0.808 -0.690) 1.589 6.156 ( -6.163 -0.644 -1.355) 6.343 6.227 ( 1.269 -0.479 0.897) 1.626 6.822 ( -5.484 -12.554 4.527) 14.428 7.181 ( -4.592 -2.975 0.188) 5.474 7.424 ( -5.003 9.815 -0.681) 11.038 7.525 ( -1.378 -0.920 4.403) 4.704 7.686 ( -4.781 8.130 6.588) 11.505 7.927 ( 10.126 5.317 -6.458) 13.134 8.249 ( 8.477 1.534 -1.451) 8.736 9.252 ( 8.349 2.402 -3.345) 9.309 9.386 ( -2.866 0.492 -0.522) 2.955 9.696 ( 3.011 1.181 -1.057) 3.402 9.834 ( 5.610 5.078 5.375) 9.282 10.272 ( 3.644 -0.933 -2.000) 4.260 10.481 ( -2.379 3.964 2.389) 5.204 10.768 ( -9.228 -3.250 -5.657) 11.301 10.990 ( -10.090 -2.253 1.878) 10.508 11.429 ( -3.783 -2.699 -3.083) 5.576 11.529 ( -7.767 -2.235 4.036) 9.034 12.187 ( 10.263 4.037 -9.432) 14.512 12.620 ( 8.152 3.566 10.077) 13.443 13.071 ( 10.502 -8.225 0.250) 13.341 13.189 ( 3.099 -2.676 3.486) 5.378 16.707 ( -7.816 -3.282 7.332) 11.208 16.833 ( -13.433 -4.537 3.250) 14.546 17.122 ( -14.877 13.363 -0.226) 19.998 17.441 ( -13.650 6.865 12.277) 19.601 17.949 ( 9.164 -11.511 -0.506) 14.722 18.258 ( 9.362 -8.141 -0.175) 12.408 18.371 ( 6.105 4.576 -4.875) 9.054 18.582 ( 1.854 3.260 -7.210) 8.127 21.147 ( 4.580 0.604 -0.258) 4.627 21.222 ( 7.367 2.738 1.770) 8.056 21.733 ( -0.948 -0.932 -8.170) 8.278 22.040 ( -1.211 -0.925 1.192) 1.935 ======================= Grid point 313 (150/170) ======================= q-point: ( 0.27 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( 18.488 5.930 -12.580) 23.135 1.828 ( 19.128 11.136 -12.611) 25.474 2.549 ( -8.010 0.016 8.493) 11.674 2.713 ( -2.405 3.135 4.294) 5.835 2.770 ( -2.579 -6.234 -3.453) 7.579 2.819 ( -5.122 1.123 -2.492) 5.806 3.061 ( 0.701 -0.056 -5.390) 5.436 3.184 ( 3.507 1.440 7.760) 8.637 3.225 ( -3.473 0.811 0.969) 3.696 3.355 ( 8.148 -2.546 1.108) 8.608 3.531 ( -6.841 1.843 -2.445) 7.495 3.593 ( 10.478 4.668 -11.542) 16.273 3.840 ( -3.574 -5.069 3.717) 7.231 3.960 ( -3.969 2.269 -12.716) 13.513 4.072 ( 3.775 -2.591 -3.406) 5.707 4.080 ( 4.335 -11.431 -6.067) 13.648 4.368 ( 4.127 6.186 0.496) 7.452 4.672 ( -1.643 -0.560 -4.900) 5.198 4.799 ( 6.141 5.094 -0.949) 8.035 4.925 ( 9.682 7.921 -1.089) 12.557 5.170 ( 11.443 9.419 2.071) 14.965 5.507 ( 0.382 1.063 1.482) 1.864 5.645 ( -6.735 2.150 6.403) 9.539 5.849 ( 0.884 -2.830 5.572) 6.312 5.940 ( -10.065 -2.698 -0.900) 10.459 6.075 ( -5.329 2.693 0.841) 6.030 6.210 ( -1.915 2.980 -1.579) 3.878 6.660 ( -12.774 -12.445 -3.651) 18.204 7.125 ( -3.328 -0.145 1.751) 3.763 7.352 ( -3.341 5.015 0.680) 6.064 7.556 ( -0.760 3.022 3.631) 4.784 7.728 ( -3.705 8.915 11.071) 14.689 8.006 ( 9.475 4.730 -7.271) 12.846 8.352 ( 7.524 0.733 -4.385) 8.739 9.296 ( -0.585 -2.168 0.203) 2.255 9.429 ( 10.648 1.110 -1.473) 10.806 9.695 ( 0.873 1.536 -2.801) 3.312 9.993 ( 7.864 3.229 1.864) 8.703 10.336 ( 5.010 -3.192 -1.529) 6.134 10.453 ( -3.259 0.079 -0.327) 3.276 10.589 ( -6.519 2.891 -2.064) 7.424 10.838 ( -10.791 -1.548 1.031) 10.950 11.327 ( -4.685 -1.392 -2.629) 5.549 11.461 ( -7.228 -2.086 4.338) 8.684 12.275 ( 11.903 3.336 -5.176) 13.401 12.856 ( 7.754 2.830 9.159) 12.330 13.174 ( 1.732 -4.403 -1.664) 5.015 13.277 ( 4.388 -5.711 2.936) 7.778 16.606 ( -11.264 2.098 1.737) 11.588 16.813 ( -6.893 8.787 10.955) 15.645 16.884 ( -11.535 9.329 5.331) 15.764 17.345 ( -16.894 7.588 15.699) 24.278 18.106 ( 10.134 -10.977 -1.782) 15.046 18.344 ( 6.125 -4.762 -7.418) 10.734 18.416 ( 2.629 0.345 -8.309) 8.722 18.478 ( 3.550 -1.530 -7.049) 8.040 21.224 ( 5.000 -2.262 0.593) 5.520 21.382 ( 8.931 3.508 3.238) 10.127 21.637 ( -0.697 -2.850 -6.766) 7.374 22.012 ( -2.476 -2.135 -0.627) 3.329 ======================= Grid point 314 (151/170) ======================= q-point: ( 0.36 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( 19.747 0.933 -4.392) 20.251 2.025 ( 21.348 7.244 -10.410) 24.831 2.399 ( -14.520 1.127 6.355) 15.890 2.569 ( -7.940 -2.368 -5.307) 9.840 2.804 ( 1.742 1.824 0.404) 2.554 2.832 ( -1.559 1.801 7.572) 7.938 2.995 ( -0.953 2.512 -4.053) 4.863 3.173 ( -11.858 2.915 1.408) 12.292 3.235 ( -2.578 -3.602 8.944) 9.980 3.349 ( -4.259 -5.306 0.058) 6.805 3.488 ( -1.019 0.864 0.565) 1.451 3.630 ( -6.924 3.085 -15.446) 17.206 3.739 ( 10.008 -0.233 -6.281) 11.818 3.887 ( 1.807 -3.998 -0.673) 4.438 4.147 ( 15.974 -9.278 -4.422) 18.995 4.240 ( 19.347 -5.341 -2.846) 20.271 4.430 ( 3.551 2.374 -1.071) 4.404 4.670 ( 2.713 2.279 2.781) 4.504 4.906 ( 9.397 6.676 -0.598) 11.542 5.102 ( 10.534 7.974 2.295) 13.410 5.279 ( -5.422 5.458 2.548) 8.104 5.512 ( -3.556 -3.704 -1.911) 5.478 5.574 ( -2.131 -4.389 0.356) 4.892 5.724 ( -10.509 2.193 1.383) 10.824 5.907 ( -9.997 1.438 -2.153) 10.327 5.989 ( -0.098 1.041 6.704) 6.785 6.143 ( -2.076 4.009 -6.422) 7.849 6.423 ( -11.777 -4.504 -1.960) 12.760 7.144 ( 1.952 1.959 3.902) 4.783 7.325 ( -2.086 2.475 1.344) 3.504 7.597 ( 1.566 4.414 3.441) 5.812 7.781 ( -5.834 8.897 11.281) 15.507 8.066 ( 8.252 3.515 -6.848) 11.285 8.352 ( 1.006 -0.333 -8.156) 8.225 9.321 ( 1.848 -2.212 3.003) 4.162 9.557 ( 4.016 -1.769 -2.571) 5.086 9.718 ( 7.927 -0.928 -0.919) 8.034 10.092 ( 5.295 0.498 -4.383) 6.892 10.359 ( -3.082 -5.109 2.927) 6.646 10.390 ( -0.426 0.938 -1.793) 2.068 10.533 ( 0.816 7.207 -2.586) 7.700 10.700 ( -8.825 0.383 2.955) 9.315 11.240 ( -1.989 -0.665 -2.893) 3.573 11.378 ( -8.522 -1.684 2.964) 9.178 12.451 ( 13.728 1.436 -0.094) 13.804 13.015 ( -2.474 -0.112 5.765) 6.274 13.158 ( 3.895 -0.192 -2.128) 4.442 13.350 ( 1.609 -3.806 0.866) 4.222 16.473 ( -6.703 7.501 0.743) 10.086 16.627 ( -11.977 16.582 -0.413) 20.459 17.000 ( -0.916 2.850 14.437) 14.744 17.264 ( -15.369 6.064 15.315) 22.529 18.166 ( 4.314 -2.202 -7.683) 9.083 18.251 ( 0.074 0.729 -14.460) 14.479 18.398 ( 8.665 -8.036 -2.944) 12.179 18.548 ( 3.388 -3.208 0.408) 4.683 21.313 ( 5.043 -5.423 0.891) 7.458 21.524 ( -0.668 -2.628 2.244) 3.520 21.596 ( 8.130 0.094 -3.589) 8.888 21.953 ( -4.114 -2.207 -0.705) 4.721 ======================= Grid point 315 (152/170) ======================= q-point: ( 0.45 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 14.913 -1.552 1.113) 15.035 2.227 ( 16.074 3.704 -9.828) 19.201 2.309 ( -8.555 3.090 9.118) 12.879 2.379 ( -10.026 -1.855 -3.122) 10.663 2.824 ( -0.210 1.306 1.540) 2.030 2.856 ( -1.714 2.969 0.449) 3.458 2.958 ( 0.343 1.923 -0.547) 2.028 3.013 ( -9.638 3.270 3.638) 10.808 3.262 ( -2.051 -2.971 -1.580) 3.941 3.281 ( -1.881 -3.204 -0.824) 3.806 3.416 ( -1.268 0.776 -2.066) 2.545 3.460 ( -1.185 -1.190 -3.510) 3.891 3.811 ( 4.343 -5.137 -0.792) 6.773 3.866 ( -2.774 -6.384 -0.449) 6.975 4.350 ( 9.438 -4.633 -0.028) 10.514 4.426 ( -0.673 -0.179 0.754) 1.026 4.620 ( 24.364 -1.811 -3.905) 24.741 4.828 ( 10.814 1.789 3.434) 11.486 4.942 ( -5.435 7.558 -1.641) 9.453 5.162 ( -11.775 -2.246 2.011) 12.155 5.295 ( 12.026 3.052 -1.586) 12.508 5.371 ( -5.859 -3.922 5.492) 8.937 5.483 ( -10.556 -1.582 2.614) 10.989 5.582 ( -8.941 4.809 -8.378) 13.163 5.842 ( 4.998 1.531 3.957) 6.556 5.992 ( -4.438 -2.737 -7.271) 8.947 6.111 ( 5.704 5.493 2.857) 8.419 6.251 ( -9.615 4.827 0.025) 10.759 7.238 ( 4.086 2.616 2.301) 5.370 7.301 ( -2.628 2.313 0.336) 3.517 7.686 ( 5.632 5.502 1.849) 8.088 7.776 ( -7.511 7.822 6.092) 12.438 8.127 ( 6.475 1.622 -2.292) 7.058 8.234 ( -4.057 -0.344 -6.382) 7.570 9.409 ( 3.434 -2.298 4.518) 6.122 9.510 ( -2.549 -1.811 -4.558) 5.527 9.887 ( 9.908 -4.321 2.139) 11.019 10.041 ( -4.399 -3.592 -4.594) 7.305 10.365 ( -1.067 -0.316 3.037) 3.234 10.377 ( 1.062 0.958 -2.509) 2.888 10.545 ( 3.277 5.680 0.058) 6.558 10.618 ( -5.541 4.099 1.076) 6.976 11.215 ( 3.169 -0.757 -2.891) 4.356 11.274 ( -7.683 -1.187 2.448) 8.150 12.682 ( 13.306 -0.408 2.309) 13.511 12.899 ( -10.914 -1.610 -1.698) 11.162 13.264 ( 5.529 1.239 2.308) 6.118 13.345 ( -2.046 -0.710 -1.175) 2.463 16.424 ( -0.365 11.582 0.661) 11.606 16.477 ( -6.170 14.508 -0.639) 15.778 17.116 ( 3.480 3.858 3.166) 6.084 17.193 ( -10.527 4.871 8.544) 14.406 18.135 ( 1.217 0.350 -3.810) 4.014 18.146 ( 0.857 0.972 -5.979) 6.117 18.505 ( 6.391 -6.363 -0.740) 9.049 18.565 ( -1.840 -3.942 0.449) 4.373 21.397 ( 4.398 -7.249 0.897) 8.526 21.471 ( -3.573 -6.825 -1.177) 7.793 21.740 ( 8.574 0.724 0.821) 8.644 21.865 ( -6.257 -1.049 -0.690) 6.382 ======================= Grid point 321 (153/170) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( 1.553 9.219 -15.388) 18.005 2.027 ( -1.553 9.219 15.388) 18.005 2.237 ( 0.677 11.783 -17.698) 21.273 2.237 ( -0.677 11.783 17.698) 21.273 2.925 ( 1.932 -11.493 -2.730) 11.970 2.925 ( -1.932 -11.493 2.730) 11.970 3.075 ( 2.820 -6.287 -3.943) 7.939 3.075 ( -2.820 -6.287 3.943) 7.939 3.404 ( -1.984 -4.638 -0.176) 5.047 3.404 ( 1.984 -4.638 0.176) 5.047 3.596 ( -7.479 2.463 -8.345) 11.473 3.596 ( 7.479 2.463 8.345) 11.473 4.069 ( -1.201 21.736 -21.494) 30.592 4.069 ( 1.201 21.736 21.494) 30.592 4.394 ( -9.835 6.370 -4.032) 12.392 4.394 ( 9.835 6.370 4.032) 12.392 4.622 ( 5.144 4.476 -2.548) 7.279 4.622 ( -5.144 4.476 2.548) 7.279 4.899 ( 1.365 8.116 -1.629) 8.389 4.899 ( -1.365 8.116 1.629) 8.389 5.260 ( -0.290 -2.197 -8.514) 8.797 5.260 ( 0.290 -2.197 8.514) 8.797 5.747 ( -2.923 3.301 -1.249) 4.583 5.747 ( 2.923 3.301 1.249) 4.583 5.962 ( -0.054 -6.203 -4.771) 7.826 5.962 ( 0.054 -6.203 4.771) 7.826 6.415 ( -2.922 -4.625 -10.991) 12.277 6.415 ( 2.922 -4.625 10.991) 12.277 7.309 ( -4.695 -3.147 -3.052) 6.423 7.309 ( 4.695 -3.147 3.052) 6.423 7.760 ( 4.061 -0.493 -4.750) 6.268 7.760 ( -4.061 -0.493 4.750) 6.268 8.085 ( -3.195 9.926 -5.490) 11.784 8.085 ( 3.195 9.926 5.490) 11.784 9.313 ( 0.326 4.333 -5.943) 7.362 9.313 ( -0.326 4.333 5.943) 7.362 9.793 ( -0.561 8.145 -7.097) 10.818 9.793 ( 0.561 8.145 7.097) 10.818 10.481 ( -4.458 4.850 -5.238) 8.416 10.481 ( 4.458 4.850 5.238) 8.416 10.991 ( 1.808 -7.071 -9.419) 11.916 10.991 ( -1.808 -7.071 9.419) 11.916 11.464 ( 0.396 -6.988 -6.521) 9.566 11.464 ( -0.396 -6.988 6.521) 9.566 12.324 ( 0.027 5.320 -11.959) 13.089 12.324 ( -0.027 5.320 11.959) 13.089 12.878 ( -1.046 -4.429 -7.682) 8.929 12.878 ( 1.046 -4.429 7.682) 8.929 16.857 ( -11.873 -11.903 -2.416) 16.985 16.857 ( 11.873 -11.903 2.416) 16.985 17.040 ( -7.588 -11.838 -2.756) 14.328 17.040 ( 7.588 -11.838 2.756) 14.328 18.243 ( -6.773 7.871 -2.024) 10.580 18.243 ( 6.773 7.871 2.024) 10.580 18.518 ( -11.127 8.089 -0.709) 13.774 18.518 ( 11.127 8.089 0.709) 13.774 21.111 ( -0.215 2.039 -1.895) 2.792 21.111 ( 0.215 2.039 1.895) 2.792 21.976 ( -0.424 2.019 -7.243) 7.531 21.976 ( 0.424 2.019 7.243) 7.531 ======================= Grid point 323 (154/170) ======================= q-point: ( 0.09 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 7.697 14.225 -12.869) 20.669 2.051 ( 3.245 14.543 -18.743) 23.944 2.237 ( 4.196 4.973 15.220) 16.553 2.421 ( 0.836 6.104 14.545) 15.796 2.890 ( -1.846 -7.141 -1.989) 7.639 2.902 ( -1.249 -10.893 -1.549) 11.074 3.100 ( 0.052 -4.296 5.466) 6.952 3.112 ( -0.978 -6.892 3.598) 7.836 3.301 ( -7.776 0.673 -4.981) 9.259 3.397 ( -0.406 -2.539 -11.093) 11.387 3.439 ( 1.126 -5.433 1.836) 5.845 3.732 ( 4.070 2.692 -1.300) 5.050 3.894 ( 3.178 12.305 -12.717) 17.979 4.106 ( -15.300 7.206 -3.887) 17.353 4.315 ( 0.307 13.324 4.202) 13.974 4.439 ( -2.239 13.103 4.792) 14.130 4.550 ( -1.881 6.993 -5.031) 8.818 4.674 ( 6.530 5.599 -5.366) 10.139 4.933 ( 4.866 6.186 -0.901) 7.922 4.984 ( 3.562 8.221 1.083) 9.024 5.149 ( -0.106 2.591 -5.769) 6.325 5.330 ( -1.390 -4.911 6.065) 7.927 5.660 ( -4.335 4.854 1.404) 6.658 5.755 ( -3.211 1.145 3.380) 4.800 5.985 ( 6.982 -6.203 -4.283) 10.275 6.067 ( 5.758 -4.790 0.549) 7.510 6.265 ( -5.200 -3.840 -3.245) 7.233 6.560 ( -2.184 -9.154 11.879) 15.155 7.207 ( -4.958 -2.505 -0.813) 5.614 7.421 ( 3.983 -2.705 3.997) 6.258 7.694 ( -3.266 4.934 -1.903) 6.215 7.786 ( 1.787 -0.606 -2.178) 2.882 8.018 ( 1.734 11.078 -2.326) 11.451 8.210 ( 4.912 7.071 3.479) 9.286 9.287 ( 3.842 5.046 -5.039) 8.100 9.392 ( 1.774 1.431 3.892) 4.510 9.722 ( 1.347 6.710 -4.968) 8.457 9.877 ( -0.269 8.811 7.368) 11.489 10.341 ( -4.785 2.586 -5.217) 7.537 10.571 ( -0.240 6.014 4.097) 7.281 10.865 ( -4.737 -5.780 -7.509) 10.594 11.005 ( -7.574 -6.345 7.283) 12.274 11.406 ( -0.223 -6.789 -4.377) 8.081 11.508 ( -4.220 -6.021 6.124) 9.569 12.248 ( 7.847 5.293 -12.296) 15.517 12.491 ( 5.242 5.306 10.382) 12.783 12.827 ( 5.284 -5.320 -6.321) 9.807 13.000 ( 3.601 -5.044 6.403) 8.911 16.688 ( -7.708 -5.515 2.702) 9.855 16.858 ( -10.065 -8.631 2.231) 13.445 17.097 ( 11.962 -12.257 2.043) 17.248 17.280 ( 12.584 -11.857 5.679) 18.199 18.052 ( -12.315 9.779 -1.486) 15.796 18.263 ( -9.703 7.940 -0.300) 12.542 18.407 ( 2.920 4.364 -1.937) 5.596 18.651 ( 4.947 4.671 -1.498) 6.966 21.119 ( 3.036 0.953 -0.969) 3.327 21.168 ( 4.007 3.692 2.369) 5.942 21.862 ( -2.212 1.587 -9.227) 9.620 22.029 ( -1.711 0.442 3.977) 4.352 ======================= Grid point 324 (155/170) ======================= q-point: ( 0.18 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( 5.968 17.630 -17.788) 25.746 1.982 ( 10.421 13.109 -11.948) 20.572 2.461 ( 4.002 -0.059 10.941) 11.650 2.569 ( 0.975 -0.241 9.598) 9.650 2.830 ( -4.080 -2.237 -0.546) 4.685 2.900 ( 1.442 -5.789 0.717) 6.009 3.071 ( -9.212 -3.103 -0.252) 9.724 3.156 ( -1.038 0.110 -0.108) 1.050 3.173 ( -0.703 -2.901 6.973) 7.585 3.315 ( 1.891 -3.526 -7.299) 8.323 3.487 ( 1.946 -6.760 1.853) 7.275 3.726 ( 2.709 0.713 -3.862) 4.771 3.831 ( 2.271 2.507 -10.452) 10.986 3.939 ( -3.079 8.627 0.122) 9.161 4.114 ( -11.907 3.674 -9.350) 15.578 4.369 ( -3.354 6.763 -14.112) 16.005 4.532 ( 1.554 12.557 -3.933) 13.250 4.751 ( 5.521 6.343 -0.894) 8.457 4.940 ( -2.753 9.260 -3.010) 10.119 4.979 ( 2.376 4.909 -0.937) 5.534 5.198 ( 8.172 9.728 1.525) 12.796 5.431 ( 4.119 0.196 7.412) 8.481 5.666 ( -1.110 -0.013 5.810) 5.915 5.746 ( -2.722 0.058 2.227) 3.517 6.022 ( -4.579 -5.730 -0.992) 7.402 6.071 ( 2.944 -7.389 -3.254) 8.594 6.233 ( 0.337 0.184 2.805) 2.831 6.562 ( -9.051 -12.928 4.034) 16.288 7.146 ( -3.035 -0.392 1.372) 3.353 7.490 ( -0.343 -1.772 0.790) 1.970 7.640 ( -1.398 10.427 0.976) 10.566 7.819 ( 2.699 4.589 2.854) 6.040 8.061 ( 5.826 8.400 -2.551) 10.536 8.312 ( 6.235 5.065 -0.625) 8.058 9.295 ( 2.547 2.176 -4.516) 5.623 9.410 ( 1.140 1.796 -2.256) 3.101 9.742 ( 3.260 3.835 -1.656) 5.299 9.952 ( 0.205 7.155 8.041) 10.766 10.255 ( 1.071 -1.172 -4.606) 4.872 10.548 ( -4.703 2.253 -1.070) 5.324 10.728 ( -5.704 0.208 -0.257) 5.714 10.931 ( -8.671 -3.650 2.846) 9.829 11.351 ( -2.555 -5.499 -1.816) 6.329 11.466 ( -7.089 -4.342 4.145) 9.289 12.281 ( 10.891 5.478 -10.119) 15.843 12.704 ( 7.733 4.937 9.204) 12.995 12.913 ( 10.955 -7.575 -2.286) 13.514 13.107 ( 2.393 -5.435 3.953) 7.134 16.686 ( -3.501 0.282 9.127) 9.779 16.766 ( -5.370 -1.505 6.522) 8.581 17.247 ( 3.943 -2.936 -0.594) 4.952 17.507 ( 2.208 -2.487 11.531) 12.001 17.866 ( -7.517 4.816 -1.017) 8.985 18.143 ( -1.863 -0.633 0.547) 2.043 18.423 ( 3.376 0.635 -5.919) 6.843 18.624 ( -1.493 1.239 -8.093) 8.322 21.168 ( 3.212 1.229 -0.137) 3.442 21.286 ( 6.766 3.669 3.199) 8.335 21.713 ( -3.060 -0.829 -9.707) 10.212 22.012 ( -3.548 -2.113 0.951) 4.238 ======================= Grid point 325 (156/170) ======================= q-point: ( 0.27 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( 9.792 11.530 -13.003) 19.948 2.047 ( 14.624 11.483 -11.967) 22.112 2.529 ( -8.142 -2.170 6.230) 10.479 2.651 ( -0.824 -4.878 -1.225) 5.096 2.777 ( -3.248 3.122 7.205) 8.498 2.843 ( -5.307 -0.004 -0.130) 5.308 3.018 ( 1.965 -3.895 -0.578) 4.401 3.191 ( -5.585 -2.974 7.744) 10.000 3.221 ( -1.598 -1.339 5.738) 6.105 3.306 ( 3.770 -1.173 -0.691) 4.008 3.530 ( -0.673 -2.583 1.528) 3.075 3.744 ( -3.085 -4.819 1.857) 6.016 3.777 ( 9.700 7.931 -14.467) 19.139 3.888 ( 0.163 -1.195 -5.073) 5.215 3.912 ( 1.532 -2.473 -5.006) 5.790 4.101 ( -4.269 2.963 -20.294) 20.949 4.511 ( 0.418 7.524 -3.296) 8.225 4.725 ( -0.752 6.426 -2.400) 6.901 4.932 ( 4.416 8.490 -0.663) 9.592 5.090 ( 9.300 8.356 1.732) 12.622 5.366 ( 8.411 10.216 2.604) 13.487 5.531 ( 0.238 1.035 1.076) 1.511 5.633 ( -10.432 -4.708 -1.363) 11.526 5.776 ( 1.694 -4.170 8.166) 9.324 5.884 ( -11.017 -3.075 5.108) 12.527 6.090 ( -2.141 -1.901 0.773) 2.966 6.282 ( 3.101 3.311 0.250) 4.543 6.400 ( -7.990 -11.603 -5.966) 15.299 7.143 ( -0.745 2.588 3.673) 4.554 7.445 ( -1.848 3.680 -2.512) 4.824 7.661 ( -1.900 8.008 5.610) 9.960 7.915 ( 2.026 8.811 6.280) 11.008 8.117 ( 5.366 6.633 -3.882) 9.373 8.382 ( 6.092 2.457 -5.656) 8.669 9.265 ( -0.327 -0.664 -1.719) 1.872 9.440 ( 6.069 -0.109 -3.059) 6.797 9.731 ( -0.658 2.353 -2.750) 3.678 10.069 ( 4.736 4.609 3.509) 7.483 10.236 ( 0.433 -7.252 -2.616) 7.721 10.461 ( -1.894 2.431 -2.156) 3.761 10.681 ( -3.467 4.214 3.851) 6.679 10.804 ( -8.702 -0.566 -0.084) 8.721 11.285 ( -3.649 -3.162 -1.218) 4.980 11.402 ( -6.710 -4.056 3.889) 8.752 12.359 ( 11.123 5.167 -6.541) 13.900 12.917 ( 6.180 2.842 7.811) 10.358 13.062 ( 7.773 -6.239 -0.949) 10.012 13.176 ( 3.414 -4.569 2.667) 6.296 16.668 ( -4.540 4.182 3.348) 7.022 16.896 ( 0.085 4.220 16.990) 17.506 17.186 ( -8.829 15.032 -0.307) 17.436 17.539 ( -14.823 11.806 13.764) 23.421 17.885 ( 10.002 -10.090 0.040) 14.207 18.218 ( 8.261 -8.108 -0.818) 11.604 18.394 ( 3.109 -3.131 -6.978) 8.256 18.457 ( -2.675 0.611 -14.071) 14.336 21.200 ( 1.527 -0.705 -1.082) 2.000 21.431 ( 4.751 0.840 4.211) 6.404 21.571 ( -0.674 -2.923 -8.622) 9.129 21.954 ( -4.004 -3.852 0.160) 5.558 ======================= Grid point 326 (157/170) ======================= q-point: ( 0.36 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( 12.269 2.860 -5.010) 13.557 2.175 ( 17.080 8.293 -10.579) 21.736 2.426 ( -10.024 1.687 5.680) 11.644 2.523 ( -8.488 -2.246 -3.975) 9.638 2.819 ( 2.133 -0.745 -1.132) 2.528 2.863 ( -0.870 0.939 8.649) 8.743 3.027 ( 0.572 0.376 -1.981) 2.096 3.179 ( -5.329 -1.815 8.598) 10.277 3.228 ( -1.792 -2.860 0.831) 3.475 3.260 ( -12.934 1.154 2.099) 13.154 3.483 ( -3.769 -1.721 1.058) 4.276 3.650 ( -6.673 -1.622 -10.941) 12.917 3.775 ( 1.274 -0.452 -4.923) 5.105 3.787 ( -0.781 -1.935 -7.906) 8.176 3.997 ( 15.451 -4.515 -5.686) 17.072 4.099 ( 21.314 -7.885 -2.438) 22.856 4.452 ( -3.206 -0.880 -1.802) 3.781 4.780 ( 4.764 9.166 4.313) 11.195 5.057 ( 11.801 8.081 -0.292) 14.306 5.223 ( 0.001 0.550 -1.579) 1.672 5.391 ( -8.938 -2.228 -3.981) 10.035 5.422 ( -8.600 3.442 4.245) 10.189 5.523 ( 0.771 2.840 1.268) 3.205 5.789 ( -8.019 3.319 6.950) 11.118 5.895 ( 1.298 -2.157 -0.165) 2.523 6.048 ( -2.966 4.100 3.853) 6.360 6.181 ( -3.330 -1.423 -10.230) 10.852 6.349 ( 0.544 -1.032 0.192) 1.182 7.210 ( 2.898 5.047 5.350) 7.906 7.405 ( -0.556 5.723 -1.414) 5.921 7.701 ( -0.723 5.941 6.157) 8.586 7.991 ( -4.181 11.965 9.256) 15.694 8.143 ( 6.614 3.609 -7.955) 10.957 8.350 ( 0.617 0.506 -9.553) 9.586 9.278 ( 2.066 -1.854 1.698) 3.255 9.502 ( 3.554 -3.898 -2.157) 5.698 9.704 ( 2.258 -0.341 -1.797) 2.905 10.086 ( -0.492 -2.336 -7.553) 7.922 10.266 ( 1.725 -2.838 6.367) 7.182 10.442 ( 1.379 4.416 -2.324) 5.177 10.686 ( -4.128 6.017 -0.502) 7.314 10.691 ( -2.463 0.825 4.383) 5.095 11.219 ( -1.851 -1.580 -2.206) 3.285 11.328 ( -7.596 -3.647 2.816) 8.885 12.494 ( 11.851 3.060 -1.802) 12.372 12.981 ( -4.432 -3.569 0.537) 5.715 13.175 ( 6.996 1.950 2.891) 7.817 13.282 ( 4.853 -2.735 1.926) 5.894 16.653 ( -0.671 10.422 1.805) 10.598 16.953 ( -10.625 11.902 2.655) 16.174 17.137 ( 0.203 15.007 9.771) 17.909 17.439 ( -15.887 12.229 13.639) 24.248 18.063 ( 9.559 -8.370 -0.150) 12.706 18.275 ( 0.382 0.662 -12.150) 12.174 18.284 ( 6.681 -2.697 -8.590) 11.212 18.423 ( 3.674 -9.163 0.918) 9.915 21.201 ( 1.233 -6.286 -1.812) 6.657 21.399 ( -5.045 -9.216 -3.361) 11.031 21.622 ( 7.917 1.756 0.967) 8.167 21.897 ( -3.909 -3.459 0.660) 5.262 ======================= Grid point 327 (158/170) ======================= q-point: ( 0.45 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( 11.376 -3.293 2.279) 12.060 2.287 ( 1.506 -0.639 -10.120) 10.251 2.346 ( -0.428 1.877 0.852) 2.105 2.391 ( -4.336 4.956 3.612) 7.511 2.853 ( 3.455 1.206 -0.658) 3.719 2.905 ( -3.156 1.346 3.016) 4.568 3.005 ( 0.324 2.914 -0.873) 3.059 3.071 ( -9.997 2.235 1.802) 10.401 3.207 ( -1.427 -2.108 1.803) 3.120 3.214 ( -1.640 -2.856 3.372) 4.714 3.417 ( 2.383 -1.906 -10.046) 10.499 3.438 ( -6.349 -1.480 -0.648) 6.552 3.746 ( -1.919 -4.496 1.568) 5.134 3.750 ( 1.878 -0.833 -4.059) 4.550 4.190 ( 13.578 -11.052 -1.869) 17.607 4.351 ( -8.300 -8.284 2.224) 11.936 4.500 ( 26.073 -9.780 -0.592) 27.854 4.889 ( -12.796 -4.580 -0.431) 13.598 4.982 ( -1.271 1.571 2.659) 3.340 5.168 ( -7.227 7.450 -4.260) 11.220 5.307 ( 9.101 2.291 0.177) 9.387 5.468 ( -6.997 2.510 1.003) 7.501 5.526 ( 6.547 13.037 6.466) 15.957 5.718 ( -7.869 8.393 -2.487) 11.771 5.872 ( 0.033 0.719 3.251) 3.329 5.968 ( -2.483 -0.097 -8.892) 9.232 6.195 ( 5.407 2.721 4.066) 7.292 6.311 ( -4.313 1.690 -1.677) 4.927 7.322 ( 3.566 6.169 3.655) 8.008 7.383 ( -1.069 6.422 -1.318) 6.642 7.796 ( 4.020 4.868 6.861) 9.324 7.948 ( -8.320 8.474 0.255) 11.878 8.172 ( 6.960 2.807 -5.648) 9.392 8.240 ( -3.691 2.048 -3.387) 5.412 9.359 ( 4.056 -2.560 3.521) 5.950 9.463 ( -3.400 -3.013 -3.521) 5.748 9.795 ( 7.799 -4.797 2.149) 9.405 9.953 ( -6.293 -5.455 -5.249) 9.844 10.366 ( 3.143 1.255 3.130) 4.610 10.425 ( -0.692 3.871 -2.256) 4.534 10.660 ( -0.885 4.776 3.644) 6.072 10.696 ( -0.454 4.365 -1.339) 4.589 11.193 ( 2.330 -1.534 -2.650) 3.847 11.238 ( -6.609 -2.607 2.286) 7.464 12.678 ( 11.252 0.128 1.348) 11.333 12.859 ( -8.940 -2.471 -1.990) 9.486 13.296 ( 3.804 2.089 2.522) 5.020 13.337 ( 0.717 0.135 -0.272) 0.778 16.693 ( 4.130 14.907 0.762) 15.488 16.800 ( -8.744 16.643 -0.075) 18.800 17.250 ( 5.714 11.244 0.980) 12.650 17.345 ( -12.157 11.310 8.974) 18.874 18.133 ( 1.118 -0.912 0.582) 1.555 18.172 ( 1.565 1.553 -8.119) 8.413 18.369 ( 8.805 -7.061 -1.952) 11.454 18.449 ( -2.872 -7.638 1.485) 8.294 21.218 ( 2.906 -11.122 -0.265) 11.498 21.289 ( -4.563 -11.898 -2.144) 12.922 21.747 ( 6.190 0.102 1.093) 6.286 21.837 ( -4.631 -1.765 0.103) 4.957 ======================= Grid point 333 (159/170) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 1.616 1.756 -9.855) 10.140 2.145 ( -1.616 1.756 9.855) 10.140 2.415 ( 3.858 6.802 -14.236) 16.242 2.415 ( -3.858 6.802 14.236) 16.242 2.779 ( -1.658 -1.372 -2.003) 2.940 2.779 ( 1.658 -1.372 2.003) 2.940 2.953 ( 3.436 -6.280 -5.146) 8.816 2.953 ( -3.436 -6.280 5.146) 8.816 3.283 ( -1.086 -7.862 -2.567) 8.342 3.283 ( 1.086 -7.862 2.567) 8.342 3.655 ( -6.102 3.474 -6.201) 9.367 3.655 ( 6.102 3.474 6.201) 9.367 4.417 ( -9.822 0.001 -2.383) 10.107 4.417 ( 9.822 0.001 2.383) 10.107 4.556 ( -0.229 24.319 -18.565) 30.596 4.556 ( 0.229 24.319 18.565) 30.596 4.791 ( -1.813 12.079 -7.524) 14.346 4.791 ( 1.813 12.079 7.524) 14.346 5.084 ( 1.336 10.657 -3.185) 11.202 5.084 ( -1.336 10.657 3.185) 11.202 5.220 ( 3.169 -1.011 -9.873) 10.419 5.220 ( -3.169 -1.011 9.873) 10.419 5.761 ( 3.926 -7.164 -3.780) 9.001 5.761 ( -3.926 -7.164 3.780) 9.001 5.886 ( -4.671 2.030 -5.205) 7.282 5.886 ( 4.671 2.030 5.205) 7.282 6.240 ( -1.030 -13.167 -11.619) 17.591 6.240 ( 1.030 -13.167 11.619) 17.591 7.261 ( -4.993 -1.480 -1.110) 5.324 7.261 ( 4.993 -1.480 1.110) 5.324 7.708 ( 3.195 -4.126 -4.305) 6.765 7.708 ( -3.195 -4.126 4.305) 6.765 8.274 ( -0.617 8.689 -5.304) 10.198 8.274 ( 0.617 8.689 5.304) 10.198 9.386 ( 0.888 3.234 -3.704) 4.996 9.386 ( -0.888 3.234 3.704) 4.996 9.993 ( 1.081 12.497 -10.818) 16.564 9.993 ( -1.081 12.497 10.818) 16.564 10.576 ( -6.305 3.693 -6.787) 9.973 10.576 ( 6.305 3.693 6.787) 9.973 10.851 ( 4.695 -6.339 -10.329) 12.997 10.851 ( -4.695 -6.339 10.329) 12.997 11.310 ( 0.030 -8.901 -6.264) 10.884 11.310 ( -0.030 -8.901 6.264) 10.884 12.414 ( -0.060 3.892 -10.717) 11.403 12.414 ( 0.060 3.892 10.717) 11.403 12.803 ( -0.340 -3.201 -7.016) 7.719 12.803 ( 0.340 -3.201 7.016) 7.719 16.657 ( -6.030 -8.861 -0.714) 10.742 16.657 ( 6.030 -8.861 0.714) 10.742 16.857 ( -1.672 -6.955 -3.459) 7.946 16.857 ( 1.672 -6.955 3.459) 7.946 18.350 ( -3.444 3.661 -1.774) 5.330 18.350 ( 3.444 3.661 1.774) 5.330 18.652 ( -7.678 5.651 -0.500) 9.546 18.652 ( 7.678 5.651 0.500) 9.546 21.147 ( -0.969 1.653 -2.216) 2.930 21.147 ( 0.969 1.653 2.216) 2.930 22.014 ( -0.190 1.851 -5.533) 5.837 22.014 ( 0.190 1.851 5.533) 5.837 ======================= Grid point 335 (160/170) ======================= q-point: ( 0.09 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 6.863 3.610 -5.299) 9.392 2.288 ( 3.253 4.497 8.968) 10.547 2.323 ( 5.147 9.235 -12.211) 16.152 2.497 ( -3.893 1.671 11.017) 11.803 2.738 ( -1.771 -3.226 -0.009) 3.680 2.830 ( 0.923 1.265 3.221) 3.581 2.961 ( 0.089 -8.129 3.285) 8.768 2.991 ( 1.060 -5.833 3.055) 6.669 3.198 ( -6.211 -8.251 -1.801) 10.483 3.325 ( 1.353 -6.185 -0.301) 6.339 3.446 ( -6.987 4.212 -7.844) 11.318 3.700 ( -4.116 -3.662 -1.183) 5.635 4.209 ( -7.598 9.232 -4.976) 12.951 4.336 ( -1.610 22.831 -12.646) 26.149 4.532 ( -0.614 2.539 -9.979) 10.315 4.585 ( -0.490 8.887 -9.078) 12.714 4.780 ( 1.744 16.017 11.482) 19.785 4.859 ( -0.947 12.674 -2.750) 13.003 5.062 ( -1.841 7.028 0.956) 7.328 5.147 ( 2.818 2.453 -6.230) 7.264 5.214 ( 5.701 9.801 4.633) 12.248 5.284 ( 0.942 0.969 9.007) 9.108 5.738 ( -2.529 -3.726 4.597) 6.435 5.751 ( -3.544 0.545 -5.329) 6.423 5.842 ( 7.981 -6.077 -3.961) 10.785 5.945 ( -1.352 -8.373 -5.932) 10.350 6.145 ( 0.083 -6.769 2.025) 7.066 6.349 ( -5.599 -12.851 13.605) 19.534 7.187 ( -3.635 0.711 0.994) 3.835 7.363 ( 4.839 -3.029 2.294) 6.152 7.730 ( 4.612 -0.720 -2.053) 5.099 7.746 ( 5.688 -2.974 -1.552) 6.603 8.226 ( 0.372 10.131 -2.604) 10.467 8.351 ( 0.781 6.356 5.778) 8.625 9.370 ( 2.516 3.564 -4.616) 6.352 9.421 ( 1.190 1.411 1.346) 2.284 9.892 ( 1.191 10.658 -9.575) 14.377 10.080 ( -2.742 12.315 9.724) 15.929 10.381 ( -6.876 0.312 -8.443) 10.894 10.671 ( -0.781 2.914 -1.247) 3.265 10.795 ( -3.360 -0.067 0.572) 3.409 10.863 ( -4.738 -7.504 8.238) 12.109 11.256 ( -0.077 -8.468 -3.465) 9.150 11.370 ( -2.476 -8.201 6.675) 10.860 12.349 ( 7.642 5.307 -11.376) 14.696 12.572 ( 6.134 2.181 8.511) 10.716 12.753 ( 3.459 -1.986 -5.658) 6.922 12.902 ( 2.465 -4.822 6.152) 8.196 16.620 ( -0.476 -1.950 4.588) 5.008 16.726 ( 0.291 -5.190 0.841) 5.265 16.884 ( 7.853 -8.964 3.519) 12.426 17.044 ( 12.098 -11.746 6.304) 18.002 18.220 ( -8.421 7.390 -3.084) 11.621 18.391 ( 0.019 3.188 -2.556) 4.086 18.490 ( -9.979 6.076 -0.542) 11.696 18.711 ( 0.172 1.452 -1.614) 2.178 21.147 ( 2.604 1.958 -0.452) 3.289 21.222 ( 4.023 1.554 3.397) 5.491 21.903 ( -4.023 2.687 -8.211) 9.531 22.029 ( -3.693 -0.539 2.198) 4.331 ======================= Grid point 336 (161/170) ======================= q-point: ( 0.18 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( 4.547 8.122 -10.276) 13.865 2.247 ( 4.998 15.221 -10.114) 18.946 2.454 ( 2.730 3.038 6.170) 7.400 2.541 ( -2.234 -3.995 7.435) 8.732 2.760 ( 1.278 -4.730 5.170) 7.123 2.872 ( -0.833 2.701 4.023) 4.917 2.977 ( -6.996 -6.541 -1.345) 9.671 3.022 ( 1.238 -8.294 1.673) 8.551 3.114 ( -4.345 -6.705 11.011) 13.605 3.284 ( 2.357 -0.684 -7.220) 7.626 3.361 ( -1.978 -4.341 0.178) 4.774 3.605 ( -2.165 -7.758 -1.340) 8.165 4.061 ( -4.387 13.558 -6.326) 15.591 4.160 ( -10.844 10.703 -5.770) 16.292 4.324 ( -0.594 20.375 -16.694) 26.348 4.435 ( -2.521 -0.167 -18.661) 18.831 4.756 ( -4.732 7.864 -5.225) 10.561 4.888 ( 2.141 9.294 0.253) 9.541 5.057 ( 1.364 3.406 3.626) 5.159 5.111 ( -2.591 7.472 0.873) 7.956 5.380 ( 6.857 8.635 5.350) 12.256 5.466 ( 8.445 2.024 6.452) 10.819 5.644 ( -5.327 -1.975 -1.358) 5.842 5.704 ( -3.430 -6.618 -8.620) 11.395 5.828 ( -4.790 -10.387 5.214) 12.571 5.936 ( 6.309 -6.023 -1.940) 8.936 6.217 ( 2.312 -1.681 3.896) 4.832 6.367 ( -6.763 -7.901 7.982) 13.111 7.175 ( -0.650 3.418 2.836) 4.488 7.444 ( 2.519 -2.995 1.475) 4.182 7.792 ( 4.082 4.924 -0.245) 6.401 7.860 ( 10.426 0.328 -1.383) 10.523 8.226 ( 1.833 8.707 -0.887) 8.942 8.414 ( 0.767 4.445 2.970) 5.400 9.341 ( 0.275 2.640 -5.496) 6.103 9.434 ( 1.775 0.393 -3.103) 3.596 9.842 ( 2.330 6.448 -5.542) 8.816 10.107 ( -7.005 8.809 9.201) 14.537 10.212 ( -0.604 -3.174 -9.571) 10.102 10.588 ( -2.873 2.571 -3.880) 5.469 10.732 ( -9.224 -2.229 6.614) 11.567 10.900 ( -1.514 2.113 3.982) 4.755 11.223 ( -1.366 -7.556 -0.578) 7.700 11.365 ( -5.634 -6.237 4.564) 9.564 12.389 ( 11.066 6.024 -9.585) 15.831 12.781 ( 11.207 -4.059 1.514) 12.015 12.800 ( 5.906 2.153 3.177) 7.043 13.003 ( 2.768 -4.942 4.717) 7.372 16.700 ( 0.479 1.537 5.489) 5.720 16.797 ( 2.726 4.444 11.324) 12.467 17.085 ( 14.231 -10.859 0.110) 17.901 17.350 ( 13.826 -12.001 10.573) 21.142 18.033 ( -10.704 10.012 -2.555) 14.878 18.254 ( -11.801 9.903 0.656) 15.420 18.402 ( 0.884 -2.662 -6.889) 7.438 18.629 ( -4.498 -0.897 -5.966) 7.525 21.195 ( 2.735 1.830 -0.187) 3.296 21.332 ( 4.184 0.477 3.874) 5.722 21.721 ( -5.851 2.134 -9.467) 11.332 21.959 ( -6.085 -3.479 0.063) 7.010 ======================= Grid point 337 (162/170) ======================= q-point: ( 0.27 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( 1.183 11.709 -11.421) 16.399 2.253 ( 8.183 9.959 -8.092) 15.219 2.494 ( -5.103 -1.977 4.300) 6.960 2.597 ( 1.169 0.270 1.019) 1.574 2.800 ( -4.632 -4.703 -3.845) 7.640 2.819 ( -1.498 0.984 4.858) 5.179 2.948 ( 2.609 -2.330 3.550) 4.984 3.069 ( -0.700 -6.991 5.048) 8.651 3.199 ( -7.571 -2.559 13.807) 15.953 3.258 ( 1.560 -6.259 -1.995) 6.752 3.394 ( 6.206 -6.161 1.791) 8.926 3.618 ( 1.523 -7.598 1.584) 7.909 3.883 ( -13.512 6.364 -5.129) 15.792 3.926 ( -4.788 7.758 -4.769) 10.289 4.095 ( -5.547 1.798 -21.939) 22.701 4.199 ( 3.360 16.818 -17.420) 24.445 4.596 ( -9.611 0.060 -4.400) 10.570 4.905 ( 1.698 11.030 1.255) 11.230 5.089 ( 3.829 6.870 -1.721) 8.051 5.177 ( 0.847 -1.866 2.972) 3.610 5.472 ( -7.170 -8.687 -2.593) 11.558 5.516 ( 3.183 3.832 0.013) 4.982 5.564 ( 0.379 3.795 0.798) 3.896 5.715 ( 7.456 -1.835 4.285) 8.793 5.835 ( -6.219 -2.081 9.352) 11.422 6.000 ( 3.817 -5.855 -0.453) 7.004 6.265 ( -1.109 -1.136 -0.583) 1.691 6.343 ( 0.228 0.620 0.363) 0.754 7.225 ( 1.608 5.813 4.791) 7.703 7.483 ( 2.379 0.306 -0.513) 2.453 7.824 ( -2.203 8.030 3.015) 8.855 8.019 ( 11.796 2.202 -2.613) 12.281 8.247 ( -0.834 6.698 1.953) 7.027 8.432 ( 1.820 2.117 -3.844) 4.750 9.276 ( -0.866 1.598 -3.611) 4.043 9.420 ( 2.031 -2.042 -4.400) 5.259 9.790 ( -2.083 3.989 -4.344) 6.255 10.091 ( -1.546 -7.078 -2.831) 7.779 10.169 ( 1.525 5.879 2.934) 6.745 10.532 ( -0.337 2.545 -1.585) 3.017 10.676 ( -6.320 -0.815 5.831) 8.637 10.882 ( -3.292 6.497 0.621) 7.310 11.200 ( -1.829 -5.786 0.587) 6.096 11.312 ( -6.090 -5.223 3.051) 8.583 12.466 ( 10.143 6.104 -6.711) 13.608 12.885 ( 4.931 -6.571 -1.511) 8.353 13.020 ( 9.542 1.953 6.759) 11.856 13.110 ( 5.318 -2.238 4.287) 7.188 16.765 ( 1.472 6.026 4.434) 7.625 16.988 ( -0.247 4.808 15.434) 16.167 17.319 ( 14.505 -1.008 -0.355) 14.545 17.664 ( 8.635 -4.507 12.019) 15.470 17.850 ( -10.336 9.331 0.324) 13.929 18.132 ( -2.642 2.103 1.089) 3.548 18.327 ( 1.120 -3.718 -9.137) 9.928 18.468 ( -3.908 -0.134 -9.874) 10.620 21.188 ( -2.137 -0.433 -2.984) 3.696 21.372 ( -4.264 -5.903 -2.147) 7.592 21.586 ( 1.654 3.816 -3.027) 5.144 21.870 ( -4.938 -4.892 0.861) 7.004 ======================= Grid point 338 (163/170) ======================= q-point: ( 0.36 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( 2.787 5.908 -5.678) 8.655 2.320 ( 9.922 6.742 -6.497) 13.642 2.413 ( -8.486 -4.413 -0.353) 9.571 2.533 ( -4.217 3.612 -2.109) 5.939 2.786 ( 4.737 -1.832 -1.491) 5.294 2.869 ( 0.684 0.344 4.776) 4.837 3.019 ( 1.973 -0.666 2.301) 3.104 3.101 ( -1.995 -5.403 3.926) 6.970 3.172 ( -4.374 -2.220 4.306) 6.527 3.283 ( -4.416 -2.482 3.647) 6.242 3.437 ( -6.361 -1.642 1.019) 6.649 3.620 ( -6.222 -2.286 -1.565) 6.811 3.690 ( -2.367 -2.178 -5.690) 6.537 3.797 ( -1.295 -0.016 -8.608) 8.705 3.903 ( 5.556 -5.265 -1.780) 7.858 4.123 ( 9.067 9.437 -12.904) 18.379 4.375 ( -12.743 -7.460 -2.185) 14.927 4.963 ( -7.206 -2.405 -0.989) 7.661 5.018 ( -2.148 -1.924 -1.883) 3.445 5.212 ( 8.137 5.189 2.668) 10.013 5.430 ( -7.368 2.202 3.054) 8.274 5.520 ( 8.323 9.075 -2.963) 12.666 5.660 ( 2.992 6.748 4.426) 8.606 5.827 ( -4.465 0.415 7.934) 9.114 5.839 ( 3.735 -2.858 -2.432) 5.295 6.077 ( 3.906 -3.158 4.152) 6.516 6.172 ( -3.992 3.994 -6.257) 8.428 6.362 ( 1.104 0.560 -1.756) 2.148 7.330 ( 4.006 7.201 6.014) 10.202 7.519 ( 3.230 5.150 -1.260) 6.209 7.809 ( -4.070 5.505 4.834) 8.381 8.144 ( 8.862 -1.206 -7.809) 11.874 8.215 ( -7.580 8.312 5.791) 12.653 8.384 ( 1.599 2.621 -8.435) 8.976 9.261 ( 1.681 0.182 0.090) 1.693 9.418 ( 2.184 -4.636 -2.081) 5.531 9.713 ( -1.701 1.541 -2.762) 3.591 9.990 ( -4.311 -6.591 -5.966) 9.881 10.281 ( 4.854 3.633 5.677) 8.306 10.539 ( 2.631 3.649 -1.534) 4.753 10.655 ( -3.756 -0.063 4.761) 6.064 10.834 ( -2.721 6.424 -0.375) 6.986 11.176 ( -0.961 -3.160 -0.788) 3.396 11.244 ( -6.220 -4.786 2.312) 8.182 12.565 ( 9.254 4.368 -2.860) 10.625 12.889 ( -1.618 -5.796 -1.908) 6.312 13.218 ( 6.958 2.228 4.996) 8.851 13.254 ( 6.333 -0.301 3.411) 7.200 16.845 ( 3.193 9.559 3.462) 10.656 17.081 ( -4.544 4.055 7.783) 9.883 17.475 ( 4.151 15.256 1.707) 15.902 17.700 ( -12.849 13.403 7.851) 20.159 17.912 ( 10.911 -5.404 4.491) 12.978 18.202 ( 6.425 -6.213 0.491) 8.951 18.265 ( 1.654 -4.415 -3.474) 5.856 18.312 ( -0.250 1.291 -11.643) 11.717 21.080 ( -4.588 -5.982 -4.606) 8.834 21.205 ( -8.011 -10.359 -5.706) 14.284 21.659 ( 5.012 2.171 1.888) 5.779 21.828 ( -2.842 -3.682 1.885) 5.018 ======================= Grid point 339 (164/170) ======================= q-point: ( 0.45 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( 6.150 -1.370 1.473) 6.471 2.213 ( -8.813 -5.147 -6.052) 11.866 2.425 ( 6.073 4.509 -0.216) 7.567 2.489 ( -1.788 4.395 -0.307) 4.755 2.866 ( 6.605 0.178 -1.642) 6.808 2.910 ( -1.425 -0.081 2.604) 2.970 3.047 ( 0.783 0.203 -0.559) 0.983 3.082 ( -4.462 0.350 1.693) 4.786 3.181 ( -2.371 -1.077 5.426) 6.019 3.208 ( -4.289 1.563 0.989) 4.671 3.350 ( -0.219 -3.475 -3.659) 5.051 3.409 ( -6.456 -0.936 -5.816) 8.740 3.694 ( 1.355 -1.026 3.555) 3.940 3.763 ( -0.245 0.491 -3.772) 3.812 3.993 ( 8.815 -8.053 -2.882) 12.282 4.145 ( -11.621 -11.675 0.917) 16.499 4.302 ( 17.365 -9.727 0.341) 19.906 4.640 ( -19.485 -15.551 -4.823) 25.392 5.149 ( 7.116 10.857 4.812) 13.844 5.304 ( -6.339 7.449 -2.567) 10.113 5.411 ( 9.385 6.201 3.057) 11.657 5.558 ( -2.533 5.444 -3.092) 6.754 5.753 ( 2.786 8.007 5.858) 10.305 5.832 ( 1.036 1.266 -4.624) 4.905 5.869 ( -0.947 1.472 8.531) 8.709 6.004 ( -3.936 4.697 -9.845) 11.597 6.215 ( 4.295 -0.239 5.685) 7.129 6.322 ( -2.352 -0.552 -3.670) 4.394 7.462 ( 4.220 8.112 4.557) 10.216 7.534 ( 0.092 8.838 -2.175) 9.102 7.846 ( 1.052 0.444 8.083) 8.163 8.014 ( -6.313 -1.807 -9.443) 11.502 8.260 ( 3.233 6.701 1.739) 7.640 8.322 ( -1.045 5.233 -3.764) 6.530 9.322 ( 3.817 -1.161 2.197) 4.555 9.402 ( -2.315 -3.156 -1.997) 4.394 9.718 ( 4.430 -2.989 0.807) 5.405 9.843 ( -6.647 -5.881 -4.191) 9.816 10.420 ( 5.037 4.290 4.475) 7.987 10.523 ( -1.802 6.245 -3.725) 7.492 10.692 ( 1.621 -0.744 5.188) 5.486 10.778 ( -2.736 2.937 -2.690) 4.832 11.160 ( 1.466 -1.776 -2.259) 3.226 11.181 ( -4.640 -3.026 2.486) 6.071 12.689 ( 7.923 1.003 0.289) 7.992 12.809 ( -5.515 -2.749 -1.819) 6.425 13.337 ( 2.721 2.033 2.446) 4.186 13.350 ( 2.350 1.076 0.731) 2.686 16.940 ( 5.279 10.589 1.534) 11.930 17.037 ( -6.441 8.303 1.477) 10.612 17.534 ( 5.087 15.958 -2.350) 16.913 17.601 ( -10.179 13.728 7.011) 18.472 18.091 ( 4.750 -2.737 4.087) 6.838 18.188 ( -0.150 -0.669 -8.434) 8.462 18.275 ( 5.389 -2.416 -1.072) 6.002 18.315 ( 0.072 -4.797 1.773) 5.115 20.997 ( -0.383 -11.339 -1.676) 11.469 21.045 ( -5.363 -12.828 -2.850) 14.192 21.748 ( 3.905 0.070 1.088) 4.054 21.802 ( -2.807 -1.820 0.722) 3.422 ======================= Grid point 345 (165/170) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( 0.044 -2.590 -3.960) 4.732 2.112 ( -0.044 -2.590 3.960) 4.732 2.544 ( 2.181 6.932 -6.361) 9.658 2.544 ( -2.181 6.932 6.361) 9.658 2.737 ( 2.063 -6.086 -4.282) 7.723 2.737 ( -2.063 -6.086 4.282) 7.723 2.949 ( -0.273 6.844 -5.605) 8.850 2.949 ( 0.273 6.844 5.605) 8.850 3.121 ( -1.378 -8.680 -4.202) 9.742 3.121 ( 1.378 -8.680 4.202) 9.742 3.708 ( -2.551 1.667 -2.348) 3.847 3.708 ( 2.551 1.667 2.348) 3.847 4.386 ( -4.701 -1.341 -0.709) 4.939 4.386 ( 4.701 -1.341 0.709) 4.939 4.924 ( 0.088 9.637 -6.102) 11.407 4.924 ( -0.088 9.637 6.102) 11.407 5.023 ( -4.299 8.911 -7.452) 12.387 5.023 ( 4.299 8.911 7.452) 12.387 5.213 ( -2.722 6.604 -8.466) 11.077 5.213 ( 2.722 6.604 8.466) 11.077 5.318 ( 2.632 6.678 -8.776) 11.338 5.318 ( -2.632 6.678 8.776) 11.338 5.584 ( 2.122 -6.582 -4.581) 8.295 5.584 ( -2.122 -6.582 4.581) 8.295 5.873 ( -0.616 -9.384 -12.951) 16.005 5.873 ( 0.616 -9.384 12.951) 16.005 6.013 ( -2.886 -3.967 -6.282) 7.971 6.013 ( 2.886 -3.967 6.282) 7.971 7.252 ( -2.559 0.179 0.034) 2.566 7.252 ( 2.559 0.179 -0.034) 2.566 7.637 ( 1.486 -2.510 -1.851) 3.455 7.637 ( -1.486 -2.510 1.851) 3.455 8.389 ( -0.018 3.141 -2.080) 3.768 8.389 ( 0.018 3.141 2.080) 3.768 9.430 ( 0.372 1.223 -1.233) 1.776 9.430 ( -0.372 1.223 1.233) 1.776 10.240 ( 0.865 12.119 -11.087) 16.448 10.240 ( -0.865 12.119 11.087) 16.448 10.522 ( -2.396 -8.487 -10.365) 13.609 10.522 ( 2.396 -8.487 10.365) 13.609 10.836 ( 1.842 3.525 -4.354) 5.897 10.836 ( -1.842 3.525 4.354) 5.897 11.151 ( -0.189 -6.456 -4.109) 7.655 11.151 ( 0.189 -6.456 4.109) 7.655 12.465 ( -0.047 1.344 -4.839) 5.022 12.465 ( 0.047 1.344 4.839) 5.022 12.762 ( 0.037 -1.073 -3.254) 3.427 12.762 ( -0.037 -1.073 3.254) 3.427 16.536 ( -1.408 -3.447 -0.160) 3.727 16.536 ( 1.408 -3.447 0.160) 3.727 16.774 ( -0.101 -2.042 -1.448) 2.505 16.774 ( 0.101 -2.042 1.448) 2.505 18.392 ( -1.046 0.989 -0.670) 1.588 18.392 ( 1.046 0.989 0.670) 1.588 18.726 ( -2.727 2.006 -0.184) 3.390 18.726 ( 2.727 2.006 0.184) 3.390 21.170 ( -0.492 0.614 -0.974) 1.252 21.170 ( 0.492 0.614 0.974) 1.252 22.040 ( -0.041 0.744 -2.093) 2.222 22.040 ( 0.041 0.744 2.093) 2.222 ======================= Grid point 347 (166/170) ======================= q-point: ( 0.09 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( 4.804 1.196 2.482) 5.538 2.230 ( 4.437 -6.715 9.372) 12.353 2.508 ( 1.917 9.508 -4.691) 10.774 2.583 ( 0.787 4.794 1.858) 5.201 2.739 ( 0.279 -2.950 1.915) 3.529 2.785 ( 1.036 -5.961 4.414) 7.489 2.871 ( -2.047 3.628 -4.432) 6.082 2.992 ( -1.464 -0.644 -1.448) 2.157 3.055 ( -2.704 -0.742 2.276) 3.612 3.188 ( 1.150 -8.148 2.733) 8.671 3.533 ( -8.820 4.703 -7.440) 12.460 3.621 ( -8.338 -4.515 -5.379) 10.902 4.341 ( -0.094 6.234 -3.196) 7.006 4.456 ( 4.158 -5.720 -5.867) 9.189 4.730 ( -11.930 14.318 -4.713) 19.223 4.845 ( -3.071 8.631 -6.175) 11.047 4.944 ( -6.551 5.165 -1.697) 8.514 5.076 ( -1.519 0.868 -5.704) 5.967 5.174 ( 1.715 9.053 2.897) 9.659 5.232 ( -1.075 11.223 -4.710) 12.219 5.351 ( 5.247 3.130 2.577) 6.631 5.390 ( 2.735 1.789 2.740) 4.265 5.597 ( 0.590 -10.237 -0.836) 10.288 5.613 ( 1.902 -8.953 -2.229) 9.420 5.744 ( -0.294 0.401 -5.224) 5.248 5.878 ( -4.557 -3.270 -1.672) 5.853 6.056 ( 3.726 -2.162 9.518) 10.448 6.116 ( -1.934 -8.767 12.480) 15.373 7.231 ( -1.119 3.585 2.038) 4.272 7.303 ( 2.420 -3.518 1.980) 4.707 7.697 ( 8.154 -1.429 -0.798) 8.316 7.701 ( 9.620 -1.528 -3.244) 10.266 8.378 ( -0.471 5.370 0.495) 5.413 8.422 ( -0.572 0.786 4.144) 4.257 9.421 ( 1.281 1.788 -3.028) 3.743 9.437 ( 0.877 0.103 -0.955) 1.301 10.105 ( -0.452 11.069 -12.830) 16.952 10.275 ( -0.549 -2.540 -8.417) 8.809 10.366 ( -9.599 8.663 5.807) 14.174 10.599 ( -6.099 -11.178 7.380) 14.717 10.796 ( -2.349 4.648 -0.362) 5.221 10.866 ( 1.714 0.831 2.014) 2.772 11.130 ( -0.551 -2.181 0.817) 2.393 11.210 ( -1.086 -7.995 6.361) 10.274 12.451 ( 7.167 5.414 -7.464) 11.678 12.547 ( 7.022 -4.110 -0.659) 8.163 12.765 ( 2.216 2.565 1.338) 3.644 12.824 ( 1.959 -3.482 4.883) 6.309 16.607 ( 7.534 0.599 2.871) 8.085 16.647 ( 11.709 -3.427 0.381) 12.206 16.794 ( -0.094 -0.154 6.108) 6.111 16.862 ( 5.390 -6.903 6.909) 11.155 18.331 ( -3.303 4.423 -3.889) 6.753 18.392 ( 0.724 -1.950 -3.812) 4.343 18.619 ( -9.756 6.119 -0.407) 11.523 18.702 ( -4.784 -2.443 -1.059) 5.475 21.189 ( 2.666 2.310 0.870) 3.633 21.224 ( 3.419 -1.118 2.526) 4.396 21.958 ( -5.164 2.894 -4.913) 7.693 22.005 ( -5.034 -1.925 -0.929) 5.469 ======================= Grid point 348 (167/170) ======================= q-point: ( 0.18 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.259 ( 3.565 4.448 2.002) 6.041 2.379 ( 1.116 -6.872 5.961) 9.166 2.524 ( 3.896 9.845 -2.712) 10.930 2.606 ( 1.357 7.629 -0.357) 7.757 2.746 ( -0.259 1.679 0.459) 1.760 2.816 ( 1.120 -4.406 1.856) 4.910 2.843 ( -5.224 -6.945 -4.718) 9.888 2.899 ( -0.563 -7.700 5.050) 9.226 3.073 ( -3.526 4.725 6.734) 8.950 3.195 ( -2.928 -6.792 0.683) 7.428 3.378 ( -1.637 3.931 -3.690) 5.634 3.474 ( -1.867 -5.987 -2.754) 6.850 4.237 ( -4.657 6.364 -10.649) 13.251 4.327 ( -5.790 -0.988 -13.047) 14.308 4.476 ( -13.135 12.124 -6.795) 19.123 4.721 ( -10.942 -5.783 -0.578) 12.389 4.773 ( -3.292 18.559 -11.817) 22.247 5.038 ( 1.592 0.111 -3.145) 3.527 5.123 ( -3.372 4.336 0.389) 5.506 5.227 ( -3.229 2.259 -0.892) 4.040 5.384 ( 0.173 -6.258 -3.737) 7.290 5.467 ( 4.016 -2.585 1.348) 4.963 5.559 ( 2.420 -1.641 2.279) 3.708 5.597 ( 1.078 -3.319 -3.093) 4.663 5.780 ( 1.047 3.889 4.301) 5.893 5.858 ( 1.821 -3.143 0.482) 3.664 6.193 ( 3.077 0.045 6.711) 7.383 6.243 ( 0.880 -5.038 9.516) 10.803 7.266 ( 1.455 5.679 3.484) 6.819 7.370 ( 2.764 -4.874 2.728) 6.232 7.839 ( 10.463 0.974 -1.718) 10.647 7.853 ( 13.590 -0.656 -3.368) 14.017 8.376 ( -1.475 6.398 1.548) 6.746 8.449 ( -1.895 -1.004 3.740) 4.311 9.389 ( -0.179 2.243 -5.011) 5.493 9.424 ( 0.468 -1.326 -3.908) 4.153 9.973 ( -0.110 7.048 -9.348) 11.707 10.100 ( -3.810 -6.034 -10.334) 12.559 10.323 ( -6.946 11.264 6.073) 14.561 10.529 ( -8.307 -9.286 3.212) 12.867 10.775 ( -1.353 8.028 2.084) 8.404 10.924 ( 0.608 -4.224 3.693) 5.643 11.130 ( -1.967 1.301 2.177) 3.210 11.235 ( -3.671 -7.154 4.768) 9.348 12.514 ( 10.273 7.122 -7.232) 14.441 12.654 ( 9.832 -7.347 -4.546) 13.089 12.870 ( 5.591 3.316 6.408) 9.127 12.929 ( 4.188 -3.119 5.609) 7.663 16.760 ( 6.434 5.009 3.585) 8.907 16.888 ( 5.173 -6.705 5.655) 10.184 16.927 ( 15.844 6.403 7.766) 18.770 17.116 ( 13.832 -11.708 10.842) 21.118 18.205 ( -6.109 7.782 -5.049) 11.107 18.327 ( -1.945 -5.149 -6.678) 8.654 18.444 ( -10.396 9.063 -0.502) 13.801 18.578 ( -7.345 -4.780 -2.849) 9.215 21.242 ( 1.822 3.065 0.155) 3.569 21.303 ( 2.158 -2.952 1.703) 4.033 21.791 ( -7.464 4.640 -5.579) 10.410 21.881 ( -7.579 -4.587 -2.013) 9.085 ======================= Grid point 349 (168/170) ======================= q-point: ( 0.27 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.258 ( -2.150 8.182 -4.155) 9.425 2.397 ( -3.800 -5.423 2.013) 6.921 2.457 ( 0.837 9.913 -8.435) 13.043 2.652 ( -5.356 -6.301 -7.141) 10.926 2.699 ( 5.068 4.513 4.042) 7.898 2.850 ( 3.625 -8.409 2.826) 9.583 2.865 ( 3.895 4.967 2.462) 6.775 2.989 ( 1.560 -5.158 5.528) 7.720 3.102 ( -3.370 -2.172 8.663) 9.545 3.146 ( -6.046 -3.908 6.079) 9.422 3.388 ( 4.357 3.186 0.102) 5.398 3.482 ( 2.690 -6.355 0.515) 6.920 3.973 ( -10.180 4.184 -13.074) 17.091 4.043 ( -8.049 -2.648 -18.007) 19.901 4.186 ( -15.226 14.637 -3.322) 21.381 4.468 ( -16.850 -12.755 -2.607) 21.293 4.577 ( -5.128 20.545 -12.885) 24.787 4.954 ( -9.416 -17.786 -9.277) 22.160 5.096 ( 0.479 7.105 2.598) 7.581 5.165 ( 2.605 0.498 1.441) 3.018 5.445 ( 3.493 5.379 5.162) 8.233 5.562 ( 5.045 -3.098 2.904) 6.594 5.603 ( 4.562 2.938 -3.183) 6.291 5.674 ( 7.926 -3.289 -0.086) 8.582 5.837 ( -0.804 2.937 5.917) 6.654 5.908 ( 1.821 -4.028 3.321) 5.529 6.282 ( 1.251 2.260 1.710) 3.098 6.328 ( 2.136 -2.009 1.843) 3.464 7.347 ( 3.223 6.534 4.563) 8.596 7.451 ( 3.901 -3.818 2.634) 6.060 7.948 ( 4.069 4.984 -1.285) 6.561 8.016 ( 11.442 -2.147 -4.704) 12.556 8.364 ( -2.272 5.407 1.852) 6.151 8.438 ( -1.701 -1.898 -0.412) 2.581 9.317 ( -1.203 2.525 -4.520) 5.315 9.369 ( -0.468 -2.949 -4.774) 5.630 9.877 ( -2.299 4.866 -6.112) 8.144 9.973 ( -1.791 -5.420 -5.876) 8.193 10.302 ( -1.844 7.939 4.487) 9.304 10.458 ( -4.115 -7.758 3.444) 9.433 10.785 ( -0.730 9.608 1.630) 9.772 10.944 ( -2.229 -3.805 1.609) 4.694 11.119 ( -1.835 1.048 1.957) 2.880 11.207 ( -4.610 -5.752 2.645) 7.831 12.593 ( 8.480 7.305 -5.498) 12.470 12.741 ( 6.602 -7.995 -3.896) 11.076 13.060 ( 8.134 1.691 6.960) 10.838 13.083 ( 7.111 -0.991 5.894) 9.289 16.894 ( 4.307 7.307 5.405) 10.058 17.015 ( 0.852 -3.732 9.378) 10.129 17.317 ( 21.981 4.847 5.184) 23.099 17.486 ( 17.424 -11.025 8.905) 22.460 18.051 ( -8.155 9.585 -1.132) 12.636 18.188 ( -6.951 -3.497 -3.392) 8.488 18.314 ( -3.326 6.108 -3.904) 7.975 18.431 ( -5.118 -4.205 -5.354) 8.517 21.196 ( -5.449 1.714 -4.655) 7.368 21.261 ( -6.696 -5.023 -4.883) 9.691 21.675 ( -1.498 5.090 -0.085) 5.307 21.773 ( -4.144 -5.211 0.908) 6.719 ======================= Grid point 350 (169/170) ======================= q-point: ( 0.36 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( -4.749 8.032 -5.103) 10.636 2.289 ( -8.195 -7.702 -3.998) 11.936 2.445 ( 5.121 6.374 -3.528) 8.905 2.548 ( 0.097 -3.333 -3.596) 4.904 2.801 ( 4.277 3.888 0.629) 5.814 2.881 ( 1.621 -1.670 -0.181) 2.334 2.980 ( 5.569 0.550 0.161) 5.598 3.066 ( 4.165 -2.990 1.238) 5.275 3.112 ( -4.641 -0.097 7.446) 8.774 3.187 ( -4.927 -5.453 11.485) 13.635 3.457 ( -1.354 2.988 1.549) 3.628 3.534 ( -0.231 -5.010 2.430) 5.573 3.703 ( -5.961 1.666 -10.065) 11.816 3.747 ( -1.929 -3.447 -11.982) 12.617 3.958 ( -9.609 9.185 -0.892) 13.323 4.173 ( -16.194 -11.983 -1.908) 20.236 4.354 ( -5.632 13.962 -11.225) 18.779 4.659 ( -13.831 -17.436 -8.548) 23.841 5.191 ( 5.470 8.172 4.521) 10.824 5.274 ( 6.580 0.029 4.365) 7.896 5.520 ( -0.331 6.827 2.528) 7.288 5.646 ( 2.324 -1.716 -0.739) 2.982 5.687 ( 7.271 2.127 0.279) 7.581 5.769 ( 7.828 -3.760 -5.781) 10.433 5.895 ( -1.275 5.707 8.565) 10.371 5.997 ( 2.160 -4.718 6.899) 8.632 6.268 ( -1.122 4.988 -3.494) 6.192 6.343 ( 0.245 -2.629 -2.716) 3.788 7.467 ( 4.907 6.671 5.446) 9.912 7.556 ( 5.523 -1.796 2.950) 6.514 7.927 ( -3.821 7.079 -1.584) 8.199 8.060 ( 1.069 -6.312 -6.725) 9.285 8.353 ( -1.144 5.336 1.789) 5.743 8.410 ( 1.819 -0.624 -4.137) 4.562 9.283 ( 1.103 2.000 -1.014) 2.498 9.337 ( 1.262 -3.667 -1.709) 4.238 9.767 ( -4.010 4.161 -3.978) 7.015 9.866 ( -4.607 -6.086 -4.851) 9.044 10.378 ( 4.098 6.043 5.248) 8.992 10.494 ( 2.786 -5.697 4.613) 7.842 10.765 ( -2.745 8.550 -1.142) 9.052 10.889 ( -4.437 -2.275 -1.604) 5.238 11.122 ( -0.497 -0.545 1.656) 1.813 11.163 ( -3.574 -3.627 1.756) 5.386 12.660 ( 5.976 5.519 -2.981) 8.664 12.772 ( 2.216 -6.221 -2.671) 7.124 13.250 ( 6.771 1.024 5.183) 8.588 13.257 ( 6.698 0.161 4.572) 8.111 17.010 ( 2.945 7.473 5.082) 9.505 17.107 ( -0.958 -1.968 6.904) 7.243 17.653 ( 14.042 5.704 -0.075) 15.157 17.766 ( 7.998 -5.323 -0.886) 9.648 17.982 ( -2.733 9.158 8.795) 12.988 18.110 ( 0.107 -4.166 2.143) 4.687 18.247 ( -0.343 2.756 -2.521) 3.751 18.311 ( -1.163 -1.985 -6.621) 7.010 21.000 ( -9.238 -1.594 -6.666) 11.504 21.041 ( -10.270 -5.937 -7.021) 13.785 21.705 ( 1.870 2.699 2.330) 4.026 21.762 ( -0.853 -3.259 2.423) 4.150 ======================= Grid point 351 (170/170) ======================= q-point: ( 0.45 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 0.00e+00 0.00e+00 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -0.502 1.993 -0.897) 2.243 2.116 ( -6.261 -4.558 -3.784) 8.619 2.500 ( 4.185 3.111 -1.279) 5.369 2.532 ( -0.210 0.039 -0.976) 0.999 2.868 ( 4.206 0.617 -0.731) 4.313 2.896 ( -0.049 -1.786 0.176) 1.796 3.056 ( 5.188 2.641 -0.743) 5.868 3.110 ( -4.008 0.085 3.733) 5.478 3.150 ( 3.297 -0.650 1.657) 3.747 3.193 ( -2.914 -2.849 1.781) 4.447 3.353 ( -5.798 2.819 -0.517) 6.468 3.396 ( -7.813 -1.233 -4.176) 8.944 3.702 ( 5.186 2.137 2.116) 5.994 3.752 ( 2.175 -1.755 -0.890) 2.933 3.903 ( 1.132 -1.512 1.145) 2.209 3.961 ( -8.708 -7.028 0.525) 11.202 4.201 ( 1.569 1.439 -4.965) 5.402 4.357 ( -13.285 -13.078 -6.031) 19.593 5.345 ( 6.592 8.896 5.002) 12.149 5.441 ( 4.853 1.731 4.777) 7.026 5.492 ( -1.488 5.856 -1.471) 6.218 5.608 ( -3.498 -2.239 -4.742) 6.303 5.774 ( 1.217 -0.585 3.157) 3.434 5.798 ( 3.929 -2.315 -5.297) 6.989 5.996 ( 1.940 7.288 7.657) 10.747 6.077 ( -0.511 -0.002 0.467) 0.692 6.221 ( 0.651 2.344 0.055) 2.433 6.286 ( -1.786 -3.172 -4.626) 5.887 7.609 ( 5.072 6.748 4.961) 9.792 7.668 ( 3.575 2.730 0.855) 4.579 7.845 ( -3.319 1.629 1.388) 3.949 7.934 ( -4.894 -5.668 -7.358) 10.498 8.371 ( 1.167 3.949 0.635) 4.167 8.394 ( 0.330 1.568 -2.256) 2.767 9.318 ( 2.512 0.767 0.997) 2.809 9.349 ( 0.310 -2.355 -0.396) 2.408 9.694 ( -0.524 0.627 -1.091) 1.363 9.742 ( -4.709 -4.271 -2.820) 6.955 10.520 ( 5.906 5.831 5.201) 9.795 10.613 ( 4.464 -1.752 2.292) 5.315 10.680 ( -3.870 4.203 -1.167) 5.831 10.776 ( -5.650 -3.356 -4.082) 7.736 11.133 ( 0.321 -0.612 0.332) 0.767 11.141 ( -1.482 -1.235 1.135) 2.239 12.716 ( 3.635 1.850 -0.582) 4.121 12.758 ( -1.070 -2.524 -1.304) 3.036 13.367 ( 2.532 0.882 2.115) 3.414 13.369 ( 2.678 0.605 1.545) 3.150 17.094 ( 2.443 5.416 2.265) 6.359 17.132 ( -2.123 1.629 2.159) 3.439 17.744 ( 3.397 5.127 -3.021) 6.853 17.768 ( -2.754 2.684 0.893) 3.948 18.094 ( 3.421 3.273 3.503) 5.890 18.151 ( -0.291 -2.182 -1.446) 2.634 18.265 ( 2.407 0.945 1.931) 3.227 18.283 ( 2.230 -0.407 -0.985) 2.472 20.831 ( -3.740 -4.777 -2.896) 6.723 20.848 ( -5.461 -6.516 -3.256) 9.104 21.753 ( 1.524 0.594 1.068) 1.954 21.772 ( -0.755 -1.309 1.007) 1.816 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/35640 10.0 4872.518 4554.036 5701.577 0.000 -439.234 0.000 3/35640 20.0 390.876 434.928 446.855 0.000 10.025 0.000 3/35640 30.0 111.066 120.513 129.439 0.000 3.314 0.000 3/35640 40.0 53.559 56.753 62.245 0.000 1.659 0.000 3/35640 50.0 33.375 34.854 38.440 0.000 1.054 0.000 3/35640 60.0 23.811 24.661 27.179 0.000 0.761 0.000 3/35640 70.0 18.379 18.943 20.826 0.000 0.591 0.000 3/35640 80.0 14.922 15.334 16.814 0.000 0.481 0.000 3/35640 90.0 12.547 12.868 14.076 0.000 0.405 0.000 3/35640 100.0 10.824 11.085 12.101 0.000 0.349 0.000 3/35640 110.0 9.522 9.740 10.613 0.000 0.307 0.000 3/35640 120.0 8.505 8.691 9.455 0.000 0.274 0.000 3/35640 130.0 7.689 7.850 8.528 0.000 0.247 0.000 3/35640 140.0 7.021 7.162 7.771 0.000 0.225 0.000 3/35640 150.0 6.465 6.588 7.140 0.000 0.207 0.000 3/35640 160.0 5.993 6.102 6.606 0.000 0.192 0.000 3/35640 170.0 5.588 5.686 6.149 0.000 0.179 0.000 3/35640 180.0 5.237 5.324 5.752 0.000 0.167 0.000 3/35640 190.0 4.929 5.008 5.405 0.000 0.157 0.000 3/35640 200.0 4.656 4.728 5.099 0.000 0.148 0.000 3/35640 210.0 4.414 4.479 4.826 0.000 0.141 0.000 3/35640 220.0 4.196 4.256 4.582 0.000 0.133 0.000 3/35640 230.0 4.000 4.054 4.362 0.000 0.127 0.000 3/35640 240.0 3.822 3.871 4.163 0.000 0.121 0.000 3/35640 250.0 3.659 3.705 3.982 0.000 0.116 0.000 3/35640 260.0 3.510 3.553 3.816 0.000 0.111 0.000 3/35640 270.0 3.373 3.413 3.664 0.000 0.107 0.000 3/35640 280.0 3.247 3.284 3.523 0.000 0.103 0.000 3/35640 290.0 3.130 3.164 3.394 0.000 0.099 0.000 3/35640 300.0 3.022 3.054 3.273 0.000 0.096 0.000 3/35640 310.0 2.921 2.950 3.161 0.000 0.093 0.000 3/35640 320.0 2.826 2.854 3.057 0.000 0.090 0.000 3/35640 330.0 2.738 2.764 2.960 0.000 0.087 0.000 3/35640 340.0 2.655 2.680 2.868 0.000 0.084 0.000 3/35640 350.0 2.577 2.600 2.782 0.000 0.082 0.000 3/35640 360.0 2.503 2.526 2.702 0.000 0.079 0.000 3/35640 370.0 2.434 2.455 2.626 0.000 0.077 0.000 3/35640 380.0 2.369 2.389 2.554 0.000 0.075 0.000 3/35640 390.0 2.306 2.326 2.486 0.000 0.073 0.000 3/35640 400.0 2.248 2.266 2.421 0.000 0.071 0.000 3/35640 410.0 2.192 2.209 2.360 0.000 0.069 0.000 3/35640 420.0 2.139 2.155 2.302 0.000 0.068 0.000 3/35640 430.0 2.088 2.104 2.247 0.000 0.066 0.000 3/35640 440.0 2.040 2.055 2.194 0.000 0.064 0.000 3/35640 450.0 1.994 2.008 2.144 0.000 0.063 0.000 3/35640 460.0 1.950 1.964 2.096 0.000 0.062 0.000 3/35640 470.0 1.908 1.921 2.051 0.000 0.060 0.000 3/35640 480.0 1.868 1.881 2.007 0.000 0.059 0.000 3/35640 490.0 1.829 1.842 1.965 0.000 0.058 0.000 3/35640 500.0 1.792 1.804 1.925 0.000 0.057 0.000 3/35640 510.0 1.756 1.768 1.886 0.000 0.056 0.000 3/35640 520.0 1.722 1.734 1.849 0.000 0.054 0.000 3/35640 530.0 1.690 1.700 1.813 0.000 0.053 0.000 3/35640 540.0 1.658 1.669 1.779 0.000 0.052 0.000 3/35640 550.0 1.628 1.638 1.746 0.000 0.051 0.000 3/35640 560.0 1.598 1.608 1.714 0.000 0.050 0.000 3/35640 570.0 1.570 1.580 1.684 0.000 0.050 0.000 3/35640 580.0 1.543 1.552 1.654 0.000 0.049 0.000 3/35640 590.0 1.516 1.525 1.626 0.000 0.048 0.000 3/35640 600.0 1.491 1.500 1.598 0.000 0.047 0.000 3/35640 610.0 1.466 1.475 1.572 0.000 0.046 0.000 3/35640 620.0 1.442 1.451 1.546 0.000 0.046 0.000 3/35640 630.0 1.419 1.428 1.521 0.000 0.045 0.000 3/35640 640.0 1.397 1.405 1.497 0.000 0.044 0.000 3/35640 650.0 1.375 1.383 1.474 0.000 0.043 0.000 3/35640 660.0 1.354 1.362 1.451 0.000 0.043 0.000 3/35640 670.0 1.334 1.342 1.429 0.000 0.042 0.000 3/35640 680.0 1.314 1.322 1.408 0.000 0.042 0.000 3/35640 690.0 1.295 1.302 1.387 0.000 0.041 0.000 3/35640 700.0 1.277 1.284 1.367 0.000 0.040 0.000 3/35640 710.0 1.259 1.265 1.348 0.000 0.040 0.000 3/35640 720.0 1.241 1.248 1.329 0.000 0.039 0.000 3/35640 730.0 1.224 1.230 1.310 0.000 0.039 0.000 3/35640 740.0 1.207 1.214 1.292 0.000 0.038 0.000 3/35640 750.0 1.191 1.197 1.275 0.000 0.038 0.000 3/35640 760.0 1.175 1.182 1.258 0.000 0.037 0.000 3/35640 770.0 1.160 1.166 1.242 0.000 0.037 0.000 3/35640 780.0 1.145 1.151 1.225 0.000 0.036 0.000 3/35640 790.0 1.131 1.136 1.210 0.000 0.036 0.000 3/35640 800.0 1.116 1.122 1.195 0.000 0.035 0.000 3/35640 810.0 1.103 1.108 1.180 0.000 0.035 0.000 3/35640 820.0 1.089 1.095 1.165 0.000 0.034 0.000 3/35640 830.0 1.076 1.081 1.151 0.000 0.034 0.000 3/35640 840.0 1.063 1.068 1.137 0.000 0.034 0.000 3/35640 850.0 1.051 1.056 1.124 0.000 0.033 0.000 3/35640 860.0 1.038 1.043 1.111 0.000 0.033 0.000 3/35640 870.0 1.026 1.031 1.098 0.000 0.032 0.000 3/35640 880.0 1.015 1.020 1.085 0.000 0.032 0.000 3/35640 890.0 1.003 1.008 1.073 0.000 0.032 0.000 3/35640 900.0 0.992 0.997 1.061 0.000 0.031 0.000 3/35640 910.0 0.981 0.986 1.049 0.000 0.031 0.000 3/35640 920.0 0.970 0.975 1.038 0.000 0.031 0.000 3/35640 930.0 0.960 0.965 1.026 0.000 0.030 0.000 3/35640 940.0 0.950 0.954 1.015 0.000 0.030 0.000 3/35640 950.0 0.940 0.944 1.005 0.000 0.030 0.000 3/35640 960.0 0.930 0.934 0.994 0.000 0.029 0.000 3/35640 970.0 0.920 0.925 0.984 0.000 0.029 0.000 3/35640 980.0 0.911 0.915 0.974 0.000 0.029 0.000 3/35640 990.0 0.902 0.906 0.964 0.000 0.028 0.000 3/35640 1000.0 0.893 0.897 0.954 0.000 0.028 0.000 3/35640 Thermal conductivity related properties were written into "kappa-m1196.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:59:22]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|